A0A077ZDP9_TRITR Loading...

SURF6 and DUF2217 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZDP9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 534 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	68.8	Low	86.8	Confident	163 Å²	163	81.7 Å²	81.7	80%	0.803	41%	0.409	S	S	*	.				0	154.8	0	-66.4	-143.3	-157.5	0	0	111	F3 E4	M1-F3 VanDerWaalsContact C-N 3.28Å; M1-F3 PolarHBondContact O-N 3.16Å; M1-F3 VanDerWaalsContact O-N 3.1Å; M1-E4 HydrophobicContact CB-CG 4.22Å; M1-E4 VanDerWaalsContact CB-OE1 3.27Å; M1-E4 WeakPolarHBondContact CB-OE1 3.17Å; M1-E4 WeakPolarHBondContact CG-OE1 3.35Å; M1-E4 PolarHBondContact N-OE1 2.81Å; M1-E4 PolarHBondContact N-OE2 3.27Å; M1-E4 WeakPolarHBondContact O-CB 3.32Å; M1-E4 PolarHBondContact O-N 2.96Å
2	L	81.1	Confident	87.2	Confident	10 Å²	10	75.8 Å²	75.8	5%	0.052	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-47.4	-43.8	-173.4	179.2	57.1	0	0	0	114.9	K8 A189 I192 W193	L2-K8 HydrophobicContact CD1-CD 3.72Å; L2-K8 WeakPolarHBondContact O-CD 3.41Å; L2-A189 HydrophobicContact CB-CB 4.1Å; L2-A189 WeakPolarHBondContact CD1-O 2.9Å; L2-I192 HydrophobicContact CD2-CB 4.44Å; L2-I192 HydrophobicContact CD2-CG2 3.85Å; L2-W193 HydrophobicContact CD1-CB 3.61Å; L2-W193 HydrophobicContact CD1-CD2 4.09Å; L2-W193 HydrophobicContact CD1-CE3 3.81Å; L2-W193 HydrophobicContact CD1-CG 4.03Å; L2-W193 HydrophobicContact CD2-CE3 4.46Å; L2-W193 HydrophobicContact CG-CE3 4.43Å
3	F	84	Confident	87.6	Confident	40 Å²	40	73.2 Å²	73.2	18%	0.175	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-96.6	13.1	-175.7	-66.9	-73.3	0	0	0	114.3	M1 D5 R9 V12 F68	M1-F3 VanDerWaalsContact C-N 3.28Å; M1-F3 PolarHBondContact O-N 3.16Å; M1-F3 VanDerWaalsContact O-N 3.1Å; F3-D5 VanDerWaalsContact C-N 3.29Å; F3-R9 HydrophobicContact CB-CG 4.17Å; F3-R9 HydrophobicContact CD1-CG 4.14Å; F3-R9 VanDerWaalsContact O-CD 3.29Å; F3-R9 WeakPolarHBondContact O-CD 3.42Å; F3-R9 WeakPolarHBondContact O-CG 3.5Å; F3-R9 PolarHBondContact O-NH1 3.28Å; F3-V12 HydrophobicContact CE1-CB 4.4Å; F3-V12 HydrophobicContact CE1-CG2 3.94Å; F3-F68 HydrophobicContact CD2-CB 3.65Å; F3-F68 HydrophobicContact CD2-CD1 4.46Å; F3-F68 HydrophobicContact CD2-CG 4.07Å; F3-F68 HydrophobicContact CE1-CD2 4.35Å; F3-F68 HydrophobicContact CE1-CG 4.46Å; F3-F68 HydrophobicContact CE2-CB 3.44Å; F3-F68 VanDerWaalsContact CE2-CB 3.44Å; F3-F68 AromaticContact CE2-CD1 3.44Å; F3-F68 HydrophobicContact CE2-CD1 3.44Å; F3-F68 VanDerWaalsContact CE2-CD1 3.44Å; F3-F68 HydrophobicContact CE2-CD2 4Å; F3-F68 HydrophobicContact CE2-CE1 4.18Å; F3-F68 AromaticContact CE2-CG 3.33Å; F3-F68 HydrophobicContact CE2-CG 3.33Å; F3-F68 HydrophobicContact CG-CB 4.46Å; F3-F68 HydrophobicContact CZ-CB 4.08Å; F3-F68 AromaticContact CZ-CD1 3.74Å; F3-F68 HydrophobicContact CZ-CD1 3.74Å; F3-F68 AromaticContact CZ-CD2 3.75Å; F3-F68 HydrophobicContact CZ-CD2 3.75Å; F3-F68 HydrophobicContact CZ-CE1 4.08Å; F3-F68 HydrophobicContact CZ-CE2 4.09Å; F3-F68 AromaticContact CZ-CG 3.56Å; F3-F68 HydrophobicContact CZ-CG 3.56Å; F3-F68 HydrophobicContact CZ-CZ 4.24Å
4	E	84.3	Confident	88.1	Confident	135 Å²	135	76.2 Å²	76.2	63%	0.631	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-70.6	-31.3	168.5	-77.3	161.8	-155.8	0	0	111.3	M1 S6 R9	M1-E4 HydrophobicContact CB-CG 4.22Å; M1-E4 VanDerWaalsContact CB-OE1 3.27Å; M1-E4 WeakPolarHBondContact CB-OE1 3.17Å; M1-E4 WeakPolarHBondContact CG-OE1 3.35Å; M1-E4 PolarHBondContact N-OE1 2.81Å; M1-E4 PolarHBondContact N-OE2 3.27Å; M1-E4 WeakPolarHBondContact O-CB 3.32Å; M1-E4 PolarHBondContact O-N 2.96Å; E4-S6 PolarHBondContact O-N 2.91Å; E4-R9 VanDerWaalsContact C-NH1 3.27Å; E4-R9 PolarHBondContact O-NH1 2.99Å
5	D	87.8	Confident	88.4	Confident	78 Å²	78	72 Å²	72	42%	0.417	36%	0.361	S	S	.	.	S	Bend	trans	-68.2	117.4	173.7	-175.7	-14.6	0	0	0	110.8	F3 G7 K8 R9	F3-D5 VanDerWaalsContact C-N 3.29Å; D5-G7 VanDerWaalsContact C-N 3.28Å; D5-G7 PolarHBondContact O-N 3.27Å; D5-G7 WeakPolarHBondContact OD1-CA 3.3Å; D5-G7 PolarHBondContact OD1-N 2.84Å; D5-K8 HydrophobicContact CB-CB 4.1Å; D5-K8 HydrophobicContact CB-CD 4Å; D5-K8 HydrophobicContact CB-CG 3.93Å; D5-K8 PolarHBondContact O-N 2.97Å; D5-R9 PolarHBondContact O-N 3.26Å
6	S	88.2	Confident	88.6	Confident	78 Å²	78	70.3 Å²	70.3	55%	0.545	35%	0.352	S	S	.	.	H	α-helix	trans	-62	-34.7	177.5	53.5	0	0	0	0	112.7	E4 R9 E10	E4-S6 PolarHBondContact O-N 2.91Å; S6-R9 PolarHBondContact O-N 2.91Å; S6-E10 PolarHBondContact O-N 2.81Å
7	G	91.4	Very high	88.9	Confident	37 Å²	37	70.6 Å²	70.6	38%	0.381	35%	0.348	S	S	.	.	H	α-helix	trans	-65.6	-40.7	177.7	0	0	0	0	0	111.9	D5 E10 W11	D5-G7 VanDerWaalsContact C-N 3.28Å; D5-G7 PolarHBondContact O-N 3.27Å; D5-G7 WeakPolarHBondContact OD1-CA 3.3Å; D5-G7 PolarHBondContact OD1-N 2.84Å; G7-E10 PolarHBondContact O-N 2.87Å; G7-W11 VanDerWaalsContact O-CB 3.31Å; G7-W11 WeakPolarHBondContact O-CB 3.46Å; G7-W11 PolarHBondContact O-N 3.38Å
8	K	91.6	Very high	89.1	Confident	24 Å²	24	70.9 Å²	70.9	10%	0.104	35%	0.352	C	S	.	.	H	α-helix	trans	-65.2	-41.1	175	-66.8	-176.7	-176.6	-178.7	0	111.5	L2 D5 W11 V12 E190 W193	L2-K8 HydrophobicContact CD1-CD 3.72Å; L2-K8 WeakPolarHBondContact O-CD 3.41Å; D5-K8 HydrophobicContact CB-CB 4.1Å; D5-K8 HydrophobicContact CB-CD 4Å; D5-K8 HydrophobicContact CB-CG 3.93Å; D5-K8 PolarHBondContact O-N 2.97Å; K8-W11 PolarHBondContact O-N 2.94Å; K8-V12 WeakPolarHBondContact O-CG2 3.32Å; K8-V12 PolarHBondContact O-N 3.1Å; K8-V12 VanDerWaalsContact O-N 3.08Å; K8-E190 IonicContact NZ-OE1 3.14Å; K8-E190 PolarHBondContact NZ-OE1 2.87Å; K8-E190 IonicContact NZ-OE2 2.71Å; K8-W193 HydrophobicContact CB-CE3 4.38Å; K8-W193 HydrophobicContact CB-CH2 3.72Å; K8-W193 HydrophobicContact CB-CZ2 4.24Å; K8-W193 HydrophobicContact CB-CZ3 3.79Å; K8-W193 HydrophobicContact CD-CD2 3.96Å; K8-W193 HydrophobicContact CD-CE3 4.11Å; K8-W193 HydrophobicContact CD-CG 4.42Å; K8-W193 HydrophobicContact CD-CH2 4.48Å; K8-W193 HydrophobicContact CD-CZ2 4.37Å; K8-W193 HydrophobicContact CD-CZ3 4.35Å; K8-W193 HydrophobicContact CG-CD2 4.25Å; K8-W193 HydrophobicContact CG-CE3 4.27Å; K8-W193 HydrophobicContact CG-CH2 3.77Å; K8-W193 HydrophobicContact CG-CZ2 3.76Å; K8-W193 HydrophobicContact CG-CZ3 4.03Å
9	R	90.6	Very high	89.2	Confident	115 Å²	115	67.6 Å²	67.6	43%	0.434	34%	0.336	S	S	.	.	H	α-helix	trans	-60.5	-50.5	174.7	-68.3	-167.9	-61.7	-96.1	2	111.9	F3 E4 D5 S6 W11 V12 T13	F3-R9 HydrophobicContact CB-CG 4.17Å; F3-R9 HydrophobicContact CD1-CG 4.14Å; F3-R9 VanDerWaalsContact O-CD 3.29Å; F3-R9 WeakPolarHBondContact O-CD 3.42Å; F3-R9 WeakPolarHBondContact O-CG 3.5Å; F3-R9 PolarHBondContact O-NH1 3.28Å; E4-R9 VanDerWaalsContact C-NH1 3.27Å; E4-R9 PolarHBondContact O-NH1 2.99Å; D5-R9 PolarHBondContact O-N 3.26Å; S6-R9 PolarHBondContact O-N 2.91Å; R9-W11 VanDerWaalsContact C-N 3.32Å; R9-W11 PolarHBondContact O-N 2.75Å; R9-V12 PolarHBondContact O-N 3.04Å; R9-T13 PolarHBondContact O-N 3.25Å; R9-T13 PolarHBondContact O-OG1 3.31Å; R9-T13 VanDerWaalsContact O-OG1 3.08Å
10	E	92.3	Very high	89.3	Confident	139 Å²	139	65.3 Å²	65.3	65%	0.65	32%	0.324	S	S	*	.	H	α-helix	trans	-61.5	-42.3	-179.6	-172.5	179.1	175.3	0	0	111.6	S6 G7 V12 T13 K14	S6-E10 PolarHBondContact O-N 2.81Å; G7-E10 PolarHBondContact O-N 2.87Å; E10-V12 PolarHBondContact O-N 2.99Å; E10-T13 PolarHBondContact O-N 3.31Å; E10-K14 VanDerWaalsContact O-CB 3.32Å; E10-K14 WeakPolarHBondContact O-CB 3.48Å; E10-K14 PolarHBondContact O-N 3.43Å
11	W	94.3	Very high	89.4	Confident	80 Å²	80	62.8 Å²	62.8	30%	0.303	31%	0.313	S	S	.	.	H	α-helix	trans	-60.8	-44.4	177.5	-175	94.9	0	0	0	112.2	G7 K8 R9 S15 W193 Q197 M200	G7-W11 VanDerWaalsContact O-CB 3.31Å; G7-W11 WeakPolarHBondContact O-CB 3.46Å; G7-W11 PolarHBondContact O-N 3.38Å; K8-W11 PolarHBondContact O-N 2.94Å; R9-W11 VanDerWaalsContact C-N 3.32Å; R9-W11 PolarHBondContact O-N 2.75Å; W11-S15 VanDerWaalsContact O-CB 3.24Å; W11-S15 WeakPolarHBondContact O-CB 3.42Å; W11-S15 PolarHBondContact O-N 3.41Å; W11-S15 PolarHBondContact O-OG 3.29Å; W11-W193 HydrophobicContact CB-CH2 4.28Å; W11-W193 AromaticContact CD2-CH2 3.98Å; W11-W193 HydrophobicContact CD2-CH2 3.98Å; W11-W193 HydrophobicContact CD2-CZ2 4.36Å; W11-W193 AromaticContact CE3-CH2 3.51Å; W11-W193 HydrophobicContact CE3-CH2 3.51Å; W11-W193 HydrophobicContact CE3-CZ2 4.21Å; W11-W193 HydrophobicContact CE3-CZ3 4.15Å; W11-W193 HydrophobicContact CG-CH2 4.31Å; W11-W193 HydrophobicContact CZ3-CH2 4.16Å; W11-Q197 HydrophobicContact CH2-CG 4.05Å; W11-Q197 HydrophobicContact CZ2-CG 4.33Å; W11-Q197 HydrophobicContact CZ3-CG 4.46Å; W11-M200 HydrophobicContact CH2-CB 3.77Å; W11-M200 HydrophobicContact CH2-CG 3.79Å; W11-M200 HydrophobicContact CZ2-CG 4.38Å
12	V	91.9	Very high	90.4	Very high	10 Å²	10	57.4 Å²	57.4	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-47.2	178.7	169.9	0	0	0	0	111.1	F3 K8 R9 E10 K14 S15 I16 F68 W193 L196	F3-V12 HydrophobicContact CE1-CB 4.4Å; F3-V12 HydrophobicContact CE1-CG2 3.94Å; K8-V12 WeakPolarHBondContact O-CG2 3.32Å; K8-V12 PolarHBondContact O-N 3.1Å; K8-V12 VanDerWaalsContact O-N 3.08Å; R9-V12 PolarHBondContact O-N 3.04Å; E10-V12 PolarHBondContact O-N 2.99Å; V12-K14 VanDerWaalsContact C-N 3.35Å; V12-K14 PolarHBondContact O-N 3.48Å; V12-S15 PolarHBondContact O-N 2.98Å; V12-I16 HydrophobicContact CG1-CD1 3.69Å; V12-I16 HydrophobicContact CG1-CG1 4.36Å; V12-I16 WeakPolarHBondContact O-CG1 3.3Å; V12-I16 PolarHBondContact O-N 3.1Å; V12-F68 HydrophobicContact CG1-CE2 4.26Å; V12-W193 HydrophobicContact CG2-CH2 4.22Å; V12-W193 HydrophobicContact CG2-CZ3 3.78Å; V12-L196 HydrophobicContact CG2-CD2 3.74Å
13	T	93	Very high	90.8	Very high	42 Å²	42	57.1 Å²	57.1	26%	0.258	28%	0.283	S	S	.	.	H	α-helix	trans	-56.8	-48.7	177.6	-63.4	0	0	0	0	111.5	R9 E10 S15 R17 Y38 I42	R9-T13 PolarHBondContact O-N 3.25Å; R9-T13 PolarHBondContact O-OG1 3.31Å; R9-T13 VanDerWaalsContact O-OG1 3.08Å; E10-T13 PolarHBondContact O-N 3.31Å; T13-S15 PolarHBondContact O-N 3.35Å; T13-R17 WeakPolarHBondContact O-CB 3.39Å; T13-R17 PolarHBondContact O-N 3.03Å; T13-Y38 HydrophobicContact CG2-CE1 3.81Å; T13-Y38 PolarHBondContact O-OH 3.46Å; T13-I42 HydrophobicContact CG2-CB 4.39Å; T13-I42 HydrophobicContact CG2-CD1 3.62Å; T13-I42 HydrophobicContact CG2-CG1 3.61Å; T13-I42 HydrophobicContact CG2-CG2 3.92Å
14	K	94.4	Very high	91.1	Very high	116 Å²	116	55.2 Å²	55.2	50%	0.504	28%	0.275	S	S	.	.	H	α-helix	trans	-62.7	-44.4	177.3	-176.7	177.8	178.4	179.3	0	111.9	E10 V12 I16 R17 D18	E10-K14 VanDerWaalsContact O-CB 3.32Å; E10-K14 WeakPolarHBondContact O-CB 3.48Å; E10-K14 PolarHBondContact O-N 3.43Å; V12-K14 VanDerWaalsContact C-N 3.35Å; V12-K14 PolarHBondContact O-N 3.48Å; K14-I16 PolarHBondContact O-N 3.35Å; K14-R17 WeakPolarHBondContact O-CB 3.49Å; K14-R17 PolarHBondContact O-N 3.19Å; K14-D18 WeakPolarHBondContact O-CB 3.38Å; K14-D18 VanDerWaalsContact O-CG 3.26Å; K14-D18 PolarHBondContact O-N 3.39Å
15	S	92.5	Very high	91.3	Very high	13 Å²	13	55 Å²	55	9%	0.091	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-42.2	-177.9	-61.4	0	0	0	0	112.1	W11 V12 T13 L19	W11-S15 VanDerWaalsContact O-CB 3.24Å; W11-S15 WeakPolarHBondContact O-CB 3.42Å; W11-S15 PolarHBondContact O-N 3.41Å; W11-S15 PolarHBondContact O-OG 3.29Å; V12-S15 PolarHBondContact O-N 2.98Å; T13-S15 PolarHBondContact O-N 3.35Å; S15-L19 WeakPolarHBondContact O-CB 3.49Å; S15-L19 PolarHBondContact O-N 2.72Å
16	I	91.2	Very high	91.1	Very high	44 Å²	44	52.9 Å²	52.9	23%	0.226	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-44.5	174.8	-68	170.6	0	0	0	110.5	V12 K14 L19 L20 Y38 M200	V12-I16 HydrophobicContact CG1-CD1 3.69Å; V12-I16 HydrophobicContact CG1-CG1 4.36Å; V12-I16 WeakPolarHBondContact O-CG1 3.3Å; V12-I16 PolarHBondContact O-N 3.1Å; K14-I16 PolarHBondContact O-N 3.35Å; I16-L19 WeakPolarHBondContact O-CB 3.46Å; I16-L19 PolarHBondContact O-N 3.3Å; I16-L20 HydrophobicContact CG2-CD1 3.97Å; I16-L20 HydrophobicContact CG2-CG 4.31Å; I16-L20 WeakPolarHBondContact O-CG 3.44Å; I16-L20 PolarHBondContact O-N 3.16Å; I16-Y38 HydrophobicContact CG2-CE2 4.2Å; I16-M200 HydrophobicContact CG1-CE 4.5Å
17	R	94.1	Very high	90.9	Very high	76 Å²	76	49.5 Å²	49.5	29%	0.287	24%	0.236	S	C	.	.	H	α-helix	trans	-58.2	-50.9	177.5	-168.7	-179.7	68.9	179	-0.3	111.6	T13 K14 L19 L20 C21 F34 Y38 D39	T13-R17 WeakPolarHBondContact O-CB 3.39Å; T13-R17 PolarHBondContact O-N 3.03Å; K14-R17 WeakPolarHBondContact O-CB 3.49Å; K14-R17 PolarHBondContact O-N 3.19Å; R17-L19 VanDerWaalsContact C-N 3.28Å; R17-L19 PolarHBondContact O-N 3.07Å; R17-L20 PolarHBondContact O-N 3.25Å; R17-C21 VanDerWaalsContact O-CB 3.23Å; R17-C21 WeakPolarHBondContact O-CB 3.39Å; R17-C21 PolarHBondContact O-N 3.02Å; R17-C21 PolarHBondContact O-SG 3.04Å; R17-F34 HydrophobicContact CG-CE1 4.18Å; R17-Y38 HydrophobicContact CB-CD1 3.96Å; R17-Y38 HydrophobicContact CB-CE1 3.62Å; R17-Y38 HydrophobicContact CG-CD1 3.73Å; R17-Y38 HydrophobicContact CG-CE1 3.95Å; R17-Y38 HydrophobicContact CG-CG 4.32Å; R17-D39 IonicContact NH1-OD1 3.54Å; R17-D39 PolarHBondContact NH1-OD1 2.97Å; R17-D39 IonicContact NH1-OD2 3.03Å
18	D	92.5	Very high	90.5	Very high	77 Å²	77	55 Å²	55	41%	0.412	26%	0.257	S	S	.	.	H	α-helix	trans	-63.2	-38.4	-178	-69.6	-12.7	0	0	0	111.1	K14 F22	K14-D18 WeakPolarHBondContact O-CB 3.38Å; K14-D18 VanDerWaalsContact O-CG 3.26Å; K14-D18 PolarHBondContact O-N 3.39Å; D18-F22 WeakPolarHBondContact O-CB 3.38Å; D18-F22 PolarHBondContact O-N 2.85Å
19	L	91.1	Very high	90.2	Very high	8 Å²	8	56 Å²	56	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-63.3	-50.7	176.4	-179.4	64.2	0	0	0	112.8	S15 I16 R17 F22 M23 F163 M200 V203 M207	S15-L19 WeakPolarHBondContact O-CB 3.49Å; S15-L19 PolarHBondContact O-N 2.72Å; I16-L19 WeakPolarHBondContact O-CB 3.46Å; I16-L19 PolarHBondContact O-N 3.3Å; R17-L19 VanDerWaalsContact C-N 3.28Å; R17-L19 PolarHBondContact O-N 3.07Å; L19-F22 PolarHBondContact O-N 2.94Å; L19-M23 PolarHBondContact O-N 3.46Å; L19-M23 VanDerWaalsContact O-N 3.1Å; L19-F163 HydrophobicContact CD2-CD2 3.76Å; L19-F163 HydrophobicContact CD2-CE2 3.36Å; L19-F163 HydrophobicContact CD2-CZ 4.27Å; L19-F163 HydrophobicContact CG-CD2 4.44Å; L19-F163 HydrophobicContact CG-CE2 4.28Å; L19-M200 HydrophobicContact CD2-CE 4.47Å; L19-M200 HydrophobicContact CD2-SD 4.2Å; L19-V203 HydrophobicContact CD1-CG1 3.38Å; L19-M207 HydrophobicContact CD1-CE 3.3Å; L19-M207 HydrophobicContact CD1-SD 3.32Å; L19-M207 WeakPolarHBondContact CD1-SD 3.18Å; L19-M207 HydrophobicContact CG-CE 4.43Å
20	L	91.2	Very high	89.8	Confident	21 Å²	21	55.2 Å²	55.2	11%	0.11	27%	0.271	C	S	.	.	H	α-helix	trans	-66.5	-42.1	178.4	-67.9	-178.2	0	0	0	111.4	I16 R17 F22 M23 L24 F34 V141 F145	I16-L20 HydrophobicContact CG2-CD1 3.97Å; I16-L20 HydrophobicContact CG2-CG 4.31Å; I16-L20 WeakPolarHBondContact O-CG 3.44Å; I16-L20 PolarHBondContact O-N 3.16Å; R17-L20 PolarHBondContact O-N 3.25Å; L20-F22 VanDerWaalsContact C-N 3.29Å; L20-F22 PolarHBondContact O-N 3.12Å; L20-M23 HydrophobicContact CD2-CE 3.41Å; L20-M23 VanDerWaalsContact CD2-CE 3.41Å; L20-M23 PolarHBondContact O-N 2.72Å; L20-M23 VanDerWaalsContact O-N 3.16Å; L20-L24 WeakPolarHBondContact O-CG 3.41Å; L20-L24 PolarHBondContact O-N 2.87Å; L20-F34 HydrophobicContact CB-CE1 3.9Å; L20-F34 HydrophobicContact CB-CE2 4.05Å; L20-F34 HydrophobicContact CB-CZ 3.44Å; L20-F34 VanDerWaalsContact CB-CZ 3.44Å; L20-F34 HydrophobicContact CD1-CE2 3.79Å; L20-F34 HydrophobicContact CD1-CZ 3.66Å; L20-F34 HydrophobicContact CG-CZ 4.18Å; L20-V141 HydrophobicContact CD2-CG1 4.17Å; L20-F145 HydrophobicContact CD2-CE2 4.47Å; L20-F145 HydrophobicContact CD2-CZ 3.76Å
21	C	92.3	Very high	89.8	Confident	12 Å²	12	49.9 Å²	49.9	8%	0.081	25%	0.248	C	C	.	.	H	α-helix	trans	-54.9	-45.2	172.1	-82.6	0	0	0	0	111.9	R17 L24 K25 V31 F34 C35	R17-C21 VanDerWaalsContact O-CB 3.23Å; R17-C21 WeakPolarHBondContact O-CB 3.39Å; R17-C21 PolarHBondContact O-N 3.02Å; R17-C21 PolarHBondContact O-SG 3.04Å; C21-L24 PolarHBondContact O-N 3.25Å; C21-K25 WeakPolarHBondContact O-CG 3.21Å; C21-K25 PolarHBondContact O-N 3.22Å; C21-V31 HydrophobicContact CB-CG1 4.04Å; C21-V31 VanDerWaalsContact SG-CG1 3.58Å; C21-F34 VanDerWaalsContact SG-CE1 3.53Å; C21-C35 PolarHBondContact SG-SG 2.96Å
22	F	89.7	Confident	89.7	Confident	51 Å²	51	53.5 Å²	53.5	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-60.1	-49.2	176.9	179.2	-89.5	0	0	0	110.6	D18 L19 L20 L24 K25 Q26 L159 M207	D18-F22 WeakPolarHBondContact O-CB 3.38Å; D18-F22 PolarHBondContact O-N 2.85Å; L19-F22 PolarHBondContact O-N 2.94Å; L20-F22 VanDerWaalsContact C-N 3.29Å; L20-F22 PolarHBondContact O-N 3.12Å; F22-L24 PolarHBondContact O-N 3.24Å; F22-K25 WeakPolarHBondContact O-CB 3.46Å; F22-K25 PolarHBondContact O-N 3.4Å; F22-Q26 HydrophobicContact CD1-CG 3.88Å; F22-Q26 HydrophobicContact CE1-CG 3.44Å; F22-Q26 VanDerWaalsContact CE1-CG 3.44Å; F22-Q26 VanDerWaalsContact CE2-NE2 3.33Å; F22-Q26 HydrophobicContact CZ-CG 3.81Å; F22-Q26 WeakPolarHBondContact O-CG 3.49Å; F22-Q26 PolarHBondContact O-N 3.47Å; F22-L159 HydrophobicContact CD1-CD2 4.4Å; F22-L159 HydrophobicContact CE1-CD1 4.15Å; F22-L159 HydrophobicContact CE1-CD2 3.98Å; F22-M207 HydrophobicContact CB-SD 4.38Å; F22-M207 HydrophobicContact CD1-CB 3.82Å; F22-M207 HydrophobicContact CD1-CG 3.96Å; F22-M207 HydrophobicContact CD1-SD 3.26Å; F22-M207 WeakPolarHBondContact CD1-SD 3.21Å; F22-M207 HydrophobicContact CE1-CB 3.56Å; F22-M207 HydrophobicContact CE1-CG 3.87Å; F22-M207 HydrophobicContact CE1-SD 3.77Å; F22-M207 HydrophobicContact CE2-CB 4.35Å; F22-M207 WeakPolarHBondContact CE2-O 3.33Å; F22-M207 HydrophobicContact CG-CB 4.31Å; F22-M207 HydrophobicContact CG-SD 4.03Å; F22-M207 HydrophobicContact CZ-CB 3.86Å; F22-M207 WeakPolarHBondContact CZ-O 3.25Å
23	M	88.1	Confident	89.7	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-39.4	179.6	-67.8	-166.4	-55.3	0	0	113	L19 L20 K25 Q26 S27 M144 F145 L159 F163 M207	L19-M23 PolarHBondContact O-N 3.46Å; L19-M23 VanDerWaalsContact O-N 3.1Å; L20-M23 HydrophobicContact CD2-CE 3.41Å; L20-M23 VanDerWaalsContact CD2-CE 3.41Å; L20-M23 PolarHBondContact O-N 2.72Å; L20-M23 VanDerWaalsContact O-N 3.16Å; M23-K25 PolarHBondContact O-N 2.88Å; M23-Q26 WeakPolarHBondContact O-CA 3.46Å; M23-Q26 WeakPolarHBondContact O-CB 3.41Å; M23-Q26 PolarHBondContact O-N 2.91Å; M23-Q26 VanDerWaalsContact O-N 3.07Å; M23-S27 PolarHBondContact O-N 3.06Å; M23-S27 PolarHBondContact O-OG 3.17Å; M23-M144 HydrophobicContact CB-CE 3.86Å; M23-M144 HydrophobicContact CB-SD 3.97Å; M23-M144 HydrophobicContact CE-CE 4.2Å; M23-M144 HydrophobicContact CE-SD 4.41Å; M23-F145 HydrophobicContact CE-CE1 3.42Å; M23-F145 VanDerWaalsContact CE-CE1 3.42Å; M23-F145 HydrophobicContact CE-CZ 3.74Å; M23-F145 HydrophobicContact SD-CE1 4.26Å; M23-L159 HydrophobicContact CG-CD2 4.2Å; M23-F163 HydrophobicContact CE-CD1 4.24Å; M23-F163 HydrophobicContact CE-CE1 4.17Å; M23-F163 HydrophobicContact SD-CB 4.43Å; M23-F163 HydrophobicContact SD-CD1 4.08Å; M23-F163 HydrophobicContact SD-CG 4.25Å; M23-M207 HydrophobicContact CG-CE 3.86Å; M23-M207 HydrophobicContact CG-SD 4.46Å; M23-M207 HydrophobicContact SD-CE 4.07Å
24	L	90.7	Very high	89.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.4	-42	174.5	-74.1	169.9	0	0	0	111.9	L20 C21 F22 Q26 S27 N28 S29 V31 F34 M144	L20-L24 WeakPolarHBondContact O-CG 3.41Å; L20-L24 PolarHBondContact O-N 2.87Å; C21-L24 PolarHBondContact O-N 3.25Å; F22-L24 PolarHBondContact O-N 3.24Å; L24-Q26 VanDerWaalsContact C-N 3.26Å; L24-Q26 PolarHBondContact O-N 3.43Å; L24-S27 WeakPolarHBondContact CA-OG 3.33Å; L24-S27 PolarHBondContact O-N 2.92Å; L24-S27 PolarHBondContact O-OG 3.26Å; L24-N28 PolarHBondContact O-N 3.41Å; L24-N28 VanDerWaalsContact O-N 3.13Å; L24-S29 PolarHBondContact O-N 2.86Å; L24-V31 HydrophobicContact CB-CG2 4.21Å; L24-F34 HydrophobicContact CD1-CB 3.36Å; L24-F34 HydrophobicContact CD1-CD1 3.63Å; L24-F34 HydrophobicContact CD1-CD2 3.93Å; L24-F34 HydrophobicContact CD1-CE1 4.44Å; L24-F34 HydrophobicContact CD1-CG 3.32Å; L24-M144 HydrophobicContact CD2-CB 3.96Å; L24-M144 HydrophobicContact CD2-CE 3.6Å; L24-M144 HydrophobicContact CD2-CG 4.18Å; L24-M144 HydrophobicContact CG-CE 3.67Å
25	K	88.6	Confident	89.9	Confident	130 Å²	130	52.9 Å²	52.9	57%	0.565	27%	0.267	S	S	*	.	H	α-helix	trans	-61.3	-37.5	172.6	-69.6	173.5	-175.9	175.4	0	111.4	C21 F22 M23 S27 N28 V31	C21-K25 WeakPolarHBondContact O-CG 3.21Å; C21-K25 PolarHBondContact O-N 3.22Å; F22-K25 WeakPolarHBondContact O-CB 3.46Å; F22-K25 PolarHBondContact O-N 3.4Å; M23-K25 PolarHBondContact O-N 2.88Å; K25-S27 VanDerWaalsContact C-N 3.33Å; K25-N28 PolarHBondContact O-N 2.95Å; K25-V31 HydrophobicContact CD-CG2 4.38Å; K25-V31 HydrophobicContact CG-CG2 3.49Å; K25-V31 VanDerWaalsContact CG-CG2 3.49Å
26	Q	83.8	Confident	90.1	Very high	34 Å²	34	55 Å²	55	16%	0.159	28%	0.281	C	S	.	.	H	α-helix	trans	-69	-30.4	177.3	-61.5	-49.7	-44.1	0	0	113.1	F22 M23 L24 N28 L156 L159	F22-Q26 HydrophobicContact CD1-CG 3.88Å; F22-Q26 HydrophobicContact CE1-CG 3.44Å; F22-Q26 VanDerWaalsContact CE1-CG 3.44Å; F22-Q26 VanDerWaalsContact CE2-NE2 3.33Å; F22-Q26 HydrophobicContact CZ-CG 3.81Å; F22-Q26 WeakPolarHBondContact O-CG 3.49Å; F22-Q26 PolarHBondContact O-N 3.47Å; M23-Q26 WeakPolarHBondContact O-CA 3.46Å; M23-Q26 WeakPolarHBondContact O-CB 3.41Å; M23-Q26 PolarHBondContact O-N 2.91Å; M23-Q26 VanDerWaalsContact O-N 3.07Å; L24-Q26 VanDerWaalsContact C-N 3.26Å; L24-Q26 PolarHBondContact O-N 3.43Å; Q26-N28 VanDerWaalsContact C-N 3.34Å; Q26-L156 HydrophobicContact CB-CD1 4.11Å; Q26-L159 HydrophobicContact CB-CD2 3.98Å; Q26-L159 HydrophobicContact CG-CD2 3.72Å
27	S	83.8	Confident	90.3	Very high	8 Å²	8	53 Å²	53	6%	0.056	27%	0.272	C	S	.	.	H	α-helix	trans	-84	-4.1	174.3	61.6	0	0	0	0	114.1	M23 L24 K25 S29 M144	M23-S27 PolarHBondContact O-N 3.06Å; M23-S27 PolarHBondContact O-OG 3.17Å; L24-S27 WeakPolarHBondContact CA-OG 3.33Å; L24-S27 PolarHBondContact O-N 2.92Å; L24-S27 PolarHBondContact O-OG 3.26Å; K25-S27 VanDerWaalsContact C-N 3.33Å; S27-S29 WeakPolarHBondContact OG-CB 3.48Å; S27-S29 PolarHBondContact OG-OG 3.24Å; S27-M144 VanDerWaalsContact OG-CG 3.25Å; S27-M144 WeakPolarHBondContact OG-CG 3.27Å
28	N	83.9	Confident	90.4	Very high	153 Å²	153	50.1 Å²	50.1	82%	0.818	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	33.4	-169.8	-45.3	-78	0	0	0	113.1	L24 K25 Q26	L24-N28 PolarHBondContact O-N 3.41Å; L24-N28 VanDerWaalsContact O-N 3.13Å; K25-N28 PolarHBondContact O-N 2.95Å; Q26-N28 VanDerWaalsContact C-N 3.34Å
29	S	84	Confident	90.5	Very high	45 Å²	45	49.2 Å²	49.2	32%	0.315	26%	0.256	S	S	.	.			trans	-87	161.4	172.6	-61.8	0	0	0	0	110.6	L24 S27	L24-S29 PolarHBondContact O-N 2.86Å; S27-S29 WeakPolarHBondContact OG-CB 3.48Å; S27-S29 PolarHBondContact OG-OG 3.24Å
30	D	83.5	Confident	90.8	Very high	98 Å²	98	54 Å²	54	52%	0.524	27%	0.274	S	S	.	.			trans	-67.9	135.1	172.3	-158.8	-27.7	0	0	0	110.2	E32	D30-E32 PolarHBondContact OD1-N 2.91Å
31	V	91.3	Very high	91	Very high	26 Å²	26	54 Å²	54	16%	0.158	27%	0.273	C	S	.	.	S	Bend	trans	-102.1	-27.8	-178.8	-174.9	0	0	0	0	110.4	C21 L24 K25 F34 C35	C21-V31 HydrophobicContact CB-CG1 4.04Å; C21-V31 VanDerWaalsContact SG-CG1 3.58Å; L24-V31 HydrophobicContact CB-CG2 4.21Å; K25-V31 HydrophobicContact CD-CG2 4.38Å; K25-V31 HydrophobicContact CG-CG2 3.49Å; K25-V31 VanDerWaalsContact CG-CG2 3.49Å; V31-F34 PolarHBondContact O-N 3.17Å; V31-C35 PolarHBondContact O-N 3.48Å; V31-C35 PolarHBondContact O-SG 3.47Å
32	E	92.2	Very high	91.1	Very high	156 Å²	156	55.5 Å²	55.5	73%	0.729	28%	0.28	S	S	*	.	H	α-helix	trans	-69.7	-44.2	-174.4	-170.8	173.6	176.9	0	0	110.9	D30 F34 C35 S36	D30-E32 PolarHBondContact OD1-N 2.91Å; E32-F34 VanDerWaalsContact C-N 3.31Å; E32-F34 PolarHBondContact O-N 2.94Å; E32-C35 PolarHBondContact O-N 3.21Å; E32-S36 WeakPolarHBondContact O-CB 3.44Å; E32-S36 PolarHBondContact O-N 3.14Å
33	E	92.4	Very high	91.3	Very high	122 Å²	122	58.3 Å²	58.3	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-60.9	-41.5	175.2	-169.8	174.8	-162.4	0	0	111.6	A37 T140	E33-A37 WeakPolarHBondContact O-CB 3.45Å; E33-A37 PolarHBondContact O-N 3.27Å; E33-T140 HydrophobicContact CB-CG2 4.25Å; E33-T140 HydrophobicContact CG-CG2 3.86Å
34	F	95.2	Very high	91.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-51.3	174.7	165.4	-101.7	0	0	0	111.8	R17 L20 C21 L24 V31 E32 S36 A37 Y38 V137 T140 V141	R17-F34 HydrophobicContact CG-CE1 4.18Å; L20-F34 HydrophobicContact CB-CE1 3.9Å; L20-F34 HydrophobicContact CB-CE2 4.05Å; L20-F34 HydrophobicContact CB-CZ 3.44Å; L20-F34 VanDerWaalsContact CB-CZ 3.44Å; L20-F34 HydrophobicContact CD1-CE2 3.79Å; L20-F34 HydrophobicContact CD1-CZ 3.66Å; L20-F34 HydrophobicContact CG-CZ 4.18Å; C21-F34 VanDerWaalsContact SG-CE1 3.53Å; L24-F34 HydrophobicContact CD1-CB 3.36Å; L24-F34 HydrophobicContact CD1-CD1 3.63Å; L24-F34 HydrophobicContact CD1-CD2 3.93Å; L24-F34 HydrophobicContact CD1-CE1 4.44Å; L24-F34 HydrophobicContact CD1-CG 3.32Å; V31-F34 PolarHBondContact O-N 3.17Å; E32-F34 VanDerWaalsContact C-N 3.31Å; E32-F34 PolarHBondContact O-N 2.94Å; F34-S36 VanDerWaalsContact C-N 3.29Å; F34-S36 PolarHBondContact O-N 3.45Å; F34-A37 PolarHBondContact O-N 3Å; F34-Y38 AromaticContact CE2-CD2 3.98Å; F34-Y38 HydrophobicContact CE2-CD2 3.98Å; F34-Y38 HydrophobicContact CE2-CG 4.4Å; F34-Y38 AromaticContact CZ-CD2 3.76Å; F34-Y38 HydrophobicContact CZ-CD2 3.76Å; F34-Y38 HydrophobicContact CZ-CG 4.02Å; F34-Y38 VanDerWaalsContact O-CB 3.24Å; F34-Y38 WeakPolarHBondContact O-CB 3.3Å; F34-Y38 PolarHBondContact O-N 3.34Å; F34-V137 HydrophobicContact CD2-CG1 4.12Å; F34-V137 HydrophobicContact CE2-CG1 3.81Å; F34-T140 HydrophobicContact CB-CG2 4.42Å; F34-T140 WeakPolarHBondContact CD2-OG1 3.46Å; F34-V141 HydrophobicContact CD2-CG2 3.49Å; F34-V141 VanDerWaalsContact CD2-CG2 3.49Å; F34-V141 HydrophobicContact CE2-CG2 3.61Å
35	C	95.7	Very high	91.6	Very high	33 Å²	33	62 Å²	62	22%	0.223	32%	0.32	C	S	.	.	H	α-helix	trans	-56.6	-46.9	180	-72.1	0	0	0	0	110.8	C21 V31 E32 A37 Y38 D39	C21-C35 PolarHBondContact SG-SG 2.96Å; V31-C35 PolarHBondContact O-N 3.48Å; V31-C35 PolarHBondContact O-SG 3.47Å; E32-C35 PolarHBondContact O-N 3.21Å; C35-A37 PolarHBondContact O-N 2.97Å; C35-Y38 PolarHBondContact O-N 3.26Å; C35-D39 WeakPolarHBondContact O-CB 3.2Å; C35-D39 VanDerWaalsContact O-CG 3.22Å; C35-D39 PolarHBondContact O-N 2.94Å
36	S	96	Very high	91.6	Very high	57 Å²	57	60.8 Å²	60.8	40%	0.399	32%	0.323	S	S	.	.	H	α-helix	trans	-61.9	-42.4	179.6	-168.9	0	0	0	0	112.4	E32 F34 R40	E32-S36 WeakPolarHBondContact O-CB 3.44Å; E32-S36 PolarHBondContact O-N 3.14Å; F34-S36 VanDerWaalsContact C-N 3.29Å; F34-S36 PolarHBondContact O-N 3.45Å; S36-R40 WeakPolarHBondContact O-CG 3.39Å; S36-R40 PolarHBondContact O-N 3.46Å; S36-R40 PolarHBondContact O-NH1 3.31Å; S36-R40 PolarHBondContact OG-NH1 3.1Å
37	A	95.2	Very high	91.9	Very high	2 Å²	2	62.7 Å²	62.7	2%	0.017	34%	0.335	C	S	.	.	H	α-helix	trans	-69.1	-39.5	176.1	0	0	0	0	0	112.5	E33 F34 C35 L41 D136 V137	E33-A37 WeakPolarHBondContact O-CB 3.45Å; E33-A37 PolarHBondContact O-N 3.27Å; F34-A37 PolarHBondContact O-N 3Å; C35-A37 PolarHBondContact O-N 2.97Å; A37-L41 PolarHBondContact O-N 2.93Å; A37-D136 HydrophobicContact CB-CB 4.47Å; A37-V137 HydrophobicContact CB-CG2 3.96Å; A37-V137 WeakPolarHBondContact O-CG2 3.5Å
38	Y	96.5	Very high	92.1	Very high	17 Å²	17	67.4 Å²	67.4	7%	0.067	36%	0.363	C	S	.	.	H	α-helix	trans	-66	-49	-179.9	-173.4	-89.8	0	0	0	111.2	T13 I16 R17 F34 C35 R40 L41 I42 V137	T13-Y38 HydrophobicContact CG2-CE1 3.81Å; T13-Y38 PolarHBondContact O-OH 3.46Å; I16-Y38 HydrophobicContact CG2-CE2 4.2Å; R17-Y38 HydrophobicContact CB-CD1 3.96Å; R17-Y38 HydrophobicContact CB-CE1 3.62Å; R17-Y38 HydrophobicContact CG-CD1 3.73Å; R17-Y38 HydrophobicContact CG-CE1 3.95Å; R17-Y38 HydrophobicContact CG-CG 4.32Å; F34-Y38 AromaticContact CE2-CD2 3.98Å; F34-Y38 HydrophobicContact CE2-CD2 3.98Å; F34-Y38 HydrophobicContact CE2-CG 4.4Å; F34-Y38 AromaticContact CZ-CD2 3.76Å; F34-Y38 HydrophobicContact CZ-CD2 3.76Å; F34-Y38 HydrophobicContact CZ-CG 4.02Å; F34-Y38 VanDerWaalsContact O-CB 3.24Å; F34-Y38 WeakPolarHBondContact O-CB 3.3Å; F34-Y38 PolarHBondContact O-N 3.34Å; C35-Y38 PolarHBondContact O-N 3.26Å; Y38-R40 VanDerWaalsContact C-N 3.32Å; Y38-R40 PolarHBondContact O-N 3.19Å; Y38-L41 WeakPolarHBondContact O-CB 3.2Å; Y38-L41 PolarHBondContact O-N 3.1Å; Y38-L41 VanDerWaalsContact O-N 3.08Å; Y38-I42 HydrophobicContact CD1-CG1 3.97Å; Y38-I42 HydrophobicContact CE1-CD1 4.08Å; Y38-I42 HydrophobicContact CE1-CG1 3.61Å; Y38-I42 WeakPolarHBondContact O-CG1 3.4Å; Y38-I42 PolarHBondContact O-N 3.34Å; Y38-V137 HydrophobicContact CD2-CG1 4.43Å
39	D	96.3	Very high	92.3	Very high	58 Å²	58	67.1 Å²	67.1	31%	0.31	36%	0.357	S	S	.	.	H	α-helix	trans	-61.7	-41.7	179.4	-64.7	-23.9	0	0	0	110.3	R17 C35 L41 I42 D43	R17-D39 IonicContact NH1-OD1 3.54Å; R17-D39 PolarHBondContact NH1-OD1 2.97Å; R17-D39 IonicContact NH1-OD2 3.03Å; C35-D39 WeakPolarHBondContact O-CB 3.2Å; C35-D39 VanDerWaalsContact O-CG 3.22Å; C35-D39 PolarHBondContact O-N 2.94Å; D39-L41 VanDerWaalsContact C-N 3.33Å; D39-L41 PolarHBondContact O-N 3.42Å; D39-I42 PolarHBondContact O-N 3.15Å; D39-D43 WeakPolarHBondContact O-CB 3.49Å; D39-D43 VanDerWaalsContact O-CG 3.26Å; D39-D43 PolarHBondContact O-N 3.3Å
40	R	95.9	Very high	92.6	Very high	109 Å²	109	65.5 Å²	65.5	41%	0.411	34%	0.344	S	S	.	.	H	α-helix	trans	-58.8	-39.6	172.4	-78.1	-167.3	-59.2	-87.3	1.1	113.7	S36 Y38 F44	S36-R40 WeakPolarHBondContact O-CG 3.39Å; S36-R40 PolarHBondContact O-N 3.46Å; S36-R40 PolarHBondContact O-NH1 3.31Å; S36-R40 PolarHBondContact OG-NH1 3.1Å; Y38-R40 VanDerWaalsContact C-N 3.32Å; Y38-R40 PolarHBondContact O-N 3.19Å; R40-F44 VanDerWaalsContact O-CB 3.27Å; R40-F44 WeakPolarHBondContact O-CB 3.35Å; R40-F44 PolarHBondContact O-N 2.95Å
41	L	95.3	Very high	92.7	Very high	19 Å²	19	66.3 Å²	66.3	10%	0.099	35%	0.345	C	S	.	.	H	α-helix	trans	-65.2	-43.9	177.3	173.2	64.2	0	0	0	110.8	A37 Y38 D39 F44 C45 F130 Q133 V137	A37-L41 PolarHBondContact O-N 2.93Å; Y38-L41 WeakPolarHBondContact O-CB 3.2Å; Y38-L41 PolarHBondContact O-N 3.1Å; Y38-L41 VanDerWaalsContact O-N 3.08Å; D39-L41 VanDerWaalsContact C-N 3.33Å; D39-L41 PolarHBondContact O-N 3.42Å; L41-F44 PolarHBondContact O-N 2.92Å; L41-C45 PolarHBondContact O-N 2.73Å; L41-C45 PolarHBondContact O-SG 3.24Å; L41-F130 HydrophobicContact CD1-CD2 4.06Å; L41-F130 HydrophobicContact CD1-CE2 3.89Å; L41-Q133 HydrophobicContact CB-CB 4.29Å; L41-Q133 HydrophobicContact CD1-CB 3.66Å; L41-V137 HydrophobicContact CB-CG2 4.07Å; L41-V137 HydrophobicContact CD2-CG2 3.88Å
42	I	94.4	Very high	92.5	Very high	44 Å²	44	75.4 Å²	75.4	23%	0.226	38%	0.377	C	S	.	.	H	α-helix	trans	-65.9	-44.9	178.8	-62.6	-57.7	0	0	0	111.1	T13 Y38 D39 F44 C45 T46	T13-I42 HydrophobicContact CG2-CB 4.39Å; T13-I42 HydrophobicContact CG2-CD1 3.62Å; T13-I42 HydrophobicContact CG2-CG1 3.61Å; T13-I42 HydrophobicContact CG2-CG2 3.92Å; Y38-I42 HydrophobicContact CD1-CG1 3.97Å; Y38-I42 HydrophobicContact CE1-CD1 4.08Å; Y38-I42 HydrophobicContact CE1-CG1 3.61Å; Y38-I42 WeakPolarHBondContact O-CG1 3.4Å; Y38-I42 PolarHBondContact O-N 3.34Å; D39-I42 PolarHBondContact O-N 3.15Å; I42-F44 VanDerWaalsContact C-N 3.29Å; I42-F44 PolarHBondContact O-N 2.94Å; I42-C45 PolarHBondContact O-N 3.45Å; I42-T46 WeakPolarHBondContact O-CB 3.46Å; I42-T46 PolarHBondContact O-N 2.9Å; I42-T46 PolarHBondContact O-OG1 3.49Å
43	D	94	Very high	92.3	Very high	111 Å²	111	74.6 Å²	74.6	59%	0.594	37%	0.367	S	S	*	.	H	α-helix	trans	-58.7	-43.9	175.8	-70.3	-17.6	0	0	0	110.6	D39 C45 T46 D47	D39-D43 WeakPolarHBondContact O-CB 3.49Å; D39-D43 VanDerWaalsContact O-CG 3.26Å; D39-D43 PolarHBondContact O-N 3.3Å; D43-C45 VanDerWaalsContact C-N 3.34Å; D43-C45 PolarHBondContact O-N 3.44Å; D43-T46 PolarHBondContact O-N 3.02Å; D43-D47 PolarHBondContact O-N 3.25Å
44	F	93	Very high	92.2	Very high	25 Å²	25	69.7 Å²	69.7	11%	0.11	35%	0.345	C	S	.	.	H	α-helix	trans	-62.1	-39.7	176.9	-173.6	-89.9	0	0	0	112.7	R40 L41 I42 N50 I54 F130 Q133	R40-F44 VanDerWaalsContact O-CB 3.27Å; R40-F44 WeakPolarHBondContact O-CB 3.35Å; R40-F44 PolarHBondContact O-N 2.95Å; L41-F44 PolarHBondContact O-N 2.92Å; I42-F44 VanDerWaalsContact C-N 3.29Å; I42-F44 PolarHBondContact O-N 2.94Å; F44-N50 HydrophobicContact CD1-CB 4.3Å; F44-N50 HydrophobicContact CE1-CB 3.85Å; F44-N50 HydrophobicContact CE2-CB 4.16Å; F44-N50 HydrophobicContact CZ-CB 3.76Å; F44-N50 WeakPolarHBondContact O-CB 3.49Å; F44-N50 PolarHBondContact O-ND2 3.26Å; F44-I54 HydrophobicContact CE1-CD1 4.34Å; F44-I54 HydrophobicContact CE1-CG1 4.03Å; F44-F130 HydrophobicContact CE1-CB 4.11Å; F44-Q133 HydrophobicContact CB-CG 4.25Å; F44-Q133 HydrophobicContact CD1-CG 4.42Å; F44-Q133 HydrophobicContact CD2-CG 4.28Å; F44-Q133 HydrophobicContact CG-CG 4.05Å
45	C	91.6	Very high	91.9	Very high	56 Å²	56	71.8 Å²	71.8	38%	0.378	36%	0.361	S	S	.	.	H	α-helix	trans	-74.2	-25.7	178.6	-64.5	0	0	0	0	113.2	L41 I42 D43	L41-C45 PolarHBondContact O-N 2.73Å; L41-C45 PolarHBondContact O-SG 3.24Å; I42-C45 PolarHBondContact O-N 3.45Å; D43-C45 VanDerWaalsContact C-N 3.34Å; D43-C45 PolarHBondContact O-N 3.44Å
46	T	89.6	Confident	91.5	Very high	103 Å²	103	73.6 Å²	73.6	63%	0.632	38%	0.375	S	S	*	.	H	α-helix	trans	-82.1	-24.8	-178.8	-53.7	0	0	0	0	111.9	I42 D43 V48	I42-T46 WeakPolarHBondContact O-CB 3.46Å; I42-T46 PolarHBondContact O-N 2.9Å; I42-T46 PolarHBondContact O-OG1 3.49Å; D43-T46 PolarHBondContact O-N 3.02Å; T46-V48 PolarHBondContact O-N 3.13Å
47	D	90.8	Very high	91.2	Very high	75 Å²	75	71 Å²	71	40%	0.401	36%	0.356	S	S	.	.			trans	-72.6	112.9	176.4	177.9	8.4	0	0	0	111.9	D43 Q49 N50	D43-D47 PolarHBondContact O-N 3.25Å; D47-Q49 PolarHBondContact O-N 3.48Å; D47-Q49 VanDerWaalsContact O-N 3.12Å; D47-Q49 WeakPolarHBondContact OD1-CB 3.47Å; D47-Q49 WeakPolarHBondContact OD1-CG 3.37Å; D47-Q49 PolarHBondContact OD1-N 3.32Å; D47-N50 WeakPolarHBondContact CB-ND2 3.35Å; D47-N50 WeakPolarHBondContact O-CB 3.37Å; D47-N50 PolarHBondContact O-N 2.88Å; D47-N50 PolarHBondContact OD2-ND2 3.01Å
48	V	87.7	Confident	91	Very high	106 Å²	106	71 Å²	71	64%	0.642	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-55.3	-29.1	179.4	-176.9	0	0	0	0	112.4	T46 N50 E51	T46-V48 PolarHBondContact O-N 3.13Å; V48-N50 PolarHBondContact O-N 3.03Å; V48-E51 WeakPolarHBondContact O-CB 3.34Å; V48-E51 PolarHBondContact O-N 2.86Å
49	Q	88.3	Confident	90.5	Very high	148 Å²	148	72.3 Å²	72.3	69%	0.692	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-66.3	-24.5	178.3	-61	-59.4	-33.8	0	0	112.6	D47	D47-Q49 PolarHBondContact O-N 3.48Å; D47-Q49 VanDerWaalsContact O-N 3.12Å; D47-Q49 WeakPolarHBondContact OD1-CB 3.47Å; D47-Q49 WeakPolarHBondContact OD1-CG 3.37Å; D47-Q49 PolarHBondContact OD1-N 3.32Å
50	N	89.2	Confident	90	Very high	10 Å²	10	75.2 Å²	75.2	5%	0.053	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-88.2	-11.6	-180	-61.3	-44.5	0	0	0	112.9	F44 D47 V48 R52 R53 I54	F44-N50 HydrophobicContact CD1-CB 4.3Å; F44-N50 HydrophobicContact CE1-CB 3.85Å; F44-N50 HydrophobicContact CE2-CB 4.16Å; F44-N50 HydrophobicContact CZ-CB 3.76Å; F44-N50 WeakPolarHBondContact O-CB 3.49Å; F44-N50 PolarHBondContact O-ND2 3.26Å; D47-N50 WeakPolarHBondContact CB-ND2 3.35Å; D47-N50 WeakPolarHBondContact O-CB 3.37Å; D47-N50 PolarHBondContact O-N 2.88Å; D47-N50 PolarHBondContact OD2-ND2 3.01Å; V48-N50 PolarHBondContact O-N 3.03Å; N50-R52 VanDerWaalsContact C-N 3.32Å; N50-R52 PolarHBondContact O-N 3.07Å; N50-R53 WeakPolarHBondContact O-CA 3.3Å; N50-R53 WeakPolarHBondContact O-CB 3.47Å; N50-R53 PolarHBondContact O-N 3.04Å; N50-R53 PolarHBondContact OD1-NH1 3.3Å; N50-R53 VanDerWaalsContact OD1-NH1 3.17Å; N50-I54 HydrophobicContact CB-CD1 4.27Å; N50-I54 WeakPolarHBondContact O-CG1 3.46Å; N50-I54 PolarHBondContact O-N 3.42Å
51	E	86.6	Confident	89.5	Confident	115 Å²	115	74.8 Å²	74.8	54%	0.537	39%	0.385	S	S	.	.	H	α-helix	trans	-55.5	-44.8	-177.3	-169.6	-179.8	177.9	0	0	112.1	V48 R53 I54 A55	V48-E51 WeakPolarHBondContact O-CB 3.34Å; V48-E51 PolarHBondContact O-N 2.86Å; E51-R53 VanDerWaalsContact C-N 3.29Å; E51-R53 PolarHBondContact O-N 3.29Å; E51-I54 PolarHBondContact O-N 3.48Å; E51-A55 WeakPolarHBondContact O-CB 3.49Å; E51-A55 PolarHBondContact O-N 2.89Å
52	R	87.1	Confident	89.2	Confident	218 Å²	218	82.8 Å²	82.8	82%	0.823	42%	0.419	S	S	*	.	H	α-helix	trans	-63	-35	176	-67.2	-175.5	-173.7	171	2.6	112.7	N50 S56	N50-R52 VanDerWaalsContact C-N 3.32Å; N50-R52 PolarHBondContact O-N 3.07Å; R52-S56 WeakPolarHBondContact O-CB 3.44Å; R52-S56 PolarHBondContact O-N 3.24Å
53	R	87.4	Confident	88.9	Confident	139 Å²	139	81.6 Å²	81.6	53%	0.525	41%	0.414	S	S	.	.	H	α-helix	trans	-72	-43.9	178.6	-62.7	176.6	178.8	164.1	-4.1	110.7	N50 E51 A55 S56 E57	N50-R53 WeakPolarHBondContact O-CA 3.3Å; N50-R53 WeakPolarHBondContact O-CB 3.47Å; N50-R53 PolarHBondContact O-N 3.04Å; N50-R53 PolarHBondContact OD1-NH1 3.3Å; N50-R53 VanDerWaalsContact OD1-NH1 3.17Å; E51-R53 VanDerWaalsContact C-N 3.29Å; E51-R53 PolarHBondContact O-N 3.29Å; R53-A55 VanDerWaalsContact C-N 3.34Å; R53-A55 PolarHBondContact O-N 2.9Å; R53-S56 PolarHBondContact O-N 3.47Å; R53-E57 PolarHBondContact O-N 2.88Å
54	I	91	Very high	88.4	Confident	19 Å²	19	81.4 Å²	81.4	10%	0.097	42%	0.418	C	S	.	.	H	α-helix	trans	-58.3	-47.9	174.4	-63.9	160.8	0	0	0	109.7	F44 N50 E51 S56 E57 L58 L66 F130	F44-I54 HydrophobicContact CE1-CD1 4.34Å; F44-I54 HydrophobicContact CE1-CG1 4.03Å; N50-I54 HydrophobicContact CB-CD1 4.27Å; N50-I54 WeakPolarHBondContact O-CG1 3.46Å; N50-I54 PolarHBondContact O-N 3.42Å; E51-I54 PolarHBondContact O-N 3.48Å; I54-S56 PolarHBondContact O-N 3.32Å; I54-E57 PolarHBondContact O-N 3.5Å; I54-L58 HydrophobicContact CG2-CD1 3.69Å; I54-L58 HydrophobicContact CG2-CG 4.39Å; I54-L58 WeakPolarHBondContact O-CB 3.48Å; I54-L58 WeakPolarHBondContact O-CG 3.38Å; I54-L58 PolarHBondContact O-N 3.35Å; I54-L66 HydrophobicContact CG2-CD1 4.45Å; I54-L66 HydrophobicContact CG2-CD2 4.09Å; I54-F130 HydrophobicContact CG1-CB 3.96Å; I54-F130 HydrophobicContact CG1-CD2 4.37Å; I54-F130 HydrophobicContact CG1-CG 4.4Å; I54-F130 HydrophobicContact CG2-CG 4.45Å
55	A	88.1	Confident	88.1	Confident	43 Å²	43	86.3 Å²	86.3	36%	0.355	44%	0.443	S	S	.	.	H	α-helix	trans	-57.4	-46.1	177	0	0	0	0	0	112.4	E51 R53 G59 L66	E51-A55 WeakPolarHBondContact O-CB 3.49Å; E51-A55 PolarHBondContact O-N 2.89Å; R53-A55 VanDerWaalsContact C-N 3.34Å; R53-A55 PolarHBondContact O-N 2.9Å; A55-G59 WeakPolarHBondContact O-CA 3.3Å; A55-G59 PolarHBondContact O-N 2.95Å; A55-L66 HydrophobicContact CB-CD1 3.68Å
56	S	87.7	Confident	87.9	Confident	72 Å²	72	87.5 Å²	87.5	50%	0.503	45%	0.445	S	S	.	.	H	α-helix	trans	-63.7	-47.2	179.2	-168.4	0	0	0	0	112	R52 R53 I54 G59 E60	R52-S56 WeakPolarHBondContact O-CB 3.44Å; R52-S56 PolarHBondContact O-N 3.24Å; R53-S56 PolarHBondContact O-N 3.47Å; I54-S56 PolarHBondContact O-N 3.32Å; S56-G59 PolarHBondContact O-N 3.45Å; S56-E60 PolarHBondContact O-N 3.38Å
57	E	90	Very high	87.8	Confident	2 Å²	2	84.1 Å²	84.1	1%	0.009	43%	0.426	C	S	.	.	H	α-helix	trans	-66.1	-42.1	-178.6	-79.9	-177	-148.2	0	0	113.1	R53 I54 V126 G129 F130 L131	R53-E57 PolarHBondContact O-N 2.88Å; I54-E57 PolarHBondContact O-N 3.5Å; E57-V126 HydrophobicContact CG-CB 4.21Å; E57-V126 HydrophobicContact CG-CG2 3.92Å; E57-V126 VanDerWaalsContact OE1-CB 3.31Å; E57-V126 WeakPolarHBondContact OE1-CB 3.49Å; E57-V126 WeakPolarHBondContact OE1-CG1 3.32Å; E57-G129 WeakPolarHBondContact OE1-CA 3.32Å; E57-F130 PolarHBondContact OE1-N 2.89Å; E57-F130 PolarHBondContact OE2-N 3.24Å; E57-F130 VanDerWaalsContact OE2-N 3.17Å; E57-L131 HydrophobicContact CB-CD1 4.33Å; E57-L131 WeakPolarHBondContact OE2-CB 3.39Å; E57-L131 WeakPolarHBondContact OE2-CG 3.26Å; E57-L131 PolarHBondContact OE2-N 2.91Å
58	L	89.7	Confident	87.6	Confident	1 Å²	1	82.4 Å²	82.4	1%	0.005	42%	0.415	C	S	.	.	H	α-helix	trans	-77.4	-28.6	-179.9	-65.6	179	0	0	0	111.7	I54 R61 K62 V63 L66 V71 F75 F130 L131	I54-L58 HydrophobicContact CG2-CD1 3.69Å; I54-L58 HydrophobicContact CG2-CG 4.39Å; I54-L58 WeakPolarHBondContact O-CB 3.48Å; I54-L58 WeakPolarHBondContact O-CG 3.38Å; I54-L58 PolarHBondContact O-N 3.35Å; L58-R61 CarbonylContact O-C 3.44Å; L58-R61 WeakPolarHBondContact O-CA 3.46Å; L58-R61 PolarHBondContact O-N 3.01Å; L58-K62 PolarHBondContact O-N 3.39Å; L58-V63 HydrophobicContact CB-CB 4Å; L58-V63 HydrophobicContact CB-CG2 4Å; L58-V63 HydrophobicContact CD2-CG2 4.23Å; L58-V63 PolarHBondContact O-N 3.21Å; L58-V63 VanDerWaalsContact O-N 3.08Å; L58-L66 HydrophobicContact CB-CD2 4.14Å; L58-L66 HydrophobicContact CD1-CD2 3.61Å; L58-L66 HydrophobicContact CG-CD2 4.47Å; L58-V71 HydrophobicContact CD1-CG1 3.83Å; L58-V71 HydrophobicContact CD1-CG2 3.85Å; L58-F75 HydrophobicContact CD2-CD1 4.19Å; L58-F75 HydrophobicContact CD2-CE1 3.92Å; L58-F75 HydrophobicContact CD2-CZ 4.47Å; L58-F130 HydrophobicContact CD1-CD1 4.34Å; L58-F130 HydrophobicContact CD1-CE1 4.25Å; L58-F130 HydrophobicContact CD2-CD1 4Å; L58-F130 HydrophobicContact CD2-CE1 3.94Å; L58-F130 HydrophobicContact CG-CD1 4.28Å; L58-F130 HydrophobicContact CG-CE1 4.47Å; L58-L131 HydrophobicContact CD2-CD2 4.5Å
59	G	86.3	Confident	87.7	Confident	45 Å²	45	81 Å²	81	46%	0.464	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-40.9	171.1	0	0	0	0	0	112.9	A55 S56 R61 K62	A55-G59 WeakPolarHBondContact O-CA 3.3Å; A55-G59 PolarHBondContact O-N 2.95Å; S56-G59 PolarHBondContact O-N 3.45Å; G59-R61 PolarHBondContact O-N 3.49Å; G59-K62 PolarHBondContact O-N 2.93Å
60	E	86.1	Confident	87.8	Confident	119 Å²	119	75.6 Å²	75.6	56%	0.556	38%	0.375	S	S	*	.	H	α-helix	trans	-59.5	-27.1	173	-73.4	-178.2	-179.3	0	0	112.6	S56 T125	S56-E60 PolarHBondContact O-N 3.38Å; E60-T125 PolarHBondContact OE2-OG1 3.07Å; E60-T125 VanDerWaalsContact OE2-OG1 3.11Å
61	R	85.9	Confident	87.9	Confident	101 Å²	101	75.9 Å²	75.9	38%	0.381	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	7.5	177.9	-63.4	-172.8	174.7	-103.1	-3.9	113.7	L58 G59 V63 F75	L58-R61 CarbonylContact O-C 3.44Å; L58-R61 WeakPolarHBondContact O-CA 3.46Å; L58-R61 PolarHBondContact O-N 3.01Å; G59-R61 PolarHBondContact O-N 3.49Å; R61-V63 VanDerWaalsContact C-N 3.29Å; R61-V63 HydrophobicContact CB-CG2 4.45Å; R61-V63 PolarHBondContact O-N 2.94Å; R61-F75 HydrophobicContact CB-CE2 4.12Å
62	K	88.7	Confident	88.1	Confident	187 Å²	187	72.4 Å²	72.4	81%	0.813	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	31.1	178.5	-49.9	179.2	179.6	-177.9	0	113.8	L58 G59 P64	L58-K62 PolarHBondContact O-N 3.39Å; G59-K62 PolarHBondContact O-N 2.93Å; K62-P64 WeakPolarHBondContact O-CD 3.47Å
63	V	88.8	Confident	88.2	Confident	19 Å²	19	62.3 Å²	62.3	12%	0.115	33%	0.326	C	S	.	.			trans	-71.7	121	171.1	-177.7	0	0	0	0	108.5	L58 R61 D70 V71 F75	L58-V63 HydrophobicContact CB-CB 4Å; L58-V63 HydrophobicContact CB-CG2 4Å; L58-V63 HydrophobicContact CD2-CG2 4.23Å; L58-V63 PolarHBondContact O-N 3.21Å; L58-V63 VanDerWaalsContact O-N 3.08Å; R61-V63 VanDerWaalsContact C-N 3.29Å; R61-V63 HydrophobicContact CB-CG2 4.45Å; R61-V63 PolarHBondContact O-N 2.94Å; V63-D70 HydrophobicContact CG1-CB 3.93Å; V63-V71 HydrophobicContact CG1-CG2 4.08Å; V63-F75 HydrophobicContact CG2-CB 4.26Å; V63-F75 HydrophobicContact CG2-CD2 3.93Å; V63-F75 HydrophobicContact CG2-CE2 4.5Å; V63-F75 HydrophobicContact CG2-CG 3.99Å
64	P	83.8	Confident	88.3	Confident	106 Å²	106	59.9 Å²	59.9	69%	0.688	32%	0.323	S	S	*	.			trans	-69.1	-46.5	-170	-23	34.6	0	0	0	114.9	K62	K62-P64 WeakPolarHBondContact O-CD 3.47Å
65	M	86	Confident	88.1	Confident	128 Å²	128	60.9 Å²	60.9	63%	0.631	33%	0.327	S	S	*	.	S	Bend	trans	-132.5	153.1	174.1	-61.2	-160.2	-72.5	0	0	111.7	S67 D70	M65-S67 PolarHBondContact O-N 3.37Å; M65-D70 WeakPolarHBondContact CB-OD2 3.47Å; M65-D70 PolarHBondContact N-OD2 2.93Å; M65-D70 VanDerWaalsContact O-CB 3.28Å; M65-D70 WeakPolarHBondContact O-CB 3.33Å
66	L	86.4	Confident	88.3	Confident	82 Å²	82	60.4 Å²	60.4	43%	0.429	32%	0.318	S	S	.	.	S	Bend	trans	-80.8	62.9	172.1	-64.9	-175.7	0	0	0	110.8	I54 A55 L58 V71	I54-L66 HydrophobicContact CG2-CD1 4.45Å; I54-L66 HydrophobicContact CG2-CD2 4.09Å; A55-L66 HydrophobicContact CB-CD1 3.68Å; L58-L66 HydrophobicContact CB-CD2 4.14Å; L58-L66 HydrophobicContact CD1-CD2 3.61Å; L58-L66 HydrophobicContact CG-CD2 4.47Å; L66-V71 HydrophobicContact CD2-CG2 4.24Å
67	S	87.6	Confident	88.3	Confident	32 Å²	32	59.2 Å²	59.2	22%	0.224	31%	0.306	C	S	.	.	S	Bend	trans	-111.4	160.2	178.5	76.5	0	0	0	0	111.1	M65 Y69 D70 V71	M65-S67 PolarHBondContact O-N 3.37Å; S67-Y69 PolarHBondContact O-N 2.94Å; S67-Y69 PolarHBondContact OG-N 3.46Å; S67-D70 PolarHBondContact O-N 3.43Å; S67-D70 PolarHBondContact OG-N 3Å; S67-D70 VanDerWaalsContact OG-N 3.12Å; S67-D70 PolarHBondContact OG-OD2 3.16Å; S67-V71 WeakPolarHBondContact O-CB 3.36Å; S67-V71 WeakPolarHBondContact O-CG2 3.42Å; S67-V71 PolarHBondContact O-N 3.32Å
68	F	87.7	Confident	88.2	Confident	38 Å²	38	62.1 Å²	62.1	17%	0.167	32%	0.321	C	S	.	.	I	π-helix	trans	-52.9	-39.8	170.1	171	-93.5	0	0	0	111.4	F3 V12 V72 S73	F3-F68 HydrophobicContact CD2-CB 3.65Å; F3-F68 HydrophobicContact CD2-CD1 4.46Å; F3-F68 HydrophobicContact CD2-CG 4.07Å; F3-F68 HydrophobicContact CE1-CD2 4.35Å; F3-F68 HydrophobicContact CE1-CG 4.46Å; F3-F68 HydrophobicContact CE2-CB 3.44Å; F3-F68 VanDerWaalsContact CE2-CB 3.44Å; F3-F68 AromaticContact CE2-CD1 3.44Å; F3-F68 HydrophobicContact CE2-CD1 3.44Å; F3-F68 VanDerWaalsContact CE2-CD1 3.44Å; F3-F68 HydrophobicContact CE2-CD2 4Å; F3-F68 HydrophobicContact CE2-CE1 4.18Å; F3-F68 AromaticContact CE2-CG 3.33Å; F3-F68 HydrophobicContact CE2-CG 3.33Å; F3-F68 HydrophobicContact CG-CB 4.46Å; F3-F68 HydrophobicContact CZ-CB 4.08Å; F3-F68 AromaticContact CZ-CD1 3.74Å; F3-F68 HydrophobicContact CZ-CD1 3.74Å; F3-F68 AromaticContact CZ-CD2 3.75Å; F3-F68 HydrophobicContact CZ-CD2 3.75Å; F3-F68 HydrophobicContact CZ-CE1 4.08Å; F3-F68 HydrophobicContact CZ-CE2 4.09Å; F3-F68 AromaticContact CZ-CG 3.56Å; F3-F68 HydrophobicContact CZ-CG 3.56Å; F3-F68 HydrophobicContact CZ-CZ 4.24Å; V12-F68 HydrophobicContact CG1-CE2 4.26Å; F68-V72 HydrophobicContact CD2-CB 3.88Å; F68-V72 HydrophobicContact CD2-CG1 4.24Å; F68-V72 HydrophobicContact CD2-CG2 4.04Å; F68-V72 HydrophobicContact CE2-CB 3.96Å; F68-V72 HydrophobicContact CE2-CG1 3.83Å; F68-V72 HydrophobicContact CE2-CG2 4.44Å; F68-V72 HydrophobicContact CG-CB 4.48Å; F68-V72 HydrophobicContact CZ-CG1 4.43Å; F68-V72 WeakPolarHBondContact O-CA 3.18Å; F68-V72 VanDerWaalsContact O-CB 3.27Å; F68-V72 WeakPolarHBondContact O-CB 3.14Å; F68-V72 PolarHBondContact O-N 3.01Å; F68-S73 PolarHBondContact O-N 2.97Å
69	Y	89.5	Confident	87.9	Confident	76 Å²	76	65.7 Å²	65.7	30%	0.298	34%	0.34	S	S	.	.	I	π-helix	trans	-68.3	-49.5	-175.7	-57	-72.1	0	0	0	112	S67 S73 D74	S67-Y69 PolarHBondContact O-N 2.94Å; S67-Y69 PolarHBondContact OG-N 3.46Å; Y69-S73 CarbonylContact O-C 3.55Å; Y69-S73 WeakPolarHBondContact O-CA 3.46Å; Y69-S73 WeakPolarHBondContact O-CB 3.36Å; Y69-S73 PolarHBondContact O-N 3.37Å; Y69-D74 PolarHBondContact O-N 3.37Å
70	D	91.1	Very high	87.8	Confident	36 Å²	36	64.8 Å²	64.8	19%	0.193	33%	0.328	C	S	.	.	I	π-helix	trans	-77.1	-37	-176.5	-59.9	-41.9	0	0	0	112.4	V63 M65 S67 F75	V63-D70 HydrophobicContact CG1-CB 3.93Å; M65-D70 WeakPolarHBondContact CB-OD2 3.47Å; M65-D70 PolarHBondContact N-OD2 2.93Å; M65-D70 VanDerWaalsContact O-CB 3.28Å; M65-D70 WeakPolarHBondContact O-CB 3.33Å; S67-D70 PolarHBondContact O-N 3.43Å; S67-D70 PolarHBondContact OG-N 3Å; S67-D70 VanDerWaalsContact OG-N 3.12Å; S67-D70 PolarHBondContact OG-OD2 3.16Å; D70-F75 WeakPolarHBondContact O-CB 3.29Å; D70-F75 PolarHBondContact O-N 3.2Å
71	V	91	Very high	87.5	Confident	15 Å²	15	60 Å²	60	9%	0.091	31%	0.306	C	S	.	.	I	π-helix	trans	-84.7	-55.3	-177.1	-175.7	0	0	0	0	111.4	L58 V63 L66 S67 F75 I76 F130	L58-V71 HydrophobicContact CD1-CG1 3.83Å; L58-V71 HydrophobicContact CD1-CG2 3.85Å; V63-V71 HydrophobicContact CG1-CG2 4.08Å; L66-V71 HydrophobicContact CD2-CG2 4.24Å; S67-V71 WeakPolarHBondContact O-CB 3.36Å; S67-V71 WeakPolarHBondContact O-CG2 3.42Å; S67-V71 PolarHBondContact O-N 3.32Å; V71-F75 WeakPolarHBondContact O-CB 3.5Å; V71-I76 HydrophobicContact CG1-CD1 4.39Å; V71-I76 VanDerWaalsContact O-CG1 3.26Å; V71-I76 WeakPolarHBondContact O-CG1 3.3Å; V71-I76 PolarHBondContact O-N 2.94Å; V71-I76 VanDerWaalsContact O-N 3.1Å; V71-F130 HydrophobicContact CG1-CZ 4.2Å
72	V	89.7	Confident	87.2	Confident	42 Å²	42	59.7 Å²	59.7	26%	0.255	31%	0.312	S	S	.	.	I	π-helix	trans	-85.3	-48.7	-172.3	-176	0	0	0	0	110.7	F68 I76 I77	F68-V72 HydrophobicContact CD2-CB 3.88Å; F68-V72 HydrophobicContact CD2-CG1 4.24Å; F68-V72 HydrophobicContact CD2-CG2 4.04Å; F68-V72 HydrophobicContact CE2-CB 3.96Å; F68-V72 HydrophobicContact CE2-CG1 3.83Å; F68-V72 HydrophobicContact CE2-CG2 4.44Å; F68-V72 HydrophobicContact CG-CB 4.48Å; F68-V72 HydrophobicContact CZ-CG1 4.43Å; F68-V72 WeakPolarHBondContact O-CA 3.18Å; F68-V72 VanDerWaalsContact O-CB 3.27Å; F68-V72 WeakPolarHBondContact O-CB 3.14Å; F68-V72 PolarHBondContact O-N 3.01Å; V72-I76 WeakPolarHBondContact O-CB 3.5Å; V72-I77 HydrophobicContact CG1-CD1 3.99Å; V72-I77 WeakPolarHBondContact O-CB 3.37Å; V72-I77 VanDerWaalsContact O-CG1 3.24Å; V72-I77 WeakPolarHBondContact O-CG1 3.27Å; V72-I77 PolarHBondContact O-N 3.2Å
73	S	89.1	Confident	86.6	Confident	7 Å²	7	55.5 Å²	55.5	5%	0.049	30%	0.295	C	S	.	.	I	π-helix	trans	-71.5	-58	-176.5	-136	0	0	0	0	111.3	F68 Y69 I77 L78 H171	F68-S73 PolarHBondContact O-N 2.97Å; Y69-S73 CarbonylContact O-C 3.55Å; Y69-S73 WeakPolarHBondContact O-CA 3.46Å; Y69-S73 WeakPolarHBondContact O-CB 3.36Å; Y69-S73 PolarHBondContact O-N 3.37Å; S73-I77 WeakPolarHBondContact O-CB 3.38Å; S73-I77 PolarHBondContact O-N 3.28Å; S73-L78 WeakPolarHBondContact O-CG 3.39Å; S73-L78 PolarHBondContact O-N 3.05Å; S73-H171 PolarHBondContact OG-CE1 3.2Å; S73-H171 PolarHBondContact OG-NE2 3.49Å
74	D	90	Very high	85.8	Confident	87 Å²	87	56.5 Å²	56.5	47%	0.465	30%	0.299	S	S	.	.	I	π-helix	trans	-80	-64.5	-173.4	-167.7	31.9	0	0	0	111.7	Y69 I76 L78 D79	Y69-D74 PolarHBondContact O-N 3.37Å; D74-I76 PolarHBondContact O-N 3.31Å; D74-L78 PolarHBondContact O-N 2.88Å; D74-D79 PolarHBondContact O-N 2.75Å; D74-D79 VanDerWaalsContact O-N 3.14Å
75	F	88	Confident	85.1	Confident	40 Å²	40	53.6 Å²	53.6	18%	0.175	28%	0.28	C	S	.	.	I	π-helix	trans	-65.6	-32.1	-173	177.6	-103	0	0	0	114.3	L58 R61 V63 D70 V71 D79 L131	L58-F75 HydrophobicContact CD2-CD1 4.19Å; L58-F75 HydrophobicContact CD2-CE1 3.92Å; L58-F75 HydrophobicContact CD2-CZ 4.47Å; R61-F75 HydrophobicContact CB-CE2 4.12Å; V63-F75 HydrophobicContact CG2-CB 4.26Å; V63-F75 HydrophobicContact CG2-CD2 3.93Å; V63-F75 HydrophobicContact CG2-CE2 4.5Å; V63-F75 HydrophobicContact CG2-CG 3.99Å; D70-F75 WeakPolarHBondContact O-CB 3.29Å; D70-F75 PolarHBondContact O-N 3.2Å; V71-F75 WeakPolarHBondContact O-CB 3.5Å; F75-D79 VanDerWaalsContact O-CB 3.27Å; F75-D79 WeakPolarHBondContact O-CB 3.33Å; F75-L131 HydrophobicContact CE1-CD2 4.24Å; F75-L131 HydrophobicContact CZ-CD2 4.39Å
76	I	90.7	Very high	84.5	Confident	34 Å²	34	54.1 Å²	54.1	17%	0.174	28%	0.28	C	S	.	.	I	π-helix	trans	-98.8	-60.4	179.8	-66.6	167.9	0	0	0	111.6	V71 V72 D74 A80 F130 F134	V71-I76 HydrophobicContact CG1-CD1 4.39Å; V71-I76 VanDerWaalsContact O-CG1 3.26Å; V71-I76 WeakPolarHBondContact O-CG1 3.3Å; V71-I76 PolarHBondContact O-N 2.94Å; V71-I76 VanDerWaalsContact O-N 3.1Å; V72-I76 WeakPolarHBondContact O-CB 3.5Å; D74-I76 PolarHBondContact O-N 3.31Å; I76-A80 WeakPolarHBondContact O-CB 3.49Å; I76-A80 PolarHBondContact O-N 2.92Å; I76-A80 VanDerWaalsContact O-N 3.14Å; I76-F130 HydrophobicContact CD1-CZ 4.36Å; I76-F134 HydrophobicContact CB-CE2 4.39Å; I76-F134 HydrophobicContact CD1-CD2 4.03Å; I76-F134 HydrophobicContact CD1-CE2 3.73Å; I76-F134 HydrophobicContact CD1-CZ 4.42Å; I76-F134 HydrophobicContact CG1-CD2 4.47Å; I76-F134 HydrophobicContact CG1-CE2 3.78Å; I76-F134 HydrophobicContact CG1-CZ 3.99Å; I76-F134 HydrophobicContact CG2-CE2 3.69Å; I76-F134 HydrophobicContact CG2-CZ 3.95Å
77	I	88.6	Confident	84	Confident	46 Å²	46	51.4 Å²	51.4	24%	0.236	27%	0.267	C	S	.	.	I	π-helix	trans	-74.4	-53.3	-168.8	-69.1	168.6	0	0	0	111.1	V72 S73 A80 M81 I167	V72-I77 HydrophobicContact CG1-CD1 3.99Å; V72-I77 WeakPolarHBondContact O-CB 3.37Å; V72-I77 VanDerWaalsContact O-CG1 3.24Å; V72-I77 WeakPolarHBondContact O-CG1 3.27Å; V72-I77 PolarHBondContact O-N 3.2Å; S73-I77 WeakPolarHBondContact O-CB 3.38Å; S73-I77 PolarHBondContact O-N 3.28Å; I77-A80 PolarHBondContact O-N 3.15Å; I77-M81 HydrophobicContact CG2-SD 4.12Å; I77-M81 VanDerWaalsContact O-CG 3.24Å; I77-M81 WeakPolarHBondContact O-CG 3.43Å; I77-M81 PolarHBondContact O-N 3.09Å; I77-I167 HydrophobicContact CG2-CD1 4.12Å; I77-I167 HydrophobicContact CG2-CG2 3.53Å
78	L	86.9	Confident	83.5	Confident	64 Å²	64	53.8 Å²	53.8	34%	0.335	28%	0.282	S	S	.	.	I	π-helix	trans	-67.3	-43.7	-177.1	-67.5	-178.7	0	0	0	111.7	S73 D74 A80 M81 D82	S73-L78 WeakPolarHBondContact O-CG 3.39Å; S73-L78 PolarHBondContact O-N 3.05Å; D74-L78 PolarHBondContact O-N 2.88Å; L78-A80 PolarHBondContact O-N 3.43Å; L78-M81 PolarHBondContact O-N 3Å; L78-M81 VanDerWaalsContact O-N 3.13Å; L78-D82 PolarHBondContact O-N 3.45Å
79	D	84.8	Confident	83	Confident	75 Å²	75	54.7 Å²	54.7	40%	0.401	30%	0.302	S	S	.	.	H	α-helix	trans	-58.5	-47.1	175.5	-168.7	53.4	0	0	0	111.5	D74 F75 M81 D82 E83	D74-D79 PolarHBondContact O-N 2.75Å; D74-D79 VanDerWaalsContact O-N 3.14Å; F75-D79 VanDerWaalsContact O-CB 3.27Å; F75-D79 WeakPolarHBondContact O-CB 3.33Å; D79-M81 VanDerWaalsContact C-N 3.29Å; D79-M81 PolarHBondContact O-N 2.71Å; D79-D82 PolarHBondContact O-N 3.31Å; D79-E83 WeakPolarHBondContact O-CG 3.41Å; D79-E83 PolarHBondContact O-N 2.93Å
80	A	84	Confident	82.4	Confident	26 Å²	26	54.8 Å²	54.8	22%	0.215	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-38.5	176.6	0	0	0	0	0	112	I76 I77 L78 M84	I76-A80 WeakPolarHBondContact O-CB 3.49Å; I76-A80 PolarHBondContact O-N 2.92Å; I76-A80 VanDerWaalsContact O-N 3.14Å; I77-A80 PolarHBondContact O-N 3.15Å; L78-A80 PolarHBondContact O-N 3.43Å; A80-M84 HydrophobicContact CB-CE 4.19Å; A80-M84 WeakPolarHBondContact O-CB 3.45Å; A80-M84 WeakPolarHBondContact O-CE 3.4Å; A80-M84 WeakPolarHBondContact O-CG 3.49Å; A80-M84 PolarHBondContact O-N 3.15Å
81	M	79.9	Confident	81.9	Confident	18 Å²	18	54.3 Å²	54.3	9%	0.089	32%	0.316	C	S	.	.	H	α-helix	trans	-68.3	-38.2	178.8	-72.1	-175.2	83.7	0	0	113	I77 L78 D79 M84 T85 R164 I167 V168	I77-M81 HydrophobicContact CG2-SD 4.12Å; I77-M81 VanDerWaalsContact O-CG 3.24Å; I77-M81 WeakPolarHBondContact O-CG 3.43Å; I77-M81 PolarHBondContact O-N 3.09Å; L78-M81 PolarHBondContact O-N 3Å; L78-M81 VanDerWaalsContact O-N 3.13Å; D79-M81 VanDerWaalsContact C-N 3.29Å; D79-M81 PolarHBondContact O-N 2.71Å; M81-M84 HydrophobicContact CG-CE 4.17Å; M81-M84 PolarHBondContact O-N 3.34Å; M81-T85 WeakPolarHBondContact O-CG2 3.4Å; M81-T85 PolarHBondContact O-N 2.94Å; M81-T85 VanDerWaalsContact O-N 3.13Å; M81-R164 HydrophobicContact CE-CB 3.76Å; M81-R164 VanDerWaalsContact CE-CD 3.46Å; M81-R164 HydrophobicContact CE-CG 3.27Å; M81-I167 HydrophobicContact CE-CB 4.45Å; M81-I167 HydrophobicContact CE-CG2 4.43Å; M81-I167 HydrophobicContact SD-CB 4.08Å; M81-I167 HydrophobicContact SD-CD1 4.19Å; M81-I167 HydrophobicContact SD-CG2 3.53Å; M81-I167 VanDerWaalsContact SD-CG2 3.53Å; M81-V168 HydrophobicContact CE-CG2 3.88Å
82	D	79.5	Confident	81.4	Confident	95 Å²	95	55.8 Å²	55.8	51%	0.508	32%	0.323	S	S	.	.	H	α-helix	trans	-67.9	-47.6	175.5	-169.2	33.9	0	0	0	111.2	L78 D79 M84 T85 H86	L78-D82 PolarHBondContact O-N 3.45Å; D79-D82 PolarHBondContact O-N 3.31Å; D82-M84 PolarHBondContact O-N 2.79Å; D82-M84 VanDerWaalsContact O-N 3.17Å; D82-T85 PolarHBondContact O-N 3.09Å; D82-T85 PolarHBondContact O-OG1 3.24Å; D82-T85 PolarHBondContact OD1-OG1 3.42Å; D82-H86 PolarHBondContact O-N 3.37Å; D82-H86 IonicContact OD1-CE1 3.42Å; D82-H86 PolarHBondContact OD1-CE1 3.47Å; D82-H86 IonicContact OD1-ND1 2.64Å; D82-H86 PolarHBondContact OD1-ND1 2.97Å
83	E	75	Confident	81	Confident	99 Å²	99	56.9 Å²	56.9	46%	0.463	34%	0.337	S	S	.	.	H	α-helix	trans	-53.9	-39.8	175.1	-75.7	-166.7	163.5	0	0	111.5	D79 K120	D79-E83 WeakPolarHBondContact O-CG 3.41Å; D79-E83 PolarHBondContact O-N 2.93Å; E83-K120 VanDerWaalsContact CD-NZ 3.34Å; E83-K120 IonicContact OE1-NZ 2.81Å; E83-K120 PolarHBondContact OE1-NZ 2.89Å; E83-K120 IonicContact OE2-NZ 3.99Å; E83-K120 PolarHBondContact OE2-NZ 3.48Å; E83-K120 VanDerWaalsContact OE2-NZ 3.09Å
84	M	71.5	Confident	80.5	Confident	40 Å²	40	58.3 Å²	58.3	20%	0.197	35%	0.345	C	S	.	.	H	α-helix	trans	-71.2	-31.5	179.4	-82.4	-169.2	-70.1	0	0	113.6	A80 M81 D82 H86 F145 L149 F160	A80-M84 HydrophobicContact CB-CE 4.19Å; A80-M84 WeakPolarHBondContact O-CB 3.45Å; A80-M84 WeakPolarHBondContact O-CE 3.4Å; A80-M84 WeakPolarHBondContact O-CG 3.49Å; A80-M84 PolarHBondContact O-N 3.15Å; M81-M84 HydrophobicContact CG-CE 4.17Å; M81-M84 PolarHBondContact O-N 3.34Å; D82-M84 PolarHBondContact O-N 2.79Å; D82-M84 VanDerWaalsContact O-N 3.17Å; M84-H86 VanDerWaalsContact C-N 3.34Å; M84-H86 PolarHBondContact O-N 2.82Å; M84-F145 HydrophobicContact SD-CB 3.94Å; M84-F145 HydrophobicContact SD-CG 4.48Å; M84-L149 HydrophobicContact CB-CD2 3.58Å; M84-L149 HydrophobicContact CG-CD2 4.2Å; M84-L149 WeakPolarHBondContact O-CD2 3.44Å; M84-L149 HydrophobicContact SD-CD2 4.47Å; M84-F160 HydrophobicContact CE-CZ 3.9Å; M84-F160 HydrophobicContact SD-CZ 3.84Å
85	T	70.8	Confident	80.2	Confident	45 Å²	45	55.4 Å²	55.4	28%	0.276	33%	0.33	S	S	.	.	H	α-helix	trans	-72.7	-24.7	-178.8	50.2	0	0	0	0	114.7	M81 D82 P87 R164	M81-T85 WeakPolarHBondContact O-CG2 3.4Å; M81-T85 PolarHBondContact O-N 2.94Å; M81-T85 VanDerWaalsContact O-N 3.13Å; D82-T85 PolarHBondContact O-N 3.09Å; D82-T85 PolarHBondContact O-OG1 3.24Å; D82-T85 PolarHBondContact OD1-OG1 3.42Å; T85-P87 WeakPolarHBondContact O-CD 3.3Å; T85-R164 VanDerWaalsContact CG2-CZ 3.47Å
86	H	72.7	Confident	79.9	Confident	139 Å²	139	62.5 Å²	62.5	64%	0.644	36%	0.356	S	S	*	.	S	Bend	trans	-119.8	60.9	-172.9	-59.8	107.7	0	0	0	112	D82 M84	D82-H86 PolarHBondContact O-N 3.37Å; D82-H86 IonicContact OD1-CE1 3.42Å; D82-H86 PolarHBondContact OD1-CE1 3.47Å; D82-H86 IonicContact OD1-ND1 2.64Å; D82-H86 PolarHBondContact OD1-ND1 2.97Å; M84-H86 VanDerWaalsContact C-N 3.34Å; M84-H86 PolarHBondContact O-N 2.82Å
87	P	75.3	Confident	79.5	Confident	25 Å²	25	63.4 Å²	63.4	16%	0.162	36%	0.361	C	S	.	.			trans	-64.5	139.2	-177.1	28.2	-36.4	0	0	0	111.2	T85 L92 L150	T85-P87 WeakPolarHBondContact O-CD 3.3Å; P87-L92 HydrophobicContact CB-CG 4.41Å; P87-L92 HydrophobicContact CG-CD1 4.24Å; P87-L92 HydrophobicContact CG-CD2 3.68Å; P87-L92 HydrophobicContact CG-CG 3.85Å; P87-L150 HydrophobicContact CB-CD1 4.05Å; P87-L150 HydrophobicContact CB-CD2 4.42Å; P87-L150 HydrophobicContact CG-CD2 3.99Å
88	P	77.2	Confident	79.4	Confident	82 Å²	82	66.9 Å²	66.9	53%	0.532	39%	0.387	S	S	.	.			trans	-51.9	146.1	174.7	-28.3	32	0	0	0	113.2	A90 I91 L92	P88-A90 PolarHBondContact O-N 2.93Å; P88-A90 VanDerWaalsContact O-N 3.09Å; P88-I91 HydrophobicContact CB-CG1 4.31Å; P88-I91 HydrophobicContact CG-CD1 4.22Å; P88-I91 WeakPolarHBondContact O-CB 3.45Å; P88-I91 PolarHBondContact O-N 3.06Å; P88-L92 PolarHBondContact O-N 3.06Å
89	G	76.9	Confident	79.3	Confident	57 Å²	57	70.9 Å²	70.9	59%	0.588	41%	0.407	S	S	*	.	H	α-helix	trans	-55.8	-32.4	-175.9	0	0	0	0	0	114.3	L92 A93	G89-L92 PolarHBondContact O-N 3.43Å; G89-A93 PolarHBondContact O-N 3.05Å
90	A	76.9	Confident	79.2	Confident	78 Å²	78	69.7 Å²	69.7	65%	0.645	40%	0.4	S	S	*	.	H	α-helix	trans	-62	-41.7	175.3	0	0	0	0	0	112.6	P88 A93 V94	P88-A90 PolarHBondContact O-N 2.93Å; P88-A90 VanDerWaalsContact O-N 3.09Å; A90-A93 PolarHBondContact O-N 3.29Å; A90-V94 PolarHBondContact O-N 3.4Å
91	I	81.1	Confident	79.3	Confident	26 Å²	26	71.3 Å²	71.3	13%	0.133	41%	0.409	C	S	.	.	H	α-helix	trans	-66.5	-45.9	177.8	-52.9	-171.4	0	0	0	109.7	P88 A93 V94 V95 L109 I112 L150	P88-I91 HydrophobicContact CB-CG1 4.31Å; P88-I91 HydrophobicContact CG-CD1 4.22Å; P88-I91 WeakPolarHBondContact O-CB 3.45Å; P88-I91 PolarHBondContact O-N 3.06Å; I91-A93 PolarHBondContact O-N 2.98Å; I91-V94 PolarHBondContact O-N 3.45Å; I91-V94 VanDerWaalsContact O-N 3.17Å; I91-V95 HydrophobicContact CG2-CG2 4.28Å; I91-V95 VanDerWaalsContact O-CG2 3.29Å; I91-V95 WeakPolarHBondContact O-CG2 3.34Å; I91-V95 PolarHBondContact O-N 3.13Å; I91-L109 HydrophobicContact CG2-CD2 3.41Å; I91-L109 VanDerWaalsContact CG2-CD2 3.41Å; I91-I112 HydrophobicContact CD1-CG2 3.76Å; I91-I112 HydrophobicContact CG1-CD1 4.29Å; I91-I112 HydrophobicContact CG1-CG2 4.38Å; I91-L150 HydrophobicContact CG2-CD1 3.72Å
92	L	80.8	Confident	79.6	Confident	46 Å²	46	71.7 Å²	71.7	24%	0.241	42%	0.417	C	S	.	.	H	α-helix	trans	-58.5	-35.7	176.8	-73.3	176	0	0	0	112.4	P87 P88 G89 R96	P87-L92 HydrophobicContact CB-CG 4.41Å; P87-L92 HydrophobicContact CG-CD1 4.24Å; P87-L92 HydrophobicContact CG-CD2 3.68Å; P87-L92 HydrophobicContact CG-CG 3.85Å; P88-L92 PolarHBondContact O-N 3.06Å; G89-L92 PolarHBondContact O-N 3.43Å; L92-R96 WeakPolarHBondContact O-CB 3.43Å; L92-R96 WeakPolarHBondContact O-CG 3.3Å; L92-R96 PolarHBondContact O-N 2.95Å
93	A	81.3	Confident	79.9	Confident	66 Å²	66	70.4 Å²	70.4	55%	0.545	42%	0.416	S	S	.	.	H	α-helix	trans	-65.1	-42.5	177.7	0	0	0	0	0	112.3	G89 A90 I91 N97	G89-A93 PolarHBondContact O-N 3.05Å; A90-A93 PolarHBondContact O-N 3.29Å; I91-A93 PolarHBondContact O-N 2.98Å; A93-N97 WeakPolarHBondContact O-CB 3.41Å; A93-N97 PolarHBondContact O-N 3.47Å
94	V	79.4	Confident	80.5	Confident	36 Å²	36	68.4 Å²	68.4	22%	0.218	41%	0.41	C	S	.	.	H	α-helix	trans	-64.6	-48.8	175.8	175.2	0	0	0	0	110.7	A90 I91 R96 N97 L100 I108	A90-V94 PolarHBondContact O-N 3.4Å; I91-V94 PolarHBondContact O-N 3.45Å; I91-V94 VanDerWaalsContact O-N 3.17Å; V94-R96 PolarHBondContact O-N 3.14Å; V94-N97 WeakPolarHBondContact O-CB 3.46Å; V94-N97 PolarHBondContact O-N 2.9Å; V94-L100 HydrophobicContact CG1-CD1 3.94Å; V94-I108 HydrophobicContact CG1-CB 4.18Å; V94-I108 HydrophobicContact CG1-CD1 3.81Å; V94-I108 HydrophobicContact CG1-CG2 3.84Å; V94-I108 HydrophobicContact CG2-CG2 4.38Å
95	V	82.1	Confident	81.3	Confident	26 Å²	26	67.7 Å²	67.7	16%	0.158	41%	0.406	C	S	.	.	H	α-helix	trans	-59.5	-46.4	-179.3	167.1	0	0	0	0	111.3	I91 N97 K105 L109 L150	I91-V95 HydrophobicContact CG2-CG2 4.28Å; I91-V95 VanDerWaalsContact O-CG2 3.29Å; I91-V95 WeakPolarHBondContact O-CG2 3.34Å; I91-V95 PolarHBondContact O-N 3.13Å; V95-N97 VanDerWaalsContact C-N 3.25Å; V95-N97 PolarHBondContact O-N 3.36Å; V95-K105 WeakPolarHBondContact O-CE 3.48Å; V95-K105 PolarHBondContact O-NZ 3.41Å; V95-L109 HydrophobicContact CG2-CD1 3.97Å; V95-L109 HydrophobicContact CG2-CD2 3.97Å; V95-L109 HydrophobicContact CG2-CG 4.34Å; V95-L150 HydrophobicContact CG1-CB 4.4Å; V95-L150 WeakPolarHBondContact CG1-O 3.42Å; V95-L150 HydrophobicContact CG2-CB 3.82Å
96	R	81.7	Confident	82.2	Confident	189 Å²	189	69 Å²	69	71%	0.713	41%	0.409	S	S	*	.	H	α-helix	trans	-78	-6.8	-177.8	-68.7	177.4	175	179.8	0.9	113.6	L92 V94 P98	L92-R96 WeakPolarHBondContact O-CB 3.43Å; L92-R96 WeakPolarHBondContact O-CG 3.3Å; L92-R96 PolarHBondContact O-N 2.95Å; V94-R96 PolarHBondContact O-N 3.14Å; R96-P98 WeakPolarHBondContact O-CD 3.48Å
97	N	83.9	Confident	83	Confident	53 Å²	53	70 Å²	70	28%	0.283	41%	0.411	S	S	.	.			trans	-71	111.4	-179.9	-170.1	-24.3	0	0	0	111	A93 V94 V95 I99 L100 K105	A93-N97 WeakPolarHBondContact O-CB 3.41Å; A93-N97 PolarHBondContact O-N 3.47Å; V94-N97 WeakPolarHBondContact O-CB 3.46Å; V94-N97 PolarHBondContact O-N 2.9Å; V95-N97 VanDerWaalsContact C-N 3.25Å; V95-N97 PolarHBondContact O-N 3.36Å; N97-I99 PolarHBondContact O-N 3.2Å; N97-I99 VanDerWaalsContact OD1-CB 3.25Å; N97-I99 WeakPolarHBondContact OD1-CB 3.49Å; N97-I99 PolarHBondContact OD1-N 3.28Å; N97-L100 HydrophobicContact CB-CD1 3.96Å; N97-L100 HydrophobicContact CB-CG 4.09Å; N97-L100 PolarHBondContact O-N 3.21Å; N97-K105 WeakPolarHBondContact O-CE 3.34Å; N97-K105 PolarHBondContact O-NZ 2.96Å
98	P	85.1	Confident	83.7	Confident	120 Å²	120	71.4 Å²	71.4	78%	0.779	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-13	-178.3	31.4	-34	0	0	0	113.1	R96	R96-P98 WeakPolarHBondContact O-CD 3.48Å
99	I	84.5	Confident	84.3	Confident	148 Å²	148	67.7 Å²	67.7	76%	0.759	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-30.1	179.9	-56.8	176	0	0	0	110.6	N97	N97-I99 PolarHBondContact O-N 3.2Å; N97-I99 VanDerWaalsContact OD1-CB 3.25Å; N97-I99 WeakPolarHBondContact OD1-CB 3.49Å; N97-I99 PolarHBondContact OD1-N 3.28Å
100	L	84.3	Confident	84.9	Confident	49 Å²	49	66.4 Å²	66.4	26%	0.257	38%	0.376	S	S	.	.	S	Bend	trans	-76.8	128	-178	-64.7	178.6	0	0	0	111.3	V94 N97 T104 K105 I108	V94-L100 HydrophobicContact CG1-CD1 3.94Å; N97-L100 HydrophobicContact CB-CD1 3.96Å; N97-L100 HydrophobicContact CB-CG 4.09Å; N97-L100 PolarHBondContact O-N 3.21Å; L100-T104 HydrophobicContact CD2-CG2 4.47Å; L100-K105 HydrophobicContact CB-CD 4.49Å; L100-K105 HydrophobicContact CB-CG 3.89Å; L100-K105 HydrophobicContact CD1-CG 4.49Å; L100-K105 WeakPolarHBondContact O-CE 3.37Å; L100-I108 HydrophobicContact CD1-CD1 4.43Å
101	P	86.3	Confident	85.5	Confident	60 Å²	60	66.5 Å²	66.5	39%	0.39	37%	0.372	S	S	.	.			trans	-59.9	148.9	169.2	-20.4	32.3	0	0	0	111.9	S103 T104 K105	P101-S103 PolarHBondContact O-N 3.13Å; P101-T104 WeakPolarHBondContact O-CB 3.36Å; P101-T104 PolarHBondContact O-N 2.95Å; P101-K105 PolarHBondContact O-N 3.03Å; P101-K105 VanDerWaalsContact O-N 3.15Å
102	G	85.6	Confident	85.8	Confident	26 Å²	26	67.7 Å²	67.7	27%	0.268	38%	0.378	S	S	.	.	H	α-helix	trans	-51.7	-50.2	179	0	0	0	0	0	113	T104 K105 E106 W147	G102-T104 PolarHBondContact O-N 3.43Å; G102-T104 VanDerWaalsContact O-N 3.11Å; G102-K105 WeakPolarHBondContact O-CA 3.48Å; G102-K105 WeakPolarHBondContact O-CB 3.31Å; G102-K105 PolarHBondContact O-N 3.37Å; G102-E106 PolarHBondContact O-N 3.07Å; G102-W147 WeakPolarHBondContact O-CH2 3.49Å
103	S	85.8	Confident	86.1	Confident	69 Å²	69	66.2 Å²	66.2	48%	0.483	37%	0.373	S	S	.	.	H	α-helix	trans	-63.4	-20.5	178.5	60	0	0	0	0	115	P101 K107	P101-S103 PolarHBondContact O-N 3.13Å; S103-K107 VanDerWaalsContact O-CG 3.32Å; S103-K107 WeakPolarHBondContact O-CG 3.34Å; S103-K107 PolarHBondContact O-N 3.44Å
104	T	87.3	Confident	86.5	Confident	56 Å²	56	65.3 Å²	65.3	34%	0.344	36%	0.361	S	S	.	.	H	α-helix	trans	-79	-40.5	171.7	-55	0	0	0	0	110.7	L100 P101 G102 E106 K107 I108	L100-T104 HydrophobicContact CD2-CG2 4.47Å; P101-T104 WeakPolarHBondContact O-CB 3.36Å; P101-T104 PolarHBondContact O-N 2.95Å; G102-T104 PolarHBondContact O-N 3.43Å; G102-T104 VanDerWaalsContact O-N 3.11Å; T104-E106 VanDerWaalsContact C-N 3.31Å; T104-K107 PolarHBondContact O-N 3.06Å; T104-I108 HydrophobicContact CG2-CD1 4.04Å; T104-I108 WeakPolarHBondContact O-CD1 3.42Å; T104-I108 VanDerWaalsContact O-CG1 3.27Å; T104-I108 WeakPolarHBondContact O-CG1 3.43Å; T104-I108 PolarHBondContact O-N 3.49Å; T104-I108 VanDerWaalsContact O-N 3.09Å
105	K	89	Confident	86.9	Confident	26 Å²	26	66.8 Å²	66.8	11%	0.113	37%	0.373	C	S	.	.	H	α-helix	trans	-62.8	-41.4	175.4	-62.7	179.2	179.6	-175.7	0	111.3	V95 N97 L100 P101 G102 I108 L109 W147	V95-K105 WeakPolarHBondContact O-CE 3.48Å; V95-K105 PolarHBondContact O-NZ 3.41Å; N97-K105 WeakPolarHBondContact O-CE 3.34Å; N97-K105 PolarHBondContact O-NZ 2.96Å; L100-K105 HydrophobicContact CB-CD 4.49Å; L100-K105 HydrophobicContact CB-CG 3.89Å; L100-K105 HydrophobicContact CD1-CG 4.49Å; L100-K105 WeakPolarHBondContact O-CE 3.37Å; P101-K105 PolarHBondContact O-N 3.03Å; P101-K105 VanDerWaalsContact O-N 3.15Å; G102-K105 WeakPolarHBondContact O-CA 3.48Å; G102-K105 WeakPolarHBondContact O-CB 3.31Å; G102-K105 PolarHBondContact O-N 3.37Å; K105-I108 PolarHBondContact O-N 3.15Å; K105-L109 WeakPolarHBondContact O-CB 3.28Å; K105-L109 WeakPolarHBondContact O-CG 3.26Å; K105-L109 PolarHBondContact O-N 2.89Å; K105-W147 HydrophobicContact CB-CH2 4.01Å; K105-W147 HydrophobicContact CB-CZ3 3.68Å
106	E	89.7	Confident	87	Confident	72 Å²	72	68.8 Å²	68.8	34%	0.336	39%	0.385	S	S	.	.	H	α-helix	trans	-56.9	-52.2	176.4	-174.6	179.7	175.4	0	0	111.6	G102 T104 I108 L109 A110 W147	G102-E106 PolarHBondContact O-N 3.07Å; T104-E106 VanDerWaalsContact C-N 3.31Å; E106-I108 VanDerWaalsContact C-N 3.29Å; E106-I108 PolarHBondContact O-N 3.02Å; E106-L109 PolarHBondContact O-N 3.37Å; E106-A110 WeakPolarHBondContact O-CB 3.2Å; E106-A110 PolarHBondContact O-N 3.04Å; E106-W147 HydrophobicContact CB-CD2 3.76Å; E106-W147 HydrophobicContact CB-CE3 3.7Å; E106-W147 HydrophobicContact CB-CH2 3.77Å; E106-W147 HydrophobicContact CB-CZ2 3.79Å; E106-W147 HydrophobicContact CB-CZ3 3.72Å; E106-W147 HydrophobicContact CG-CD2 3.7Å; E106-W147 HydrophobicContact CG-CE3 4.09Å; E106-W147 HydrophobicContact CG-CG 3.96Å; E106-W147 HydrophobicContact CG-CZ2 4.27Å
107	K	89.5	Confident	87.3	Confident	159 Å²	159	60.3 Å²	60.3	69%	0.691	35%	0.354	S	S	*	.	H	α-helix	trans	-60	-38.9	176.7	-71.4	-178.9	-178.4	-155.6	0	113.1	S103 T104 S111	S103-K107 VanDerWaalsContact O-CG 3.32Å; S103-K107 WeakPolarHBondContact O-CG 3.34Å; S103-K107 PolarHBondContact O-N 3.44Å; T104-K107 PolarHBondContact O-N 3.06Å; K107-S111 VanDerWaalsContact O-CB 3.29Å; K107-S111 WeakPolarHBondContact O-CB 3.48Å; K107-S111 PolarHBondContact O-N 3.21Å
108	I	89.2	Confident	87.6	Confident	56 Å²	56	59.9 Å²	59.9	29%	0.287	36%	0.357	S	S	.	.	H	α-helix	trans	-67.4	-46	177.4	-66	164.1	0	0	0	110.2	V94 L100 T104 K105 E106 S111 I112	V94-I108 HydrophobicContact CG1-CB 4.18Å; V94-I108 HydrophobicContact CG1-CD1 3.81Å; V94-I108 HydrophobicContact CG1-CG2 3.84Å; V94-I108 HydrophobicContact CG2-CG2 4.38Å; L100-I108 HydrophobicContact CD1-CD1 4.43Å; T104-I108 HydrophobicContact CG2-CD1 4.04Å; T104-I108 WeakPolarHBondContact O-CD1 3.42Å; T104-I108 VanDerWaalsContact O-CG1 3.27Å; T104-I108 WeakPolarHBondContact O-CG1 3.43Å; T104-I108 PolarHBondContact O-N 3.49Å; T104-I108 VanDerWaalsContact O-N 3.09Å; K105-I108 PolarHBondContact O-N 3.15Å; E106-I108 VanDerWaalsContact C-N 3.29Å; E106-I108 PolarHBondContact O-N 3.02Å; I108-S111 PolarHBondContact O-N 3Å; I108-I112 HydrophobicContact CG2-CD1 3.69Å; I108-I112 HydrophobicContact CG2-CG1 4.39Å; I108-I112 WeakPolarHBondContact O-CD1 3.49Å; I108-I112 VanDerWaalsContact O-CG1 3.23Å; I108-I112 WeakPolarHBondContact O-CG1 3.26Å; I108-I112 PolarHBondContact O-N 3.33Å
109	L	89	Confident	87.7	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-63.5	-43.7	178.8	-76.9	171.1	0	0	0	112	I91 V95 K105 E106 I112 A113 W147 L150	I91-L109 HydrophobicContact CG2-CD2 3.41Å; I91-L109 VanDerWaalsContact CG2-CD2 3.41Å; V95-L109 HydrophobicContact CG2-CD1 3.97Å; V95-L109 HydrophobicContact CG2-CD2 3.97Å; V95-L109 HydrophobicContact CG2-CG 4.34Å; K105-L109 WeakPolarHBondContact O-CB 3.28Å; K105-L109 WeakPolarHBondContact O-CG 3.26Å; K105-L109 PolarHBondContact O-N 2.89Å; E106-L109 PolarHBondContact O-N 3.37Å; L109-I112 PolarHBondContact O-N 3.46Å; L109-A113 PolarHBondContact O-N 2.97Å; L109-W147 HydrophobicContact CD1-CE3 3.52Å; L109-W147 HydrophobicContact CD1-CZ3 3.82Å; L109-L150 HydrophobicContact CD1-CB 3.99Å; L109-L150 HydrophobicContact CD2-CB 4.36Å; L109-L150 HydrophobicContact CD2-CD1 3.99Å
110	A	90.3	Very high	87.7	Confident	29 Å²	29	52.5 Å²	52.5	24%	0.24	31%	0.314	C	S	.	.	H	α-helix	trans	-58.4	-49.3	174	0	0	0	0	0	111.1	E106 I112 A113 T114 P143	E106-A110 WeakPolarHBondContact O-CB 3.2Å; E106-A110 PolarHBondContact O-N 3.04Å; A110-I112 VanDerWaalsContact C-N 3.27Å; A110-I112 PolarHBondContact O-N 3.29Å; A110-A113 PolarHBondContact O-N 3.41Å; A110-T114 PolarHBondContact O-N 3.1Å; A110-T114 PolarHBondContact O-OG1 2.92Å; A110-T114 VanDerWaalsContact O-OG1 3.07Å; A110-P143 HydrophobicContact CB-CB 3.91Å
111	S	89.4	Confident	87.9	Confident	80 Å²	80	53.7 Å²	53.7	56%	0.559	32%	0.315	S	S	*	.	H	α-helix	trans	-60.3	-35.7	177.4	-179.6	0	0	0	0	113	K107 I108 S115	K107-S111 VanDerWaalsContact O-CB 3.29Å; K107-S111 WeakPolarHBondContact O-CB 3.48Å; K107-S111 PolarHBondContact O-N 3.21Å; I108-S111 PolarHBondContact O-N 3Å; S111-S115 VanDerWaalsContact O-CB 3.26Å; S111-S115 WeakPolarHBondContact O-CB 3.46Å; S111-S115 PolarHBondContact O-N 3.05Å
112	I	87	Confident	88	Confident	51 Å²	51	57.7 Å²	57.7	26%	0.262	33%	0.333	S	S	.	.	H	α-helix	trans	-69.4	-46.1	176.2	-68.9	163.5	0	0	0	110.2	I91 I108 L109 A110 T114 S115 V116	I91-I112 HydrophobicContact CD1-CG2 3.76Å; I91-I112 HydrophobicContact CG1-CD1 4.29Å; I91-I112 HydrophobicContact CG1-CG2 4.38Å; I108-I112 HydrophobicContact CG2-CD1 3.69Å; I108-I112 HydrophobicContact CG2-CG1 4.39Å; I108-I112 WeakPolarHBondContact O-CD1 3.49Å; I108-I112 VanDerWaalsContact O-CG1 3.23Å; I108-I112 WeakPolarHBondContact O-CG1 3.26Å; I108-I112 PolarHBondContact O-N 3.33Å; L109-I112 PolarHBondContact O-N 3.46Å; A110-I112 VanDerWaalsContact C-N 3.27Å; A110-I112 PolarHBondContact O-N 3.29Å; I112-T114 PolarHBondContact O-N 2.92Å; I112-S115 WeakPolarHBondContact O-CB 3.48Å; I112-S115 PolarHBondContact O-N 2.97Å; I112-V116 WeakPolarHBondContact O-CG2 3.43Å; I112-V116 PolarHBondContact O-N 3.23Å
113	A	87.3	Confident	88	Confident	15 Å²	15	64.9 Å²	64.9	12%	0.124	35%	0.352	C	S	.	.	H	α-helix	trans	-58.1	-49.7	177.8	0	0	0	0	0	111.2	L109 A110 S115 V116 I117 A142 P143 A146	L109-A113 PolarHBondContact O-N 2.97Å; A110-A113 PolarHBondContact O-N 3.41Å; A113-S115 VanDerWaalsContact C-N 3.31Å; A113-S115 PolarHBondContact O-N 3.09Å; A113-V116 PolarHBondContact O-N 3.18Å; A113-I117 WeakPolarHBondContact O-CG1 3.48Å; A113-I117 PolarHBondContact O-N 3.38Å; A113-A142 HydrophobicContact CB-CB 4.29Å; A113-P143 HydrophobicContact CB-CG 4.25Å; A113-A146 HydrophobicContact CB-CB 4.31Å
114	T	89.3	Confident	88	Confident	47 Å²	47	63.1 Å²	63.1	29%	0.288	34%	0.337	S	S	.	.	H	α-helix	trans	-61.5	-38.3	176.1	-50.3	0	0	0	0	111.8	A110 I112 V116 I117 A118 E139	A110-T114 PolarHBondContact O-N 3.1Å; A110-T114 PolarHBondContact O-OG1 2.92Å; A110-T114 VanDerWaalsContact O-OG1 3.07Å; I112-T114 PolarHBondContact O-N 2.92Å; T114-V116 PolarHBondContact O-N 3.24Å; T114-I117 PolarHBondContact O-N 2.93Å; T114-A118 WeakPolarHBondContact O-CB 3.39Å; T114-A118 PolarHBondContact O-N 3.46Å; T114-E139 HydrophobicContact CG2-CG 4.49Å
115	S	88	Confident	87.7	Confident	67 Å²	67	65 Å²	65	47%	0.469	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-38.6	175.8	175.1	0	0	0	0	112.9	S111 I112 A113 S119	S111-S115 VanDerWaalsContact O-CB 3.26Å; S111-S115 WeakPolarHBondContact O-CB 3.46Å; S111-S115 PolarHBondContact O-N 3.05Å; I112-S115 WeakPolarHBondContact O-CB 3.48Å; I112-S115 PolarHBondContact O-N 2.97Å; A113-S115 VanDerWaalsContact C-N 3.31Å; A113-S115 PolarHBondContact O-N 3.09Å; S115-S119 WeakPolarHBondContact O-CB 3.5Å; S115-S119 PolarHBondContact O-N 2.83Å
116	V	85.5	Confident	87.4	Confident	68 Å²	68	66.3 Å²	66.3	41%	0.412	36%	0.359	S	S	.	.	H	α-helix	trans	-67	-44.3	177.4	171.7	0	0	0	0	109.8	I112 A113 T114 S119 K120	I112-V116 WeakPolarHBondContact O-CG2 3.43Å; I112-V116 PolarHBondContact O-N 3.23Å; A113-V116 PolarHBondContact O-N 3.18Å; T114-V116 PolarHBondContact O-N 3.24Å; V116-S119 WeakPolarHBondContact O-CB 3.4Å; V116-S119 PolarHBondContact O-N 3.19Å; V116-K120 HydrophobicContact CG1-CD 4.47Å; V116-K120 PolarHBondContact O-N 3.21Å
117	I	87.5	Confident	86.9	Confident	12 Å²	12	71.1 Å²	71.1	6%	0.062	38%	0.379	C	S	.	.	H	α-helix	trans	-62.9	-48	177.1	-66.3	170.1	0	0	0	110.7	A113 T114 S119 K120 R121 Y135 M138 A142	A113-I117 WeakPolarHBondContact O-CG1 3.48Å; A113-I117 PolarHBondContact O-N 3.38Å; T114-I117 PolarHBondContact O-N 2.93Å; I117-S119 PolarHBondContact O-N 2.83Å; I117-K120 CarbonylContact O-C 3.55Å; I117-K120 WeakPolarHBondContact O-CA 3.24Å; I117-K120 PolarHBondContact O-N 2.92Å; I117-R121 HydrophobicContact CG2-CG 4.24Å; I117-R121 WeakPolarHBondContact O-CG 3.5Å; I117-R121 PolarHBondContact O-N 3.05Å; I117-Y135 HydrophobicContact CG2-CD1 4.29Å; I117-Y135 HydrophobicContact CG2-CG 4.35Å; I117-M138 VanDerWaalsContact CD1-C 3.46Å; I117-M138 HydrophobicContact CD1-CB 3.93Å; I117-M138 WeakPolarHBondContact CD1-O 3.31Å; I117-A142 HydrophobicContact CD1-CB 3.55Å
118	A	89.3	Confident	86.7	Confident	43 Å²	43	68.5 Å²	68.5	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-57.8	-38.9	176.4	0	0	0	0	0	112	T114 R121 N122	T114-A118 WeakPolarHBondContact O-CB 3.39Å; T114-A118 PolarHBondContact O-N 3.46Å; A118-R121 PolarHBondContact O-N 3.19Å; A118-N122 VanDerWaalsContact O-CG 3.23Å; A118-N122 PolarHBondContact O-N 2.86Å; A118-N122 PolarHBondContact O-ND2 3.15Å; A118-N122 PolarHBondContact O-OD1 3.11Å
119	S	87.4	Confident	86.8	Confident	53 Å²	53	65.8 Å²	65.8	37%	0.371	36%	0.358	S	S	.	.	H	α-helix	trans	-65.3	-43.1	174.1	-169.6	0	0	0	0	112.3	S115 V116 I117 N122	S115-S119 WeakPolarHBondContact O-CB 3.5Å; S115-S119 PolarHBondContact O-N 2.83Å; V116-S119 WeakPolarHBondContact O-CB 3.4Å; V116-S119 PolarHBondContact O-N 3.19Å; I117-S119 PolarHBondContact O-N 2.83Å; S119-N122 PolarHBondContact O-N 3.05Å
120	K	85.7	Confident	87	Confident	60 Å²	60	66.1 Å²	66.1	26%	0.261	36%	0.36	S	S	.	.	H	α-helix	trans	-63.8	-39	174.9	-72.5	-174.6	176	-175.9	0	111.1	E83 V116 I117 R123 Y135	E83-K120 VanDerWaalsContact CD-NZ 3.34Å; E83-K120 IonicContact OE1-NZ 2.81Å; E83-K120 PolarHBondContact OE1-NZ 2.89Å; E83-K120 IonicContact OE2-NZ 3.99Å; E83-K120 PolarHBondContact OE2-NZ 3.48Å; E83-K120 VanDerWaalsContact OE2-NZ 3.09Å; V116-K120 HydrophobicContact CG1-CD 4.47Å; V116-K120 PolarHBondContact O-N 3.21Å; I117-K120 CarbonylContact O-C 3.55Å; I117-K120 WeakPolarHBondContact O-CA 3.24Å; I117-K120 PolarHBondContact O-N 2.92Å; K120-R123 PolarHBondContact O-N 2.6Å; K120-Y135 HydrophobicContact CB-CE1 3.99Å; K120-Y135 HydrophobicContact CB-CE2 4.11Å; K120-Y135 HydrophobicContact CD-CE1 4.06Å
121	R	87.4	Confident	87	Confident	74 Å²	74	65.1 Å²	65.1	28%	0.279	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-41.5	174.4	-72.3	177.9	75	140.2	21.4	112.6	I117 A118 R123 L124 Y135 D136 E139	I117-R121 HydrophobicContact CG2-CG 4.24Å; I117-R121 WeakPolarHBondContact O-CG 3.5Å; I117-R121 PolarHBondContact O-N 3.05Å; A118-R121 PolarHBondContact O-N 3.19Å; R121-R123 PolarHBondContact O-N 3.35Å; R121-R123 VanDerWaalsContact O-N 3.17Å; R121-L124 HydrophobicContact CB-CD1 4.41Å; R121-L124 VanDerWaalsContact O-CB 3.26Å; R121-L124 WeakPolarHBondContact O-CB 3.38Å; R121-L124 VanDerWaalsContact O-CG 3.25Å; R121-L124 WeakPolarHBondContact O-CG 3.5Å; R121-L124 PolarHBondContact O-N 3.2Å; R121-L124 VanDerWaalsContact O-N 3.1Å; R121-Y135 HydrophobicContact CG-CD2 3.88Å; R121-Y135 HydrophobicContact CG-CG 4.05Å; R121-D136 IonicContact CZ-OD1 2.77Å; R121-D136 IonicContact NH1-OD1 2.78Å; R121-D136 PolarHBondContact NH1-OD1 3.22Å; R121-D136 IonicContact NH2-OD1 2.86Å; R121-D136 PolarHBondContact NH2-OD1 2.91Å; R121-E139 IonicContact NH1-OE2 3.82Å; R121-E139 PolarHBondContact NH1-OE2 3Å
122	N	88.7	Confident	87.2	Confident	144 Å²	144	63.4 Å²	63.4	77%	0.77	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.8	179.4	-70.3	-15.4	0	0	0	113.7	A118 S119	A118-N122 VanDerWaalsContact O-CG 3.23Å; A118-N122 PolarHBondContact O-N 2.86Å; A118-N122 PolarHBondContact O-ND2 3.15Å; A118-N122 PolarHBondContact O-OD1 3.11Å; S119-N122 PolarHBondContact O-N 3.05Å
123	R	86.6	Confident	87.5	Confident	178 Å²	178	62.2 Å²	62.2	67%	0.672	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	4.5	177.1	-62	178.2	-172.8	-167.8	1.9	112.8	K120 R121 T125	K120-R123 PolarHBondContact O-N 2.6Å; R121-R123 PolarHBondContact O-N 3.35Å; R121-R123 VanDerWaalsContact O-N 3.17Å; R123-T125 PolarHBondContact O-N 3.4Å
124	L	84.6	Confident	87.8	Confident	32 Å²	32	62.7 Å²	62.7	17%	0.168	33%	0.325	C	S	.	.			trans	-68.9	125.2	176.6	-70.2	173.7	0	0	0	110.4	R121 L131 K132 Y135	R121-L124 HydrophobicContact CB-CD1 4.41Å; R121-L124 VanDerWaalsContact O-CB 3.26Å; R121-L124 WeakPolarHBondContact O-CB 3.38Å; R121-L124 VanDerWaalsContact O-CG 3.25Å; R121-L124 WeakPolarHBondContact O-CG 3.5Å; R121-L124 PolarHBondContact O-N 3.2Å; R121-L124 VanDerWaalsContact O-N 3.1Å; L124-L131 HydrophobicContact CD2-CB 3.43Å; L124-L131 VanDerWaalsContact CD2-CB 3.43Å; L124-L131 HydrophobicContact CD2-CD1 3.91Å; L124-L131 HydrophobicContact CD2-CG 4.34Å; L124-K132 HydrophobicContact CD1-CB 4.08Å; L124-Y135 HydrophobicContact CD1-CD2 4.11Å; L124-Y135 HydrophobicContact CD1-CE2 4.43Å; L124-Y135 HydrophobicContact CD2-CD2 4.28Å; L124-Y135 HydrophobicContact CD2-CE2 3.84Å; L124-Y135 HydrophobicContact CG-CD2 4.45Å; L124-Y135 HydrophobicContact CG-CE2 4.28Å
125	T	81.1	Confident	88	Confident	96 Å²	96	61 Å²	61	59%	0.589	31%	0.314	S	S	*	.	S	Bend	trans	-71.1	-45.4	170.5	44.5	0	0	0	0	110.2	E60 R123	E60-T125 PolarHBondContact OE2-OG1 3.07Å; E60-T125 VanDerWaalsContact OE2-OG1 3.11Å; R123-T125 PolarHBondContact O-N 3.4Å
126	V	82.6	Confident	88.2	Confident	52 Å²	52	59.1 Å²	59.1	32%	0.315	30%	0.298	S	S	.	.			trans	-96.4	117.6	176.9	-174.4	0	0	0	0	110	E57	E57-V126 HydrophobicContact CG-CB 4.21Å; E57-V126 HydrophobicContact CG-CG2 3.92Å; E57-V126 VanDerWaalsContact OE1-CB 3.31Å; E57-V126 WeakPolarHBondContact OE1-CB 3.49Å; E57-V126 WeakPolarHBondContact OE1-CG1 3.32Å
127	K	80.5	Confident	88.6	Confident	174 Å²	174	56.3 Å²	56.3	76%	0.757	28%	0.281	S	S	*	.	S	Bend	trans	-72	-34.2	-178.4	-68.7	-174.3	178.9	178.9	0	113.4	K132	K127-K132 WeakPolarHBondContact O-CB 3.5Å; K127-K132 WeakPolarHBondContact O-CG 3.04Å
128	D	85.3	Confident	88.8	Confident	103 Å²	103	57.6 Å²	57.6	55%	0.551	29%	0.287	S	S	*	.	S	Bend	trans	-125.3	72.9	-178.2	-73.8	-49.4	0	0	0	111	K132	D128-K132 IonicContact OD1-NZ 3.8Å; D128-K132 PolarHBondContact OD1-NZ 3.25Å
129	G	90.4	Very high	88.9	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	-147.5	-159.1	172.6	0	0	0	0	0	113.6	E57 L131 K132 Q133	E57-G129 WeakPolarHBondContact OE1-CA 3.32Å; G129-L131 PolarHBondContact O-N 2.68Å; G129-K132 WeakPolarHBondContact O-CB 3.41Å; G129-K132 PolarHBondContact O-N 2.84Å; G129-Q133 PolarHBondContact O-N 3.3Å
130	F	92.7	Very high	89.1	Confident	11 Å²	11	57.2 Å²	57.2	5%	0.048	27%	0.274	C	S	.	.	H	α-helix	trans	-58.6	-49.4	-166	172.3	-103	0	0	0	112.1	L41 F44 I54 E57 L58 V71 I76 K132 Q133 F134	L41-F130 HydrophobicContact CD1-CD2 4.06Å; L41-F130 HydrophobicContact CD1-CE2 3.89Å; F44-F130 HydrophobicContact CE1-CB 4.11Å; I54-F130 HydrophobicContact CG1-CB 3.96Å; I54-F130 HydrophobicContact CG1-CD2 4.37Å; I54-F130 HydrophobicContact CG1-CG 4.4Å; I54-F130 HydrophobicContact CG2-CG 4.45Å; E57-F130 PolarHBondContact OE1-N 2.89Å; E57-F130 PolarHBondContact OE2-N 3.24Å; E57-F130 VanDerWaalsContact OE2-N 3.17Å; L58-F130 HydrophobicContact CD1-CD1 4.34Å; L58-F130 HydrophobicContact CD1-CE1 4.25Å; L58-F130 HydrophobicContact CD2-CD1 4Å; L58-F130 HydrophobicContact CD2-CE1 3.94Å; L58-F130 HydrophobicContact CG-CD1 4.28Å; L58-F130 HydrophobicContact CG-CE1 4.47Å; V71-F130 HydrophobicContact CG1-CZ 4.2Å; I76-F130 HydrophobicContact CD1-CZ 4.36Å; F130-K132 PolarHBondContact O-N 3.28Å; F130-Q133 PolarHBondContact O-N 3.17Å; F130-F134 WeakPolarHBondContact O-CB 3.15Å; F130-F134 PolarHBondContact O-N 3.02Å
131	L	91.7	Very high	89.4	Confident	7 Å²	7	54.5 Å²	54.5	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-66	-29.7	-176.6	-67.5	169.7	0	0	0	112.2	E57 L58 F75 L124 G129 Y135	E57-L131 HydrophobicContact CB-CD1 4.33Å; E57-L131 WeakPolarHBondContact OE2-CB 3.39Å; E57-L131 WeakPolarHBondContact OE2-CG 3.26Å; E57-L131 PolarHBondContact OE2-N 2.91Å; L58-L131 HydrophobicContact CD2-CD2 4.5Å; F75-L131 HydrophobicContact CE1-CD2 4.24Å; F75-L131 HydrophobicContact CZ-CD2 4.39Å; L124-L131 HydrophobicContact CD2-CB 3.43Å; L124-L131 VanDerWaalsContact CD2-CB 3.43Å; L124-L131 HydrophobicContact CD2-CD1 3.91Å; L124-L131 HydrophobicContact CD2-CG 4.34Å; G129-L131 PolarHBondContact O-N 2.68Å; L131-Y135 HydrophobicContact CB-CD2 4.49Å; L131-Y135 HydrophobicContact CB-CE2 4.16Å; L131-Y135 WeakPolarHBondContact O-CB 3.24Å; L131-Y135 WeakPolarHBondContact O-CD2 3.35Å; L131-Y135 VanDerWaalsContact O-CG 3.26Å; L131-Y135 PolarHBondContact O-N 2.95Å
132	K	92.4	Very high	89.5	Confident	45 Å²	45	51.8 Å²	51.8	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-49.4	173.3	176	-113.1	-177.2	153.9	0	110.8	L124 K127 D128 G129 F130 F134 Y135 D136	L124-K132 HydrophobicContact CD1-CB 4.08Å; K127-K132 WeakPolarHBondContact O-CB 3.5Å; K127-K132 WeakPolarHBondContact O-CG 3.04Å; D128-K132 IonicContact OD1-NZ 3.8Å; D128-K132 PolarHBondContact OD1-NZ 3.25Å; G129-K132 WeakPolarHBondContact O-CB 3.41Å; G129-K132 PolarHBondContact O-N 2.84Å; F130-K132 PolarHBondContact O-N 3.28Å; K132-F134 VanDerWaalsContact C-N 3.31Å; K132-F134 PolarHBondContact O-N 2.9Å; K132-Y135 PolarHBondContact O-N 3.27Å; K132-D136 PolarHBondContact O-N 3.09Å
133	Q	94	Very high	89.6	Confident	25 Å²	25	46 Å²	46	12%	0.117	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-41.5	176.8	-58.7	-63.2	-13.4	0	0	111.4	L41 F44 G129 F130 D136 V137	L41-Q133 HydrophobicContact CB-CB 4.29Å; L41-Q133 HydrophobicContact CD1-CB 3.66Å; F44-Q133 HydrophobicContact CB-CG 4.25Å; F44-Q133 HydrophobicContact CD1-CG 4.42Å; F44-Q133 HydrophobicContact CD2-CG 4.28Å; F44-Q133 HydrophobicContact CG-CG 4.05Å; G129-Q133 PolarHBondContact O-N 3.3Å; F130-Q133 PolarHBondContact O-N 3.17Å; Q133-D136 PolarHBondContact O-N 2.98Å; Q133-V137 PolarHBondContact O-N 3.29Å
134	F	93.3	Very high	89.7	Confident	26 Å²	26	37.6 Å²	37.6	11%	0.114	19%	0.194	C	C	.	.	H	α-helix	trans	-60.7	-45.7	175.4	172.7	-104.6	0	0	0	112.1	I76 F130 K132 D136 V137 M138	I76-F134 HydrophobicContact CB-CE2 4.39Å; I76-F134 HydrophobicContact CD1-CD2 4.03Å; I76-F134 HydrophobicContact CD1-CE2 3.73Å; I76-F134 HydrophobicContact CD1-CZ 4.42Å; I76-F134 HydrophobicContact CG1-CD2 4.47Å; I76-F134 HydrophobicContact CG1-CE2 3.78Å; I76-F134 HydrophobicContact CG1-CZ 3.99Å; I76-F134 HydrophobicContact CG2-CE2 3.69Å; I76-F134 HydrophobicContact CG2-CZ 3.95Å; F130-F134 WeakPolarHBondContact O-CB 3.15Å; F130-F134 PolarHBondContact O-N 3.02Å; K132-F134 VanDerWaalsContact C-N 3.31Å; K132-F134 PolarHBondContact O-N 2.9Å; F134-D136 VanDerWaalsContact C-N 3.32Å; F134-D136 PolarHBondContact O-N 3.37Å; F134-V137 WeakPolarHBondContact O-CB 3.44Å; F134-V137 PolarHBondContact O-N 2.73Å; F134-M138 HydrophobicContact CD1-CG 4.19Å; F134-M138 HydrophobicContact CD2-CG 4.32Å; F134-M138 HydrophobicContact CE1-CG 3.7Å; F134-M138 HydrophobicContact CE2-CG 3.83Å; F134-M138 HydrophobicContact CE2-SD 4.08Å; F134-M138 HydrophobicContact CG-CG 4.48Å; F134-M138 HydrophobicContact CZ-CG 3.5Å; F134-M138 VanDerWaalsContact CZ-CG 3.5Å; F134-M138 HydrophobicContact CZ-SD 3.92Å; F134-M138 WeakPolarHBondContact O-CG 3.07Å; F134-M138 PolarHBondContact O-N 3.19Å
135	Y	92.6	Very high	89.9	Confident	11 Å²	11	37.3 Å²	37.3	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-68.7	-29.9	178.1	-69.8	-44.3	0	0	0	113.3	I117 K120 R121 L124 L131 K132 V137 M138 E139	I117-Y135 HydrophobicContact CG2-CD1 4.29Å; I117-Y135 HydrophobicContact CG2-CG 4.35Å; K120-Y135 HydrophobicContact CB-CE1 3.99Å; K120-Y135 HydrophobicContact CB-CE2 4.11Å; K120-Y135 HydrophobicContact CD-CE1 4.06Å; R121-Y135 HydrophobicContact CG-CD2 3.88Å; R121-Y135 HydrophobicContact CG-CG 4.05Å; L124-Y135 HydrophobicContact CD1-CD2 4.11Å; L124-Y135 HydrophobicContact CD1-CE2 4.43Å; L124-Y135 HydrophobicContact CD2-CD2 4.28Å; L124-Y135 HydrophobicContact CD2-CE2 3.84Å; L124-Y135 HydrophobicContact CG-CD2 4.45Å; L124-Y135 HydrophobicContact CG-CE2 4.28Å; L131-Y135 HydrophobicContact CB-CD2 4.49Å; L131-Y135 HydrophobicContact CB-CE2 4.16Å; L131-Y135 WeakPolarHBondContact O-CB 3.24Å; L131-Y135 WeakPolarHBondContact O-CD2 3.35Å; L131-Y135 VanDerWaalsContact O-CG 3.26Å; L131-Y135 PolarHBondContact O-N 2.95Å; K132-Y135 PolarHBondContact O-N 3.27Å; Y135-V137 VanDerWaalsContact C-N 3.31Å; Y135-M138 PolarHBondContact O-N 3.45Å; Y135-E139 WeakPolarHBondContact O-CB 3.36Å; Y135-E139 PolarHBondContact O-N 3.47Å
136	D	93.4	Very high	90.2	Very high	28 Å²	28	33.7 Å²	33.7	15%	0.15	17%	0.172	C	C	.	.	H	α-helix	trans	-62.5	-39.6	171.6	-69.5	-23.9	0	0	0	110.7	A37 R121 K132 Q133 F134	A37-D136 HydrophobicContact CB-CB 4.47Å; R121-D136 IonicContact CZ-OD1 2.77Å; R121-D136 IonicContact NH1-OD1 2.78Å; R121-D136 PolarHBondContact NH1-OD1 3.22Å; R121-D136 IonicContact NH2-OD1 2.86Å; R121-D136 PolarHBondContact NH2-OD1 2.91Å; K132-D136 PolarHBondContact O-N 3.09Å; Q133-D136 PolarHBondContact O-N 2.98Å; F134-D136 VanDerWaalsContact C-N 3.32Å; F134-D136 PolarHBondContact O-N 3.37Å
137	V	94.3	Very high	90.4	Very high	9 Å²	9	32.1 Å²	32.1	6%	0.055	16%	0.16	C	C	.	.	H	α-helix	trans	-64.8	-50.5	170.9	177.8	0	0	0	0	110.6	F34 A37 Y38 L41 Q133 F134 Y135 E139 T140 V141	F34-V137 HydrophobicContact CD2-CG1 4.12Å; F34-V137 HydrophobicContact CE2-CG1 3.81Å; A37-V137 HydrophobicContact CB-CG2 3.96Å; A37-V137 WeakPolarHBondContact O-CG2 3.5Å; Y38-V137 HydrophobicContact CD2-CG1 4.43Å; L41-V137 HydrophobicContact CB-CG2 4.07Å; L41-V137 HydrophobicContact CD2-CG2 3.88Å; Q133-V137 PolarHBondContact O-N 3.29Å; F134-V137 WeakPolarHBondContact O-CB 3.44Å; F134-V137 PolarHBondContact O-N 2.73Å; Y135-V137 VanDerWaalsContact C-N 3.31Å; V137-E139 PolarHBondContact O-N 3.44Å; V137-T140 PolarHBondContact O-N 3.21Å; V137-T140 VanDerWaalsContact O-N 3.08Å; V137-T140 PolarHBondContact O-OG1 3.05Å; V137-V141 HydrophobicContact CG1-CG2 4.18Å; V137-V141 WeakPolarHBondContact O-CG2 3.27Å; V137-V141 PolarHBondContact O-N 3.46Å
138	M	91.7	Very high	90.7	Very high	38 Å²	38	23.9 Å²	23.9	19%	0.187	12%	0.124	C	C	.	.	H	α-helix	trans	-62.6	-26.5	-176.7	-69.3	-57.7	-68.8	0	0	113.4	I117 F134 Y135 T140 V141 A142	I117-M138 VanDerWaalsContact CD1-C 3.46Å; I117-M138 HydrophobicContact CD1-CB 3.93Å; I117-M138 WeakPolarHBondContact CD1-O 3.31Å; F134-M138 HydrophobicContact CD1-CG 4.19Å; F134-M138 HydrophobicContact CD2-CG 4.32Å; F134-M138 HydrophobicContact CE1-CG 3.7Å; F134-M138 HydrophobicContact CE2-CG 3.83Å; F134-M138 HydrophobicContact CE2-SD 4.08Å; F134-M138 HydrophobicContact CG-CG 4.48Å; F134-M138 HydrophobicContact CZ-CG 3.5Å; F134-M138 VanDerWaalsContact CZ-CG 3.5Å; F134-M138 HydrophobicContact CZ-SD 3.92Å; F134-M138 WeakPolarHBondContact O-CG 3.07Å; F134-M138 PolarHBondContact O-N 3.19Å; Y135-M138 PolarHBondContact O-N 3.45Å; M138-T140 PolarHBondContact O-N 2.95Å; M138-V141 PolarHBondContact O-N 2.97Å; M138-A142 HydrophobicContact CE-CB 4.25Å; M138-A142 WeakPolarHBondContact O-CB 3.44Å; M138-A142 PolarHBondContact O-N 3.24Å
139	E	91.1	Very high	90.6	Very high	72 Å²	72	21 Å²	21	34%	0.336	11%	0.108	S	C	.	.	H	α-helix	trans	-60.3	-31.7	176.5	-170.7	159	-174.7	0	0	112.2	T114 R121 Y135 V137 P143	T114-E139 HydrophobicContact CG2-CG 4.49Å; R121-E139 IonicContact NH1-OE2 3.82Å; R121-E139 PolarHBondContact NH1-OE2 3Å; Y135-E139 WeakPolarHBondContact O-CB 3.36Å; Y135-E139 PolarHBondContact O-N 3.47Å; V137-E139 PolarHBondContact O-N 3.44Å; E139-P143 VanDerWaalsContact O-CD 3.28Å; E139-P143 WeakPolarHBondContact O-CD 3.36Å; E139-P143 WeakPolarHBondContact O-CG 3.46Å
140	T	91.3	Very high	90.3	Very high	17 Å²	17	22.5 Å²	22.5	10%	0.104	12%	0.116	C	C	.	.	H	α-helix	trans	-83.6	-39	175.5	67.8	0	0	0	0	112.6	E33 F34 V137 M138	E33-T140 HydrophobicContact CB-CG2 4.25Å; E33-T140 HydrophobicContact CG-CG2 3.86Å; F34-T140 HydrophobicContact CB-CG2 4.42Å; F34-T140 WeakPolarHBondContact CD2-OG1 3.46Å; V137-T140 PolarHBondContact O-N 3.21Å; V137-T140 VanDerWaalsContact O-N 3.08Å; V137-T140 PolarHBondContact O-OG1 3.05Å; M138-T140 PolarHBondContact O-N 2.95Å
141	V	91.3	Very high	89.9	Confident	2 Å²	2	22.5 Å²	22.5	1%	0.012	12%	0.12	C	C	.	.	H	α-helix	trans	-90.8	-36.3	-169.7	-165	0	0	0	0	113	L20 F34 V137 M138 M144 F145	L20-V141 HydrophobicContact CD2-CG1 4.17Å; F34-V141 HydrophobicContact CD2-CG2 3.49Å; F34-V141 VanDerWaalsContact CD2-CG2 3.49Å; F34-V141 HydrophobicContact CE2-CG2 3.61Å; V137-V141 HydrophobicContact CG1-CG2 4.18Å; V137-V141 WeakPolarHBondContact O-CG2 3.27Å; V137-V141 PolarHBondContact O-N 3.46Å; M138-V141 PolarHBondContact O-N 2.97Å; V141-M144 HydrophobicContact CB-CE 4.49Å; V141-M144 HydrophobicContact CG1-CE 3.49Å; V141-M144 VanDerWaalsContact CG1-CE 3.49Å; V141-M144 WeakPolarHBondContact O-CB 3.23Å; V141-M144 PolarHBondContact O-N 3.48Å; V141-M144 VanDerWaalsContact O-N 3.1Å; V141-F145 HydrophobicContact CB-CD2 4.45Å; V141-F145 HydrophobicContact CB-CE2 4.3Å; V141-F145 HydrophobicContact CG1-CD2 3.55Å; V141-F145 HydrophobicContact CG1-CE1 4.45Å; V141-F145 HydrophobicContact CG1-CE2 3.16Å; V141-F145 HydrophobicContact CG1-CG 4.36Å; V141-F145 HydrophobicContact CG1-CZ 3.67Å; V141-F145 PolarHBondContact O-N 2.85Å
142	A	89.7	Confident	89.3	Confident	17 Å²	17	25.4 Å²	25.4	14%	0.14	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-39.6	-175.7	0	0	0	0	0	114.1	A113 I117 M138 M144 F145 A146	A113-A142 HydrophobicContact CB-CB 4.29Å; I117-A142 HydrophobicContact CD1-CB 3.55Å; M138-A142 HydrophobicContact CE-CB 4.25Å; M138-A142 WeakPolarHBondContact O-CB 3.44Å; M138-A142 PolarHBondContact O-N 3.24Å; A142-M144 VanDerWaalsContact C-N 3.28Å; A142-M144 PolarHBondContact O-N 2.99Å; A142-F145 PolarHBondContact O-N 3.29Å; A142-A146 WeakPolarHBondContact O-CB 3.16Å; A142-A146 PolarHBondContact O-N 2.65Å
143	P	90.2	Very high	88.9	Confident	22 Å²	22	26.3 Å²	26.3	14%	0.143	15%	0.148	C	C	.	.	H	α-helix	trans	-58.8	-40.5	172.3	-27.3	37.8	0	0	0	112.8	A110 A113 E139 A146 W147	A110-P143 HydrophobicContact CB-CB 3.91Å; A113-P143 HydrophobicContact CB-CG 4.25Å; E139-P143 VanDerWaalsContact O-CD 3.28Å; E139-P143 WeakPolarHBondContact O-CD 3.36Å; E139-P143 WeakPolarHBondContact O-CG 3.46Å; P143-A146 PolarHBondContact O-N 2.91Å; P143-W147 WeakPolarHBondContact O-CB 3.3Å; P143-W147 PolarHBondContact O-N 3.33Å
144	M	89.7	Confident	88.4	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-65.2	-44.1	177.3	169.2	-94.5	-74	0	0	111.1	M23 L24 S27 V141 A142 W147 S148	M23-M144 HydrophobicContact CB-CE 3.86Å; M23-M144 HydrophobicContact CB-SD 3.97Å; M23-M144 HydrophobicContact CE-CE 4.2Å; M23-M144 HydrophobicContact CE-SD 4.41Å; L24-M144 HydrophobicContact CD2-CB 3.96Å; L24-M144 HydrophobicContact CD2-CE 3.6Å; L24-M144 HydrophobicContact CD2-CG 4.18Å; L24-M144 HydrophobicContact CG-CE 3.67Å; S27-M144 VanDerWaalsContact OG-CG 3.25Å; S27-M144 WeakPolarHBondContact OG-CG 3.27Å; V141-M144 HydrophobicContact CB-CE 4.49Å; V141-M144 HydrophobicContact CG1-CE 3.49Å; V141-M144 VanDerWaalsContact CG1-CE 3.49Å; V141-M144 WeakPolarHBondContact O-CB 3.23Å; V141-M144 PolarHBondContact O-N 3.48Å; V141-M144 VanDerWaalsContact O-N 3.1Å; A142-M144 VanDerWaalsContact C-N 3.28Å; A142-M144 PolarHBondContact O-N 2.99Å; M144-W147 PolarHBondContact O-N 3.26Å; M144-S148 WeakPolarHBondContact O-CB 3.46Å; M144-S148 PolarHBondContact O-N 2.84Å; M144-S148 PolarHBondContact O-OG 3.49Å
145	F	88.4	Confident	87.9	Confident	25 Å²	25	35.4 Å²	35.4	11%	0.11	19%	0.192	C	C	.	.	H	α-helix	trans	-66.2	-41	175	-73.3	-41.6	0	0	0	113.6	L20 M23 M84 V141 A142 W147 S148 L149 F160 F163	L20-F145 HydrophobicContact CD2-CE2 4.47Å; L20-F145 HydrophobicContact CD2-CZ 3.76Å; M23-F145 HydrophobicContact CE-CE1 3.42Å; M23-F145 VanDerWaalsContact CE-CE1 3.42Å; M23-F145 HydrophobicContact CE-CZ 3.74Å; M23-F145 HydrophobicContact SD-CE1 4.26Å; M84-F145 HydrophobicContact SD-CB 3.94Å; M84-F145 HydrophobicContact SD-CG 4.48Å; V141-F145 HydrophobicContact CB-CD2 4.45Å; V141-F145 HydrophobicContact CB-CE2 4.3Å; V141-F145 HydrophobicContact CG1-CD2 3.55Å; V141-F145 HydrophobicContact CG1-CE1 4.45Å; V141-F145 HydrophobicContact CG1-CE2 3.16Å; V141-F145 HydrophobicContact CG1-CG 4.36Å; V141-F145 HydrophobicContact CG1-CZ 3.67Å; V141-F145 PolarHBondContact O-N 2.85Å; A142-F145 PolarHBondContact O-N 3.29Å; F145-W147 VanDerWaalsContact C-N 3.28Å; F145-W147 PolarHBondContact O-N 3.33Å; F145-S148 WeakPolarHBondContact CA-OG 3.39Å; F145-S148 PolarHBondContact O-N 3.09Å; F145-S148 PolarHBondContact O-OG 3.28Å; F145-L149 WeakPolarHBondContact O-CB 3.46Å; F145-L149 PolarHBondContact O-N 2.87Å; F145-F160 AromaticContact CD1-CD2 3.56Å; F145-F160 HydrophobicContact CD1-CD2 3.56Å; F145-F160 AromaticContact CD1-CE2 3.23Å; F145-F160 HydrophobicContact CD1-CE2 3.23Å; F145-F160 HydrophobicContact CD1-CZ 4.17Å; F145-F160 AromaticContact CE1-CD2 3.75Å; F145-F160 HydrophobicContact CE1-CD2 3.75Å; F145-F160 AromaticContact CE1-CE2 3.46Å; F145-F160 HydrophobicContact CE1-CE2 3.46Å; F145-F160 VanDerWaalsContact CE1-CE2 3.46Å; F145-F160 HydrophobicContact CG-CE2 4.14Å; F145-F160 HydrophobicContact CZ-CE2 4.49Å; F145-F163 HydrophobicContact CE1-CD1 4.46Å; F145-F163 HydrophobicContact CE1-CE1 4.09Å; F145-F163 HydrophobicContact CZ-CE1 4.13Å
146	A	87.3	Confident	87.5	Confident	21 Å²	21	35.2 Å²	35.2	17%	0.174	19%	0.191	C	C	.	.	H	α-helix	trans	-60.7	-41	175.4	0	0	0	0	0	111.1	A113 A142 P143 L150	A113-A146 HydrophobicContact CB-CB 4.31Å; A142-A146 WeakPolarHBondContact O-CB 3.16Å; A142-A146 PolarHBondContact O-N 2.65Å; P143-A146 PolarHBondContact O-N 2.91Å; A146-L150 WeakPolarHBondContact O-CB 3.49Å; A146-L150 PolarHBondContact O-N 3.28Å
147	W	87.2	Confident	87.2	Confident	19 Å²	19	39.4 Å²	39.4	7%	0.072	21%	0.205	C	C	.	.	H	α-helix	trans	-73.7	-36.4	177	-171.6	-121.4	0	0	0	113.3	G102 K105 E106 L109 P143 M144 F145 L149 G151	G102-W147 WeakPolarHBondContact O-CH2 3.49Å; K105-W147 HydrophobicContact CB-CH2 4.01Å; K105-W147 HydrophobicContact CB-CZ3 3.68Å; E106-W147 HydrophobicContact CB-CD2 3.76Å; E106-W147 HydrophobicContact CB-CE3 3.7Å; E106-W147 HydrophobicContact CB-CH2 3.77Å; E106-W147 HydrophobicContact CB-CZ2 3.79Å; E106-W147 HydrophobicContact CB-CZ3 3.72Å; E106-W147 HydrophobicContact CG-CD2 3.7Å; E106-W147 HydrophobicContact CG-CE3 4.09Å; E106-W147 HydrophobicContact CG-CG 3.96Å; E106-W147 HydrophobicContact CG-CZ2 4.27Å; L109-W147 HydrophobicContact CD1-CE3 3.52Å; L109-W147 HydrophobicContact CD1-CZ3 3.82Å; P143-W147 WeakPolarHBondContact O-CB 3.3Å; P143-W147 PolarHBondContact O-N 3.33Å; M144-W147 PolarHBondContact O-N 3.26Å; F145-W147 VanDerWaalsContact C-N 3.28Å; F145-W147 PolarHBondContact O-N 3.33Å; W147-L149 VanDerWaalsContact C-N 3.31Å; W147-L149 PolarHBondContact O-N 3.48Å; W147-G151 VanDerWaalsContact CZ3-CA 3.43Å; W147-G151 WeakPolarHBondContact O-CA 3.44Å; W147-G151 PolarHBondContact O-N 3.08Å
148	S	86.7	Confident	86.9	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.007	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-37.1	177.4	71.4	0	0	0	0	111.9	M144 F145 R157 F160	M144-S148 WeakPolarHBondContact O-CB 3.46Å; M144-S148 PolarHBondContact O-N 2.84Å; M144-S148 PolarHBondContact O-OG 3.49Å; F145-S148 WeakPolarHBondContact CA-OG 3.39Å; F145-S148 PolarHBondContact O-N 3.09Å; F145-S148 PolarHBondContact O-OG 3.28Å; S148-R157 WeakPolarHBondContact O-CA 3.49Å; S148-R157 VanDerWaalsContact O-CB 3.24Å; S148-R157 WeakPolarHBondContact O-CB 3.49Å; S148-F160 WeakPolarHBondContact OG-CB 3.43Å; S148-F160 WeakPolarHBondContact OG-CG 3.27Å
149	L	84.4	Confident	86.6	Confident	41 Å²	41	45.7 Å²	45.7	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-83.3	-46.2	-178	-176.1	59.5	0	0	0	113.4	M84 F145 W147 F160	M84-L149 HydrophobicContact CB-CD2 3.58Å; M84-L149 HydrophobicContact CG-CD2 4.2Å; M84-L149 WeakPolarHBondContact O-CD2 3.44Å; M84-L149 HydrophobicContact SD-CD2 4.47Å; F145-L149 WeakPolarHBondContact O-CB 3.46Å; F145-L149 PolarHBondContact O-N 2.87Å; W147-L149 VanDerWaalsContact C-N 3.31Å; W147-L149 PolarHBondContact O-N 3.48Å; L149-F160 HydrophobicContact CB-CD1 4.32Å; L149-F160 HydrophobicContact CB-CE1 4.13Å; L149-F160 HydrophobicContact CD1-CD1 4.36Å; L149-F160 HydrophobicContact CD1-CE1 4.09Å; L149-F160 HydrophobicContact CG-CE1 4.49Å
150	L	83.9	Confident	86.4	Confident	32 Å²	32	42.6 Å²	42.6	17%	0.168	22%	0.22	C	C	.	.	H	α-helix	trans	-106	-8.5	-171.4	-57.1	176.4	0	0	0	113.3	P87 I91 V95 L109 A146	P87-L150 HydrophobicContact CB-CD1 4.05Å; P87-L150 HydrophobicContact CB-CD2 4.42Å; P87-L150 HydrophobicContact CG-CD2 3.99Å; I91-L150 HydrophobicContact CG2-CD1 3.72Å; V95-L150 HydrophobicContact CG1-CB 4.4Å; V95-L150 WeakPolarHBondContact CG1-O 3.42Å; V95-L150 HydrophobicContact CG2-CB 3.82Å; L109-L150 HydrophobicContact CD1-CB 3.99Å; L109-L150 HydrophobicContact CD2-CB 4.36Å; L109-L150 HydrophobicContact CD2-CD1 3.99Å; A146-L150 WeakPolarHBondContact O-CB 3.49Å; A146-L150 PolarHBondContact O-N 3.28Å
151	G	82.8	Confident	86.3	Confident	12 Å²	12	43.6 Å²	43.6	12%	0.124	23%	0.233	C	C	.	.	S	Bend	trans	-73.4	178.3	-178.7	0	0	0	0	0	113.8	W147	W147-G151 VanDerWaalsContact CZ3-CA 3.43Å; W147-G151 WeakPolarHBondContact O-CA 3.44Å; W147-G151 PolarHBondContact O-N 3.08Å
152	S	80.4	Confident	86.1	Confident	68 Å²	68	45 Å²	45	48%	0.476	24%	0.243	S	C	.	.	S	Bend	trans	-96.7	6.1	178.3	55.5	0	0	0	0	113.7	D154	S152-D154 PolarHBondContact O-N 3.46Å
153	D	83	Confident	86.1	Confident	64 Å²	64	45.7 Å²	45.7	34%	0.342	24%	0.243	S	C	.	.			trans	-85.8	104.5	177.2	-166.7	-41.1	0	0	0	109.8	K155 L156 R157	D153-K155 VanDerWaalsContact C-N 3.25Å; D153-K155 PolarHBondContact O-N 3.25Å; D153-K155 WeakPolarHBondContact OD1-CB 3.49Å; D153-K155 PolarHBondContact OD1-N 3.36Å; D153-L156 HydrophobicContact CB-CB 3.96Å; D153-L156 PolarHBondContact OD1-N 2.64Å; D153-R157 VanDerWaalsContact O-CB 3.23Å; D153-R157 WeakPolarHBondContact O-CB 3.44Å; D153-R157 PolarHBondContact O-N 3.14Å; D153-R157 VanDerWaalsContact O-N 3.07Å
154	D	83.1	Confident	86	Confident	106 Å²	106	48.5 Å²	48.5	57%	0.567	25%	0.251	S	S	*	.	H	α-helix	trans	-62	-33.7	-178.8	-62.5	-26.7	0	0	0	112.4	S152 R157 E158	S152-D154 PolarHBondContact O-N 3.46Å; D154-R157 IonicContact OD1-CZ 2.78Å; D154-R157 IonicContact OD1-NH2 3.05Å; D154-R157 PolarHBondContact OD1-NH2 3.09Å; D154-E158 WeakPolarHBondContact O-CB 3.4Å; D154-E158 PolarHBondContact O-N 2.86Å
155	K	83.4	Confident	86.1	Confident	135 Å²	135	49.8 Å²	49.8	59%	0.587	27%	0.265	S	S	*	.	H	α-helix	trans	-75.8	-45.3	-177	-63.6	-176.7	176.4	-171.5	0	111.4	D153 R157 E158 L159	D153-K155 VanDerWaalsContact C-N 3.25Å; D153-K155 PolarHBondContact O-N 3.25Å; D153-K155 WeakPolarHBondContact OD1-CB 3.49Å; D153-K155 PolarHBondContact OD1-N 3.36Å; K155-R157 PolarHBondContact O-N 2.89Å; K155-E158 PolarHBondContact O-N 3.22Å; K155-L159 WeakPolarHBondContact O-CB 3.22Å; K155-L159 PolarHBondContact O-N 3.3Å
156	L	84.4	Confident	86.2	Confident	7 Å²	7	49.9 Å²	49.9	4%	0.037	27%	0.266	C	S	.	.	H	α-helix	trans	-63.3	-36	177.1	-170.9	65	0	0	0	110.4	Q26 D153 L159 F160	Q26-L156 HydrophobicContact CB-CD1 4.11Å; D153-L156 HydrophobicContact CB-CB 3.96Å; D153-L156 PolarHBondContact OD1-N 2.64Å; L156-L159 HydrophobicContact CD1-CD2 4.44Å; L156-L159 PolarHBondContact O-N 3.44Å; L156-F160 WeakPolarHBondContact O-CB 3.25Å; L156-F160 PolarHBondContact O-N 2.8Å
157	R	87	Confident	86.4	Confident	116 Å²	116	49.9 Å²	49.9	44%	0.438	26%	0.263	S	S	.	.	H	α-helix	trans	-69	-39	175.1	-174.5	161.8	51.1	106.2	0.4	113.4	S148 D153 D154 K155 G161	S148-R157 WeakPolarHBondContact O-CA 3.49Å; S148-R157 VanDerWaalsContact O-CB 3.24Å; S148-R157 WeakPolarHBondContact O-CB 3.49Å; D153-R157 VanDerWaalsContact O-CB 3.23Å; D153-R157 WeakPolarHBondContact O-CB 3.44Å; D153-R157 PolarHBondContact O-N 3.14Å; D153-R157 VanDerWaalsContact O-N 3.07Å; D154-R157 IonicContact OD1-CZ 2.78Å; D154-R157 IonicContact OD1-NH2 3.05Å; D154-R157 PolarHBondContact OD1-NH2 3.09Å; K155-R157 PolarHBondContact O-N 2.89Å; R157-G161 WeakPolarHBondContact O-CA 3.23Å; R157-G161 PolarHBondContact O-N 3.31Å
158	E	87.4	Confident	86.6	Confident	150 Å²	150	52.2 Å²	52.2	70%	0.701	28%	0.279	S	S	*	.	H	α-helix	trans	-64.5	-44.9	172.5	-176.9	178.1	-170.9	0	0	111.3	D154 K155 G161 C162	D154-E158 WeakPolarHBondContact O-CB 3.4Å; D154-E158 PolarHBondContact O-N 2.86Å; K155-E158 PolarHBondContact O-N 3.22Å; E158-G161 PolarHBondContact O-N 3.24Å; E158-C162 WeakPolarHBondContact O-CB 3.49Å; E158-C162 PolarHBondContact O-N 3.06Å
159	L	86.1	Confident	86.9	Confident	30 Å²	30	55.1 Å²	55.1	16%	0.157	30%	0.296	C	S	.	.	H	α-helix	trans	-59.7	-51.7	176.8	-178.5	68.4	0	0	0	111.6	F22 M23 Q26 K155 L156 G161 C162 F163 M207	F22-L159 HydrophobicContact CD1-CD2 4.4Å; F22-L159 HydrophobicContact CE1-CD1 4.15Å; F22-L159 HydrophobicContact CE1-CD2 3.98Å; M23-L159 HydrophobicContact CG-CD2 4.2Å; Q26-L159 HydrophobicContact CB-CD2 3.98Å; Q26-L159 HydrophobicContact CG-CD2 3.72Å; K155-L159 WeakPolarHBondContact O-CB 3.22Å; K155-L159 PolarHBondContact O-N 3.3Å; L156-L159 HydrophobicContact CD1-CD2 4.44Å; L156-L159 PolarHBondContact O-N 3.44Å; L159-G161 VanDerWaalsContact C-N 3.33Å; L159-G161 PolarHBondContact O-N 2.82Å; L159-C162 WeakPolarHBondContact O-CB 3.37Å; L159-C162 PolarHBondContact O-N 2.96Å; L159-F163 PolarHBondContact O-N 3.32Å; L159-M207 HydrophobicContact CD1-CE 3.76Å; L159-M207 HydrophobicContact CD1-CG 3.81Å; L159-M207 HydrophobicContact CD1-SD 4.19Å; L159-M207 HydrophobicContact CG-CE 4.15Å
160	F	87.4	Confident	87.4	Confident	6 Å²	6	53.9 Å²	53.9	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-64.3	-40.1	177.2	-179.6	-105.8	0	0	0	111.4	M84 F145 S148 L149 L156 C162 F163 R164	M84-F160 HydrophobicContact CE-CZ 3.9Å; M84-F160 HydrophobicContact SD-CZ 3.84Å; F145-F160 AromaticContact CD1-CD2 3.56Å; F145-F160 HydrophobicContact CD1-CD2 3.56Å; F145-F160 AromaticContact CD1-CE2 3.23Å; F145-F160 HydrophobicContact CD1-CE2 3.23Å; F145-F160 HydrophobicContact CD1-CZ 4.17Å; F145-F160 AromaticContact CE1-CD2 3.75Å; F145-F160 HydrophobicContact CE1-CD2 3.75Å; F145-F160 AromaticContact CE1-CE2 3.46Å; F145-F160 HydrophobicContact CE1-CE2 3.46Å; F145-F160 VanDerWaalsContact CE1-CE2 3.46Å; F145-F160 HydrophobicContact CG-CE2 4.14Å; F145-F160 HydrophobicContact CZ-CE2 4.49Å; S148-F160 WeakPolarHBondContact OG-CB 3.43Å; S148-F160 WeakPolarHBondContact OG-CG 3.27Å; L149-F160 HydrophobicContact CB-CD1 4.32Å; L149-F160 HydrophobicContact CB-CE1 4.13Å; L149-F160 HydrophobicContact CD1-CD1 4.36Å; L149-F160 HydrophobicContact CD1-CE1 4.09Å; L149-F160 HydrophobicContact CG-CE1 4.49Å; L156-F160 WeakPolarHBondContact O-CB 3.25Å; L156-F160 PolarHBondContact O-N 2.8Å; F160-C162 VanDerWaalsContact C-N 3.27Å; F160-C162 PolarHBondContact O-N 3.46Å; F160-F163 HydrophobicContact CD2-CD1 4.01Å; F160-F163 HydrophobicContact CE2-CD1 4.04Å; F160-F163 HydrophobicContact CE2-CE1 4.38Å; F160-F163 PolarHBondContact O-N 3.31Å; F160-R164 HydrophobicContact CE1-CB 4.48Å; F160-R164 WeakPolarHBondContact O-CB 3.39Å; F160-R164 PolarHBondContact O-N 2.88Å
161	G	88	Confident	87.8	Confident	38 Å²	38	53.6 Å²	53.6	39%	0.392	29%	0.287	S	S	.	.	H	α-helix	trans	-58.9	-38.8	174.4	0	0	0	0	0	112.5	R157 E158 L159 G165	R157-G161 WeakPolarHBondContact O-CA 3.23Å; R157-G161 PolarHBondContact O-N 3.31Å; E158-G161 PolarHBondContact O-N 3.24Å; L159-G161 VanDerWaalsContact C-N 3.33Å; L159-G161 PolarHBondContact O-N 2.82Å; G161-G165 PolarHBondContact O-N 3.01Å
162	C	88.3	Confident	88.3	Confident	33 Å²	33	56.3 Å²	56.3	22%	0.223	30%	0.304	C	S	.	.	H	α-helix	trans	-67.6	-47.4	174.3	-175.4	0	0	0	0	112.2	E158 L159 F160 G165 H166 K206	E158-C162 WeakPolarHBondContact O-CB 3.49Å; E158-C162 PolarHBondContact O-N 3.06Å; L159-C162 WeakPolarHBondContact O-CB 3.37Å; L159-C162 PolarHBondContact O-N 2.96Å; F160-C162 VanDerWaalsContact C-N 3.27Å; F160-C162 PolarHBondContact O-N 3.46Å; C162-G165 PolarHBondContact O-N 3.3Å; C162-H166 PolarHBondContact O-CD2 2.99Å; C162-H166 VanDerWaalsContact O-CD2 3.26Å; C162-H166 PolarHBondContact O-N 3.37Å; C162-K206 WeakPolarHBondContact SG-CD 3.23Å; C162-K206 PolarHBondContact SG-NZ 3.46Å
163	F	88.5	Confident	89	Confident	31 Å²	31	54.5 Å²	54.5	14%	0.136	29%	0.289	C	S	.	.	H	α-helix	trans	-58	-50.9	176	167.3	-117.8	0	0	0	111.4	L19 M23 F145 L159 F160 G165 H166 I167 M207	L19-F163 HydrophobicContact CD2-CD2 3.76Å; L19-F163 HydrophobicContact CD2-CE2 3.36Å; L19-F163 HydrophobicContact CD2-CZ 4.27Å; L19-F163 HydrophobicContact CG-CD2 4.44Å; L19-F163 HydrophobicContact CG-CE2 4.28Å; M23-F163 HydrophobicContact CE-CD1 4.24Å; M23-F163 HydrophobicContact CE-CE1 4.17Å; M23-F163 HydrophobicContact SD-CB 4.43Å; M23-F163 HydrophobicContact SD-CD1 4.08Å; M23-F163 HydrophobicContact SD-CG 4.25Å; F145-F163 HydrophobicContact CE1-CD1 4.46Å; F145-F163 HydrophobicContact CE1-CE1 4.09Å; F145-F163 HydrophobicContact CZ-CE1 4.13Å; L159-F163 PolarHBondContact O-N 3.32Å; F160-F163 HydrophobicContact CD2-CD1 4.01Å; F160-F163 HydrophobicContact CE2-CD1 4.04Å; F160-F163 HydrophobicContact CE2-CE1 4.38Å; F160-F163 PolarHBondContact O-N 3.31Å; F163-G165 VanDerWaalsContact C-N 3.32Å; F163-G165 PolarHBondContact O-N 3.42Å; F163-H166 PolarHBondContact O-N 2.98Å; F163-I167 HydrophobicContact CD1-CD1 4.11Å; F163-I167 HydrophobicContact CD2-CD1 4.18Å; F163-I167 HydrophobicContact CE1-CD1 3.57Å; F163-I167 HydrophobicContact CE2-CD1 3.62Å; F163-I167 HydrophobicContact CE2-CG1 4.11Å; F163-I167 HydrophobicContact CG-CD1 4.42Å; F163-I167 HydrophobicContact CZ-CD1 3.32Å; F163-I167 HydrophobicContact CZ-CG1 4.29Å; F163-I167 PolarHBondContact O-N 3.24Å; F163-M207 HydrophobicContact CB-CE 4.3Å
164	R	88.9	Confident	89.5	Confident	80 Å²	80	52 Å²	52	30%	0.302	28%	0.276	S	S	.	.	H	α-helix	trans	-55.2	-45.1	172.9	157.6	151.6	-161.4	-152.5	0.2	112.1	M81 T85 F160 H166 I167 V168	M81-R164 HydrophobicContact CE-CB 3.76Å; M81-R164 VanDerWaalsContact CE-CD 3.46Å; M81-R164 HydrophobicContact CE-CG 3.27Å; T85-R164 VanDerWaalsContact CG2-CZ 3.47Å; F160-R164 HydrophobicContact CE1-CB 4.48Å; F160-R164 WeakPolarHBondContact O-CB 3.39Å; F160-R164 PolarHBondContact O-N 2.88Å; R164-H166 VanDerWaalsContact C-N 3.32Å; R164-H166 PolarHBondContact O-N 2.93Å; R164-I167 PolarHBondContact O-N 3.39Å; R164-V168 WeakPolarHBondContact O-CG2 3.35Å; R164-V168 PolarHBondContact O-N 3.39Å
165	G	91.1	Very high	90	Very high	30 Å²	30	54.5 Å²	54.5	31%	0.309	28%	0.282	S	S	.	.	H	α-helix	trans	-57.2	-47	177.4	0	0	0	0	0	111.5	G161 C162 F163 I167 V168 T169	G161-G165 PolarHBondContact O-N 3.01Å; C162-G165 PolarHBondContact O-N 3.3Å; F163-G165 VanDerWaalsContact C-N 3.32Å; F163-G165 PolarHBondContact O-N 3.42Å; G165-I167 PolarHBondContact O-N 2.92Å; G165-V168 PolarHBondContact O-N 3.21Å; G165-T169 PolarHBondContact O-N 3Å; G165-T169 PolarHBondContact O-OG1 3Å
166	H	92.1	Very high	90.5	Very high	27 Å²	27	50.8 Å²	50.8	13%	0.125	27%	0.268	C	S	.	.	H	α-helix	trans	-64.6	-35.8	177.2	-79.9	-65.8	0	0	0	113.6	C162 F163 R164 F170 H199 S202 V203 K206	C162-H166 PolarHBondContact O-CD2 2.99Å; C162-H166 VanDerWaalsContact O-CD2 3.26Å; C162-H166 PolarHBondContact O-N 3.37Å; F163-H166 PolarHBondContact O-N 2.98Å; R164-H166 VanDerWaalsContact C-N 3.32Å; R164-H166 PolarHBondContact O-N 2.93Å; H166-F170 VanDerWaalsContact O-CB 3.26Å; H166-F170 WeakPolarHBondContact O-CB 3.18Å; H166-F170 PolarHBondContact O-N 2.97Å; H166-H199 AromaticContact ND1-ND1 3.38Å; H166-H199 PolarHBondContact ND1-ND1 3.23Å; H166-S202 WeakPolarHBondContact CE1-CB 3.21Å; H166-V203 HydrophobicContact CB-CG2 3.55Å; H166-V203 WeakPolarHBondContact CD2-CG2 3.43Å; H166-V203 VanDerWaalsContact CG-CG2 3.49Å; H166-K206 PolarHBondContact NE2-NZ 3.16Å; H166-K206 VanDerWaalsContact NE2-NZ 3.12Å
167	I	90.7	Very high	90.9	Very high	22 Å²	22	58.4 Å²	58.4	11%	0.113	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-47.7	172.8	-68.9	166.7	0	0	0	110.9	I77 M81 F163 R164 G165 F170 H171	I77-I167 HydrophobicContact CG2-CD1 4.12Å; I77-I167 HydrophobicContact CG2-CG2 3.53Å; M81-I167 HydrophobicContact CE-CB 4.45Å; M81-I167 HydrophobicContact CE-CG2 4.43Å; M81-I167 HydrophobicContact SD-CB 4.08Å; M81-I167 HydrophobicContact SD-CD1 4.19Å; M81-I167 HydrophobicContact SD-CG2 3.53Å; M81-I167 VanDerWaalsContact SD-CG2 3.53Å; F163-I167 HydrophobicContact CD1-CD1 4.11Å; F163-I167 HydrophobicContact CD2-CD1 4.18Å; F163-I167 HydrophobicContact CE1-CD1 3.57Å; F163-I167 HydrophobicContact CE2-CD1 3.62Å; F163-I167 HydrophobicContact CE2-CG1 4.11Å; F163-I167 HydrophobicContact CG-CD1 4.42Å; F163-I167 HydrophobicContact CZ-CD1 3.32Å; F163-I167 HydrophobicContact CZ-CG1 4.29Å; F163-I167 PolarHBondContact O-N 3.24Å; R164-I167 PolarHBondContact O-N 3.39Å; G165-I167 PolarHBondContact O-N 2.92Å; I167-F170 PolarHBondContact O-N 3.19Å; I167-H171 PolarHBondContact O-N 3.29Å; I167-H171 PolarHBondContact O-ND1 3.14Å
168	V	91.7	Very high	91.1	Very high	68 Å²	68	61.6 Å²	61.6	41%	0.412	32%	0.323	S	S	.	.	H	α-helix	trans	-64.7	-42.2	-179.1	173.6	0	0	0	0	110.8	M81 R164 G165 H171 S172	M81-V168 HydrophobicContact CE-CG2 3.88Å; R164-V168 WeakPolarHBondContact O-CG2 3.35Å; R164-V168 PolarHBondContact O-N 3.39Å; G165-V168 PolarHBondContact O-N 3.21Å; V168-H171 PolarHBondContact O-N 3.42Å; V168-S172 PolarHBondContact O-N 3.08Å; V168-S172 PolarHBondContact O-OG 3.49Å
169	T	93.3	Very high	91.3	Very high	61 Å²	61	56.9 Å²	56.9	37%	0.374	31%	0.305	S	S	.	.	H	α-helix	trans	-64.7	-43.6	175.7	-55	0	0	0	0	111.3	G165 H171 S172 D173	G165-T169 PolarHBondContact O-N 3Å; G165-T169 PolarHBondContact O-OG1 3Å; T169-H171 VanDerWaalsContact C-N 3.32Å; T169-H171 PolarHBondContact O-N 3.02Å; T169-S172 WeakPolarHBondContact O-CA 3.1Å; T169-S172 WeakPolarHBondContact O-CB 3.34Å; T169-S172 PolarHBondContact O-N 3.42Å; T169-D173 WeakPolarHBondContact O-CB 3.16Å; T169-D173 PolarHBondContact O-N 2.89Å
170	F	93.6	Very high	91.6	Very high	15 Å²	15	55.5 Å²	55.5	7%	0.066	30%	0.298	C	S	.	.	H	α-helix	trans	-53.9	-49.3	174.3	169.5	-100.3	0	0	0	111.4	H166 I167 S172 D173 I174 I192 V195 L196 H199	H166-F170 VanDerWaalsContact O-CB 3.26Å; H166-F170 WeakPolarHBondContact O-CB 3.18Å; H166-F170 PolarHBondContact O-N 2.97Å; I167-F170 PolarHBondContact O-N 3.19Å; F170-S172 PolarHBondContact O-N 3.02Å; F170-D173 PolarHBondContact O-N 3.48Å; F170-I174 HydrophobicContact CD2-CG2 4.08Å; F170-I174 HydrophobicContact CE1-CD1 4.24Å; F170-I174 HydrophobicContact CE1-CG2 4.26Å; F170-I174 HydrophobicContact CE2-CG2 3.62Å; F170-I174 HydrophobicContact CZ-CG2 3.72Å; F170-I174 WeakPolarHBondContact O-CG2 3.41Å; F170-I174 PolarHBondContact O-N 3.06Å; F170-I192 HydrophobicContact CZ-CG2 4.47Å; F170-V195 HydrophobicContact CD2-CG1 3.93Å; F170-V195 HydrophobicContact CE2-CG1 4.36Å; F170-L196 HydrophobicContact CD2-CD1 4.28Å; F170-L196 HydrophobicContact CE2-CB 3.91Å; F170-L196 HydrophobicContact CE2-CD1 3.89Å; F170-L196 HydrophobicContact CE2-CG 4.49Å; F170-L196 HydrophobicContact CZ-CD1 4.22Å; F170-H199 WeakPolarHBondContact CA-NE2 3.42Å; F170-H199 AromaticContact CD2-CD2 3.93Å
171	H	92.7	Very high	91.8	Very high	27 Å²	27	60.9 Å²	60.9	13%	0.125	32%	0.318	C	S	.	.	H	α-helix	trans	-64.5	-28.7	177.9	-74.4	82.8	0	0	0	112.9	S73 I167 V168 T169 I174 F175	S73-H171 PolarHBondContact OG-CE1 3.2Å; S73-H171 PolarHBondContact OG-NE2 3.49Å; I167-H171 PolarHBondContact O-N 3.29Å; I167-H171 PolarHBondContact O-ND1 3.14Å; V168-H171 PolarHBondContact O-N 3.42Å; T169-H171 VanDerWaalsContact C-N 3.32Å; T169-H171 PolarHBondContact O-N 3.02Å; H171-I174 WeakPolarHBondContact O-CG1 3.34Å; H171-F175 VanDerWaalsContact O-CD2 3.27Å; H171-F175 WeakPolarHBondContact O-CD2 3.46Å
172	S	93.8	Very high	92	Very high	69 Å²	69	64 Å²	64	48%	0.483	32%	0.321	S	S	.	.	H	α-helix	trans	-75.4	-41.4	175.2	-53.1	0	0	0	0	111	V168 T169 F170 F175 N176	V168-S172 PolarHBondContact O-N 3.08Å; V168-S172 PolarHBondContact O-OG 3.49Å; T169-S172 WeakPolarHBondContact O-CA 3.1Å; T169-S172 WeakPolarHBondContact O-CB 3.34Å; T169-S172 PolarHBondContact O-N 3.42Å; F170-S172 PolarHBondContact O-N 3.02Å; S172-F175 PolarHBondContact O-N 2.96Å; S172-N176 WeakPolarHBondContact O-CB 3.28Å; S172-N176 PolarHBondContact O-N 3.29Å
173	D	95.1	Very high	92.1	Very high	29 Å²	29	67.6 Å²	67.6	16%	0.155	34%	0.342	C	S	.	.	H	α-helix	trans	-68.8	-37.9	-175.6	-75.1	2.3	0	0	0	112	T169 F170 F175 N176 V179 V195 H199	T169-D173 WeakPolarHBondContact O-CB 3.16Å; T169-D173 PolarHBondContact O-N 2.89Å; F170-D173 PolarHBondContact O-N 3.48Å; D173-F175 PolarHBondContact O-N 3.26Å; D173-N176 PolarHBondContact O-N 3.4Å; D173-N176 VanDerWaalsContact O-N 3.12Å; D173-V179 HydrophobicContact CB-CG1 4.03Å; D173-V195 HydrophobicContact CB-CG1 3.76Å; D173-H199 IonicContact OD2-CE1 2.83Å; D173-H199 IonicContact OD2-NE2 3.55Å; D173-H199 PolarHBondContact OD2-NE2 3.15Å; D173-H199 VanDerWaalsContact OD2-NE2 3.16Å
174	I	93.6	Very high	92.3	Very high	12 Å²	12	70.6 Å²	70.6	6%	0.062	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-14.6	177.5	65	175	0	0	0	114	F170 H171 V180 I192	F170-I174 HydrophobicContact CD2-CG2 4.08Å; F170-I174 HydrophobicContact CE1-CD1 4.24Å; F170-I174 HydrophobicContact CE1-CG2 4.26Å; F170-I174 HydrophobicContact CE2-CG2 3.62Å; F170-I174 HydrophobicContact CZ-CG2 3.72Å; F170-I174 WeakPolarHBondContact O-CG2 3.41Å; F170-I174 PolarHBondContact O-N 3.06Å; H171-I174 WeakPolarHBondContact O-CG1 3.34Å; I174-V180 WeakPolarHBondContact O-CG2 3.42Å; I174-I192 HydrophobicContact CB-CG1 4.36Å; I174-I192 HydrophobicContact CG2-CG1 4.11Å; I174-I192 HydrophobicContact CG2-CG2 4.1Å
175	F	93.1	Very high	92.4	Very high	159 Å²	159	71.7 Å²	71.7	70%	0.697	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	7.1	175.1	-68.8	-69.5	0	0	0	112.4	H171 S172 D173	H171-F175 VanDerWaalsContact O-CD2 3.27Å; H171-F175 WeakPolarHBondContact O-CD2 3.46Å; S172-F175 PolarHBondContact O-N 2.96Å; D173-F175 PolarHBondContact O-N 3.26Å
176	N	93.5	Very high	92.3	Very high	57 Å²	57	72.1 Å²	72.1	31%	0.305	38%	0.379	S	S	.	.			trans	-97.2	115.8	-178.7	-173.8	-8.4	0	0	0	110.8	S172 D173 E178 V179 V180	S172-N176 WeakPolarHBondContact O-CB 3.28Å; S172-N176 PolarHBondContact O-N 3.29Å; D173-N176 PolarHBondContact O-N 3.4Å; D173-N176 VanDerWaalsContact O-N 3.12Å; N176-E178 PolarHBondContact O-N 2.74Å; N176-E178 WeakPolarHBondContact OD1-CB 3.44Å; N176-E178 PolarHBondContact OD1-N 3Å; N176-V179 HydrophobicContact CB-CB 4.14Å; N176-V179 HydrophobicContact CB-CG2 3.96Å; N176-V179 PolarHBondContact O-N 2.97Å; N176-V180 WeakPolarHBondContact O-CG2 3.49Å; N176-V180 PolarHBondContact O-N 3.22Å
177	E	92.1	Very high	92.3	Very high	166 Å²	166	74.4 Å²	74.4	78%	0.776	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.6	179.1	-60.2	179.7	179.5	0	0	113.5	V179 F182	E177-V179 VanDerWaalsContact C-N 3.34Å; E177-F182 HydrophobicContact CB-CD2 4.4Å; E177-F182 HydrophobicContact CB-CE2 4.33Å; E177-F182 HydrophobicContact CG-CD2 3.85Å; E177-F182 HydrophobicContact CG-CE2 3.79Å
178	E	91.5	Very high	92.4	Very high	183 Å²	183	75.3 Å²	75.3	86%	0.855	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-17.6	174.6	-60	-176	166.9	0	0	112.8	N176	N176-E178 PolarHBondContact O-N 2.74Å; N176-E178 WeakPolarHBondContact OD1-CB 3.44Å; N176-E178 PolarHBondContact OD1-N 3Å
179	V	91.3	Very high	92.5	Very high	52 Å²	52	72.6 Å²	72.6	32%	0.315	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-39.4	-173.7	-178	0	0	0	0	111.9	D173 N176 E177 V195	D173-V179 HydrophobicContact CB-CG1 4.03Å; N176-V179 HydrophobicContact CB-CB 4.14Å; N176-V179 HydrophobicContact CB-CG2 3.96Å; N176-V179 PolarHBondContact O-N 2.97Å; E177-V179 VanDerWaalsContact C-N 3.34Å; V179-V195 HydrophobicContact CG1-CG2 3.73Å
180	V	93.7	Very high	92.4	Very high	1 Å²	1	74 Å²	74	1%	0.006	38%	0.382	C	S	.	.	S	Bend	trans	-123.9	142.1	179.4	-58	0	0	0	0	110.7	I174 N176 F182 L188 D191 I192 V195	I174-V180 WeakPolarHBondContact O-CG2 3.42Å; N176-V180 WeakPolarHBondContact O-CG2 3.49Å; N176-V180 PolarHBondContact O-N 3.22Å; V180-F182 HydrophobicContact CG2-CD2 4.39Å; V180-F182 HydrophobicContact CG2-CE1 4.08Å; V180-F182 HydrophobicContact CG2-CE2 3.59Å; V180-F182 HydrophobicContact CG2-CZ 3.39Å; V180-L188 HydrophobicContact CB-CD1 3.95Å; V180-L188 HydrophobicContact CG2-CD1 3.83Å; V180-D191 HydrophobicContact CB-CB 3.97Å; V180-D191 HydrophobicContact CG1-CB 3.94Å; V180-I192 HydrophobicContact CG1-CG1 4.48Å; V180-V195 HydrophobicContact CG1-CG2 4.03Å
181	R	91.9	Very high	92.4	Very high	119 Å²	119	74.4 Å²	74.4	45%	0.449	39%	0.385	S	S	.	.			trans	-88.2	123.5	179.1	-65.9	169.2	-74.2	165.9	-3.6	110.5	T183 E187 L188 D191	R181-T183 VanDerWaalsContact C-N 3.3Å; R181-E187 IonicContact NH1-OE1 3.53Å; R181-E187 PolarHBondContact NH1-OE1 3.25Å; R181-E187 IonicContact NH1-OE2 3.82Å; R181-L188 WeakPolarHBondContact O-CA 3.46Å; R181-L188 WeakPolarHBondContact O-CB 3.46Å; R181-D191 WeakPolarHBondContact CB-OD2 3.26Å; R181-D191 WeakPolarHBondContact CG-OD2 3.23Å; R181-D191 IonicContact CZ-OD1 2.73Å; R181-D191 IonicContact CZ-OD2 3.4Å; R181-D191 PolarHBondContact N-OD2 3.02Å; R181-D191 IonicContact NE-OD1 3.53Å; R181-D191 PolarHBondContact NE-OD1 3.42Å; R181-D191 IonicContact NE-OD2 3.54Å; R181-D191 PolarHBondContact NE-OD2 3.05Å; R181-D191 IonicContact NH2-OD1 2.73Å; R181-D191 PolarHBondContact NH2-OD1 2.89Å; R181-D191 IonicContact NH2-OD2 3.49Å
182	F	90.6	Very high	92.5	Very high	103 Å²	103	73.8 Å²	73.8	45%	0.452	38%	0.382	S	S	.	.			trans	-93.9	19.7	175.8	-63	-80.2	0	0	0	113.3	E177 V180 L188	E177-F182 HydrophobicContact CB-CD2 4.4Å; E177-F182 HydrophobicContact CB-CE2 4.33Å; E177-F182 HydrophobicContact CG-CD2 3.85Å; E177-F182 HydrophobicContact CG-CE2 3.79Å; V180-F182 HydrophobicContact CG2-CD2 4.39Å; V180-F182 HydrophobicContact CG2-CE1 4.08Å; V180-F182 HydrophobicContact CG2-CE2 3.59Å; V180-F182 HydrophobicContact CG2-CZ 3.39Å; F182-L188 HydrophobicContact CD1-CD1 3.96Å; F182-L188 HydrophobicContact CD1-CD2 4.07Å; F182-L188 HydrophobicContact CE1-CD1 3.86Å; F182-L188 HydrophobicContact CE1-CD2 4.32Å
183	T	91.5	Very high	92.5	Very high	109 Å²	109	71.7 Å²	71.7	67%	0.669	36%	0.364	S	S	*	.	S	Bend	trans	-72.8	-45.5	-177.7	33.8	0	0	0	0	112.7	R181 E187	R181-T183 VanDerWaalsContact C-N 3.3Å; T183-E187 PolarHBondContact OG1-OE2 2.93Å
184	D	91.9	Very high	92.5	Very high	94 Å²	94	73.3 Å²	73.3	50%	0.503	38%	0.375	S	S	.	.			trans	-142.9	150.6	-179.6	176.8	62.3	0	0	0	110.7	G186 E187 L188	D184-G186 VanDerWaalsContact C-N 3.29Å; D184-G186 PolarHBondContact O-N 2.95Å; D184-G186 VanDerWaalsContact OD2-CA 3.3Å; D184-G186 WeakPolarHBondContact OD2-CA 3.44Å; D184-G186 PolarHBondContact OD2-N 3.33Å; D184-E187 HydrophobicContact CB-CB 4.38Å; D184-E187 HydrophobicContact CB-CG 4.21Å; D184-E187 PolarHBondContact O-N 3.39Å; D184-E187 PolarHBondContact OD2-N 2.99Å; D184-L188 WeakPolarHBondContact O-CB 3.39Å; D184-L188 PolarHBondContact O-N 3.29Å
185	V	90.9	Very high	92.5	Very high	102 Å²	102	72.9 Å²	72.9	62%	0.618	37%	0.373	S	S	*	.	H	α-helix	trans	-65	-34.3	-178.6	179.7	0	0	0	0	111.6	A189	V185-A189 WeakPolarHBondContact O-CB 3.43Å; V185-A189 PolarHBondContact O-N 3.1Å
186	G	90.7	Very high	92.5	Very high	39 Å²	39	66.3 Å²	66.3	40%	0.402	35%	0.345	S	S	.	.	H	α-helix	trans	-68.2	-46.6	175.8	0	0	0	0	0	112	D184 A189 E190	D184-G186 VanDerWaalsContact C-N 3.29Å; D184-G186 PolarHBondContact O-N 2.95Å; D184-G186 VanDerWaalsContact OD2-CA 3.3Å; D184-G186 WeakPolarHBondContact OD2-CA 3.44Å; D184-G186 PolarHBondContact OD2-N 3.33Å; G186-A189 PolarHBondContact O-N 2.99Å; G186-E190 PolarHBondContact O-N 3.36Å; G186-E190 VanDerWaalsContact O-N 3.11Å
187	E	91.7	Very high	92.5	Very high	76 Å²	76	66.3 Å²	66.3	36%	0.355	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-44.3	175.8	-65.7	-165.7	141.2	0	0	111.8	R181 T183 D184 A189 E190 D191	R181-E187 IonicContact NH1-OE1 3.53Å; R181-E187 PolarHBondContact NH1-OE1 3.25Å; R181-E187 IonicContact NH1-OE2 3.82Å; T183-E187 PolarHBondContact OG1-OE2 2.93Å; D184-E187 HydrophobicContact CB-CB 4.38Å; D184-E187 HydrophobicContact CB-CG 4.21Å; D184-E187 PolarHBondContact O-N 3.39Å; D184-E187 PolarHBondContact OD2-N 2.99Å; E187-A189 VanDerWaalsContact C-N 3.31Å; E187-A189 PolarHBondContact O-N 3.14Å; E187-E190 PolarHBondContact O-N 2.85Å; E187-D191 PolarHBondContact O-N 2.91Å
188	L	93.1	Very high	92.6	Very high	40 Å²	40	63.8 Å²	63.8	21%	0.209	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-42.3	175.8	-179.9	60	0	0	0	111.5	V180 R181 F182 D184 D191 I192	V180-L188 HydrophobicContact CB-CD1 3.95Å; V180-L188 HydrophobicContact CG2-CD1 3.83Å; R181-L188 WeakPolarHBondContact O-CA 3.46Å; R181-L188 WeakPolarHBondContact O-CB 3.46Å; F182-L188 HydrophobicContact CD1-CD1 3.96Å; F182-L188 HydrophobicContact CD1-CD2 4.07Å; F182-L188 HydrophobicContact CE1-CD1 3.86Å; F182-L188 HydrophobicContact CE1-CD2 4.32Å; D184-L188 WeakPolarHBondContact O-CB 3.39Å; D184-L188 PolarHBondContact O-N 3.29Å; L188-D191 PolarHBondContact O-N 3.26Å; L188-I192 HydrophobicContact CD1-CD1 3.87Å; L188-I192 HydrophobicContact CD1-CG1 4.09Å; L188-I192 HydrophobicContact CD2-CD1 4.5Å; L188-I192 HydrophobicContact CG-CD1 3.8Å; L188-I192 HydrophobicContact CG-CG1 4.41Å; L188-I192 WeakPolarHBondContact O-CB 3.5Å; L188-I192 WeakPolarHBondContact O-CG1 3.45Å; L188-I192 PolarHBondContact O-N 2.95Å
189	A	92.6	Very high	92.7	Very high	12 Å²	12	55.9 Å²	55.9	10%	0.099	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-43.4	178.1	0	0	0	0	0	112.2	L2 V185 G186 E187 W193	L2-A189 HydrophobicContact CB-CB 4.1Å; L2-A189 WeakPolarHBondContact CD1-O 2.9Å; V185-A189 WeakPolarHBondContact O-CB 3.43Å; V185-A189 PolarHBondContact O-N 3.1Å; G186-A189 PolarHBondContact O-N 2.99Å; E187-A189 VanDerWaalsContact C-N 3.31Å; E187-A189 PolarHBondContact O-N 3.14Å; A189-W193 WeakPolarHBondContact O-CB 3.47Å; A189-W193 PolarHBondContact O-N 3.05Å
190	E	92.2	Very high	92.7	Very high	91 Å²	91	54.3 Å²	54.3	43%	0.425	28%	0.279	S	S	.	.	H	α-helix	trans	-68.9	-35.9	177.4	-69.2	-54.2	135.4	0	0	112.7	K8 G186 E187 W193 T194	K8-E190 IonicContact NZ-OE1 3.14Å; K8-E190 PolarHBondContact NZ-OE1 2.87Å; K8-E190 IonicContact NZ-OE2 2.71Å; G186-E190 PolarHBondContact O-N 3.36Å; G186-E190 VanDerWaalsContact O-N 3.11Å; E187-E190 PolarHBondContact O-N 2.85Å; E190-W193 WeakPolarHBondContact O-CB 3.39Å; E190-W193 PolarHBondContact O-N 2.89Å; E190-T194 PolarHBondContact O-N 3.34Å; E190-T194 PolarHBondContact O-OG1 2.93Å
191	D	94.1	Very high	92.5	Very high	23 Å²	23	60 Å²	60	12%	0.123	31%	0.306	C	S	.	.	H	α-helix	trans	-67.6	-45.8	175.1	-71.8	-9.7	0	0	0	111.1	V180 R181 E187 L188 W193 T194 V195	V180-D191 HydrophobicContact CB-CB 3.97Å; V180-D191 HydrophobicContact CG1-CB 3.94Å; R181-D191 WeakPolarHBondContact CB-OD2 3.26Å; R181-D191 WeakPolarHBondContact CG-OD2 3.23Å; R181-D191 IonicContact CZ-OD1 2.73Å; R181-D191 IonicContact CZ-OD2 3.4Å; R181-D191 PolarHBondContact N-OD2 3.02Å; R181-D191 IonicContact NE-OD1 3.53Å; R181-D191 PolarHBondContact NE-OD1 3.42Å; R181-D191 IonicContact NE-OD2 3.54Å; R181-D191 PolarHBondContact NE-OD2 3.05Å; R181-D191 IonicContact NH2-OD1 2.73Å; R181-D191 PolarHBondContact NH2-OD1 2.89Å; R181-D191 IonicContact NH2-OD2 3.49Å; E187-D191 PolarHBondContact O-N 2.91Å; L188-D191 PolarHBondContact O-N 3.26Å; D191-W193 VanDerWaalsContact C-N 3.28Å; D191-W193 PolarHBondContact O-N 3.47Å; D191-T194 WeakPolarHBondContact O-CB 3.39Å; D191-T194 PolarHBondContact O-N 2.66Å; D191-T194 VanDerWaalsContact O-N 3.17Å; D191-V195 VanDerWaalsContact O-CG2 3.27Å; D191-V195 WeakPolarHBondContact O-CG2 3.04Å; D191-V195 PolarHBondContact O-N 3.24Å
192	I	94.1	Very high	92.4	Very high	14 Å²	14	56.2 Å²	56.2	7%	0.072	30%	0.297	C	S	.	.	H	α-helix	trans	-59.3	-40.5	174.3	-69.2	169.8	0	0	0	110.8	L2 F170 I174 V180 L188 V195 L196	L2-I192 HydrophobicContact CD2-CB 4.44Å; L2-I192 HydrophobicContact CD2-CG2 3.85Å; F170-I192 HydrophobicContact CZ-CG2 4.47Å; I174-I192 HydrophobicContact CB-CG1 4.36Å; I174-I192 HydrophobicContact CG2-CG1 4.11Å; I174-I192 HydrophobicContact CG2-CG2 4.1Å; V180-I192 HydrophobicContact CG1-CG1 4.48Å; L188-I192 HydrophobicContact CD1-CD1 3.87Å; L188-I192 HydrophobicContact CD1-CG1 4.09Å; L188-I192 HydrophobicContact CD2-CD1 4.5Å; L188-I192 HydrophobicContact CG-CD1 3.8Å; L188-I192 HydrophobicContact CG-CG1 4.41Å; L188-I192 WeakPolarHBondContact O-CB 3.5Å; L188-I192 WeakPolarHBondContact O-CG1 3.45Å; L188-I192 PolarHBondContact O-N 2.95Å; I192-V195 PolarHBondContact O-N 3.48Å; I192-L196 WeakPolarHBondContact O-CB 3.43Å; I192-L196 PolarHBondContact O-N 3.46Å
193	W	94.2	Very high	92.2	Very high	24 Å²	24	51.6 Å²	51.6	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-48.4	175.2	-175	-117.6	0	0	0	111.9	L2 K8 W11 V12 A189 E190 D191 V195 L196 Q197	L2-W193 HydrophobicContact CD1-CB 3.61Å; L2-W193 HydrophobicContact CD1-CD2 4.09Å; L2-W193 HydrophobicContact CD1-CE3 3.81Å; L2-W193 HydrophobicContact CD1-CG 4.03Å; L2-W193 HydrophobicContact CD2-CE3 4.46Å; L2-W193 HydrophobicContact CG-CE3 4.43Å; K8-W193 HydrophobicContact CB-CE3 4.38Å; K8-W193 HydrophobicContact CB-CH2 3.72Å; K8-W193 HydrophobicContact CB-CZ2 4.24Å; K8-W193 HydrophobicContact CB-CZ3 3.79Å; K8-W193 HydrophobicContact CD-CD2 3.96Å; K8-W193 HydrophobicContact CD-CE3 4.11Å; K8-W193 HydrophobicContact CD-CG 4.42Å; K8-W193 HydrophobicContact CD-CH2 4.48Å; K8-W193 HydrophobicContact CD-CZ2 4.37Å; K8-W193 HydrophobicContact CD-CZ3 4.35Å; K8-W193 HydrophobicContact CG-CD2 4.25Å; K8-W193 HydrophobicContact CG-CE3 4.27Å; K8-W193 HydrophobicContact CG-CH2 3.77Å; K8-W193 HydrophobicContact CG-CZ2 3.76Å; K8-W193 HydrophobicContact CG-CZ3 4.03Å; W11-W193 HydrophobicContact CB-CH2 4.28Å; W11-W193 AromaticContact CD2-CH2 3.98Å; W11-W193 HydrophobicContact CD2-CH2 3.98Å; W11-W193 HydrophobicContact CD2-CZ2 4.36Å; W11-W193 AromaticContact CE3-CH2 3.51Å; W11-W193 HydrophobicContact CE3-CH2 3.51Å; W11-W193 HydrophobicContact CE3-CZ2 4.21Å; W11-W193 HydrophobicContact CE3-CZ3 4.15Å; W11-W193 HydrophobicContact CG-CH2 4.31Å; W11-W193 HydrophobicContact CZ3-CH2 4.16Å; V12-W193 HydrophobicContact CG2-CH2 4.22Å; V12-W193 HydrophobicContact CG2-CZ3 3.78Å; A189-W193 WeakPolarHBondContact O-CB 3.47Å; A189-W193 PolarHBondContact O-N 3.05Å; E190-W193 WeakPolarHBondContact O-CB 3.39Å; E190-W193 PolarHBondContact O-N 2.89Å; D191-W193 VanDerWaalsContact C-N 3.28Å; D191-W193 PolarHBondContact O-N 3.47Å; W193-V195 VanDerWaalsContact C-N 3.31Å; W193-V195 PolarHBondContact O-N 2.82Å; W193-L196 HydrophobicContact CE3-CD2 4.11Å; W193-L196 HydrophobicContact CZ3-CD2 4.02Å; W193-L196 WeakPolarHBondContact O-CB 3.17Å; W193-L196 PolarHBondContact O-N 2.82Å; W193-Q197 HydrophobicContact CD2-CG 4.36Å; W193-Q197 HydrophobicContact CZ2-CG 4.19Å; W193-Q197 VanDerWaalsContact NE1-CD 3.28Å; W193-Q197 WeakPolarHBondContact O-CG 3.29Å; W193-Q197 PolarHBondContact O-N 2.81Å
194	T	94.1	Very high	91.9	Very high	64 Å²	64	49.3 Å²	49.3	39%	0.393	26%	0.261	S	S	.	.	H	α-helix	trans	-61.3	-41.5	179.1	-56.9	0	0	0	0	111.2	E190 D191 R198	E190-T194 PolarHBondContact O-N 3.34Å; E190-T194 PolarHBondContact O-OG1 2.93Å; D191-T194 WeakPolarHBondContact O-CB 3.39Å; D191-T194 PolarHBondContact O-N 2.66Å; D191-T194 VanDerWaalsContact O-N 3.17Å; T194-R198 WeakPolarHBondContact O-CB 3.47Å; T194-R198 PolarHBondContact O-N 3.27Å
195	V	94.4	Very high	91.5	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-45.3	175.4	172.7	0	0	0	0	110.9	F170 D173 V179 V180 D191 I192 W193 R198 H199	F170-V195 HydrophobicContact CD2-CG1 3.93Å; F170-V195 HydrophobicContact CE2-CG1 4.36Å; D173-V195 HydrophobicContact CB-CG1 3.76Å; V179-V195 HydrophobicContact CG1-CG2 3.73Å; V180-V195 HydrophobicContact CG1-CG2 4.03Å; D191-V195 VanDerWaalsContact O-CG2 3.27Å; D191-V195 WeakPolarHBondContact O-CG2 3.04Å; D191-V195 PolarHBondContact O-N 3.24Å; I192-V195 PolarHBondContact O-N 3.48Å; W193-V195 VanDerWaalsContact C-N 3.31Å; W193-V195 PolarHBondContact O-N 2.82Å; V195-R198 PolarHBondContact O-N 3.06Å; V195-H199 PolarHBondContact O-CD2 3.22Å; V195-H199 PolarHBondContact O-N 2.93Å
196	L	92.9	Very high	90.8	Very high	21 Å²	21	48.1 Å²	48.1	11%	0.11	25%	0.25	C	S	.	.	H	α-helix	trans	-60	-48	177.5	-178.1	63.2	0	0	0	111.8	V12 F170 I192 W193 H199 M200	V12-L196 HydrophobicContact CG2-CD2 3.74Å; F170-L196 HydrophobicContact CD2-CD1 4.28Å; F170-L196 HydrophobicContact CE2-CB 3.91Å; F170-L196 HydrophobicContact CE2-CD1 3.89Å; F170-L196 HydrophobicContact CE2-CG 4.49Å; F170-L196 HydrophobicContact CZ-CD1 4.22Å; I192-L196 WeakPolarHBondContact O-CB 3.43Å; I192-L196 PolarHBondContact O-N 3.46Å; W193-L196 HydrophobicContact CE3-CD2 4.11Å; W193-L196 HydrophobicContact CZ3-CD2 4.02Å; W193-L196 WeakPolarHBondContact O-CB 3.17Å; W193-L196 PolarHBondContact O-N 2.82Å; L196-H199 PolarHBondContact O-N 2.88Å; L196-M200 WeakPolarHBondContact O-CB 3.25Å; L196-M200 PolarHBondContact O-N 3.4Å
197	Q	94.2	Very high	89.8	Confident	57 Å²	57	46.6 Å²	46.6	27%	0.266	23%	0.233	S	C	.	.	H	α-helix	trans	-59.6	-49.2	177.5	-71.6	-175.9	-58.3	0	0	111.4	W11 W193 H199 M200 E201	W11-Q197 HydrophobicContact CH2-CG 4.05Å; W11-Q197 HydrophobicContact CZ2-CG 4.33Å; W11-Q197 HydrophobicContact CZ3-CG 4.46Å; W193-Q197 HydrophobicContact CD2-CG 4.36Å; W193-Q197 HydrophobicContact CZ2-CG 4.19Å; W193-Q197 VanDerWaalsContact NE1-CD 3.28Å; W193-Q197 WeakPolarHBondContact O-CG 3.29Å; W193-Q197 PolarHBondContact O-N 2.81Å; Q197-H199 VanDerWaalsContact C-N 3.31Å; Q197-H199 PolarHBondContact O-N 2.84Å; Q197-M200 PolarHBondContact O-N 3.06Å; Q197-M200 VanDerWaalsContact O-N 3.16Å; Q197-E201 WeakPolarHBondContact O-CB 3.49Å; Q197-E201 WeakPolarHBondContact O-CG 3.25Å; Q197-E201 PolarHBondContact O-N 2.92Å
198	R	93.9	Very high	88.5	Confident	113 Å²	113	48.2 Å²	48.2	43%	0.426	25%	0.248	S	C	.	.	H	α-helix	trans	-55.5	-44.5	178.7	-174.7	-169.6	-58.9	132.8	1.8	112.1	T194 V195 S202	T194-R198 WeakPolarHBondContact O-CB 3.47Å; T194-R198 PolarHBondContact O-N 3.27Å; V195-R198 PolarHBondContact O-N 3.06Å; R198-S202 VanDerWaalsContact O-CB 3.3Å; R198-S202 WeakPolarHBondContact O-CB 3.32Å; R198-S202 PolarHBondContact O-N 3.38Å; R198-S202 PolarHBondContact O-OG 2.87Å
199	H	93.3	Very high	86.6	Confident	17 Å²	17	54.5 Å²	54.5	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-69.4	-42.6	178.1	-74.2	-51.5	0	0	0	112.4	H166 F170 D173 V195 L196 Q197 E201 S202 V203	H166-H199 AromaticContact ND1-ND1 3.38Å; H166-H199 PolarHBondContact ND1-ND1 3.23Å; F170-H199 WeakPolarHBondContact CA-NE2 3.42Å; F170-H199 AromaticContact CD2-CD2 3.93Å; D173-H199 IonicContact OD2-CE1 2.83Å; D173-H199 IonicContact OD2-NE2 3.55Å; D173-H199 PolarHBondContact OD2-NE2 3.15Å; D173-H199 VanDerWaalsContact OD2-NE2 3.16Å; V195-H199 PolarHBondContact O-CD2 3.22Å; V195-H199 PolarHBondContact O-N 2.93Å; L196-H199 PolarHBondContact O-N 2.88Å; Q197-H199 VanDerWaalsContact C-N 3.31Å; Q197-H199 PolarHBondContact O-N 2.84Å; H199-E201 PolarHBondContact O-N 3.26Å; H199-S202 WeakPolarHBondContact O-CB 3.34Å; H199-S202 PolarHBondContact O-N 3.28Å; H199-V203 VanDerWaalsContact O-CG2 3.26Å; H199-V203 WeakPolarHBondContact O-CG2 3.37Å; H199-V203 PolarHBondContact O-N 3.45Å
200	M	90.5	Very high	84.5	Confident	20 Å²	20	59.2 Å²	59.2	10%	0.099	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-43.3	177.6	-171.2	61.8	77.1	0	0	111.7	W11 I16 L19 L196 Q197 V203 N204	W11-M200 HydrophobicContact CH2-CB 3.77Å; W11-M200 HydrophobicContact CH2-CG 3.79Å; W11-M200 HydrophobicContact CZ2-CG 4.38Å; I16-M200 HydrophobicContact CG1-CE 4.5Å; L19-M200 HydrophobicContact CD2-CE 4.47Å; L19-M200 HydrophobicContact CD2-SD 4.2Å; L196-M200 WeakPolarHBondContact O-CB 3.25Å; L196-M200 PolarHBondContact O-N 3.4Å; Q197-M200 PolarHBondContact O-N 3.06Å; Q197-M200 VanDerWaalsContact O-N 3.16Å; M200-V203 PolarHBondContact O-N 3.38Å; M200-N204 WeakPolarHBondContact O-CB 3.34Å; M200-N204 PolarHBondContact O-N 3.28Å; M200-N204 PolarHBondContact O-ND2 3.49Å
201	E	90.5	Very high	82.1	Confident	121 Å²	121	60.5 Å²	60.5	57%	0.565	30%	0.298	S	S	*	.	H	α-helix	trans	-63.6	-41.3	174.4	-72.3	176.3	-177.7	0	0	112.3	Q197 H199 V203 N204 S205	Q197-E201 WeakPolarHBondContact O-CB 3.49Å; Q197-E201 WeakPolarHBondContact O-CG 3.25Å; Q197-E201 PolarHBondContact O-N 2.92Å; H199-E201 PolarHBondContact O-N 3.26Å; E201-V203 VanDerWaalsContact C-N 3.3Å; E201-V203 PolarHBondContact O-N 2.59Å; E201-N204 PolarHBondContact O-N 3.01Å; E201-S205 VanDerWaalsContact O-CB 3.32Å; E201-S205 WeakPolarHBondContact O-CB 3.14Å; E201-S205 PolarHBondContact O-N 3.4Å; E201-S205 PolarHBondContact O-OG 3.06Å; E201-S205 VanDerWaalsContact O-OG 3.07Å
202	S	89.1	Confident	79.7	Confident	39 Å²	39	62.1 Å²	62.1	27%	0.273	31%	0.31	S	S	.	.	H	α-helix	trans	-63	-38.3	176.1	-64.9	0	0	0	0	112.1	H166 R198 H199 S205 K206	H166-S202 WeakPolarHBondContact CE1-CB 3.21Å; R198-S202 VanDerWaalsContact O-CB 3.3Å; R198-S202 WeakPolarHBondContact O-CB 3.32Å; R198-S202 PolarHBondContact O-N 3.38Å; R198-S202 PolarHBondContact O-OG 2.87Å; H199-S202 WeakPolarHBondContact O-CB 3.34Å; H199-S202 PolarHBondContact O-N 3.28Å; S202-S205 PolarHBondContact O-OG 2.84Å; S202-K206 WeakPolarHBondContact O-CG 3.45Å; S202-K206 PolarHBondContact O-N 3.04Å
203	V	87.2	Confident	77.2	Confident	6 Å²	6	63.7 Å²	63.7	4%	0.036	33%	0.33	C	S	.	.	H	α-helix	trans	-66.8	-53	173.4	175.9	0	0	0	0	109.7	L19 H166 H199 M200 E201 S205 K206 M207	L19-V203 HydrophobicContact CD1-CG1 3.38Å; H166-V203 HydrophobicContact CB-CG2 3.55Å; H166-V203 WeakPolarHBondContact CD2-CG2 3.43Å; H166-V203 VanDerWaalsContact CG-CG2 3.49Å; H199-V203 VanDerWaalsContact O-CG2 3.26Å; H199-V203 WeakPolarHBondContact O-CG2 3.37Å; H199-V203 PolarHBondContact O-N 3.45Å; M200-V203 PolarHBondContact O-N 3.38Å; E201-V203 VanDerWaalsContact C-N 3.3Å; E201-V203 PolarHBondContact O-N 2.59Å; V203-S205 PolarHBondContact O-N 2.98Å; V203-K206 PolarHBondContact O-N 3.44Å; V203-K206 VanDerWaalsContact O-N 3.07Å; V203-M207 HydrophobicContact CG1-CE 3.59Å; V203-M207 HydrophobicContact CG1-CG 4.07Å; V203-M207 HydrophobicContact CG1-SD 4.06Å; V203-M207 VanDerWaalsContact O-CG 3.25Å; V203-M207 WeakPolarHBondContact O-CG 2.97Å; V203-M207 PolarHBondContact O-N 2.89Å
204	N	84.8	Confident	74.9	Confident	61 Å²	61	66.6 Å²	66.6	33%	0.326	35%	0.354	S	S	.	.	H	α-helix	trans	-59.7	-40.1	-177.8	-78.9	-26.8	0	0	0	113.4	M200 E201 K206 M207 T208	M200-N204 WeakPolarHBondContact O-CB 3.34Å; M200-N204 PolarHBondContact O-N 3.28Å; M200-N204 PolarHBondContact O-ND2 3.49Å; E201-N204 PolarHBondContact O-N 3.01Å; N204-K206 VanDerWaalsContact C-N 3.27Å; N204-K206 PolarHBondContact O-N 2.9Å; N204-M207 PolarHBondContact O-N 2.98Å; N204-T208 WeakPolarHBondContact O-CG2 3.36Å; N204-T208 PolarHBondContact O-N 3.25Å; N204-T208 PolarHBondContact O-OG1 3.19Å
205	S	83.5	Confident	72.5	Confident	57 Å²	57	65.7 Å²	65.7	40%	0.399	35%	0.348	S	S	.	.	H	α-helix	trans	-65.5	-28.3	177.3	64.1	0	0	0	0	113.3	E201 S202 V203 T208 K209	E201-S205 VanDerWaalsContact O-CB 3.32Å; E201-S205 WeakPolarHBondContact O-CB 3.14Å; E201-S205 PolarHBondContact O-N 3.4Å; E201-S205 PolarHBondContact O-OG 3.06Å; E201-S205 VanDerWaalsContact O-OG 3.07Å; S202-S205 PolarHBondContact O-OG 2.84Å; V203-S205 PolarHBondContact O-N 2.98Å; S205-T208 PolarHBondContact O-OG1 3.09Å; S205-K209 WeakPolarHBondContact O-CG 3.4Å
206	K	75.6	Confident	70.5	Confident	114 Å²	114	72.2 Å²	72.2	50%	0.496	38%	0.377	S	S	.	.	H	α-helix	trans	-83.1	-33.8	173.4	-69.6	174.5	-176.2	166.8	0	111.9	C162 H166 S202 V203 N204	C162-K206 WeakPolarHBondContact SG-CD 3.23Å; C162-K206 PolarHBondContact SG-NZ 3.46Å; H166-K206 PolarHBondContact NE2-NZ 3.16Å; H166-K206 VanDerWaalsContact NE2-NZ 3.12Å; S202-K206 WeakPolarHBondContact O-CG 3.45Å; S202-K206 PolarHBondContact O-N 3.04Å; V203-K206 PolarHBondContact O-N 3.44Å; V203-K206 VanDerWaalsContact O-N 3.07Å; N204-K206 VanDerWaalsContact C-N 3.27Å; N204-K206 PolarHBondContact O-N 2.9Å
207	M	69.7	Low	68.5	Low	7 Å²	7	78.2 Å²	78.2	3%	0.034	41%	0.406	C	S	.	.	H	α-helix	trans	-69.8	-38.8	177.8	-66.9	-149.9	172.5	0	0	112.4	L19 F22 M23 L159 F163 V203 N204 K209	L19-M207 HydrophobicContact CD1-CE 3.3Å; L19-M207 HydrophobicContact CD1-SD 3.32Å; L19-M207 WeakPolarHBondContact CD1-SD 3.18Å; L19-M207 HydrophobicContact CG-CE 4.43Å; F22-M207 HydrophobicContact CB-SD 4.38Å; F22-M207 HydrophobicContact CD1-CB 3.82Å; F22-M207 HydrophobicContact CD1-CG 3.96Å; F22-M207 HydrophobicContact CD1-SD 3.26Å; F22-M207 WeakPolarHBondContact CD1-SD 3.21Å; F22-M207 HydrophobicContact CE1-CB 3.56Å; F22-M207 HydrophobicContact CE1-CG 3.87Å; F22-M207 HydrophobicContact CE1-SD 3.77Å; F22-M207 HydrophobicContact CE2-CB 4.35Å; F22-M207 WeakPolarHBondContact CE2-O 3.33Å; F22-M207 HydrophobicContact CG-CB 4.31Å; F22-M207 HydrophobicContact CG-SD 4.03Å; F22-M207 HydrophobicContact CZ-CB 3.86Å; F22-M207 WeakPolarHBondContact CZ-O 3.25Å; M23-M207 HydrophobicContact CG-CE 3.86Å; M23-M207 HydrophobicContact CG-SD 4.46Å; M23-M207 HydrophobicContact SD-CE 4.07Å; L159-M207 HydrophobicContact CD1-CE 3.76Å; L159-M207 HydrophobicContact CD1-CG 3.81Å; L159-M207 HydrophobicContact CD1-SD 4.19Å; L159-M207 HydrophobicContact CG-CE 4.15Å; F163-M207 HydrophobicContact CB-CE 4.3Å; V203-M207 HydrophobicContact CG1-CE 3.59Å; V203-M207 HydrophobicContact CG1-CG 4.07Å; V203-M207 HydrophobicContact CG1-SD 4.06Å; V203-M207 VanDerWaalsContact O-CG 3.25Å; V203-M207 WeakPolarHBondContact O-CG 2.97Å; V203-M207 PolarHBondContact O-N 2.89Å; N204-M207 PolarHBondContact O-N 2.98Å; M207-K209 VanDerWaalsContact C-N 3.28Å; M207-K209 PolarHBondContact O-N 3.44Å
208	T	64.7	Low	66.8	Low	110 Å²	110	78 Å²	78	68%	0.675	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-24.5	177.8	48.6	0	0	0	0	114.1	N204 S205 R210	N204-T208 WeakPolarHBondContact O-CG2 3.36Å; N204-T208 PolarHBondContact O-N 3.25Å; N204-T208 PolarHBondContact O-OG1 3.19Å; S205-T208 PolarHBondContact O-OG1 3.09Å; T208-R210 PolarHBondContact O-N 2.93Å
209	K	52.4	Low	65.6	Low	171 Å²	171	76.6 Å²	76.6	74%	0.743	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	8.7	-177.4	-75.8	178.5	-177.2	177.3	0	115.5	S205 M207 D211	S205-K209 WeakPolarHBondContact O-CG 3.4Å; M207-K209 VanDerWaalsContact C-N 3.28Å; M207-K209 PolarHBondContact O-N 3.44Å; K209-D211 VanDerWaalsContact C-N 3.31Å; K209-D211 PolarHBondContact O-N 3.4Å
210	R	49.6	Very low	64.8	Low	112 Å²	112	79.9 Å²	79.9	42%	0.423	43%	0.433	S	S	.	.			trans	-78.4	90	166.1	-167.3	174.2	173.6	156.7	-7.9	109.7	T208 P212	T208-R210 PolarHBondContact O-N 2.93Å; R210-P212 WeakPolarHBondContact O-CD 3.2Å
211	D	41.2	Very low	64.1	Low	117 Å²	117	83.8 Å²	83.8	63%	0.626	45%	0.454	S	S	*	.			trans	-34.9	103.5	150.6	-153.9	8.5	0	0	0	108.2	K209 G213	K209-D211 VanDerWaalsContact C-N 3.31Å; K209-D211 PolarHBondContact O-N 3.4Å; D211-G213 PolarHBondContact O-N 3.36Å; D211-G213 VanDerWaalsContact O-N 3.13Å
212	P	42.9	Very low	63.6	Low	57 Å²	57	82.5 Å²	82.5	37%	0.37	45%	0.448	S	S	.	.			trans	-58.1	128.5	-165.3	-21.1	26.9	0	0	0	108.7	R210 S214 T215 K216	R210-P212 WeakPolarHBondContact O-CD 3.2Å; P212-S214 WeakPolarHBondContact CB-OG 3.42Å; P212-S214 PolarHBondContact O-N 2.78Å; P212-T215 WeakPolarHBondContact CB-OG1 3.42Å; P212-T215 VanDerWaalsContact CD-OG1 3.23Å; P212-T215 WeakPolarHBondContact CD-OG1 3.03Å; P212-T215 VanDerWaalsContact CG-OG1 3.25Å; P212-T215 WeakPolarHBondContact CG-OG1 3.06Å; P212-T215 WeakPolarHBondContact O-CA 3.46Å; P212-T215 WeakPolarHBondContact O-CB 3.36Å; P212-T215 PolarHBondContact O-N 3.49Å; P212-K216 PolarHBondContact O-N 2.64Å
213	G	42.7	Very low	63.3	Low	48 Å²	48	88.3 Å²	88.3	50%	0.495	46%	0.464	S	S	.	.	H	α-helix	trans	-57.4	-14.5	164.9	0	0	0	0	0	111.9	D211	D211-G213 PolarHBondContact O-N 3.36Å; D211-G213 VanDerWaalsContact O-N 3.13Å
214	S	44.9	Very low	63.3	Low	85 Å²	85	93 Å²	93	59%	0.594	49%	0.488	S	S	*	.	H	α-helix	trans	-76.2	-33.3	166.5	65.1	0	0	0	0	113	P212 K216 M217 A218	P212-S214 WeakPolarHBondContact CB-OG 3.42Å; P212-S214 PolarHBondContact O-N 2.78Å; S214-K216 VanDerWaalsContact C-N 3.32Å; S214-K216 PolarHBondContact O-N 2.75Å; S214-M217 CarbonylContact O-C 3.54Å; S214-M217 WeakPolarHBondContact O-CA 3.13Å; S214-M217 WeakPolarHBondContact O-CB 3.47Å; S214-M217 PolarHBondContact O-N 3.49Å; S214-A218 PolarHBondContact O-N 2.99Å
215	T	44.9	Very low	63.3	Low	44 Å²	44	94.6 Å²	94.6	27%	0.27	50%	0.496	S	S	.	.	H	α-helix	trans	-64.9	-37.6	171.7	-42.2	0	0	0	0	110.3	P212 M217 A218 D219	P212-T215 WeakPolarHBondContact CB-OG1 3.42Å; P212-T215 VanDerWaalsContact CD-OG1 3.23Å; P212-T215 WeakPolarHBondContact CD-OG1 3.03Å; P212-T215 VanDerWaalsContact CG-OG1 3.25Å; P212-T215 WeakPolarHBondContact CG-OG1 3.06Å; P212-T215 WeakPolarHBondContact O-CA 3.46Å; P212-T215 WeakPolarHBondContact O-CB 3.36Å; P212-T215 PolarHBondContact O-N 3.49Å; T215-M217 PolarHBondContact O-N 2.91Å; T215-A218 CarbonylContact O-C 3.6Å; T215-A218 PolarHBondContact O-N 3.05Å; T215-A218 VanDerWaalsContact O-N 3.14Å; T215-D219 WeakPolarHBondContact O-CA 3.4Å; T215-D219 WeakPolarHBondContact O-CB 3.43Å; T215-D219 PolarHBondContact O-N 3.42Å
216	K	50.9	Low	63.4	Low	139 Å²	139	97.2 Å²	97.2	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-59.4	-33.2	169.9	-76.1	-172.6	-179.1	178.1	0	112.7	P212 S214 N220	P212-K216 PolarHBondContact O-N 2.64Å; S214-K216 VanDerWaalsContact C-N 3.32Å; S214-K216 PolarHBondContact O-N 2.75Å; K216-N220 WeakPolarHBondContact O-CB 3.39Å; K216-N220 PolarHBondContact O-N 3.21Å; K216-N220 PolarHBondContact O-ND2 2.65Å
217	M	52.4	Low	64	Low	147 Å²	147	97.3 Å²	97.3	72%	0.724	51%	0.507	S	S	*	.	H	α-helix	trans	-75.6	-40.3	175.2	-164	152.4	89.9	0	0	111.8	S214 T215 N220 L221	S214-M217 CarbonylContact O-C 3.54Å; S214-M217 WeakPolarHBondContact O-CA 3.13Å; S214-M217 WeakPolarHBondContact O-CB 3.47Å; S214-M217 PolarHBondContact O-N 3.49Å; T215-M217 PolarHBondContact O-N 2.91Å; M217-N220 PolarHBondContact O-N 3.2Å; M217-L221 VanDerWaalsContact O-CB 3.25Å; M217-L221 WeakPolarHBondContact O-CB 3.23Å; M217-L221 PolarHBondContact O-N 2.74Å
218	A	58.5	Low	64.7	Low	54 Å²	54	101 Å²	101	45%	0.446	53%	0.527	S	S	.	.	H	α-helix	trans	-64.5	-48.2	174.4	0	0	0	0	0	111.7	S214 T215 N220 L221 E222	S214-A218 PolarHBondContact O-N 2.99Å; T215-A218 CarbonylContact O-C 3.6Å; T215-A218 PolarHBondContact O-N 3.05Å; T215-A218 VanDerWaalsContact O-N 3.14Å; A218-N220 VanDerWaalsContact C-N 3.34Å; A218-N220 PolarHBondContact O-N 2.92Å; A218-L221 CarbonylContact O-C 3.55Å; A218-L221 WeakPolarHBondContact O-CB 3.24Å; A218-L221 PolarHBondContact O-N 3.14Å; A218-L221 VanDerWaalsContact O-N 3.14Å; A218-E222 WeakPolarHBondContact O-CB 3.21Å; A218-E222 PolarHBondContact O-N 3.45Å
219	D	67.9	Low	65.7	Low	83 Å²	83	98.1 Å²	98.1	44%	0.444	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-39.8	172.6	-71.2	-6.7	0	0	0	111.9	T215 L221 R223	T215-D219 WeakPolarHBondContact O-CA 3.4Å; T215-D219 WeakPolarHBondContact O-CB 3.43Å; T215-D219 PolarHBondContact O-N 3.42Å; D219-L221 VanDerWaalsContact C-N 3.34Å; D219-R223 WeakPolarHBondContact O-CB 2.91Å; D219-R223 WeakPolarHBondContact O-CG 3.37Å; D219-R223 PolarHBondContact O-N 3.37Å
220	N	76	Confident	67.3	Low	85 Å²	85	97 Å²	97	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-67.8	-39	174.5	-75.8	-24.5	0	0	0	110.7	K216 M217 A218 R223 I224	K216-N220 WeakPolarHBondContact O-CB 3.39Å; K216-N220 PolarHBondContact O-N 3.21Å; K216-N220 PolarHBondContact O-ND2 2.65Å; M217-N220 PolarHBondContact O-N 3.2Å; A218-N220 VanDerWaalsContact C-N 3.34Å; A218-N220 PolarHBondContact O-N 2.92Å; N220-R223 PolarHBondContact O-N 3.1Å; N220-I224 WeakPolarHBondContact O-CB 3.27Å; N220-I224 WeakPolarHBondContact O-CD1 3.49Å; N220-I224 WeakPolarHBondContact O-CG1 3.44Å; N220-I224 PolarHBondContact O-N 3.14Å
221	L	75.8	Confident	69.1	Low	102 Å²	102	95.8 Å²	95.8	53%	0.534	51%	0.507	S	S	.	.	H	α-helix	trans	-64.9	-47	176	-177.6	63.3	0	0	0	110.3	M217 A218 D219 R223 I224 L225	M217-L221 VanDerWaalsContact O-CB 3.25Å; M217-L221 WeakPolarHBondContact O-CB 3.23Å; M217-L221 PolarHBondContact O-N 2.74Å; A218-L221 CarbonylContact O-C 3.55Å; A218-L221 WeakPolarHBondContact O-CB 3.24Å; A218-L221 PolarHBondContact O-N 3.14Å; A218-L221 VanDerWaalsContact O-N 3.14Å; D219-L221 VanDerWaalsContact C-N 3.34Å; L221-R223 PolarHBondContact O-N 3.32Å; L221-I224 CarbonylContact O-C 3.56Å; L221-I224 WeakPolarHBondContact O-CA 3.21Å; L221-I224 WeakPolarHBondContact O-CB 3.18Å; L221-I224 PolarHBondContact O-N 2.93Å; L221-L225 HydrophobicContact CG-CD1 4.35Å; L221-L225 WeakPolarHBondContact O-CG 3.42Å; L221-L225 PolarHBondContact O-N 2.78Å
222	E	81.2	Confident	71.1	Confident	94 Å²	94	92.7 Å²	92.7	44%	0.439	49%	0.491	S	S	.	.	H	α-helix	trans	-59.4	-45.7	175.2	-177.5	55	-146.9	0	0	110.8	A218 I224 L225 Q226	A218-E222 WeakPolarHBondContact O-CB 3.21Å; A218-E222 PolarHBondContact O-N 3.45Å; E222-I224 VanDerWaalsContact C-N 3.31Å; E222-I224 PolarHBondContact O-N 3.33Å; E222-L225 PolarHBondContact O-N 3.41Å; E222-Q226 WeakPolarHBondContact O-CB 3.49Å; E222-Q226 VanDerWaalsContact O-CG 3.28Å; E222-Q226 WeakPolarHBondContact O-CG 3.11Å; E222-Q226 PolarHBondContact O-N 2.8Å; E222-Q226 PolarHBondContact OE1-NE2 2.61Å
223	R	82.4	Confident	72.9	Confident	161 Å²	161	99.5 Å²	99.5	61%	0.608	51%	0.509	S	S	*	.	H	α-helix	trans	-61.9	-37.1	172.9	-78.9	174.3	155.7	172.3	-1.4	112.8	D219 N220 L221 L227	D219-R223 WeakPolarHBondContact O-CB 2.91Å; D219-R223 WeakPolarHBondContact O-CG 3.37Å; D219-R223 PolarHBondContact O-N 3.37Å; N220-R223 PolarHBondContact O-N 3.1Å; L221-R223 PolarHBondContact O-N 3.32Å; R223-L227 VanDerWaalsContact O-CB 3.27Å; R223-L227 WeakPolarHBondContact O-CB 3.35Å; R223-L227 WeakPolarHBondContact O-CD1 3.41Å; R223-L227 VanDerWaalsContact O-CG 3.23Å; R223-L227 WeakPolarHBondContact O-CG 3.4Å; R223-L227 PolarHBondContact O-N 3.44Å
224	I	86.4	Confident	75	Confident	104 Å²	104	100.9 Å²	100.9	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-66.6	-44.6	175.5	-74.1	162.1	0	0	0	109.8	N220 L221 E222 L227 D228	N220-I224 WeakPolarHBondContact O-CB 3.27Å; N220-I224 WeakPolarHBondContact O-CD1 3.49Å; N220-I224 WeakPolarHBondContact O-CG1 3.44Å; N220-I224 PolarHBondContact O-N 3.14Å; L221-I224 CarbonylContact O-C 3.56Å; L221-I224 WeakPolarHBondContact O-CA 3.21Å; L221-I224 WeakPolarHBondContact O-CB 3.18Å; L221-I224 PolarHBondContact O-N 2.93Å; E222-I224 VanDerWaalsContact C-N 3.31Å; E222-I224 PolarHBondContact O-N 3.33Å; I224-L227 PolarHBondContact O-N 3.48Å; I224-D228 WeakPolarHBondContact O-CB 3.29Å; I224-D228 PolarHBondContact O-N 2.84Å
225	L	85.1	Confident	76.8	Confident	95 Å²	95	98.1 Å²	98.1	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-42.2	177.4	-68.7	173.6	0	0	0	111.6	L221 E222 D228 A229	L221-L225 HydrophobicContact CG-CD1 4.35Å; L221-L225 WeakPolarHBondContact O-CG 3.42Å; L221-L225 PolarHBondContact O-N 2.78Å; E222-L225 PolarHBondContact O-N 3.41Å; L225-D228 PolarHBondContact O-N 3.44Å; L225-A229 WeakPolarHBondContact O-CB 3.27Å; L225-A229 PolarHBondContact O-N 2.93Å
226	Q	86	Confident	78.6	Confident	112 Å²	112	98.2 Å²	98.2	52%	0.523	49%	0.485	S	S	.	.	H	α-helix	trans	-64.2	-41	174	-71.1	174.9	8	0	0	112.2	E222 K230	E222-Q226 WeakPolarHBondContact O-CB 3.49Å; E222-Q226 VanDerWaalsContact O-CG 3.28Å; E222-Q226 WeakPolarHBondContact O-CG 3.11Å; E222-Q226 PolarHBondContact O-N 2.8Å; E222-Q226 PolarHBondContact OE1-NE2 2.61Å; Q226-K230 WeakPolarHBondContact O-CB 3.36Å; Q226-K230 PolarHBondContact O-N 2.92Å
227	L	87.6	Confident	79.9	Confident	116 Å²	116	99.6 Å²	99.6	61%	0.607	50%	0.496	S	S	*	.	H	α-helix	trans	-65.3	-39.4	174.7	-81.7	166.9	0	0	0	111.9	R223 I224 K230 F231	R223-L227 VanDerWaalsContact O-CB 3.27Å; R223-L227 WeakPolarHBondContact O-CB 3.35Å; R223-L227 WeakPolarHBondContact O-CD1 3.41Å; R223-L227 VanDerWaalsContact O-CG 3.23Å; R223-L227 WeakPolarHBondContact O-CG 3.4Å; R223-L227 PolarHBondContact O-N 3.44Å; I224-L227 PolarHBondContact O-N 3.48Å; L227-K230 PolarHBondContact O-N 2.99Å; L227-F231 VanDerWaalsContact O-CB 3.31Å; L227-F231 WeakPolarHBondContact O-CB 3.32Å; L227-F231 PolarHBondContact O-N 2.78Å
228	D	85.3	Confident	81.2	Confident	85 Å²	85	95.8 Å²	95.8	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-65.9	-48.1	177.4	-167.3	60.9	0	0	0	111	I224 L225 K230 F231 L232	I224-D228 WeakPolarHBondContact O-CB 3.29Å; I224-D228 PolarHBondContact O-N 2.84Å; L225-D228 PolarHBondContact O-N 3.44Å; D228-K230 VanDerWaalsContact C-N 3.31Å; D228-K230 PolarHBondContact O-N 3.13Å; D228-F231 WeakPolarHBondContact O-CB 3.18Å; D228-F231 PolarHBondContact O-N 2.81Å; D228-L232 WeakPolarHBondContact O-CG 3.44Å; D228-L232 PolarHBondContact O-N 3.2Å
229	A	85.9	Confident	82.1	Confident	50 Å²	50	97.8 Å²	97.8	41%	0.413	48%	0.481	S	S	.	.	H	α-helix	trans	-57.9	-41.7	174.2	0	0	0	0	0	112.3	L225 R233	L225-A229 WeakPolarHBondContact O-CB 3.27Å; L225-A229 PolarHBondContact O-N 2.93Å; A229-R233 WeakPolarHBondContact O-CG 3.2Å; A229-R233 PolarHBondContact O-N 3.33Å; A229-R233 VanDerWaalsContact O-N 3.07Å
230	K	85.6	Confident	82.6	Confident	148 Å²	148	95 Å²	95	64%	0.643	47%	0.467	S	S	*	.	H	α-helix	trans	-65.7	-40.1	174.6	-174.7	175.3	-179.1	174.1	0	112	Q226 L227 D228 T234	Q226-K230 WeakPolarHBondContact O-CB 3.36Å; Q226-K230 PolarHBondContact O-N 2.92Å; L227-K230 PolarHBondContact O-N 2.99Å; D228-K230 VanDerWaalsContact C-N 3.31Å; D228-K230 PolarHBondContact O-N 3.13Å; K230-T234 PolarHBondContact O-N 3.02Å; K230-T234 VanDerWaalsContact O-N 3.15Å; K230-T234 PolarHBondContact O-OG1 2.75Å
231	F	87.7	Confident	82.5	Confident	85 Å²	85	95 Å²	95	37%	0.373	48%	0.479	S	S	.	.	H	α-helix	trans	-65.9	-43.3	178	-171.9	-107.8	0	0	0	111.2	L227 D228 T234 L235 K343	L227-F231 VanDerWaalsContact O-CB 3.31Å; L227-F231 WeakPolarHBondContact O-CB 3.32Å; L227-F231 PolarHBondContact O-N 2.78Å; D228-F231 WeakPolarHBondContact O-CB 3.18Å; D228-F231 PolarHBondContact O-N 2.81Å; F231-T234 WeakPolarHBondContact O-CA 3.41Å; F231-T234 WeakPolarHBondContact O-CB 3.45Å; F231-T234 PolarHBondContact O-N 3.36Å; F231-L235 HydrophobicContact CD1-CD1 3.95Å; F231-L235 HydrophobicContact CD1-CG 4.22Å; F231-L235 HydrophobicContact CE1-CD1 3.58Å; F231-L235 HydrophobicContact CE1-CD2 4.11Å; F231-L235 HydrophobicContact CE1-CG 3.91Å; F231-L235 HydrophobicContact CZ-CD1 4.27Å; F231-L235 HydrophobicContact CZ-CD2 3.94Å; F231-L235 HydrophobicContact CZ-CG 4.2Å; F231-L235 PolarHBondContact O-N 2.88Å; F231-K343 VanDerWaalsContact CZ-NZ 3.25Å
232	L	82.3	Confident	82.6	Confident	53 Å²	53	95.1 Å²	95.1	28%	0.277	48%	0.479	S	S	.	.	H	α-helix	trans	-61.2	-44.9	175.5	-71.6	166.3	0	0	0	112	D228 T234 L235 D236	D228-L232 WeakPolarHBondContact O-CG 3.44Å; D228-L232 PolarHBondContact O-N 3.2Å; L232-T234 PolarHBondContact O-N 3.21Å; L232-L235 PolarHBondContact O-N 3.45Å; L232-L235 VanDerWaalsContact O-N 3.11Å; L232-D236 WeakPolarHBondContact O-CB 3.39Å; L232-D236 PolarHBondContact O-N 3.01Å
233	R	82.2	Confident	82.6	Confident	199 Å²	199	94.1 Å²	94.1	75%	0.751	47%	0.472	S	S	*	.	H	α-helix	trans	-58.2	-31.9	172.3	-72.2	-174.3	-173.3	-163.5	2.8	113.1	A229	A229-R233 WeakPolarHBondContact O-CG 3.2Å; A229-R233 PolarHBondContact O-N 3.33Å; A229-R233 VanDerWaalsContact O-N 3.07Å
234	T	85.6	Confident	82.5	Confident	78 Å²	78	89.5 Å²	89.5	48%	0.479	48%	0.475	S	S	.	.	H	α-helix	trans	-75.8	-38.3	177.3	-49.4	0	0	0	0	111.7	K230 F231 L232 D236 M237	K230-T234 PolarHBondContact O-N 3.02Å; K230-T234 VanDerWaalsContact O-N 3.15Å; K230-T234 PolarHBondContact O-OG1 2.75Å; F231-T234 WeakPolarHBondContact O-CA 3.41Å; F231-T234 WeakPolarHBondContact O-CB 3.45Å; F231-T234 PolarHBondContact O-N 3.36Å; L232-T234 PolarHBondContact O-N 3.21Å; T234-D236 VanDerWaalsContact C-N 3.32Å; T234-M237 PolarHBondContact O-N 2.9Å
235	L	82.5	Confident	82.3	Confident	26 Å²	26	86.5 Å²	86.5	14%	0.136	46%	0.458	C	S	.	.	H	α-helix	trans	-66.1	-36.4	174.3	-68	-177.7	0	0	0	111.6	F231 L232 M237 I238 W297	F231-L235 HydrophobicContact CD1-CD1 3.95Å; F231-L235 HydrophobicContact CD1-CG 4.22Å; F231-L235 HydrophobicContact CE1-CD1 3.58Å; F231-L235 HydrophobicContact CE1-CD2 4.11Å; F231-L235 HydrophobicContact CE1-CG 3.91Å; F231-L235 HydrophobicContact CZ-CD1 4.27Å; F231-L235 HydrophobicContact CZ-CD2 3.94Å; F231-L235 HydrophobicContact CZ-CG 4.2Å; F231-L235 PolarHBondContact O-N 2.88Å; L232-L235 PolarHBondContact O-N 3.45Å; L232-L235 VanDerWaalsContact O-N 3.11Å; L235-M237 PolarHBondContact O-N 3.34Å; L235-I238 HydrophobicContact CD2-CD1 4.25Å; L235-I238 WeakPolarHBondContact O-CB 3.48Å; L235-I238 PolarHBondContact O-N 2.81Å; L235-W297 HydrophobicContact CD1-CH2 4.25Å; L235-W297 HydrophobicContact CD1-CZ3 4.25Å
236	D	82.3	Confident	82.1	Confident	46 Å²	46	86 Å²	86	25%	0.246	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15	178.1	-79.1	1	0	0	0	113.8	L232 T234 I238 T292 I293 S294	L232-D236 WeakPolarHBondContact O-CB 3.39Å; L232-D236 PolarHBondContact O-N 3.01Å; T234-D236 VanDerWaalsContact C-N 3.32Å; D236-I238 VanDerWaalsContact C-N 3.32Å; D236-T292 HydrophobicContact CB-CG2 4.05Å; D236-T292 VanDerWaalsContact CG-OG1 3.31Å; D236-T292 WeakPolarHBondContact OD1-CB 3.44Å; D236-T292 VanDerWaalsContact OD2-CB 3.28Å; D236-T292 WeakPolarHBondContact OD2-CB 3.35Å; D236-T292 PolarHBondContact OD2-OG1 3.11Å; D236-I293 PolarHBondContact OD1-N 2.97Å; D236-S294 VanDerWaalsContact OD1-CB 3.26Å; D236-S294 WeakPolarHBondContact OD1-CB 3.43Å; D236-S294 PolarHBondContact OD1-N 3.15Å; D236-S294 PolarHBondContact OD1-OG 2.92Å; D236-S294 WeakPolarHBondContact OD2-CB 3.25Å; D236-S294 PolarHBondContact OD2-OG 2.98Å
237	M	78.5	Confident	81.8	Confident	169 Å²	169	85.2 Å²	85.2	83%	0.833	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-10.6	170.2	-64.8	-164.3	72.2	0	0	113.5	T234 L235	T234-M237 PolarHBondContact O-N 2.9Å; L235-M237 PolarHBondContact O-N 3.34Å
238	I	79.3	Confident	81.5	Confident	66 Å²	66	81.5 Å²	81.5	34%	0.338	43%	0.434	S	S	.	.	S	Bend	trans	-90.9	125.8	179.3	-56	175.7	0	0	0	107.9	L235 D236 I242 Y243	L235-I238 HydrophobicContact CD2-CD1 4.25Å; L235-I238 WeakPolarHBondContact O-CB 3.48Å; L235-I238 PolarHBondContact O-N 2.81Å; D236-I238 VanDerWaalsContact C-N 3.32Å; I238-I242 HydrophobicContact CG2-CB 4.24Å; I238-I242 HydrophobicContact CG2-CD1 3.78Å; I238-I242 HydrophobicContact CG2-CG2 4.46Å; I238-Y243 HydrophobicContact CB-CE2 3.97Å; I238-Y243 HydrophobicContact CG2-CD2 4.5Å; I238-Y243 HydrophobicContact CG2-CE2 3.68Å
239	D	78.2	Confident	81.3	Confident	96 Å²	96	78.1 Å²	78.1	51%	0.513	42%	0.416	S	S	.	.			trans	-53.1	127	179.1	-169.8	-42.3	0	0	0	111	A241 I242	D239-A241 PolarHBondContact O-N 3.07Å; D239-A241 VanDerWaalsContact OD1-CB 3.3Å; D239-A241 WeakPolarHBondContact OD1-CB 3.47Å; D239-A241 PolarHBondContact OD1-N 3.4Å; D239-I242 HydrophobicContact CB-CD1 4.17Å; D239-I242 HydrophobicContact CB-CG1 4.42Å; D239-I242 WeakPolarHBondContact O-CB 3.26Å; D239-I242 PolarHBondContact O-N 2.85Å
240	P	78.1	Confident	81.1	Confident	25 Å²	25	79.8 Å²	79.8	16%	0.162	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-51.4	-28	177.1	-28.3	34.7	0	0	0	115.6	I242 Y243 R291 I293 I296	P240-I242 PolarHBondContact O-N 3.3Å; P240-Y243 PolarHBondContact O-N 2.9Å; P240-R291 WeakPolarHBondContact CG-O 3.36Å; P240-I293 HydrophobicContact CB-CD1 3.73Å; P240-I293 HydrophobicContact CG-CD1 3.99Å; P240-I293 HydrophobicContact CG-CG1 4.48Å; P240-I296 HydrophobicContact CB-CD1 3.77Å; P240-I296 HydrophobicContact CG-CD1 4Å
241	A	74.3	Confident	80.8	Confident	84 Å²	84	74.5 Å²	74.5	69%	0.694	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-59.1	-28.1	178.3	0	0	0	0	0	113	D239 Y243	D239-A241 PolarHBondContact O-N 3.07Å; D239-A241 VanDerWaalsContact OD1-CB 3.3Å; D239-A241 WeakPolarHBondContact OD1-CB 3.47Å; D239-A241 PolarHBondContact OD1-N 3.4Å; A241-Y243 VanDerWaalsContact C-N 3.29Å; A241-Y243 PolarHBondContact O-N 3.35Å
242	I	77.9	Confident	80.5	Confident	105 Å²	105	71.7 Å²	71.7	54%	0.538	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-72.6	-21.9	-177.2	-60.8	169.3	0	0	0	112	I238 D239 P240 G244	I238-I242 HydrophobicContact CG2-CB 4.24Å; I238-I242 HydrophobicContact CG2-CD1 3.78Å; I238-I242 HydrophobicContact CG2-CG2 4.46Å; D239-I242 HydrophobicContact CB-CD1 4.17Å; D239-I242 HydrophobicContact CB-CG1 4.42Å; D239-I242 WeakPolarHBondContact O-CB 3.26Å; D239-I242 PolarHBondContact O-N 2.85Å; P240-I242 PolarHBondContact O-N 3.3Å; I242-G244 VanDerWaalsContact C-N 3.26Å; I242-G244 PolarHBondContact O-N 3.48Å
243	Y	80.5	Confident	80.4	Confident	73 Å²	73	70 Å²	70	29%	0.286	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-77.8	-7.6	-174	-75.6	-105.3	0	0	0	114.1	I238 P240 A241 F245 I293 W297	I238-Y243 HydrophobicContact CB-CE2 3.97Å; I238-Y243 HydrophobicContact CG2-CD2 4.5Å; I238-Y243 HydrophobicContact CG2-CE2 3.68Å; P240-Y243 PolarHBondContact O-N 2.9Å; A241-Y243 VanDerWaalsContact C-N 3.29Å; A241-Y243 PolarHBondContact O-N 3.35Å; Y243-F245 HydrophobicContact CG-CE2 4.37Å; Y243-I293 HydrophobicContact CD1-CD1 4.37Å; Y243-I293 HydrophobicContact CD2-CD1 3.59Å; Y243-I293 HydrophobicContact CD2-CG1 3.85Å; Y243-I293 HydrophobicContact CE1-CG1 4.28Å; Y243-I293 HydrophobicContact CE1-CG2 3.99Å; Y243-I293 HydrophobicContact CE2-CD1 3.78Å; Y243-I293 HydrophobicContact CE2-CG1 3.46Å; Y243-I293 VanDerWaalsContact CE2-CG1 3.46Å; Y243-I293 HydrophobicContact CG-CD1 3.91Å; Y243-I293 HydrophobicContact CG-CG1 4.43Å; Y243-W297 HydrophobicContact CD1-CZ2 4.35Å; Y243-W297 HydrophobicContact CE1-CH2 4.5Å; Y243-W297 HydrophobicContact CE1-CZ2 4.13Å
244	G	80.7	Confident	80.2	Confident	65 Å²	65	66.4 Å²	66.4	67%	0.67	36%	0.358	S	S	*	.			trans	68.2	35.9	173.2	0	0	0	0	0	114.3	I242	I242-G244 VanDerWaalsContact C-N 3.26Å; I242-G244 PolarHBondContact O-N 3.48Å
245	F	81.7	Confident	79.8	Confident	40 Å²	40	65.3 Å²	65.3	18%	0.175	35%	0.347	C	S	.	.			trans	-57.6	138	171.6	-63.8	-75.2	0	0	0	110.6	Y243 T249 K250 I293 I296 L300	Y243-F245 HydrophobicContact CG-CE2 4.37Å; F245-T249 HydrophobicContact CB-CG2 4.32Å; F245-T249 HydrophobicContact CD1-CG2 3.99Å; F245-T249 HydrophobicContact CG-CG2 4.45Å; F245-K250 HydrophobicContact CB-CG 4.37Å; F245-K250 WeakPolarHBondContact O-CE 3.34Å; F245-I293 HydrophobicContact CE2-CD1 3.9Å; F245-I293 HydrophobicContact CZ-CD1 4.2Å; F245-I296 HydrophobicContact CE1-CG2 4.19Å; F245-I296 HydrophobicContact CE2-CD1 4.42Å; F245-I296 HydrophobicContact CE2-CG2 4.42Å; F245-I296 HydrophobicContact CZ-CG2 3.88Å; F245-L300 HydrophobicContact CE1-CD1 4.2Å
246	D	81.4	Confident	79.5	Confident	86 Å²	86	65.4 Å²	65.4	46%	0.46	35%	0.348	S	S	.	.			trans	-68.2	155.6	175.6	61.3	-59.3	0	0	0	111.4	T248 T249 K250	D246-T248 PolarHBondContact O-N 3.01Å; D246-T248 WeakPolarHBondContact OD2-CB 3.32Å; D246-T249 WeakPolarHBondContact O-CB 3.47Å; D246-T249 PolarHBondContact O-N 2.93Å; D246-T249 VanDerWaalsContact O-N 3.09Å; D246-T249 WeakPolarHBondContact OD1-CB 3.26Å; D246-T249 PolarHBondContact OD1-OG1 3.28Å; D246-T249 PolarHBondContact OD2-N 3.06Å; D246-T249 PolarHBondContact OD2-OG1 3.47Å; D246-K250 PolarHBondContact O-N 3.23Å
247	E	79.9	Confident	79	Confident	95 Å²	95	64.9 Å²	64.9	44%	0.444	35%	0.345	S	S	.	.	H	α-helix	trans	-62.2	-31.7	-173.8	-156.7	59.1	-147.4	0	0	112.5	K250 N251 R254	E247-K250 PolarHBondContact O-N 3.04Å; E247-K250 IonicContact OE2-NZ 2.72Å; E247-K250 PolarHBondContact OE2-NZ 2.92Å; E247-N251 WeakPolarHBondContact O-CB 3.33Å; E247-N251 PolarHBondContact O-N 3.12Å; E247-R254 IonicContact OE1-NH1 2.61Å
248	T	82.3	Confident	78.7	Confident	38 Å²	38	62.3 Å²	62.3	23%	0.233	33%	0.327	C	S	.	.	H	α-helix	trans	-62.1	-47.1	174.5	-53.1	0	0	0	0	111.5	D246 N251 Y252 V308 A309 A311 A312	D246-T248 PolarHBondContact O-N 3.01Å; D246-T248 WeakPolarHBondContact OD2-CB 3.32Å; T248-N251 PolarHBondContact O-N 3.07Å; T248-Y252 PolarHBondContact O-N 3.23Å; T248-V308 WeakPolarHBondContact CG2-O 3.45Å; T248-A309 WeakPolarHBondContact CG2-O 3.41Å; T248-A311 HydrophobicContact CG2-CB 4.49Å; T248-A312 HydrophobicContact CG2-CB 3.79Å
249	T	81.1	Confident	78.3	Confident	13 Å²	13	65.4 Å²	65.4	8%	0.08	34%	0.338	C	S	.	.	H	α-helix	trans	-61.3	-43.8	173.7	-63.2	0	0	0	0	111.6	F245 D246 N251 Y252 L253 L300	F245-T249 HydrophobicContact CB-CG2 4.32Å; F245-T249 HydrophobicContact CD1-CG2 3.99Å; F245-T249 HydrophobicContact CG-CG2 4.45Å; D246-T249 WeakPolarHBondContact O-CB 3.47Å; D246-T249 PolarHBondContact O-N 2.93Å; D246-T249 VanDerWaalsContact O-N 3.09Å; D246-T249 WeakPolarHBondContact OD1-CB 3.26Å; D246-T249 PolarHBondContact OD1-OG1 3.28Å; D246-T249 PolarHBondContact OD2-N 3.06Å; D246-T249 PolarHBondContact OD2-OG1 3.47Å; T249-N251 PolarHBondContact O-N 3.35Å; T249-Y252 WeakPolarHBondContact O-CB 3.45Å; T249-Y252 PolarHBondContact O-N 3.07Å; T249-L253 HydrophobicContact CG2-CD1 4.03Å; T249-L253 HydrophobicContact CG2-CG 4.37Å; T249-L253 VanDerWaalsContact O-CG 3.26Å; T249-L253 WeakPolarHBondContact O-CG 3.3Å; T249-L253 PolarHBondContact O-N 3.49Å; T249-L300 HydrophobicContact CG2-CD1 4.11Å; T249-L300 HydrophobicContact CG2-CD2 4.03Å
250	K	80.3	Confident	77.6	Confident	85 Å²	85	64.4 Å²	64.4	37%	0.37	33%	0.333	S	S	.	.	H	α-helix	trans	-60	-45.1	177	-64.8	-176.9	-158.8	156.2	0	112.1	F245 D246 E247 Y252 L253 R254	F245-K250 HydrophobicContact CB-CG 4.37Å; F245-K250 WeakPolarHBondContact O-CE 3.34Å; D246-K250 PolarHBondContact O-N 3.23Å; E247-K250 PolarHBondContact O-N 3.04Å; E247-K250 IonicContact OE2-NZ 2.72Å; E247-K250 PolarHBondContact OE2-NZ 2.92Å; K250-Y252 VanDerWaalsContact C-N 3.34Å; K250-Y252 PolarHBondContact O-N 3.3Å; K250-L253 PolarHBondContact O-N 3.23Å; K250-R254 WeakPolarHBondContact O-CG 3.25Å; K250-R254 PolarHBondContact O-N 3.26Å
251	N	79.8	Confident	76.8	Confident	37 Å²	37	68.4 Å²	68.4	20%	0.198	35%	0.347	C	S	.	.	H	α-helix	trans	-63.5	-40	177.7	-74.5	-12.9	0	0	0	111.9	E247 T248 T249 R254 F255	E247-N251 WeakPolarHBondContact O-CB 3.33Å; E247-N251 PolarHBondContact O-N 3.12Å; T248-N251 PolarHBondContact O-N 3.07Å; T249-N251 PolarHBondContact O-N 3.35Å; N251-R254 PolarHBondContact O-N 3.33Å; N251-R254 PolarHBondContact OD1-NH1 3.45Å; N251-F255 WeakPolarHBondContact O-CB 3.48Å; N251-F255 PolarHBondContact O-N 3.14Å
252	Y	81.5	Confident	76.1	Confident	27 Å²	27	67 Å²	67	11%	0.106	33%	0.33	C	S	.	.	H	α-helix	trans	-60.4	-46.5	173.1	-177.9	-100.3	0	0	0	111.9	T248 T249 K250 R254 F255 V256 I299 L300 S303 K307 V308 A311	T248-Y252 PolarHBondContact O-N 3.23Å; T249-Y252 WeakPolarHBondContact O-CB 3.45Å; T249-Y252 PolarHBondContact O-N 3.07Å; K250-Y252 VanDerWaalsContact C-N 3.34Å; K250-Y252 PolarHBondContact O-N 3.3Å; Y252-R254 PolarHBondContact O-N 3.24Å; Y252-F255 WeakPolarHBondContact O-CB 3.32Å; Y252-F255 PolarHBondContact O-N 3.06Å; Y252-V256 HydrophobicContact CD1-CG2 4.14Å; Y252-V256 HydrophobicContact CE1-CG2 3.67Å; Y252-V256 HydrophobicContact CE2-CG2 4.37Å; Y252-V256 WeakPolarHBondContact O-CG2 3.48Å; Y252-V256 PolarHBondContact O-N 3.39Å; Y252-I299 HydrophobicContact CE1-CG2 4.39Å; Y252-L300 HydrophobicContact CD1-CD2 4.5Å; Y252-S303 WeakPolarHBondContact CE1-OG 3.36Å; Y252-S303 WeakPolarHBondContact OH-CB 3.43Å; Y252-S303 PolarHBondContact OH-OG 3.24Å; Y252-K307 HydrophobicContact CE2-CB 4.09Å; Y252-V308 HydrophobicContact CD1-CG1 4.39Å; Y252-V308 HydrophobicContact CD1-CG2 3.9Å; Y252-V308 HydrophobicContact CD2-CG2 4.35Å; Y252-V308 HydrophobicContact CE1-CG2 3.88Å; Y252-V308 HydrophobicContact CE2-CG2 4.33Å; Y252-V308 HydrophobicContact CG-CB 4.35Å; Y252-V308 HydrophobicContact CG-CG1 4.25Å; Y252-V308 HydrophobicContact CG-CG2 4.14Å; Y252-A311 HydrophobicContact CD2-CB 4.2Å
253	L	80	Confident	74.9	Confident	16 Å²	16	63.7 Å²	63.7	8%	0.084	32%	0.322	C	S	.	.	H	α-helix	trans	-62.5	-42.9	179.7	-64.9	169.5	0	0	0	111.7	T249 K250 F255 V256 D257 R291 I296 I299 L300	T249-L253 HydrophobicContact CG2-CD1 4.03Å; T249-L253 HydrophobicContact CG2-CG 4.37Å; T249-L253 VanDerWaalsContact O-CG 3.26Å; T249-L253 WeakPolarHBondContact O-CG 3.3Å; T249-L253 PolarHBondContact O-N 3.49Å; K250-L253 PolarHBondContact O-N 3.23Å; L253-F255 VanDerWaalsContact C-N 3.33Å; L253-F255 PolarHBondContact O-N 3.01Å; L253-V256 PolarHBondContact O-N 3.34Å; L253-D257 PolarHBondContact O-N 3.17Å; L253-R291 PolarHBondContact O-NH2 3.33Å; L253-I296 HydrophobicContact CD1-CG2 3.84Å; L253-I296 HydrophobicContact CD2-CG2 4.1Å; L253-I299 HydrophobicContact CD2-CG2 4.23Å; L253-L300 HydrophobicContact CD2-CD2 4.35Å
254	R	78.2	Confident	73.6	Confident	125 Å²	125	65.5 Å²	65.5	47%	0.472	33%	0.333	S	S	.	.	H	α-helix	trans	-57.6	-43.6	173	-73.5	174.6	177.2	164.9	-3.2	111.9	E247 K250 N251 Y252 D257 Y258	E247-R254 IonicContact OE1-NH1 2.61Å; K250-R254 WeakPolarHBondContact O-CG 3.25Å; K250-R254 PolarHBondContact O-N 3.26Å; N251-R254 PolarHBondContact O-N 3.33Å; N251-R254 PolarHBondContact OD1-NH1 3.45Å; Y252-R254 PolarHBondContact O-N 3.24Å; R254-D257 PolarHBondContact O-N 3.09Å; R254-Y258 PolarHBondContact O-N 3.03Å
255	F	77.1	Confident	72	Confident	55 Å²	55	65.3 Å²	65.3	24%	0.241	33%	0.325	C	S	.	.	H	α-helix	trans	-64.1	-40.5	176.8	176.1	-99.4	0	0	0	112.5	N251 Y252 L253 D257 Y258 K259 F316	N251-F255 WeakPolarHBondContact O-CB 3.48Å; N251-F255 PolarHBondContact O-N 3.14Å; Y252-F255 WeakPolarHBondContact O-CB 3.32Å; Y252-F255 PolarHBondContact O-N 3.06Å; L253-F255 VanDerWaalsContact C-N 3.33Å; L253-F255 PolarHBondContact O-N 3.01Å; F255-D257 VanDerWaalsContact C-N 3.32Å; F255-D257 PolarHBondContact O-N 2.83Å; F255-Y258 PolarHBondContact O-N 3.46Å; F255-K259 HydrophobicContact CE1-CD 3.83Å; F255-K259 HydrophobicContact CE1-CG 4.3Å; F255-K259 HydrophobicContact CZ-CD 3.9Å; F255-K259 HydrophobicContact CZ-CG 4.23Å; F255-K259 PolarHBondContact O-N 3.02Å; F255-F316 AromaticContact CD2-CD2 3.9Å; F255-F316 HydrophobicContact CD2-CD2 3.9Å; F255-F316 HydrophobicContact CD2-CE1 4.34Å; F255-F316 AromaticContact CD2-CE2 3.64Å; F255-F316 HydrophobicContact CD2-CE2 3.64Å; F255-F316 HydrophobicContact CD2-CG 4.35Å; F255-F316 AromaticContact CD2-CZ 3.88Å; F255-F316 HydrophobicContact CD2-CZ 3.88Å; F255-F316 HydrophobicContact CE2-CD1 4.43Å; F255-F316 HydrophobicContact CE2-CD2 4.31Å; F255-F316 AromaticContact CE2-CE1 3.85Å; F255-F316 HydrophobicContact CE2-CE1 3.85Å; F255-F316 AromaticContact CE2-CE2 3.69Å; F255-F316 HydrophobicContact CE2-CE2 3.69Å; F255-F316 AromaticContact CE2-CZ 3.44Å; F255-F316 HydrophobicContact CE2-CZ 3.44Å; F255-F316 VanDerWaalsContact CE2-CZ 3.44Å; F255-F316 HydrophobicContact CG-CE2 4.48Å; F255-F316 HydrophobicContact CZ-CZ 4.22Å
256	V	76.3	Confident	70.5	Confident	28 Å²	28	72.3 Å²	72.3	17%	0.17	36%	0.355	C	S	.	.	H	α-helix	trans	-62.7	-40.3	175	175.3	0	0	0	0	110.6	Y252 L253 K259 L260 I299	Y252-V256 HydrophobicContact CD1-CG2 4.14Å; Y252-V256 HydrophobicContact CE1-CG2 3.67Å; Y252-V256 HydrophobicContact CE2-CG2 4.37Å; Y252-V256 WeakPolarHBondContact O-CG2 3.48Å; Y252-V256 PolarHBondContact O-N 3.39Å; L253-V256 PolarHBondContact O-N 3.34Å; V256-K259 PolarHBondContact O-N 2.82Å; V256-L260 HydrophobicContact CG1-CD1 4.15Å; V256-L260 PolarHBondContact O-N 3.41Å; V256-L260 VanDerWaalsContact O-N 3.08Å; V256-I299 HydrophobicContact CG1-CD1 4.41Å
257	D	71.3	Confident	69	Low	35 Å²	35	76.8 Å²	76.8	19%	0.187	37%	0.371	C	S	.	.	H	α-helix	trans	-65.1	-43.2	175.2	-77.4	-33.3	0	0	0	112	L253 R254 F255 K259 L260 K261 R291	L253-D257 PolarHBondContact O-N 3.17Å; R254-D257 PolarHBondContact O-N 3.09Å; F255-D257 VanDerWaalsContact C-N 3.32Å; F255-D257 PolarHBondContact O-N 2.83Å; D257-K259 VanDerWaalsContact C-N 3.32Å; D257-K259 PolarHBondContact O-N 2.83Å; D257-L260 PolarHBondContact O-N 3Å; D257-L260 VanDerWaalsContact O-N 3.15Å; D257-K261 PolarHBondContact O-N 3.26Å; D257-R291 IonicContact OD1-CZ 2.95Å; D257-R291 IonicContact OD1-NE 2.88Å; D257-R291 PolarHBondContact OD1-NE 3Å; D257-R291 IonicContact OD1-NH2 3.46Å; D257-R291 PolarHBondContact OD1-NH2 3.2Å; D257-R291 IonicContact OD2-CZ 3.19Å; D257-R291 IonicContact OD2-NE 3.92Å; D257-R291 PolarHBondContact OD2-NE 3.38Å; D257-R291 IonicContact OD2-NH2 3.36Å; D257-R291 PolarHBondContact OD2-NH2 2.84Å
258	Y	73.5	Confident	67.2	Low	114 Å²	114	79.1 Å²	79.1	45%	0.447	38%	0.382	S	S	.	.	H	α-helix	trans	-58	-44.4	176.4	178.7	-101.7	0	0	0	111.8	R254 F255 L260 K261 T262	R254-Y258 PolarHBondContact O-N 3.03Å; F255-Y258 PolarHBondContact O-N 3.46Å; Y258-L260 VanDerWaalsContact C-N 3.35Å; Y258-L260 PolarHBondContact O-N 3.38Å; Y258-K261 PolarHBondContact O-N 3.46Å; Y258-T262 HydrophobicContact CD1-CG2 4.46Å; Y258-T262 HydrophobicContact CD2-CG2 4.27Å; Y258-T262 HydrophobicContact CE1-CG2 4.04Å; Y258-T262 HydrophobicContact CE2-CG2 3.81Å; Y258-T262 WeakPolarHBondContact O-CB 3.45Å; Y258-T262 WeakPolarHBondContact O-CG2 3.19Å; Y258-T262 PolarHBondContact O-N 2.91Å; Y258-T262 PolarHBondContact O-OG1 3.46Å
259	K	70.5	Confident	65	Low	132 Å²	132	80.9 Å²	80.9	57%	0.574	41%	0.407	S	S	*	.	H	α-helix	trans	-64.5	-36.5	175.8	-83.1	-161.4	166	-178.4	0	113.3	F255 V256 D257 T262 G263	F255-K259 HydrophobicContact CE1-CD 3.83Å; F255-K259 HydrophobicContact CE1-CG 4.3Å; F255-K259 HydrophobicContact CZ-CD 3.9Å; F255-K259 HydrophobicContact CZ-CG 4.23Å; F255-K259 PolarHBondContact O-N 3.02Å; V256-K259 PolarHBondContact O-N 2.82Å; D257-K259 VanDerWaalsContact C-N 3.32Å; D257-K259 PolarHBondContact O-N 2.83Å; K259-T262 WeakPolarHBondContact CA-OG1 3.5Å; K259-T262 PolarHBondContact O-OG1 3.32Å; K259-G263 PolarHBondContact O-N 3.36Å
260	L	62.9	Low	63.2	Low	75 Å²	75	91.2 Å²	91.2	39%	0.393	45%	0.445	S	S	.	.	H	α-helix	trans	-67.3	-49.3	175.9	-97.1	149.5	0	0	0	111.7	V256 D257 Y258 G263 Q264	V256-L260 HydrophobicContact CG1-CD1 4.15Å; V256-L260 PolarHBondContact O-N 3.41Å; V256-L260 VanDerWaalsContact O-N 3.08Å; D257-L260 PolarHBondContact O-N 3Å; D257-L260 VanDerWaalsContact O-N 3.15Å; Y258-L260 VanDerWaalsContact C-N 3.35Å; Y258-L260 PolarHBondContact O-N 3.38Å; L260-G263 PolarHBondContact O-N 3.02Å; L260-Q264 WeakPolarHBondContact O-CG 3.23Å; L260-Q264 PolarHBondContact O-N 2.89Å
261	K	60.9	Low	61	Low	108 Å²	108	95.6 Å²	95.6	47%	0.47	47%	0.467	S	S	.	.	H	α-helix	trans	-62.7	-46.3	179.4	-71.4	-173.2	179	-174.2	0	112	D257 Y258 G263 Q264 A265	D257-K261 PolarHBondContact O-N 3.26Å; Y258-K261 PolarHBondContact O-N 3.46Å; K261-G263 VanDerWaalsContact C-N 3.31Å; K261-G263 PolarHBondContact O-N 3.46Å; K261-Q264 PolarHBondContact O-N 3.23Å; K261-A265 PolarHBondContact O-N 3.26Å
262	T	59.7	Low	58.7	Low	54 Å²	54	97.5 Å²	97.5	33%	0.331	50%	0.495	S	S	.	.	H	α-helix	trans	-65.7	-33.2	176.7	51.6	0	0	0	0	112.8	Y258 K259 K266	Y258-T262 HydrophobicContact CD1-CG2 4.46Å; Y258-T262 HydrophobicContact CD2-CG2 4.27Å; Y258-T262 HydrophobicContact CE1-CG2 4.04Å; Y258-T262 HydrophobicContact CE2-CG2 3.81Å; Y258-T262 WeakPolarHBondContact O-CB 3.45Å; Y258-T262 WeakPolarHBondContact O-CG2 3.19Å; Y258-T262 PolarHBondContact O-N 2.91Å; Y258-T262 PolarHBondContact O-OG1 3.46Å; K259-T262 WeakPolarHBondContact CA-OG1 3.5Å; K259-T262 PolarHBondContact O-OG1 3.32Å; T262-K266 WeakPolarHBondContact O-CG 3.29Å; T262-K266 PolarHBondContact O-N 3Å
263	G	53.6	Low	56.2	Low	36 Å²	36	104.6 Å²	104.6	37%	0.371	53%	0.531	S	S	.	.	H	α-helix	trans	-67.2	-37.1	172.3	0	0	0	0	0	113.6	K259 L260 K261 K267	K259-G263 PolarHBondContact O-N 3.36Å; L260-G263 PolarHBondContact O-N 3.02Å; K261-G263 VanDerWaalsContact C-N 3.31Å; K261-G263 PolarHBondContact O-N 3.46Å; G263-K267 PolarHBondContact O-N 3.18Å
264	Q	51.7	Low	53.9	Low	112 Å²	112	108.4 Å²	108.4	52%	0.523	56%	0.559	S	S	.	*	H	α-helix	trans	-71.5	-42.3	175.9	-73.1	-178.1	3.7	0	0	112.3	L260 K261 K266 K267 Q268	L260-Q264 WeakPolarHBondContact O-CG 3.23Å; L260-Q264 PolarHBondContact O-N 2.89Å; K261-Q264 PolarHBondContact O-N 3.23Å; Q264-K266 VanDerWaalsContact C-N 3.27Å; Q264-K266 PolarHBondContact O-N 2.85Å; Q264-K267 WeakPolarHBondContact O-CA 3.33Å; Q264-K267 PolarHBondContact O-N 3.39Å; Q264-Q268 PolarHBondContact O-N 2.97Å
265	A	47.1	Very low	51.7	Low	61 Å²	61	112.8 Å²	112.8	50%	0.504	58%	0.582	S	S	.	*	H	α-helix	trans	-59.1	-38.5	175.9	0	0	0	0	0	112.1	K261 K267 Q268 G269	K261-A265 PolarHBondContact O-N 3.26Å; A265-K267 VanDerWaalsContact C-N 3.27Å; A265-K267 PolarHBondContact O-N 2.8Å; A265-Q268 PolarHBondContact O-N 3.37Å; A265-G269 PolarHBondContact O-N 3.25Å
266	K	50.5	Low	49.5	Very low	186 Å²	186	118.2 Å²	118.2	81%	0.809	61%	0.608	S	S	*	*	H	α-helix	trans	-66.4	-24	173.7	-75.4	-174.2	178.6	-174.7	0	113.9	T262 Q264	T262-K266 WeakPolarHBondContact O-CG 3.29Å; T262-K266 PolarHBondContact O-N 3Å; Q264-K266 VanDerWaalsContact C-N 3.27Å; Q264-K266 PolarHBondContact O-N 2.85Å
267	K	49.6	Very low	47.3	Very low	180 Å²	180	128.6 Å²	128.6	78%	0.783	64%	0.644	S	S	*	*	H	α-helix	trans	-85.3	-36.1	173.8	-80.3	-173.2	175.1	-176.9	0	112.7	G263 Q264 A265	G263-K267 PolarHBondContact O-N 3.18Å; Q264-K267 WeakPolarHBondContact O-CA 3.33Å; Q264-K267 PolarHBondContact O-N 3.39Å; A265-K267 VanDerWaalsContact C-N 3.27Å; A265-K267 PolarHBondContact O-N 2.8Å
268	Q	42.5	Very low	45.4	Very low	145 Å²	145	135.7 Å²	135.7	68%	0.678	68%	0.676	S	S	*	*	H	α-helix	trans	-78.5	-27.3	-179.5	-73.2	-177.3	-18.2	0	0	113.4	Q264 A265 R270 Q271	Q264-Q268 PolarHBondContact O-N 2.97Å; A265-Q268 PolarHBondContact O-N 3.37Å; Q268-R270 PolarHBondContact O-N 3.23Å; Q268-Q271 PolarHBondContact O-N 3.5Å; Q268-Q271 VanDerWaalsContact O-N 3.14Å
269	G	37.4	Very low	43.2	Very low	74 Å²	74	141.7 Å²	141.7	76%	0.763	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	4.5	175.5	0	0	0	0	0	115.8	A265	A265-G269 PolarHBondContact O-N 3.25Å
270	R	42.5	Very low	41.2	Very low	230 Å²	230	145.3 Å²	145.3	87%	0.868	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	0.3	175.2	-129.9	177.5	173.7	-177.2	-3.4	114.7	Q268	Q268-R270 PolarHBondContact O-N 3.23Å
271	Q	34.9	Very low	39.6	Very low	177 Å²	177	146.4 Å²	146.4	83%	0.827	73%	0.725	S	S	*	*	S	Bend	trans	-126	102	170.5	-75	-178.1	-13.4	0	0	108.7	Q268	Q268-Q271 PolarHBondContact O-N 3.5Å; Q268-Q271 VanDerWaalsContact O-N 3.14Å
272	G	31.8	Very low	38.2	Very low	77 Å²	77	147 Å²	147	79%	0.794	74%	0.74	S	S	*	*			trans	-62.2	135	-179.9	0	0	0	0	0	111
273	M	27.9	Very low	37	Very low	177 Å²	177	151.5 Å²	151.5	87%	0.872	76%	0.762	S	S	*	*			trans	-141.3	139.1	162.3	-88.1	-64.8	-74.1	0	0	109.8
274	S	30.9	Very low	35.8	Very low	95 Å²	95	155.6 Å²	155.6	66%	0.664	78%	0.779	S	S	*	*			trans	-69.6	152.6	-168	45.2	0	0	0	0	114.3	E276	S274-E276 PolarHBondContact O-N 2.9Å; S274-E276 VanDerWaalsContact O-N 3.15Å
275	K	32.7	Very low	34.9	Very low	217 Å²	217	160.2 Å²	160.2	94%	0.943	79%	0.794	S	S	*	*			trans	-71.2	97	175	-66.6	176.7	176.9	176	0	110.3
276	E	30.5	Very low	34.3	Very low	169 Å²	169	163.2 Å²	163.2	79%	0.79	80%	0.801	S	S	*	*			trans	-112.9	119.9	162.8	-164.6	144	-155.1	0	0	109.3	S274 E278	S274-E276 PolarHBondContact O-N 2.9Å; S274-E276 VanDerWaalsContact O-N 3.15Å; E276-E278 PolarHBondContact O-N 3.46Å; E276-E278 VanDerWaalsContact O-N 3.16Å
277	R	30.9	Very low	33.6	Very low	247 Å²	247	158.8 Å²	158.8	93%	0.932	79%	0.793	S	S	*	*			trans	-77.7	90.5	-178	-79	176.3	166.5	-173.3	-3.4	108.9
278	E	30.6	Very low	33.2	Very low	183 Å²	183	152.1 Å²	152.1	86%	0.855	78%	0.775	S	S	*	*			trans	-89.1	141.3	167.2	-81.8	-168	145.7	0	0	112.5	E276	E276-E278 PolarHBondContact O-N 3.46Å; E276-E278 VanDerWaalsContact O-N 3.16Å
279	R	28.2	Very low	33.6	Very low	240 Å²	240	148 Å²	148	91%	0.906	76%	0.762	S	S	*	*			trans	-68.8	134.3	-169.3	-64.9	170	175	170.8	-2.6	110.7	P281	R279-P281 WeakPolarHBondContact O-CD 3.22Å
280	K	27.8	Very low	34.5	Very low	208 Å²	208	148.7 Å²	148.7	90%	0.904	75%	0.751	S	S	*	*			trans	-53.1	110.4	-179.8	-64.5	-178.9	177.4	-175.4	0	111.8
281	P	29.7	Very low	35.6	Very low	98 Å²	98	138.7 Å²	138.7	64%	0.636	71%	0.714	S	S	*	*			trans	-74.7	152.7	160.8	-1	21.1	0	0	0	108.8	R279	R279-P281 WeakPolarHBondContact O-CD 3.22Å
282	P	32.7	Very low	37.8	Very low	122 Å²	122	133 Å²	133	79%	0.792	69%	0.691	S	S	*	*	S	Bend	trans	-70.7	137.9	-167.1	30.5	-33.1	0	0	0	110.8	V284	P282-V284 VanDerWaalsContact C-N 3.29Å; P282-V284 PolarHBondContact O-N 2.85Å
283	D	33	Very low	40.3	Very low	147 Å²	147	129.3 Å²	129.3	79%	0.786	65%	0.653	S	S	*	*			trans	13.7	69.7	168.2	-77.4	-21.2	0	0	0	114.2	Y285	D283-Y285 PolarHBondContact O-N 2.98Å
284	V	29	Very low	42.9	Very low	122 Å²	122	122.3 Å²	122.3	74%	0.739	62%	0.622	S	S	*	*			trans	-66.9	98.9	160.3	179.2	0	0	0	0	103.7	P282 D286	P282-V284 VanDerWaalsContact C-N 3.29Å; P282-V284 PolarHBondContact O-N 2.85Å; V284-D286 PolarHBondContact O-N 2.93Å
285	Y	32.6	Very low	45.4	Very low	210 Å²	210	122.7 Å²	122.7	82%	0.824	61%	0.609	S	S	*	*			trans	-43.4	109.3	166.6	-67.1	-86.7	0	0	0	106.8	D283 C287	D283-Y285 PolarHBondContact O-N 2.98Å; Y285-C287 PolarHBondContact O-N 3.18Å
286	D	35.5	Very low	47.9	Very low	124 Å²	124	112.7 Å²	112.7	66%	0.663	57%	0.566	S	S	*	*			trans	-62.7	91.5	169.9	-178.8	24.8	0	0	0	104.6	V284 G288	V284-D286 PolarHBondContact O-N 2.93Å; D286-G288 PolarHBondContact O-N 3.13Å
287	C	35.6	Very low	50.4	Low	93 Å²	93	110 Å²	110	63%	0.628	55%	0.549	S	S	*	.			trans	-70.4	71.4	174.6	-177	0	0	0	0	105.3	Y285 S289 V290	Y285-C287 PolarHBondContact O-N 3.18Å; C287-S289 VanDerWaalsContact C-N 3.34Å; C287-S289 PolarHBondContact O-N 3.28Å; C287-V290 WeakPolarHBondContact SG-CG2 3.17Å
288	G	41.7	Very low	53	Low	39 Å²	39	103.8 Å²	103.8	40%	0.402	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	97.4	-169.9	0	0	0	0	0	108.7	D286 V290	D286-G288 PolarHBondContact O-N 3.13Å; G288-V290 VanDerWaalsContact C-N 3.31Å; G288-V290 PolarHBondContact O-N 3.38Å
289	S	50.1	Low	55.6	Low	59 Å²	59	95.9 Å²	95.9	41%	0.413	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	25.7	64.9	178.4	60.9	0	0	0	0	113.3	C287 R291	C287-S289 VanDerWaalsContact C-N 3.34Å; C287-S289 PolarHBondContact O-N 3.28Å; S289-R291 PolarHBondContact O-N 3.07Å
290	V	55.5	Low	58.3	Low	89 Å²	89	86.6 Å²	86.6	54%	0.539	46%	0.46	S	S	.	.			trans	-64.3	93.6	176	178.7	0	0	0	0	107.1	C287 G288 T292	C287-V290 WeakPolarHBondContact SG-CG2 3.17Å; G288-V290 VanDerWaalsContact C-N 3.31Å; G288-V290 PolarHBondContact O-N 3.38Å; V290-T292 PolarHBondContact O-N 3.49Å
291	R	66.8	Low	61	Low	20 Å²	20	80.9 Å²	80.9	8%	0.075	45%	0.452	C	S	.	.			trans	-63.6	125.2	174.1	-67.9	-175.2	177.9	-174.9	3.5	106.8	P240 L253 D257 S289 Y295 I296	P240-R291 WeakPolarHBondContact CG-O 3.36Å; L253-R291 PolarHBondContact O-NH2 3.33Å; D257-R291 IonicContact OD1-CZ 2.95Å; D257-R291 IonicContact OD1-NE 2.88Å; D257-R291 PolarHBondContact OD1-NE 3Å; D257-R291 IonicContact OD1-NH2 3.46Å; D257-R291 PolarHBondContact OD1-NH2 3.2Å; D257-R291 IonicContact OD2-CZ 3.19Å; D257-R291 IonicContact OD2-NE 3.92Å; D257-R291 PolarHBondContact OD2-NE 3.38Å; D257-R291 IonicContact OD2-NH2 3.36Å; D257-R291 PolarHBondContact OD2-NH2 2.84Å; S289-R291 PolarHBondContact O-N 3.07Å; R291-Y295 HydrophobicContact CB-CD1 4.02Å; R291-Y295 HydrophobicContact CG-CD1 3.8Å; R291-Y295 HydrophobicContact CG-CE1 4.15Å; R291-I296 HydrophobicContact CB-CD1 4Å; R291-I296 HydrophobicContact CB-CG1 3.57Å
292	T	81.6	Confident	63.6	Low	56 Å²	56	83 Å²	83	34%	0.344	45%	0.453	S	S	.	.			trans	-65.8	153.3	170.3	74.6	0	0	0	0	109.8	D236 V290 S294 Y295 I296	D236-T292 HydrophobicContact CB-CG2 4.05Å; D236-T292 VanDerWaalsContact CG-OG1 3.31Å; D236-T292 WeakPolarHBondContact OD1-CB 3.44Å; D236-T292 VanDerWaalsContact OD2-CB 3.28Å; D236-T292 WeakPolarHBondContact OD2-CB 3.35Å; D236-T292 PolarHBondContact OD2-OG1 3.11Å; V290-T292 PolarHBondContact O-N 3.49Å; T292-S294 PolarHBondContact O-N 3.2Å; T292-Y295 WeakPolarHBondContact O-CA 3.35Å; T292-Y295 WeakPolarHBondContact O-CB 3.42Å; T292-Y295 PolarHBondContact O-N 3.42Å; T292-I296 PolarHBondContact O-N 3.44Å
293	I	82.9	Confident	66.1	Low	0 Å²	0	78.2 Å²	78.2	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-56.7	-39.5	-178.4	-72.9	-56.7	0	0	0	112.2	D236 P240 Y243 F245 Y295 I296 W297	D236-I293 PolarHBondContact OD1-N 2.97Å; P240-I293 HydrophobicContact CB-CD1 3.73Å; P240-I293 HydrophobicContact CG-CD1 3.99Å; P240-I293 HydrophobicContact CG-CG1 4.48Å; Y243-I293 HydrophobicContact CD1-CD1 4.37Å; Y243-I293 HydrophobicContact CD2-CD1 3.59Å; Y243-I293 HydrophobicContact CD2-CG1 3.85Å; Y243-I293 HydrophobicContact CE1-CG1 4.28Å; Y243-I293 HydrophobicContact CE1-CG2 3.99Å; Y243-I293 HydrophobicContact CE2-CD1 3.78Å; Y243-I293 HydrophobicContact CE2-CG1 3.46Å; Y243-I293 VanDerWaalsContact CE2-CG1 3.46Å; Y243-I293 HydrophobicContact CG-CD1 3.91Å; Y243-I293 HydrophobicContact CG-CG1 4.43Å; F245-I293 HydrophobicContact CE2-CD1 3.9Å; F245-I293 HydrophobicContact CZ-CD1 4.2Å; I293-Y295 VanDerWaalsContact C-N 3.27Å; I293-Y295 PolarHBondContact O-N 2.76Å; I293-I296 HydrophobicContact CD1-CD1 4.11Å; I293-I296 PolarHBondContact O-N 3.31Å; I293-W297 HydrophobicContact CG2-CD2 3.85Å; I293-W297 HydrophobicContact CG2-CE3 4.05Å; I293-W297 HydrophobicContact CG2-CH2 3.95Å; I293-W297 HydrophobicContact CG2-CZ2 3.74Å; I293-W297 HydrophobicContact CG2-CZ3 4.09Å; I293-W297 PolarHBondContact O-N 2.83Å
294	S	83	Confident	68.4	Low	31 Å²	31	74.8 Å²	74.8	22%	0.217	40%	0.404	C	S	.	.	H	α-helix	trans	-58.9	-40.7	175.9	-57.4	0	0	0	0	111.7	D236 T292 K298	D236-S294 VanDerWaalsContact OD1-CB 3.26Å; D236-S294 WeakPolarHBondContact OD1-CB 3.43Å; D236-S294 PolarHBondContact OD1-N 3.15Å; D236-S294 PolarHBondContact OD1-OG 2.92Å; D236-S294 WeakPolarHBondContact OD2-CB 3.25Å; D236-S294 PolarHBondContact OD2-OG 2.98Å; T292-S294 PolarHBondContact O-N 3.2Å; S294-K298 WeakPolarHBondContact O-CB 3.24Å; S294-K298 PolarHBondContact O-N 3.32Å
295	Y	83.9	Confident	70.9	Confident	102 Å²	102	73.9 Å²	73.9	40%	0.4	40%	0.4	S	S	.	.	H	α-helix	trans	-70.5	-38.9	177	-172.6	-109.2	0	0	0	112.5	R291 T292 I293 K298 I299	R291-Y295 HydrophobicContact CB-CD1 4.02Å; R291-Y295 HydrophobicContact CG-CD1 3.8Å; R291-Y295 HydrophobicContact CG-CE1 4.15Å; T292-Y295 WeakPolarHBondContact O-CA 3.35Å; T292-Y295 WeakPolarHBondContact O-CB 3.42Å; T292-Y295 PolarHBondContact O-N 3.42Å; I293-Y295 VanDerWaalsContact C-N 3.27Å; I293-Y295 PolarHBondContact O-N 2.76Å; Y295-K298 WeakPolarHBondContact O-CB 3.49Å; Y295-K298 PolarHBondContact O-N 3.33Å; Y295-I299 HydrophobicContact CD1-CD1 3.8Å; Y295-I299 HydrophobicContact CE1-CD1 3.3Å; Y295-I299 HydrophobicContact CE1-CG1 4.23Å; Y295-I299 HydrophobicContact CE2-CD1 4.47Å; Y295-I299 WeakPolarHBondContact O-CG1 3.4Å; Y295-I299 PolarHBondContact O-N 2.99Å
296	I	83.9	Confident	73.1	Confident	8 Å²	8	68.8 Å²	68.8	4%	0.041	39%	0.391	C	S	.	.	H	α-helix	trans	-60.8	-48.4	174.9	-64.7	174.5	0	0	0	110.4	P240 F245 L253 R291 T292 I293 K298 I299 L300	P240-I296 HydrophobicContact CB-CD1 3.77Å; P240-I296 HydrophobicContact CG-CD1 4Å; F245-I296 HydrophobicContact CE1-CG2 4.19Å; F245-I296 HydrophobicContact CE2-CD1 4.42Å; F245-I296 HydrophobicContact CE2-CG2 4.42Å; F245-I296 HydrophobicContact CZ-CG2 3.88Å; L253-I296 HydrophobicContact CD1-CG2 3.84Å; L253-I296 HydrophobicContact CD2-CG2 4.1Å; R291-I296 HydrophobicContact CB-CD1 4Å; R291-I296 HydrophobicContact CB-CG1 3.57Å; T292-I296 PolarHBondContact O-N 3.44Å; I293-I296 HydrophobicContact CD1-CD1 4.11Å; I293-I296 PolarHBondContact O-N 3.31Å; I296-K298 VanDerWaalsContact C-N 3.3Å; I296-K298 PolarHBondContact O-N 3Å; I296-I299 PolarHBondContact O-N 2.89Å; I296-L300 HydrophobicContact CG2-CD1 3.9Å; I296-L300 HydrophobicContact CG2-CG 4.36Å; I296-L300 WeakPolarHBondContact O-CG 3.49Å; I296-L300 PolarHBondContact O-N 3.24Å
297	W	84.2	Confident	75.1	Confident	112 Å²	112	68.9 Å²	68.9	42%	0.424	39%	0.386	S	S	.	.	H	α-helix	trans	-63.9	-36	178	-71.8	-13	0	0	0	112.7	L235 Y243 I293 L300 A301	L235-W297 HydrophobicContact CD1-CH2 4.25Å; L235-W297 HydrophobicContact CD1-CZ3 4.25Å; Y243-W297 HydrophobicContact CD1-CZ2 4.35Å; Y243-W297 HydrophobicContact CE1-CH2 4.5Å; Y243-W297 HydrophobicContact CE1-CZ2 4.13Å; I293-W297 HydrophobicContact CG2-CD2 3.85Å; I293-W297 HydrophobicContact CG2-CE3 4.05Å; I293-W297 HydrophobicContact CG2-CH2 3.95Å; I293-W297 HydrophobicContact CG2-CZ2 3.74Å; I293-W297 HydrophobicContact CG2-CZ3 4.09Å; I293-W297 PolarHBondContact O-N 2.83Å; W297-L300 PolarHBondContact O-N 2.97Å; W297-A301 VanDerWaalsContact O-CB 3.26Å; W297-A301 WeakPolarHBondContact O-CB 3.26Å; W297-A301 PolarHBondContact O-N 2.94Å
298	K	85.6	Confident	77.1	Confident	117 Å²	117	65.4 Å²	65.4	51%	0.509	36%	0.361	S	S	.	.	H	α-helix	trans	-59.8	-48.8	172.7	-176	176.7	178.4	178.3	0	111.4	S294 Y295 I296 L300 A301 E302	S294-K298 WeakPolarHBondContact O-CB 3.24Å; S294-K298 PolarHBondContact O-N 3.32Å; Y295-K298 WeakPolarHBondContact O-CB 3.49Å; Y295-K298 PolarHBondContact O-N 3.33Å; I296-K298 VanDerWaalsContact C-N 3.3Å; I296-K298 PolarHBondContact O-N 3Å; K298-L300 VanDerWaalsContact C-N 3.35Å; K298-L300 PolarHBondContact O-N 3.09Å; K298-A301 PolarHBondContact O-N 3.46Å; K298-E302 WeakPolarHBondContact CE-OE1 3.41Å; K298-E302 WeakPolarHBondContact CG-OE1 3.49Å; K298-E302 WeakPolarHBondContact O-CG 3.46Å; K298-E302 PolarHBondContact O-N 3.48Å
299	I	85	Confident	78.7	Confident	16 Å²	16	66.7 Å²	66.7	8%	0.082	37%	0.368	C	S	.	.	H	α-helix	trans	-59.7	-47.5	177.3	-70.9	176.1	0	0	0	110.6	Y252 L253 V256 Y295 I296 A301 E302 S303	Y252-I299 HydrophobicContact CE1-CG2 4.39Å; L253-I299 HydrophobicContact CD2-CG2 4.23Å; V256-I299 HydrophobicContact CG1-CD1 4.41Å; Y295-I299 HydrophobicContact CD1-CD1 3.8Å; Y295-I299 HydrophobicContact CE1-CD1 3.3Å; Y295-I299 HydrophobicContact CE1-CG1 4.23Å; Y295-I299 HydrophobicContact CE2-CD1 4.47Å; Y295-I299 WeakPolarHBondContact O-CG1 3.4Å; Y295-I299 PolarHBondContact O-N 2.99Å; I296-I299 PolarHBondContact O-N 2.89Å; I299-A301 VanDerWaalsContact C-N 3.3Å; I299-A301 PolarHBondContact O-N 3.19Å; I299-E302 PolarHBondContact O-N 3.48Å; I299-S303 VanDerWaalsContact O-CB 3.23Å; I299-S303 WeakPolarHBondContact O-CB 3.44Å; I299-S303 PolarHBondContact O-N 2.93Å; I299-S303 PolarHBondContact O-OG 2.86Å
300	L	84.5	Confident	79.8	Confident	46 Å²	46	67 Å²	67	24%	0.241	37%	0.37	C	S	.	.	H	α-helix	trans	-65.5	-33.3	-179	-67	175.3	0	0	0	112.7	F245 T249 Y252 L253 I296 W297 K298 S303 V308	F245-L300 HydrophobicContact CE1-CD1 4.2Å; T249-L300 HydrophobicContact CG2-CD1 4.11Å; T249-L300 HydrophobicContact CG2-CD2 4.03Å; Y252-L300 HydrophobicContact CD1-CD2 4.5Å; L253-L300 HydrophobicContact CD2-CD2 4.35Å; I296-L300 HydrophobicContact CG2-CD1 3.9Å; I296-L300 HydrophobicContact CG2-CG 4.36Å; I296-L300 WeakPolarHBondContact O-CG 3.49Å; I296-L300 PolarHBondContact O-N 3.24Å; W297-L300 PolarHBondContact O-N 2.97Å; K298-L300 VanDerWaalsContact C-N 3.35Å; K298-L300 PolarHBondContact O-N 3.09Å; L300-S303 PolarHBondContact O-N 3.29Å; L300-V308 HydrophobicContact CD2-CG1 4.45Å; L300-V308 HydrophobicContact CD2-CG2 4.38Å
301	A	84.3	Confident	80.2	Confident	88 Å²	88	63.5 Å²	63.5	73%	0.727	35%	0.35	S	S	*	.	H	α-helix	trans	-71.4	-34	175.7	0	0	0	0	0	112.8	W297 K298 I299	W297-A301 VanDerWaalsContact O-CB 3.26Å; W297-A301 WeakPolarHBondContact O-CB 3.26Å; W297-A301 PolarHBondContact O-N 2.94Å; K298-A301 PolarHBondContact O-N 3.46Å; I299-A301 VanDerWaalsContact C-N 3.3Å; I299-A301 PolarHBondContact O-N 3.19Å
302	E	85.2	Confident	79.6	Confident	143 Å²	143	65 Å²	65	67%	0.668	37%	0.367	S	S	*	.	H	α-helix	trans	-83.7	-13	176.5	-68.8	172.6	-175.2	0	0	112.8	K298 I299	K298-E302 WeakPolarHBondContact CE-OE1 3.41Å; K298-E302 WeakPolarHBondContact CG-OE1 3.49Å; K298-E302 WeakPolarHBondContact O-CG 3.46Å; K298-E302 PolarHBondContact O-N 3.48Å; I299-E302 PolarHBondContact O-N 3.48Å
303	S	84	Confident	78.1	Confident	21 Å²	21	68.4 Å²	68.4	15%	0.147	39%	0.388	C	S	.	.	S	Bend	trans	-88.5	142.6	-177.4	-63.5	0	0	0	0	112.4	Y252 I299 L300 P305	Y252-S303 WeakPolarHBondContact CE1-OG 3.36Å; Y252-S303 WeakPolarHBondContact OH-CB 3.43Å; Y252-S303 PolarHBondContact OH-OG 3.24Å; I299-S303 VanDerWaalsContact O-CB 3.23Å; I299-S303 WeakPolarHBondContact O-CB 3.44Å; I299-S303 PolarHBondContact O-N 2.93Å; I299-S303 PolarHBondContact O-OG 2.86Å; L300-S303 PolarHBondContact O-N 3.29Å; S303-P305 WeakPolarHBondContact O-CD 3.33Å
304	D	81.9	Confident	76.3	Confident	75 Å²	75	74.8 Å²	74.8	40%	0.401	42%	0.415	S	S	.	.			trans	-68.2	123.6	171.8	-179.8	-8.9	0	0	0	110.3	V306 K307 V308	D304-V306 PolarHBondContact O-N 3Å; D304-V306 VanDerWaalsContact O-N 3.09Å; D304-V306 PolarHBondContact OD1-N 3.13Å; D304-K307 HydrophobicContact CB-CB 4.39Å; D304-K307 HydrophobicContact CB-CD 4.05Å; D304-K307 HydrophobicContact CB-CG 4.05Å; D304-K307 WeakPolarHBondContact O-CB 3.33Å; D304-K307 PolarHBondContact O-N 3.17Å; D304-V308 PolarHBondContact O-N 3.03Å
305	P	81.7	Confident	74.5	Confident	102 Å²	102	80 Å²	80	66%	0.662	44%	0.441	S	S	*	.	H	α-helix	trans	-53.1	-32.8	-179.7	-25.7	32.6	0	0	0	114	S303 K307 V308 A309	S303-P305 WeakPolarHBondContact O-CD 3.33Å; P305-K307 VanDerWaalsContact C-N 3.35Å; P305-V308 PolarHBondContact O-N 3.33Å; P305-A309 PolarHBondContact O-N 2.74Å
306	V	78.9	Confident	72.6	Confident	103 Å²	103	80.2 Å²	80.2	62%	0.624	44%	0.444	S	S	*	.	H	α-helix	trans	-69.2	-35.1	-179.7	-176.5	0	0	0	0	111.2	D304 S310	D304-V306 PolarHBondContact O-N 3Å; D304-V306 VanDerWaalsContact O-N 3.09Å; D304-V306 PolarHBondContact OD1-N 3.13Å; V306-S310 WeakPolarHBondContact O-CB 3.15Å; V306-S310 PolarHBondContact O-N 3.48Å; V306-S310 PolarHBondContact O-OG 2.84Å
307	K	77.3	Confident	70.6	Confident	127 Å²	127	87.6 Å²	87.6	55%	0.552	48%	0.484	S	S	*	.	H	α-helix	trans	-70.5	-37.1	176.6	-66.8	-178.4	-173.9	169.4	0	111.8	Y252 D304 P305 S310 A311	Y252-K307 HydrophobicContact CE2-CB 4.09Å; D304-K307 HydrophobicContact CB-CB 4.39Å; D304-K307 HydrophobicContact CB-CD 4.05Å; D304-K307 HydrophobicContact CB-CG 4.05Å; D304-K307 WeakPolarHBondContact O-CB 3.33Å; D304-K307 PolarHBondContact O-N 3.17Å; P305-K307 VanDerWaalsContact C-N 3.35Å; K307-S310 WeakPolarHBondContact CA-OG 3.36Å; K307-S310 PolarHBondContact O-OG 3.47Å; K307-A311 PolarHBondContact O-N 3.31Å
308	V	77.4	Confident	68.6	Low	20 Å²	20	86.5 Å²	86.5	12%	0.121	49%	0.485	C	S	.	.	H	α-helix	trans	-64.8	-49.5	175.5	-174.9	0	0	0	0	109.6	T248 Y252 L300 D304 P305 S310 A311	T248-V308 WeakPolarHBondContact CG2-O 3.45Å; Y252-V308 HydrophobicContact CD1-CG1 4.39Å; Y252-V308 HydrophobicContact CD1-CG2 3.9Å; Y252-V308 HydrophobicContact CD2-CG2 4.35Å; Y252-V308 HydrophobicContact CE1-CG2 3.88Å; Y252-V308 HydrophobicContact CE2-CG2 4.33Å; Y252-V308 HydrophobicContact CG-CB 4.35Å; Y252-V308 HydrophobicContact CG-CG1 4.25Å; Y252-V308 HydrophobicContact CG-CG2 4.14Å; L300-V308 HydrophobicContact CD2-CG1 4.45Å; L300-V308 HydrophobicContact CD2-CG2 4.38Å; D304-V308 PolarHBondContact O-N 3.03Å; P305-V308 PolarHBondContact O-N 3.33Å; V308-S310 PolarHBondContact O-N 2.99Å; V308-A311 VanDerWaalsContact O-CB 3.3Å; V308-A311 WeakPolarHBondContact O-CB 3.4Å; V308-A311 PolarHBondContact O-N 2.91Å
309	A	75.8	Confident	66.2	Low	66 Å²	66	85.2 Å²	85.2	55%	0.545	49%	0.489	S	S	.	.	H	α-helix	trans	-64	-36.5	-178.9	0	0	0	0	0	113.7	T248 P305 A311	T248-A309 WeakPolarHBondContact CG2-O 3.41Å; P305-A309 PolarHBondContact O-N 2.74Å; A309-A311 VanDerWaalsContact C-N 3.27Å; A309-A311 PolarHBondContact O-N 2.96Å
310	S	72.7	Confident	64.1	Low	65 Å²	65	90.9 Å²	90.9	46%	0.455	52%	0.519	S	S	.	.	H	α-helix	trans	-74.5	-12.3	179.5	54.7	0	0	0	0	114.3	V306 K307 V308 A312 V313	V306-S310 WeakPolarHBondContact O-CB 3.15Å; V306-S310 PolarHBondContact O-N 3.48Å; V306-S310 PolarHBondContact O-OG 2.84Å; K307-S310 WeakPolarHBondContact CA-OG 3.36Å; K307-S310 PolarHBondContact O-OG 3.47Å; V308-S310 PolarHBondContact O-N 2.99Å; S310-A312 PolarHBondContact O-N 3.41Å; S310-A312 VanDerWaalsContact O-N 3.14Å; S310-V313 PolarHBondContact O-N 3.1Å
311	A	64.2	Low	62	Low	15 Å²	15	97.6 Å²	97.6	12%	0.124	55%	0.549	C	S	.	.	G	3₁₀ helix	trans	-62.3	-18.7	175.3	0	0	0	0	0	113.2	T248 Y252 K307 V308 A309 V313	T248-A311 HydrophobicContact CG2-CB 4.49Å; Y252-A311 HydrophobicContact CD2-CB 4.2Å; K307-A311 PolarHBondContact O-N 3.31Å; V308-A311 VanDerWaalsContact O-CB 3.3Å; V308-A311 WeakPolarHBondContact O-CB 3.4Å; V308-A311 PolarHBondContact O-N 2.91Å; A309-A311 VanDerWaalsContact C-N 3.27Å; A309-A311 PolarHBondContact O-N 2.96Å; A311-V313 PolarHBondContact O-N 3.22Å
312	A	54.4	Low	59.8	Low	51 Å²	51	99.7 Å²	99.7	42%	0.421	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-63.9	-23.7	176	0	0	0	0	0	113.8	T248 S310	T248-A312 HydrophobicContact CG2-CB 3.79Å; S310-A312 PolarHBondContact O-N 3.41Å; S310-A312 VanDerWaalsContact O-N 3.14Å
313	V	50.5	Low	57.4	Low	128 Å²	128	98.5 Å²	98.5	78%	0.776	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-93.1	-11.7	-170.9	-175.5	0	0	0	0	112.3	S310 A311	S310-V313 PolarHBondContact O-N 3.1Å; A311-V313 PolarHBondContact O-N 3.22Å
314	K	44	Very low	54.7	Low	134 Å²	134	105.7 Å²	105.7	58%	0.583	58%	0.581	S	S	*	*			trans	-117.4	89	-178	-62.5	-175.1	-178.9	-175.6	0	109.2	F316	K314-F316 HydrophobicContact CB-CD2 3.61Å; K314-F316 HydrophobicContact CB-CE2 3.39Å; K314-F316 HydrophobicContact CB-CG 4.46Å; K314-F316 HydrophobicContact CB-CZ 4.09Å; K314-F316 HydrophobicContact CD-CE2 3.68Å; K314-F316 HydrophobicContact CD-CZ 3.61Å; K314-F316 HydrophobicContact CG-CE2 4.17Å; K314-F316 HydrophobicContact CG-CZ 4.48Å; K314-F316 WeakPolarHBondContact O-CD2 3.23Å; K314-F316 PolarHBondContact O-N 2.82Å
315	N	45.6	Very low	52.1	Low	142 Å²	142	105.4 Å²	105.4	76%	0.759	60%	0.596	S	S	*	*			trans	-60.7	90.1	152.1	-75.4	-20	0	0	0	105.7	D317	N315-D317 PolarHBondContact O-N 3.31Å
316	F	43.3	Very low	49.4	Very low	105 Å²	105	110 Å²	110	46%	0.461	60%	0.602	S	S	.	*			trans	-68	120.9	170.8	-81	-86.5	0	0	0	106.5	F255 K314 I318	F255-F316 AromaticContact CD2-CD2 3.9Å; F255-F316 HydrophobicContact CD2-CD2 3.9Å; F255-F316 HydrophobicContact CD2-CE1 4.34Å; F255-F316 AromaticContact CD2-CE2 3.64Å; F255-F316 HydrophobicContact CD2-CE2 3.64Å; F255-F316 HydrophobicContact CD2-CG 4.35Å; F255-F316 AromaticContact CD2-CZ 3.88Å; F255-F316 HydrophobicContact CD2-CZ 3.88Å; F255-F316 HydrophobicContact CE2-CD1 4.43Å; F255-F316 HydrophobicContact CE2-CD2 4.31Å; F255-F316 AromaticContact CE2-CE1 3.85Å; F255-F316 HydrophobicContact CE2-CE1 3.85Å; F255-F316 AromaticContact CE2-CE2 3.69Å; F255-F316 HydrophobicContact CE2-CE2 3.69Å; F255-F316 AromaticContact CE2-CZ 3.44Å; F255-F316 HydrophobicContact CE2-CZ 3.44Å; F255-F316 VanDerWaalsContact CE2-CZ 3.44Å; F255-F316 HydrophobicContact CG-CE2 4.48Å; F255-F316 HydrophobicContact CZ-CZ 4.22Å; K314-F316 HydrophobicContact CB-CD2 3.61Å; K314-F316 HydrophobicContact CB-CE2 3.39Å; K314-F316 HydrophobicContact CB-CG 4.46Å; K314-F316 HydrophobicContact CB-CZ 4.09Å; K314-F316 HydrophobicContact CD-CE2 3.68Å; K314-F316 HydrophobicContact CD-CZ 3.61Å; K314-F316 HydrophobicContact CG-CE2 4.17Å; K314-F316 HydrophobicContact CG-CZ 4.48Å; K314-F316 WeakPolarHBondContact O-CD2 3.23Å; K314-F316 PolarHBondContact O-N 2.82Å; F316-I318 VanDerWaalsContact C-N 3.28Å; F316-I318 PolarHBondContact O-N 2.9Å
317	D	42.2	Very low	46.9	Very low	163 Å²	163	110.3 Å²	110.3	87%	0.872	61%	0.608	S	S	*	*			trans	-59.8	92.5	168.8	-68.2	-45.2	0	0	0	108.2	N315 P319	N315-D317 PolarHBondContact O-N 3.31Å; D317-P319 WeakPolarHBondContact O-CD 3.37Å
318	I	42.8	Very low	44.5	Very low	89 Å²	89	111.5 Å²	111.5	46%	0.456	62%	0.616	S	S	.	*			trans	-80.8	119.7	171.1	-62.7	165.2	0	0	0	105.1	F316 D320	F316-I318 VanDerWaalsContact C-N 3.28Å; F316-I318 PolarHBondContact O-N 2.9Å; I318-D320 PolarHBondContact O-N 3.31Å
319	P	35.6	Very low	42	Very low	91 Å²	91	117.9 Å²	117.9	59%	0.591	65%	0.649	S	S	*	*			trans	-55.6	136.8	-175.9	-25.8	33.9	0	0	0	112.8	D317 E321	D317-P319 WeakPolarHBondContact O-CD 3.37Å; P319-E321 PolarHBondContact O-N 3.27Å
320	D	40.4	Very low	39.7	Very low	135 Å²	135	121.9 Å²	121.9	72%	0.722	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-57.2	-10	-170.4	-83.1	-24.7	0	0	0	116.2	I318 L322 L323	I318-D320 PolarHBondContact O-N 3.31Å; D320-L322 PolarHBondContact O-N 2.99Å; D320-L323 PolarHBondContact O-N 3.04Å
321	E	39.8	Very low	37.5	Very low	186 Å²	186	126.4 Å²	126.4	87%	0.869	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-69.6	2.7	-175	-152	174.5	-178.8	0	0	114.3	P319	P319-E321 PolarHBondContact O-N 3.27Å
322	L	39	Very low	35.7	Very low	133 Å²	133	130 Å²	130	70%	0.696	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-121.6	12.2	172.7	-80.9	164.1	0	0	0	113.9	D320	D320-L322 PolarHBondContact O-N 2.99Å
323	L	34.8	Very low	34.3	Very low	117 Å²	117	137 Å²	137	61%	0.613	73%	0.727	S	S	*	*			trans	-101.7	31.2	-175.6	-137.4	131.6	0	0	0	113.7	D320	D320-L323 PolarHBondContact O-N 3.04Å
324	L	26.9	Very low	33.1	Very low	172 Å²	172	138.7 Å²	138.7	90%	0.901	73%	0.731	S	S	*	*			trans	-98.8	111.1	175.2	-74.3	167.1	0	0	0	110.4
325	G	26.7	Very low	32.3	Very low	69 Å²	69	136.9 Å²	136.9	71%	0.711	74%	0.735	S	S	*	*			trans	140.3	35.9	169.7	0	0	0	0	0	116.4
326	Y	26.2	Very low	31.5	Very low	200 Å²	200	134.9 Å²	134.9	78%	0.784	73%	0.732	S	S	*	*			trans	-111.5	87.9	163.8	-70.7	-81.4	0	0	0	109.1	E328	Y326-E328 PolarHBondContact O-N 3.35Å
327	S	26.3	Very low	30.7	Very low	109 Å²	109	135.9 Å²	135.9	76%	0.762	75%	0.747	S	S	*	*			trans	-72	109.3	160.1	66.3	0	0	0	0	107.6	N329	S327-N329 PolarHBondContact O-N 3.4Å
328	E	25.8	Very low	29.9	Very low	152 Å²	152	136.3 Å²	136.3	71%	0.71	74%	0.744	S	S	*	*			trans	-61.2	94.9	167.3	-66.3	-168	172	0	0	109.7	Y326 K330	Y326-E328 PolarHBondContact O-N 3.35Å; E328-K330 IonicContact OE2-NZ 3.28Å; E328-K330 PolarHBondContact OE2-NZ 3.02Å
329	N	25.8	Very low	29.1	Very low	154 Å²	154	140.3 Å²	140.3	82%	0.824	76%	0.758	S	S	*	*			trans	-99.3	91.8	151.2	-86.1	-23.2	0	0	0	107.3	S327	S327-N329 PolarHBondContact O-N 3.4Å
330	K	26.8	Very low	28.7	Very low	149 Å²	149	142.7 Å²	142.7	65%	0.648	76%	0.764	S	S	*	*			trans	-61.2	153.1	152.4	-74	170.2	177.7	141.2	0	108.3	E328	E328-K330 IonicContact OE2-NZ 3.28Å; E328-K330 PolarHBondContact OE2-NZ 3.02Å
331	D	26.6	Very low	27.9	Very low	160 Å²	160	145.1 Å²	145.1	86%	0.856	77%	0.768	S	S	*	*			trans	83.3	67.1	163.5	-45.3	-32.3	0	0	0	117.7
332	A	25.5	Very low	27.2	Very low	91 Å²	91	143.8 Å²	143.8	75%	0.752	76%	0.764	S	S	*	*			trans	-158.9	77.7	140.7	0	0	0	0	0	110	L334	A332-L334 PolarHBondContact O-N 3.03Å
333	E	26.1	Very low	26.4	Very low	199 Å²	199	144.7 Å²	144.7	93%	0.93	76%	0.762	S	S	*	*			trans	-66	75.7	164.9	-81.6	-164.6	146.4	0	0	110.3	S335	E333-S335 PolarHBondContact O-N 2.8Å
334	L	24.2	Very low	26	Very low	162 Å²	162	143.5 Å²	143.5	85%	0.848	77%	0.77	S	S	*	*			trans	-90.3	71.5	158.6	-115.3	145.6	0	0	0	108	A332 S336	A332-L334 PolarHBondContact O-N 3.03Å; L334-S336 PolarHBondContact O-N 3.35Å; L334-S336 VanDerWaalsContact O-N 3.16Å
335	S	27	Very low	25.9	Very low	97 Å²	97	144.8 Å²	144.8	68%	0.678	77%	0.768	S	S	*	*			trans	-56.6	112.1	166.1	170.9	0	0	0	0	110.1	E333	E333-S335 PolarHBondContact O-N 2.8Å
336	S	29.8	Very low	25.8	Very low	99 Å²	99	147.4 Å²	147.4	69%	0.692	78%	0.775	S	S	*	*			trans	74.1	68.4	143.3	74	0	0	0	0	118.7	L334	L334-S336 PolarHBondContact O-N 3.35Å; L334-S336 VanDerWaalsContact O-N 3.16Å
337	T	25.6	Very low	25.8	Very low	127 Å²	127	147.8 Å²	147.8	78%	0.779	78%	0.781	S	S	*	*			trans	-104.7	91.6	131.7	54	0	0	0	0	109.9
338	Q	25.6	Very low	25.9	Very low	171 Å²	171	146.3 Å²	146.3	80%	0.799	78%	0.783	S	S	*	*			trans	-113.9	94.2	143.9	-90.2	-170.2	-3.8	0	0	109
339	K	26.6	Very low	26	Very low	174 Å²	174	149.5 Å²	149.5	76%	0.757	79%	0.794	S	S	*	*			trans	-39.1	137.5	150.6	-74.2	174.2	178.5	171.8	0	110.1
340	I	26.6	Very low	26	Very low	141 Å²	141	145.6 Å²	145.6	72%	0.723	79%	0.791	S	S	*	*				50.8	114.2	126.1	-51.4	166.9	0	0	0	114.9
341	K	24.6	Very low	26	Very low	185 Å²	185	148.6 Å²	148.6	80%	0.804	80%	0.804	S	S	*	*			trans	174.8	138.5	133	-92.2	158.5	-176.6	-173.2	0	105.5
342	M	24	Very low	26.1	Very low	158 Å²	158	149.5 Å²	149.5	78%	0.778	80%	0.803	S	S	*	*			cis	-172.3	178	11.4	-101.3	-119.2	151	0	0	105.6
343	K	23.9	Very low	26	Very low	152 Å²	152	154.2 Å²	154.2	66%	0.661	81%	0.806	S	S	*	*			trans	97.8	76.8	165.3	-55.3	-179.9	177.3	178.9	0	112	F231	F231-K343 VanDerWaalsContact CZ-NZ 3.25Å
344	A	26	Very low	26	Very low	93 Å²	93	148.8 Å²	148.8	77%	0.769	80%	0.804	S	S	*	*				50.4	102.1	75	0	0	0	0	0	111.5
345	K	23.8	Very low	26.3	Very low	199 Å²	199	150.6 Å²	150.6	87%	0.865	81%	0.805	S	S	*	*				-160.6	108.9	123.8	-107.1	165.8	-175.4	178.5	0	110	K347	K345-K347 PolarHBondContact O-N 3.25Å
346	S	25.8	Very low	26.3	Very low	123 Å²	123	155.3 Å²	155.3	86%	0.86	81%	0.813	S	S	*	*			trans	-42.9	114.4	148.1	46.3	0	0	0	0	109.7
347	K	26.2	Very low	26.3	Very low	209 Å²	209	159.2 Å²	159.2	91%	0.909	82%	0.821	S	S	*	*			trans	-108.6	124.1	155	-98	-175.8	175	173.5	0	106	K345	K345-K347 PolarHBondContact O-N 3.25Å
348	G	28.7	Very low	26.7	Very low	78 Å²	78	163.2 Å²	163.2	80%	0.804	83%	0.827	S	S	*	*			trans	-163	-17.1	178.5	0	0	0	0	0	119	G350	G348-G350 PolarHBondContact O-N 3.04Å
349	K	27.4	Very low	27.3	Very low	218 Å²	218	164.6 Å²	164.6	95%	0.948	83%	0.831	S	S	*	*	S	Bend	trans	-91.6	100.8	165.4	-87.8	-176.1	175.1	176.8	0	109.1
350	G	26.3	Very low	27.8	Very low	72 Å²	72	163.6 Å²	163.6	74%	0.742	83%	0.833	S	S	*	*			trans	-72.2	133.2	-178.5	0	0	0	0	0	112.3	G348	G348-G350 PolarHBondContact O-N 3.04Å
351	K	26.6	Very low	28.1	Very low	212 Å²	212	168.3 Å²	168.3	92%	0.922	84%	0.842	S	S	*	*			trans	-146.5	135.8	140.9	-117.5	172.7	-177.1	176.9	0	110.2
352	Q	27.1	Very low	28.7	Very low	180 Å²	180	168.8 Å²	168.8	84%	0.841	85%	0.846	S	S	*	*			trans	-63	137.7	-177.4	-62.7	160.1	-18.3	0	0	111.2
353	K	24.9	Very low	29.2	Very low	189 Å²	189	165.8 Å²	165.8	82%	0.822	85%	0.846	S	S	*	*				170.8	95	116.9	-97.7	173.6	174.1	173.6	0	110.2
354	G	25.1	Very low	29.5	Very low	86 Å²	86	168.2 Å²	168.2	89%	0.887	86%	0.857	S	S	*	*			trans	-113.8	77.3	154.7	0	0	0	0	0	108.4
355	K	29.8	Very low	29.7	Very low	199 Å²	199	173.2 Å²	173.2	87%	0.865	86%	0.861	S	S	*	*			trans	-134.6	53.9	174.1	-144.2	-176.5	-169.2	-175.2	0	109.3
356	K	27.8	Very low	30	Very low	197 Å²	197	173.2 Å²	173.2	86%	0.857	86%	0.864	S	S	*	*			trans	-152.5	25.5	174.1	-114.9	-176.2	-174.7	-172.5	0	116.1
357	E	29.6	Very low	30	Very low	181 Å²	181	174.9 Å²	174.9	85%	0.846	86%	0.863	S	S	*	*	S	Bend	trans	-119.9	30.3	172.7	-137.6	178.2	176.7	0	0	113.5
358	K	35	Very low	30	Very low	211 Å²	211	171.9 Å²	171.9	92%	0.917	86%	0.862	S	S	*	*	S	Bend	trans	-107.6	16.5	166.7	-96.3	-173.4	176.6	-177.5	0	113.8
359	K	37.6	Very low	30.1	Very low	199 Å²	199	172.5 Å²	172.5	87%	0.865	86%	0.859	S	S	*	*	S	Bend	trans	-109.6	0.2	177.2	-86.6	-164.8	172.6	-167.8	0	116.5
360	L	36	Very low	29.8	Very low	153 Å²	153	173.8 Å²	173.8	80%	0.801	86%	0.858	S	S	*	*	S	Bend	trans	-94.8	1.9	-179.9	-160.8	58	0	0	0	115.5
361	R	34	Very low	29.8	Very low	241 Å²	241	176 Å²	176	91%	0.909	86%	0.862	S	S	*	*	S	Bend	trans	-106.2	13.3	-173.5	-83.9	-170.1	161.4	-151.6	-3.8	116.8
362	H	36.6	Very low	29.6	Very low	195 Å²	195	172.8 Å²	172.8	90%	0.903	86%	0.855	S	S	*	*	S	Bend	trans	-127.3	8.7	177.7	-96.7	48.1	0	0	0	115.8
363	A	34.5	Very low	29.6	Very low	94 Å²	94	173.4 Å²	173.4	78%	0.777	86%	0.857	S	S	*	*	S	Bend	trans	-110.1	17.2	-177.3	0	0	0	0	0	115.2
364	K	31.5	Very low	29.5	Very low	203 Å²	203	172.5 Å²	172.5	88%	0.883	86%	0.856	S	S	*	*	S	Bend	trans	-120.1	30.2	178.7	-149.5	174.2	-176.3	175.4	0	114.5
365	K	30.3	Very low	29.6	Very low	198 Å²	198	173.9 Å²	173.9	86%	0.861	85%	0.849	S	S	*	*	S	Bend	trans	-140.2	63.5	174.5	-152	178.7	-171.2	-174.7	0	110.8
366	Q	29.3	Very low	29.8	Very low	199 Å²	199	169.8 Å²	169.8	93%	0.93	84%	0.841	S	S	*	*			trans	-173.9	79.5	159.6	-103.5	162.6	12.1	0	0	106.7
367	L	26.8	Very low	29.9	Very low	158 Å²	158	165.9 Å²	165.9	83%	0.827	84%	0.836	S	S	*	*			trans	-123.7	136.4	161.5	-106.1	151.6	0	0	0	103.3
368	V	26.2	Very low	29.6	Very low	147 Å²	147	162.3 Å²	162.3	89%	0.891	83%	0.831	S	S	*	*			trans	102.2	132.6	179.3	-170.6	0	0	0	0	114.7
369	A	29.7	Very low	29.1	Very low	90 Å²	90	164.2 Å²	164.2	74%	0.744	83%	0.832	S	S	*	*			trans	84.1	88.1	-169.2	0	0	0	0	0	113.1
370	R	22.3	Very low	28.5	Very low	246 Å²	246	158.2 Å²	158.2	93%	0.928	83%	0.827	S	S	*	*				50.1	101.2	55.9	-82	-169.8	175.6	178.5	-1.9	113.6
371	S	24.9	Very low	28.2	Very low	118 Å²	118	158.8 Å²	158.8	83%	0.825	83%	0.831	S	S	*	*				172.5	148.9	109.5	55.9	0	0	0	0	111.5
372	D	22.9	Very low	27.7	Very low	145 Å²	145	156.3 Å²	156.3	78%	0.775	83%	0.83	S	S	*	*			trans	-62.2	144.1	-167.5	-52.4	-77.4	0	0	0	115.8
373	H	27	Very low	27.3	Very low	193 Å²	193	150.5 Å²	150.5	89%	0.894	82%	0.822	S	S	*	*			trans	-162.7	99.8	148.2	-96.7	-62.2	0	0	0	109.5
374	E	22.3	Very low	27.1	Very low	170 Å²	170	151.4 Å²	151.4	79%	0.794	81%	0.814	S	S	*	*			trans	-91.7	141.6	142.1	-87.8	-134.7	153	0	0	107.1
375	P	28.2	Very low	27.3	Very low	114 Å²	114	148.3 Å²	148.3	74%	0.74	81%	0.806	S	S	*	*				-146	155.3	91.8	33.7	-14.6	0	0	0	115.7
376	T	32.8	Very low	27.5	Very low	114 Å²	114	144.7 Å²	144.7	70%	0.699	80%	0.796	S	S	*	*			trans	-56.6	155.1	164.8	48.9	0	0	0	0	114.3
377	P	30.5	Very low	27.9	Very low	114 Å²	114	144.1 Å²	144.1	74%	0.74	79%	0.785	S	S	*	*				-146.3	127.5	103.2	24.1	-2	0	0	0	113.7
378	S	23.4	Very low	28.5	Very low	106 Å²	106	140.4 Å²	140.4	74%	0.741	77%	0.772	S	S	*	*				66.9	109.1	99.6	79.1	0	0	0	0	117.8
379	R	24.2	Very low	29.4	Very low	252 Å²	252	139.8 Å²	139.8	95%	0.951	76%	0.762	S	S	*	*				68.2	115.5	123.5	-154	172.9	177.1	169.1	-2.3	119.4
380	G	26.1	Very low	29.9	Very low	73 Å²	73	142.4 Å²	142.4	75%	0.753	76%	0.764	S	S	*	*			trans	100.4	96.5	143.3	0	0	0	0	0	115.1
381	D	28.7	Very low	30.3	Very low	165 Å²	165	138.6 Å²	138.6	88%	0.882	75%	0.754	S	S	*	*				-153.7	131.7	125.7	-142.2	-6.7	0	0	0	110.4
382	E	24.5	Very low	30.9	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	75%	0.749	S	S	*	*			trans	-71.8	151	178.2	-64.1	176.7	148.8	0	0	109.6
383	G	27.5	Very low	31.1	Very low	72 Å²	72	136.9 Å²	136.9	74%	0.742	75%	0.747	S	S	*	*			trans	135.1	92.3	161.9	0	0	0	0	0	116.2
384	N	30.5	Very low	31.5	Very low	114 Å²	114	137.5 Å²	137.5	61%	0.61	74%	0.743	S	S	*	*			trans	71.6	75.4	136.1	-156.9	8.3	0	0	0	117.6	N386	N384-N386 PolarHBondContact O-N 2.96Å; N384-N386 VanDerWaalsContact O-N 3.12Å
385	I	34.8	Very low	31.9	Very low	138 Å²	138	137.1 Å²	137.1	71%	0.708	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-66	-4.6	174.9	-68.8	169	0	0	0	113.8	R387 S388	I385-R387 PolarHBondContact O-N 3.17Å; I385-S388 PolarHBondContact O-N 2.98Å; I385-S388 VanDerWaalsContact O-N 3.07Å
386	N	36.1	Very low	32.1	Very low	121 Å²	121	139.5 Å²	139.5	65%	0.647	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-70	-1	178.2	-76.9	-12.9	0	0	0	114.6	N384	N384-N386 PolarHBondContact O-N 2.96Å; N384-N386 VanDerWaalsContact O-N 3.12Å
387	R	36.7	Very low	31.9	Very low	188 Å²	188	144.6 Å²	144.6	71%	0.709	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-104.5	3.2	169.3	-72.4	-162	-87.1	-177.4	-7.2	115.2	I385	I385-R387 PolarHBondContact O-N 3.17Å
388	S	39.2	Very low	31.8	Very low	80 Å²	80	146.4 Å²	146.4	56%	0.559	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-16.6	-179.3	-63.4	0	0	0	0	114.3	I385 D390	I385-S388 PolarHBondContact O-N 2.98Å; I385-S388 VanDerWaalsContact O-N 3.07Å; S388-D390 VanDerWaalsContact C-N 3.3Å
389	I	45.3	Very low	32.1	Very low	133 Å²	133	151.4 Å²	151.4	68%	0.682	77%	0.766	S	S	*	*	S	Bend	trans	-73	-28.2	169.2	-64.2	176.9	0	0	0	110.8
390	D	39.7	Very low	32.5	Very low	145 Å²	145	144.4 Å²	144.4	78%	0.775	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-2.2	176.5	-81.8	-15.3	0	0	0	114.6	S388	S388-D390 VanDerWaalsContact C-N 3.3Å
391	K	31.4	Very low	32.6	Very low	167 Å²	167	143.6 Å²	143.6	73%	0.726	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	23.5	179.9	-79.9	-175.6	-180	-179.1	0	114.7	A393	K391-A393 PolarHBondContact O-N 2.93Å
392	L	37.9	Very low	32.7	Very low	137 Å²	137	143.5 Å²	143.5	72%	0.717	75%	0.752	S	S	*	*			trans	-77.6	77.8	160.1	-94.2	144.2	0	0	0	109.7	Y394	L392-Y394 HydrophobicContact CD2-CE2 4.33Å; L392-Y394 PolarHBondContact O-N 3.16Å
393	A	25.5	Very low	32.8	Very low	89 Å²	89	140 Å²	140	74%	0.736	75%	0.749	S	S	*	*			trans	-63.1	103.6	176.4	0	0	0	0	0	111.1	K391	K391-A393 PolarHBondContact O-N 2.93Å
394	Y	36.1	Very low	32.9	Very low	206 Å²	206	141.7 Å²	141.7	81%	0.808	75%	0.75	S	S	*	*			trans	-124.3	91.6	158	-80.6	-79.5	0	0	0	109.3	L392	L392-Y394 HydrophobicContact CD2-CE2 4.33Å; L392-Y394 PolarHBondContact O-N 3.16Å
395	N	30.3	Very low	33	Very low	163 Å²	163	142.6 Å²	142.6	87%	0.872	75%	0.754	S	S	*	*	S	Bend	trans	22.3	103.5	160.6	-75.3	-17.8	0	0	0	118.3
396	K	32.2	Very low	32.7	Very low	164 Å²	164	146.4 Å²	146.4	71%	0.713	77%	0.765	S	S	*	*			trans	71.1	90.7	151.1	-160.1	173.4	-175	-179.3	0	116.6	E398	K396-E398 WeakPolarHBondContact CE-OE1 3.41Å; K396-E398 IonicContact NZ-OE1 3.61Å; K396-E398 PolarHBondContact NZ-OE1 3.17Å
397	F	29.8	Very low	32.6	Very low	220 Å²	220	148.7 Å²	148.7	97%	0.965	77%	0.769	S	S	*	*			trans	-130.7	128.7	146.7	-101.5	-86.2	0	0	0	110.9
398	E	27.8	Very low	32.3	Very low	152 Å²	152	149 Å²	149	71%	0.71	78%	0.776	S	S	*	*			trans	-83.4	159.7	-178.8	-75.2	172.2	-172.8	0	0	111.6	K396	K396-E398 WeakPolarHBondContact CE-OE1 3.41Å; K396-E398 IonicContact NZ-OE1 3.61Å; K396-E398 PolarHBondContact NZ-OE1 3.17Å
399	F	29.4	Very low	32.1	Very low	212 Å²	212	154.7 Å²	154.7	93%	0.93	79%	0.793	S	S	*	*			trans	-43.3	130.5	-167	-114.9	-112.4	0	0	0	116.5
400	A	32.8	Very low	31.6	Very low	105 Å²	105	158.9 Å²	158.9	87%	0.868	80%	0.8	S	S	*	*			trans	-98.4	83.8	162.7	0	0	0	0	0	109.7
401	G	28.8	Very low	31.6	Very low	55 Å²	55	161.7 Å²	161.7	57%	0.567	81%	0.806	S	S	*	*			trans	-96.7	127.3	147.2	0	0	0	0	0	107.7
402	N	30.4	Very low	32.5	Very low	163 Å²	163	161.7 Å²	161.7	87%	0.872	80%	0.801	S	S	*	*			trans	87.5	71.6	170.7	-56.4	13.2	0	0	0	116.3	S404	N402-S404 PolarHBondContact O-N 2.85Å; N402-S404 VanDerWaalsContact O-N 3.14Å
403	S	27.5	Very low	33.5	Very low	117 Å²	117	157.5 Å²	157.5	82%	0.818	79%	0.791	S	S	*	*			trans	-57.5	101	149.9	53.5	0	0	0	0	110.6
404	S	28.1	Very low	35.1	Very low	107 Å²	107	161.5 Å²	161.5	75%	0.748	79%	0.792	S	S	*	*			trans	173.9	65	148.4	-81.2	0	0	0	0	110.5	N402	N402-S404 PolarHBondContact O-N 2.85Å; N402-S404 VanDerWaalsContact O-N 3.14Å
405	L	33.2	Very low	36.5	Very low	133 Å²	133	154.3 Å²	154.3	70%	0.696	77%	0.765	S	S	*	*			trans	-162.9	76.2	162	-94.8	131.2	0	0	0	110.1	K407	L405-K407 HydrophobicContact CD2-CD 3.82Å; L405-K407 HydrophobicContact CD2-CG 4.12Å; L405-K407 PolarHBondContact O-N 2.95Å
406	K	28.7	Very low	38.4	Very low	218 Å²	218	147.5 Å²	147.5	95%	0.948	73%	0.731	S	S	*	*			trans	-66.7	80.1	162.8	-72.3	-179.5	179.3	169.5	0	109.4	K408	K406-K408 PolarHBondContact O-N 3.38Å
407	K	33.3	Very low	40.2	Very low	168 Å²	168	140 Å²	140	73%	0.73	70%	0.699	S	S	*	*			trans	-88.8	101.1	170.4	-86.4	176.5	177.1	165.3	0	110.4	L405	L405-K407 HydrophobicContact CD2-CD 3.82Å; L405-K407 HydrophobicContact CD2-CG 4.12Å; L405-K407 PolarHBondContact O-N 2.95Å
408	K	31.2	Very low	42.2	Very low	196 Å²	196	130.9 Å²	130.9	85%	0.852	66%	0.66	S	S	*	*			trans	-39.5	139.8	166.4	-73.8	175.2	175.4	172.7	0	111.2	K406 R410	K406-K408 PolarHBondContact O-N 3.38Å; K408-R410 PolarHBondContact O-N 3.32Å
409	H	35.2	Very low	44.4	Very low	198 Å²	198	126.2 Å²	126.2	92%	0.917	64%	0.64	S	S	*	*			trans	-47.7	86.8	176.6	-75.1	-78	0	0	0	113	K411	H409-K411 PolarHBondContact O-N 3.1Å
410	R	35.4	Very low	46.9	Very low	221 Å²	221	116.4 Å²	116.4	83%	0.834	60%	0.597	S	S	*	*			trans	-64.7	122.9	166.8	-65.8	-177.2	89.9	133.6	-0.5	106.7	K408 R412	K408-R410 PolarHBondContact O-N 3.32Å; R410-R412 PolarHBondContact O-N 3.43Å
411	K	37.9	Very low	49	Very low	205 Å²	205	114.5 Å²	114.5	89%	0.891	58%	0.575	S	S	*	*			trans	-47.3	111.8	169.1	-75.1	178.6	179.2	173.5	0	107.2	H409 G413	H409-K411 PolarHBondContact O-N 3.1Å; K411-G413 PolarHBondContact O-N 3.03Å
412	R	50.8	Low	51.6	Low	167 Å²	167	113.3 Å²	113.3	63%	0.63	56%	0.563	S	S	*	*			trans	-58.2	130.4	-174.9	-71.7	178.5	161.6	179.8	-8.2	108.9	R410 A416 D418	R410-R412 PolarHBondContact O-N 3.43Å; R412-A416 HydrophobicContact CB-CB 4.29Å; R412-D418 IonicContact CZ-OD2 3.19Å; R412-D418 IonicContact NE-OD2 3.09Å; R412-D418 IonicContact NH1-OD2 3.53Å; R412-D418 IonicContact NH2-OD2 3.16Å
413	G	58.4	Low	53.9	Low	49 Å²	49	112 Å²	112	51%	0.505	55%	0.551	S	S	.	*			trans	-54.8	151	-175.5	0	0	0	0	0	112.5	K411 F415 A416	K411-G413 PolarHBondContact O-N 3.03Å; G413-F415 PolarHBondContact O-N 2.89Å; G413-F415 VanDerWaalsContact O-N 3.09Å; G413-A416 WeakPolarHBondContact O-CB 3.44Å; G413-A416 PolarHBondContact O-N 2.88Å
414	K	59.4	Low	56.6	Low	172 Å²	172	115.7 Å²	115.7	75%	0.748	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.7	-177.3	-67.9	175.2	-177.7	173.8	0	112.8
415	F	66.8	Low	59.3	Low	55 Å²	55	112.4 Å²	112.4	24%	0.241	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	10.6	176	-65.4	-81.3	0	0	0	114.2	G413 V417 R435 K438 L442 V453 I457	G413-F415 PolarHBondContact O-N 2.89Å; G413-F415 VanDerWaalsContact O-N 3.09Å; F415-V417 PolarHBondContact O-N 3.16Å; F415-R435 HydrophobicContact CD1-CG 3.96Å; F415-R435 HydrophobicContact CE1-CG 4.31Å; F415-R435 PolarHBondContact O-NH2 3.17Å; F415-K438 HydrophobicContact CE1-CB 4.16Å; F415-K438 HydrophobicContact CZ-CB 3.89Å; F415-L442 HydrophobicContact CE2-CD1 4.01Å; F415-L442 HydrophobicContact CZ-CD1 3.55Å; F415-V453 HydrophobicContact CD1-CG1 4.23Å; F415-V453 HydrophobicContact CD2-CG1 4.47Å; F415-V453 HydrophobicContact CE1-CG1 4.31Å; F415-V453 HydrophobicContact CG-CG1 4.31Å; F415-V453 HydrophobicContact CZ-CG1 4.48Å; F415-I457 HydrophobicContact CB-CD1 4.17Å; F415-I457 HydrophobicContact CB-CG1 4.38Å; F415-I457 HydrophobicContact CD1-CD1 3.61Å; F415-I457 HydrophobicContact CE1-CD1 4.38Å; F415-I457 HydrophobicContact CG-CD1 4.2Å
416	A	69.1	Low	61.7	Low	21 Å²	21	110 Å²	110	17%	0.174	51%	0.513	C	S	.	.			trans	-68.2	123.6	-179.1	0	0	0	0	0	111.7	R412 G413 D418 N419	R412-A416 HydrophobicContact CB-CB 4.29Å; G413-A416 WeakPolarHBondContact O-CB 3.44Å; G413-A416 PolarHBondContact O-N 2.88Å; A416-D418 PolarHBondContact O-N 3.38Å; A416-N419 PolarHBondContact O-N 3.05Å
417	V	70.7	Confident	64.4	Low	5 Å²	5	101.2 Å²	101.2	3%	0.03	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-58.3	-29.6	179.2	-68	0	0	0	0	113.3	F415 N419 L420 R435 D460 T461 R464 I471	F415-V417 PolarHBondContact O-N 3.16Å; V417-N419 PolarHBondContact O-N 3.3Å; V417-L420 PolarHBondContact O-N 3.38Å; V417-R435 VanDerWaalsContact CG1-NH2 3.35Å; V417-D460 HydrophobicContact CG1-CB 3.94Å; V417-D460 HydrophobicContact CG2-CB 4.03Å; V417-T461 VanDerWaalsContact CG1-OG1 3.25Å; V417-T461 WeakPolarHBondContact CG1-OG1 3.41Å; V417-R464 HydrophobicContact CG2-CG 3.78Å; V417-I471 HydrophobicContact CB-CD1 4.11Å; V417-I471 HydrophobicContact CG2-CD1 4.46Å
418	D	71.3	Confident	67	Low	29 Å²	29	93.4 Å²	93.4	16%	0.155	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-56.9	-26.3	179	-75.1	-13.9	0	0	0	114.2	R412 A416 L420 R464	R412-D418 IonicContact CZ-OD2 3.19Å; R412-D418 IonicContact NE-OD2 3.09Å; R412-D418 IonicContact NH1-OD2 3.53Å; R412-D418 IonicContact NH2-OD2 3.16Å; A416-D418 PolarHBondContact O-N 3.38Å; D418-L420 PolarHBondContact O-N 3.39Å; D418-R464 IonicContact OD1-CZ 2.65Å; D418-R464 IonicContact OD1-NE 2.95Å; D418-R464 IonicContact OD1-NH1 3.49Å; D418-R464 PolarHBondContact OD1-NH1 3.18Å; D418-R464 IonicContact OD1-NH2 3.45Å; D418-R464 PolarHBondContact OD1-NH2 2.81Å; D418-R464 IonicContact OD2-CZ 3.29Å; D418-R464 IonicContact OD2-NH1 3.18Å; D418-R464 PolarHBondContact OD2-NH1 3.29Å; D418-R464 IonicContact OD2-NH2 3.64Å; D418-R464 PolarHBondContact OD2-NH2 2.97Å
419	N	74.8	Confident	69.8	Low	54 Å²	54	85.3 Å²	85.3	29%	0.289	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-73.6	-12.9	-177.5	-68.5	-34.6	0	0	0	113	A416 V417 K431	A416-N419 PolarHBondContact O-N 3.05Å; V417-N419 PolarHBondContact O-N 3.3Å; N419-K431 HydrophobicContact CB-CD 4.49Å; N419-K431 WeakPolarHBondContact O-CD 3.14Å; N419-K431 PolarHBondContact O-NZ 3.26Å
420	L	80.1	Confident	72.3	Confident	6 Å²	6	83.2 Å²	83.2	3%	0.031	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-100.1	20.7	-177.8	-64.5	105.4	0	0	0	113.6	V417 D418 L428 V432 I471 K472 D473	V417-L420 PolarHBondContact O-N 3.38Å; D418-L420 PolarHBondContact O-N 3.39Å; L420-L428 VanDerWaalsContact C-CD2 3.49Å; L420-L428 HydrophobicContact CB-CD2 4.41Å; L420-V432 HydrophobicContact CD2-CB 4.39Å; L420-V432 HydrophobicContact CD2-CG2 3.32Å; L420-I471 HydrophobicContact CB-CG2 4.22Å; L420-K472 PolarHBondContact O-N 3.22Å; L420-K472 VanDerWaalsContact O-N 3.14Å; L420-D473 WeakPolarHBondContact CB-OD1 3.5Å; L420-D473 VanDerWaalsContact CD2-OD1 3.24Å; L420-D473 WeakPolarHBondContact CD2-OD1 3.37Å
421	V	77.4	Confident	74.9	Confident	66 Å²	66	76.6 Å²	76.6	40%	0.4	37%	0.372	S	S	.	.			trans	-103.4	130.8	175.3	-172.7	0	0	0	0	109.6	V469 I471	V421-V469 HydrophobicContact CG1-CG1 4.19Å; V421-V469 HydrophobicContact CG2-CG1 3.55Å; V421-I471 HydrophobicContact CG2-CG1 4.44Å
422	G	83.1	Confident	77.3	Confident	30 Å²	30	67.7 Å²	67.7	31%	0.309	34%	0.335	S	S	.	.	S	Bend	trans	146.2	-167.2	172.7	0	0	0	0	0	116.4	K472	G422-K472 PolarHBondContact O-NZ 3.36Å
423	H	79.4	Confident	79.2	Confident	135 Å²	135	64.1 Å²	64.1	63%	0.625	33%	0.326	S	S	*	.	S	Bend	trans	-115.5	-3.3	-173	-105.5	80.2	0	0	0	114.8	Y425 R485	H423-Y425 VanDerWaalsContact O-CD2 3.31Å; H423-Y425 WeakPolarHBondContact O-CD2 3.26Å; H423-Y425 WeakPolarHBondContact O-CE2 3.5Å; H423-Y425 PolarHBondContact O-N 3.47Å; H423-R485 PolarHBondContact O-NH1 2.71Å
424	R	84.5	Confident	80.6	Confident	194 Å²	194	65.7 Å²	65.7	73%	0.732	32%	0.32	S	S	*	.			trans	-89	81.9	179.4	-65.5	-175	-176.3	-179.7	2.2	110	S426 S427 L428	R424-S426 VanDerWaalsContact C-N 3.33Å; R424-S426 PolarHBondContact O-N 3.38Å; R424-S427 WeakPolarHBondContact CB-OG 3.19Å; R424-S427 PolarHBondContact O-N 2.97Å; R424-S427 PolarHBondContact O-OG 3Å; R424-L428 WeakPolarHBondContact O-CG 3.35Å; R424-L428 PolarHBondContact O-N 3.16Å
425	Y	85.2	Confident	82	Confident	38 Å²	38	59 Å²	59	15%	0.149	29%	0.29	C	S	.	.	H	α-helix	trans	-54.4	-40	-175.1	-63.9	-79.8	0	0	0	114.3	H423 L428 L429 K472 L478 R485	H423-Y425 VanDerWaalsContact O-CD2 3.31Å; H423-Y425 WeakPolarHBondContact O-CD2 3.26Å; H423-Y425 WeakPolarHBondContact O-CE2 3.5Å; H423-Y425 PolarHBondContact O-N 3.47Å; Y425-L428 PolarHBondContact O-N 3.39Å; Y425-L429 WeakPolarHBondContact O-CB 3.08Å; Y425-L429 PolarHBondContact O-N 3.41Å; Y425-K472 PolarHBondContact OH-NZ 2.88Å; Y425-L478 HydrophobicContact CD1-CD2 3.69Å; Y425-L478 HydrophobicContact CE1-CD2 4.29Å; Y425-R485 HydrophobicContact CE2-CG 4.47Å
426	S	82.4	Confident	83.1	Confident	82 Å²	82	61 Å²	61	57%	0.573	30%	0.3	S	S	*	.	H	α-helix	trans	-63.7	-45.2	178.4	50.8	0	0	0	0	112.6	R424 L429 R430	R424-S426 VanDerWaalsContact C-N 3.33Å; R424-S426 PolarHBondContact O-N 3.38Å; S426-L429 PolarHBondContact O-N 2.96Å; S426-R430 PolarHBondContact O-N 2.98Å
427	S	86.9	Confident	84.1	Confident	35 Å²	35	65.7 Å²	65.7	25%	0.245	32%	0.318	C	S	.	.	H	α-helix	trans	-70.9	-32.6	177.1	56.4	0	0	0	0	112.8	R424 K431	R424-S427 WeakPolarHBondContact CB-OG 3.19Å; R424-S427 PolarHBondContact O-N 2.97Å; R424-S427 PolarHBondContact O-OG 3Å; S427-K431 VanDerWaalsContact O-CG 3.3Å; S427-K431 WeakPolarHBondContact O-CG 3.28Å; S427-K431 PolarHBondContact O-N 2.95Å; S427-K431 VanDerWaalsContact O-N 3.14Å
428	L	87.8	Confident	84.9	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-66.1	-44.6	175.1	-75.3	167.1	0	0	0	110.3	L420 R424 Y425 R430 K431 V432 K472 L478	L420-L428 VanDerWaalsContact C-CD2 3.49Å; L420-L428 HydrophobicContact CB-CD2 4.41Å; R424-L428 WeakPolarHBondContact O-CG 3.35Å; R424-L428 PolarHBondContact O-N 3.16Å; Y425-L428 PolarHBondContact O-N 3.39Å; L428-R430 PolarHBondContact O-N 3.01Å; L428-K431 WeakPolarHBondContact O-CB 3.47Å; L428-K431 PolarHBondContact O-N 2.92Å; L428-V432 WeakPolarHBondContact O-CG2 3.22Å; L428-V432 PolarHBondContact O-N 3.13Å; L428-K472 HydrophobicContact CD1-CD 4.21Å; L428-L478 HydrophobicContact CB-CD1 3.88Å; L428-L478 HydrophobicContact CB-CD2 3.83Å; L428-L478 HydrophobicContact CD1-CD2 3.96Å
429	L	89.3	Confident	85.7	Confident	25 Å²	25	68.9 Å²	68.9	13%	0.131	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-48.1	178.4	-174.2	65.7	0	0	0	111.2	Y425 S426 K431 V432 E433 P475 L478 K479	Y425-L429 WeakPolarHBondContact O-CB 3.08Å; Y425-L429 PolarHBondContact O-N 3.41Å; S426-L429 PolarHBondContact O-N 2.96Å; L429-K431 VanDerWaalsContact C-N 3.26Å; L429-K431 PolarHBondContact O-N 3.18Å; L429-V432 PolarHBondContact O-N 3.48Å; L429-V432 VanDerWaalsContact O-N 3.14Å; L429-E433 WeakPolarHBondContact CG-OE1 3.27Å; L429-E433 WeakPolarHBondContact O-CG 3.42Å; L429-E433 PolarHBondContact O-N 3.46Å; L429-P475 HydrophobicContact CD1-CB 3.79Å; L429-L478 HydrophobicContact CB-CD1 4.44Å; L429-L478 HydrophobicContact CD1-CB 4.31Å; L429-K479 HydrophobicContact CD1-CG 4.2Å; L429-K479 HydrophobicContact CD2-CG 3.93Å
430	R	88.6	Confident	86.4	Confident	155 Å²	155	71.1 Å²	71.1	59%	0.585	34%	0.341	S	S	*	.	H	α-helix	trans	-58.1	-37.6	175	-170.8	178.1	69.9	173.3	4.3	112.9	S426 L428 Q434	S426-R430 PolarHBondContact O-N 2.98Å; L428-R430 PolarHBondContact O-N 3.01Å; R430-Q434 WeakPolarHBondContact O-CB 3.42Å; R430-Q434 WeakPolarHBondContact O-CG 3.24Å; R430-Q434 PolarHBondContact O-N 3.32Å
431	K	88.5	Confident	86.9	Confident	81 Å²	81	73.8 Å²	73.8	35%	0.352	36%	0.357	S	S	.	.	H	α-helix	trans	-70.3	-38.5	178.1	-74.9	177.5	-175.6	-170.2	0	112.2	N419 S427 L428 L429 R435	N419-K431 HydrophobicContact CB-CD 4.49Å; N419-K431 WeakPolarHBondContact O-CD 3.14Å; N419-K431 PolarHBondContact O-NZ 3.26Å; S427-K431 VanDerWaalsContact O-CG 3.3Å; S427-K431 WeakPolarHBondContact O-CG 3.28Å; S427-K431 PolarHBondContact O-N 2.95Å; S427-K431 VanDerWaalsContact O-N 3.14Å; L428-K431 WeakPolarHBondContact O-CB 3.47Å; L428-K431 PolarHBondContact O-N 2.92Å; L429-K431 VanDerWaalsContact C-N 3.26Å; L429-K431 PolarHBondContact O-N 3.18Å; K431-R435 WeakPolarHBondContact O-CB 3.5Å; K431-R435 PolarHBondContact O-N 3.07Å
432	V	89.7	Confident	87.3	Confident	19 Å²	19	73 Å²	73	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-62.7	-50	174.8	172.4	0	0	0	0	109.6	L420 L428 L429 Q434 R435 Q436 D473 P475 L478	L420-V432 HydrophobicContact CD2-CB 4.39Å; L420-V432 HydrophobicContact CD2-CG2 3.32Å; L428-V432 WeakPolarHBondContact O-CG2 3.22Å; L428-V432 PolarHBondContact O-N 3.13Å; L429-V432 PolarHBondContact O-N 3.48Å; L429-V432 VanDerWaalsContact O-N 3.14Å; V432-Q434 PolarHBondContact O-N 3.09Å; V432-R435 WeakPolarHBondContact O-CB 3.47Å; V432-R435 PolarHBondContact O-N 3.38Å; V432-Q436 PolarHBondContact O-N 3.07Å; V432-D473 VanDerWaalsContact CG1-O 3.3Å; V432-D473 WeakPolarHBondContact CG1-O 3.37Å; V432-D473 WeakPolarHBondContact CG2-O 3.31Å; V432-P475 HydrophobicContact CG1-CB 4.34Å; V432-L478 HydrophobicContact CG2-CD1 3.8Å
433	E	89.1	Confident	87.5	Confident	92 Å²	92	77.5 Å²	77.5	43%	0.43	36%	0.363	S	S	.	.	H	α-helix	trans	-57.7	-48.7	178.1	-71.3	165.6	175.1	0	0	111.3	L429 R435 Q436 E437	L429-E433 WeakPolarHBondContact CG-OE1 3.27Å; L429-E433 WeakPolarHBondContact O-CG 3.42Å; L429-E433 PolarHBondContact O-N 3.46Å; E433-R435 PolarHBondContact O-N 2.98Å; E433-Q436 WeakPolarHBondContact O-CB 3.5Å; E433-Q436 PolarHBondContact O-N 2.93Å; E433-Q436 VanDerWaalsContact O-N 3.17Å; E433-E437 WeakPolarHBondContact O-CB 3.44Å; E433-E437 PolarHBondContact O-N 2.86Å
434	Q	89.3	Confident	87.8	Confident	81 Å²	81	79 Å²	79	38%	0.379	37%	0.371	S	S	.	.	H	α-helix	trans	-63.7	-24.1	176.3	-75.8	179.4	-4.5	0	0	114.4	R430 V432 K438	R430-Q434 WeakPolarHBondContact O-CB 3.42Å; R430-Q434 WeakPolarHBondContact O-CG 3.24Å; R430-Q434 PolarHBondContact O-N 3.32Å; V432-Q434 PolarHBondContact O-N 3.09Å; Q434-K438 WeakPolarHBondContact O-CB 3.41Å; Q434-K438 VanDerWaalsContact O-CD 3.3Å; Q434-K438 WeakPolarHBondContact O-CD 3.42Å; Q434-K438 WeakPolarHBondContact O-CG 3.38Å; Q434-K438 PolarHBondContact O-N 3.01Å
435	R	88.1	Confident	88.1	Confident	31 Å²	31	77.5 Å²	77.5	12%	0.117	37%	0.369	C	S	.	.	H	α-helix	trans	-80.4	-39.5	176.3	-167.6	-175.6	-156.8	179.7	1.4	110.3	F415 V417 K431 V432 E433 K438 L439 I457	F415-R435 HydrophobicContact CD1-CG 3.96Å; F415-R435 HydrophobicContact CE1-CG 4.31Å; F415-R435 PolarHBondContact O-NH2 3.17Å; V417-R435 VanDerWaalsContact CG1-NH2 3.35Å; K431-R435 WeakPolarHBondContact O-CB 3.5Å; K431-R435 PolarHBondContact O-N 3.07Å; V432-R435 WeakPolarHBondContact O-CB 3.47Å; V432-R435 PolarHBondContact O-N 3.38Å; E433-R435 PolarHBondContact O-N 2.98Å; R435-K438 PolarHBondContact O-N 3.46Å; R435-L439 WeakPolarHBondContact O-CB 3.4Å; R435-L439 PolarHBondContact O-N 2.81Å; R435-I457 VanDerWaalsContact NH2-CG2 3.34Å
436	Q	89.3	Confident	88.3	Confident	99 Å²	99	78.8 Å²	78.8	46%	0.463	38%	0.379	S	S	.	.	H	α-helix	trans	-64.3	-51.4	176.9	-173.3	61.7	27.4	0	0	111	V432 E433 K438 L439 E440	V432-Q436 PolarHBondContact O-N 3.07Å; E433-Q436 WeakPolarHBondContact O-CB 3.5Å; E433-Q436 PolarHBondContact O-N 2.93Å; E433-Q436 VanDerWaalsContact O-N 3.17Å; Q436-K438 VanDerWaalsContact C-N 3.27Å; Q436-K438 PolarHBondContact O-N 3.45Å; Q436-L439 WeakPolarHBondContact O-CA 3.47Å; Q436-L439 WeakPolarHBondContact O-CB 3.33Å; Q436-L439 PolarHBondContact O-N 3.27Å; Q436-E440 WeakPolarHBondContact CG-OE1 3.27Å; Q436-E440 PolarHBondContact NE2-OE1 3.33Å; Q436-E440 PolarHBondContact O-N 3.12Å
437	E	91	Very high	88.7	Confident	119 Å²	119	78.7 Å²	78.7	56%	0.556	38%	0.376	S	S	*	.	H	α-helix	trans	-56.5	-40.7	176.2	-177.8	-172.7	-172.6	0	0	111.9	E433 L439 E440 T441	E433-E437 WeakPolarHBondContact O-CB 3.44Å; E433-E437 PolarHBondContact O-N 2.86Å; E437-L439 VanDerWaalsContact C-N 3.29Å; E437-L439 PolarHBondContact O-N 3.28Å; E437-E440 PolarHBondContact O-N 3.2Å; E437-T441 WeakPolarHBondContact O-CB 3.49Å; E437-T441 VanDerWaalsContact O-CG2 3.3Å; E437-T441 WeakPolarHBondContact O-CG2 3.46Å; E437-T441 PolarHBondContact O-N 2.71Å; E437-T441 PolarHBondContact O-OG1 3.08Å
438	K	87.6	Confident	88.8	Confident	71 Å²	71	80.6 Å²	80.6	31%	0.309	39%	0.394	S	S	.	.	H	α-helix	trans	-69	-28.2	176.1	-77.6	175.5	-171.5	144.8	0	113.6	F415 Q434 R435 Q436 T441 L442	F415-K438 HydrophobicContact CE1-CB 4.16Å; F415-K438 HydrophobicContact CZ-CB 3.89Å; Q434-K438 WeakPolarHBondContact O-CB 3.41Å; Q434-K438 VanDerWaalsContact O-CD 3.3Å; Q434-K438 WeakPolarHBondContact O-CD 3.42Å; Q434-K438 WeakPolarHBondContact O-CG 3.38Å; Q434-K438 PolarHBondContact O-N 3.01Å; R435-K438 PolarHBondContact O-N 3.46Å; Q436-K438 VanDerWaalsContact C-N 3.27Å; Q436-K438 PolarHBondContact O-N 3.45Å; K438-T441 VanDerWaalsContact CA-OG1 3.27Å; K438-T441 WeakPolarHBondContact CA-OG1 3.38Å; K438-T441 PolarHBondContact O-OG1 3.14Å; K438-L442 WeakPolarHBondContact O-CB 3.41Å; K438-L442 WeakPolarHBondContact O-CD1 3.37Å; K438-L442 WeakPolarHBondContact O-CG 3.24Å; K438-L442 PolarHBondContact O-N 2.94Å
439	L	87.7	Confident	88.7	Confident	30 Å²	30	86.2 Å²	86.2	16%	0.157	42%	0.418	C	S	.	.	H	α-helix	trans	-78.2	-40.2	178.2	-171.6	64.9	0	0	0	110.5	R435 Q436 E437 L442 Q443 T454	R435-L439 WeakPolarHBondContact O-CB 3.4Å; R435-L439 PolarHBondContact O-N 2.81Å; Q436-L439 WeakPolarHBondContact O-CA 3.47Å; Q436-L439 WeakPolarHBondContact O-CB 3.33Å; Q436-L439 PolarHBondContact O-N 3.27Å; E437-L439 VanDerWaalsContact C-N 3.29Å; E437-L439 PolarHBondContact O-N 3.28Å; L439-L442 PolarHBondContact O-N 3.04Å; L439-Q443 WeakPolarHBondContact O-CB 3.45Å; L439-Q443 PolarHBondContact O-N 3.35Å; L439-T454 HydrophobicContact CD1-CG2 3.54Å; L439-T454 HydrophobicContact CD2-CG2 3.58Å; L439-T454 HydrophobicContact CG-CG2 4.02Å
440	E	89.9	Confident	88.6	Confident	101 Å²	101	85.2 Å²	85.2	47%	0.472	41%	0.414	S	S	.	.	H	α-helix	trans	-61.9	-48.7	173.8	-71.8	165.6	-172	0	0	111	Q436 E437 L442 Q443 E444	Q436-E440 WeakPolarHBondContact CG-OE1 3.27Å; Q436-E440 PolarHBondContact NE2-OE1 3.33Å; Q436-E440 PolarHBondContact O-N 3.12Å; E437-E440 PolarHBondContact O-N 3.2Å; E440-L442 PolarHBondContact O-N 2.74Å; E440-Q443 WeakPolarHBondContact O-CB 3.48Å; E440-Q443 PolarHBondContact O-N 3.36Å; E440-Q443 VanDerWaalsContact O-N 3.1Å; E440-E444 PolarHBondContact O-N 3.4Å
441	T	90	Very high	88.5	Confident	61 Å²	61	84.3 Å²	84.3	37%	0.374	42%	0.416	S	S	.	.	H	α-helix	trans	-64.8	-24.9	175.6	51.8	0	0	0	0	113.9	E437 K438 K445	E437-T441 WeakPolarHBondContact O-CB 3.49Å; E437-T441 VanDerWaalsContact O-CG2 3.3Å; E437-T441 WeakPolarHBondContact O-CG2 3.46Å; E437-T441 PolarHBondContact O-N 2.71Å; E437-T441 PolarHBondContact O-OG1 3.08Å; K438-T441 VanDerWaalsContact CA-OG1 3.27Å; K438-T441 WeakPolarHBondContact CA-OG1 3.38Å; K438-T441 PolarHBondContact O-OG1 3.14Å; T441-K445 WeakPolarHBondContact O-CG 3.41Å
442	L	86.6	Confident	88.6	Confident	51 Å²	51	82.3 Å²	82.3	27%	0.267	42%	0.415	S	S	.	.	H	α-helix	trans	-79.3	-36.1	172.1	-81.8	170.9	0	0	0	111.8	F415 K438 L439 E440 E444 K445 D446 A450	F415-L442 HydrophobicContact CE2-CD1 4.01Å; F415-L442 HydrophobicContact CZ-CD1 3.55Å; K438-L442 WeakPolarHBondContact O-CB 3.41Å; K438-L442 WeakPolarHBondContact O-CD1 3.37Å; K438-L442 WeakPolarHBondContact O-CG 3.24Å; K438-L442 PolarHBondContact O-N 2.94Å; L439-L442 PolarHBondContact O-N 3.04Å; E440-L442 PolarHBondContact O-N 2.74Å; L442-E444 VanDerWaalsContact C-N 3.35Å; L442-K445 PolarHBondContact O-N 3.43Å; L442-D446 CarbonylContact O-C 3.54Å; L442-D446 PolarHBondContact O-N 2.89Å; L442-A450 HydrophobicContact CB-CB 4.27Å
443	Q	85.9	Confident	88.5	Confident	124 Å²	124	83.3 Å²	83.3	58%	0.579	42%	0.421	S	S	*	.	H	α-helix	trans	-67	-37.8	178	-174.7	175	-3.3	0	0	111.6	L439 E440 A450	L439-Q443 WeakPolarHBondContact O-CB 3.45Å; L439-Q443 PolarHBondContact O-N 3.35Å; E440-Q443 WeakPolarHBondContact O-CB 3.48Å; E440-Q443 PolarHBondContact O-N 3.36Å; E440-Q443 VanDerWaalsContact O-N 3.1Å; Q443-A450 HydrophobicContact CB-CB 3.99Å
444	E	87.2	Confident	88.5	Confident	167 Å²	167	81.6 Å²	81.6	78%	0.78	42%	0.417	S	S	*	.	H	α-helix	trans	-65.5	-37.2	174.8	-172.3	178	-168	0	0	112.5	E440 L442	E440-E444 PolarHBondContact O-N 3.4Å; L442-E444 VanDerWaalsContact C-N 3.35Å
445	K	89.6	Confident	88.6	Confident	161 Å²	161	85.7 Å²	85.7	70%	0.7	43%	0.429	S	S	*	.	H	α-helix	trans	-83.2	-48.8	-177.8	-68.9	178.9	-177.5	-172.1	0	113.6	T441 L442	T441-K445 WeakPolarHBondContact O-CG 3.41Å; L442-K445 PolarHBondContact O-N 3.43Å
446	D	90.5	Very high	88.7	Confident	65 Å²	65	91 Å²	91	35%	0.348	45%	0.453	S	S	.	.			trans	-145.7	88.4	-171.3	-77.5	-46.8	0	0	0	109.8	L442 A448 K449 A450	L442-D446 CarbonylContact O-C 3.54Å; L442-D446 PolarHBondContact O-N 2.89Å; D446-A448 VanDerWaalsContact C-N 3.3Å; D446-A448 PolarHBondContact O-N 3.38Å; D446-K449 HydrophobicContact CB-CB 3.9Å; D446-K449 HydrophobicContact CB-CD 3.93Å; D446-K449 HydrophobicContact CB-CG 4.01Å; D446-K449 PolarHBondContact O-N 2.91Å; D446-K449 VanDerWaalsContact O-N 3.12Å; D446-K449 IonicContact OD1-NZ 3.75Å; D446-K449 WeakPolarHBondContact OD2-CD 3.43Å; D446-K449 WeakPolarHBondContact OD2-CE 3.47Å; D446-K449 IonicContact OD2-NZ 3.96Å; D446-K449 PolarHBondContact OD2-NZ 2.88Å; D446-A450 PolarHBondContact O-N 3.26Å
447	P	89.7	Confident	88.6	Confident	80 Å²	80	87.7 Å²	87.7	52%	0.519	44%	0.438	S	S	.	.	H	α-helix	trans	-58.2	-40.4	-175.5	21	-32.3	0	0	0	112.5	K449 A450 E451	P447-K449 PolarHBondContact O-N 2.83Å; P447-A450 WeakPolarHBondContact O-CB 3.32Å; P447-A450 PolarHBondContact O-N 2.91Å; P447-E451 WeakPolarHBondContact O-CG 3.41Å; P447-E451 PolarHBondContact O-N 3.41Å
448	A	88.9	Confident	88.6	Confident	75 Å²	75	91.7 Å²	91.7	62%	0.62	45%	0.448	S	S	*	.	H	α-helix	trans	-63.4	-38.2	178.4	0	0	0	0	0	113.3	D446 A452	D446-A448 VanDerWaalsContact C-N 3.3Å; D446-A448 PolarHBondContact O-N 3.38Å; A448-A452 PolarHBondContact O-N 2.9Å; A448-A452 VanDerWaalsContact O-N 3.09Å
449	K	86.1	Confident	88.8	Confident	123 Å²	123	97 Å²	97	54%	0.535	47%	0.466	S	S	.	.	H	α-helix	trans	-72.3	-38	176.7	-67.1	-178.1	-165.8	150.2	0	110.9	D446 P447 A452 V453	D446-K449 HydrophobicContact CB-CB 3.9Å; D446-K449 HydrophobicContact CB-CD 3.93Å; D446-K449 HydrophobicContact CB-CG 4.01Å; D446-K449 PolarHBondContact O-N 2.91Å; D446-K449 VanDerWaalsContact O-N 3.12Å; D446-K449 IonicContact OD1-NZ 3.75Å; D446-K449 WeakPolarHBondContact OD2-CD 3.43Å; D446-K449 WeakPolarHBondContact OD2-CE 3.47Å; D446-K449 IonicContact OD2-NZ 3.96Å; D446-K449 PolarHBondContact OD2-NZ 2.88Å; P447-K449 PolarHBondContact O-N 2.83Å; K449-A452 PolarHBondContact O-N 2.91Å; K449-V453 WeakPolarHBondContact O-CB 3.43Å; K449-V453 VanDerWaalsContact O-CG2 3.29Å; K449-V453 WeakPolarHBondContact O-CG2 3.27Å; K449-V453 PolarHBondContact O-N 3.36Å
450	A	86.3	Confident	88.8	Confident	4 Å²	4	98.9 Å²	98.9	3%	0.033	48%	0.476	C	S	.	.	H	α-helix	trans	-59.9	-47	175.2	0	0	0	0	0	110.9	L442 Q443 D446 P447 A452 V453 T454	L442-A450 HydrophobicContact CB-CB 4.27Å; Q443-A450 HydrophobicContact CB-CB 3.99Å; D446-A450 PolarHBondContact O-N 3.26Å; P447-A450 WeakPolarHBondContact O-CB 3.32Å; P447-A450 PolarHBondContact O-N 2.91Å; A450-A452 PolarHBondContact O-N 3.48Å; A450-V453 CarbonylContact O-C 3.42Å; A450-V453 PolarHBondContact O-N 3.17Å; A450-V453 VanDerWaalsContact O-N 3.15Å; A450-T454 WeakPolarHBondContact O-CG2 3.37Å; A450-T454 PolarHBondContact O-N 2.92Å; A450-T454 PolarHBondContact O-OG1 3.2Å
451	E	87.4	Confident	88.8	Confident	135 Å²	135	94.5 Å²	94.5	63%	0.631	46%	0.457	S	S	*	.	H	α-helix	trans	-60	-41.9	174.6	-73.2	178.4	-171.7	0	0	113	P447 V453 T454 R455	P447-E451 WeakPolarHBondContact O-CG 3.41Å; P447-E451 PolarHBondContact O-N 3.41Å; E451-V453 VanDerWaalsContact C-N 3.31Å; E451-V453 PolarHBondContact O-N 2.88Å; E451-T454 WeakPolarHBondContact CA-OG1 3.26Å; E451-T454 PolarHBondContact O-N 2.92Å; E451-T454 PolarHBondContact O-OG1 3.49Å; E451-R455 VanDerWaalsContact O-CB 3.24Å; E451-R455 WeakPolarHBondContact O-CB 3.27Å; E451-R455 PolarHBondContact O-N 3.22Å
452	A	90	Very high	88.8	Confident	40 Å²	40	94 Å²	94	33%	0.331	46%	0.459	S	S	.	.	H	α-helix	trans	-62.9	-38.8	175.3	0	0	0	0	0	112	A448 K449 A450 K456	A448-A452 PolarHBondContact O-N 2.9Å; A448-A452 VanDerWaalsContact O-N 3.09Å; K449-A452 PolarHBondContact O-N 2.91Å; A450-A452 PolarHBondContact O-N 3.48Å; A452-K456 WeakPolarHBondContact O-CG 3.43Å; A452-K456 PolarHBondContact O-N 2.89Å; A452-K456 VanDerWaalsContact O-N 3.09Å
453	V	88.5	Confident	88.9	Confident	39 Å²	39	96.7 Å²	96.7	24%	0.236	47%	0.47	C	S	.	.	H	α-helix	trans	-72.6	-43.4	178	171.7	0	0	0	0	111.4	F415 K449 A450 E451 R455 K456 I457	F415-V453 HydrophobicContact CD1-CG1 4.23Å; F415-V453 HydrophobicContact CD2-CG1 4.47Å; F415-V453 HydrophobicContact CE1-CG1 4.31Å; F415-V453 HydrophobicContact CG-CG1 4.31Å; F415-V453 HydrophobicContact CZ-CG1 4.48Å; K449-V453 WeakPolarHBondContact O-CB 3.43Å; K449-V453 VanDerWaalsContact O-CG2 3.29Å; K449-V453 WeakPolarHBondContact O-CG2 3.27Å; K449-V453 PolarHBondContact O-N 3.36Å; A450-V453 CarbonylContact O-C 3.42Å; A450-V453 PolarHBondContact O-N 3.17Å; A450-V453 VanDerWaalsContact O-N 3.15Å; E451-V453 VanDerWaalsContact C-N 3.31Å; E451-V453 PolarHBondContact O-N 2.88Å; V453-R455 VanDerWaalsContact C-N 3.32Å; V453-R455 PolarHBondContact O-N 3.26Å; V453-K456 PolarHBondContact O-N 3.4Å; V453-I457 HydrophobicContact CG1-CD1 3.7Å; V453-I457 HydrophobicContact CG1-CG1 4.33Å; V453-I457 WeakPolarHBondContact O-CB 3.04Å; V453-I457 VanDerWaalsContact O-CG1 3.26Å; V453-I457 WeakPolarHBondContact O-CG1 3.43Å; V453-I457 PolarHBondContact O-N 2.73Å
454	T	88.2	Confident	88.8	Confident	57 Å²	57	94.1 Å²	94.1	35%	0.35	46%	0.455	S	S	.	.	H	α-helix	trans	-60.7	-43.3	174.9	56.1	0	0	0	0	111	L439 A450 E451 K456 I457 R458	L439-T454 HydrophobicContact CD1-CG2 3.54Å; L439-T454 HydrophobicContact CD2-CG2 3.58Å; L439-T454 HydrophobicContact CG-CG2 4.02Å; A450-T454 WeakPolarHBondContact O-CG2 3.37Å; A450-T454 PolarHBondContact O-N 2.92Å; A450-T454 PolarHBondContact O-OG1 3.2Å; E451-T454 WeakPolarHBondContact CA-OG1 3.26Å; E451-T454 PolarHBondContact O-N 2.92Å; E451-T454 PolarHBondContact O-OG1 3.49Å; T454-K456 PolarHBondContact O-N 3.49Å; T454-I457 PolarHBondContact O-N 2.85Å; T454-R458 WeakPolarHBondContact O-CB 3.45Å; T454-R458 PolarHBondContact O-N 3.27Å
455	R	91.4	Very high	88.8	Confident	166 Å²	166	92.6 Å²	92.6	63%	0.626	44%	0.442	S	S	*	.	H	α-helix	trans	-58.2	-49.2	175.8	-171.8	172.1	69	152.3	-0.2	110.9	E451 V453 I457 R458 W459	E451-R455 VanDerWaalsContact O-CB 3.24Å; E451-R455 WeakPolarHBondContact O-CB 3.27Å; E451-R455 PolarHBondContact O-N 3.22Å; V453-R455 VanDerWaalsContact C-N 3.32Å; V453-R455 PolarHBondContact O-N 3.26Å; R455-I457 PolarHBondContact O-N 2.97Å; R455-R458 WeakPolarHBondContact O-CB 3.38Å; R455-R458 PolarHBondContact O-N 3.02Å; R455-W459 PolarHBondContact O-N 3.46Å; R455-W459 VanDerWaalsContact O-N 3.08Å
456	K	90.4	Very high	88.7	Confident	144 Å²	144	89.2 Å²	89.2	63%	0.626	44%	0.444	S	S	*	.	H	α-helix	trans	-59.9	-46	176.1	-76.1	-179.9	-179.2	-177.7	0	112.3	A452 V453 T454 R458 W459 D460	A452-K456 WeakPolarHBondContact O-CG 3.43Å; A452-K456 PolarHBondContact O-N 2.89Å; A452-K456 VanDerWaalsContact O-N 3.09Å; V453-K456 PolarHBondContact O-N 3.4Å; T454-K456 PolarHBondContact O-N 3.49Å; K456-R458 VanDerWaalsContact C-N 3.28Å; K456-R458 PolarHBondContact O-N 3.07Å; K456-W459 PolarHBondContact O-N 3.26Å; K456-D460 WeakPolarHBondContact O-CB 3.44Å; K456-D460 PolarHBondContact O-N 3.01Å
457	I	88.6	Confident	88.2	Confident	28 Å²	28	91.3 Å²	91.3	14%	0.144	45%	0.451	C	S	.	.	H	α-helix	trans	-59.7	-41.7	177.6	-70.3	166.7	0	0	0	111	F415 R435 V453 T454 R455 T461	F415-I457 HydrophobicContact CB-CD1 4.17Å; F415-I457 HydrophobicContact CB-CG1 4.38Å; F415-I457 HydrophobicContact CD1-CD1 3.61Å; F415-I457 HydrophobicContact CE1-CD1 4.38Å; F415-I457 HydrophobicContact CG-CD1 4.2Å; R435-I457 VanDerWaalsContact NH2-CG2 3.34Å; V453-I457 HydrophobicContact CG1-CD1 3.7Å; V453-I457 HydrophobicContact CG1-CG1 4.33Å; V453-I457 WeakPolarHBondContact O-CB 3.04Å; V453-I457 VanDerWaalsContact O-CG1 3.26Å; V453-I457 WeakPolarHBondContact O-CG1 3.43Å; V453-I457 PolarHBondContact O-N 2.73Å; T454-I457 PolarHBondContact O-N 2.85Å; R455-I457 PolarHBondContact O-N 2.97Å; I457-T461 VanDerWaalsContact O-CB 3.23Å; I457-T461 WeakPolarHBondContact O-CB 3.4Å; I457-T461 PolarHBondContact O-N 2.72Å; I457-T461 PolarHBondContact O-OG1 3.02Å
458	R	89.4	Confident	87.8	Confident	203 Å²	203	90.1 Å²	90.1	77%	0.766	45%	0.454	S	S	*	.	H	α-helix	trans	-62.2	-45.5	179.5	-174.2	176.8	178.4	179.5	-1.1	111.2	T454 R455 K456 T461 A462	T454-R458 WeakPolarHBondContact O-CB 3.45Å; T454-R458 PolarHBondContact O-N 3.27Å; R455-R458 WeakPolarHBondContact O-CB 3.38Å; R455-R458 PolarHBondContact O-N 3.02Å; K456-R458 VanDerWaalsContact C-N 3.28Å; K456-R458 PolarHBondContact O-N 3.07Å; R458-T461 PolarHBondContact O-N 2.91Å; R458-A462 WeakPolarHBondContact O-CB 3.33Å; R458-A462 PolarHBondContact O-N 3.35Å
459	W	91.7	Very high	87.6	Confident	182 Å²	182	88.6 Å²	88.6	69%	0.689	44%	0.437	S	S	*	.	H	α-helix	trans	-66.2	-48.3	176.4	-73.9	112.6	0	0	0	112.6	R455 K456 T461 A462 E463	R455-W459 PolarHBondContact O-N 3.46Å; R455-W459 VanDerWaalsContact O-N 3.08Å; K456-W459 PolarHBondContact O-N 3.26Å; W459-T461 PolarHBondContact O-N 3.18Å; W459-A462 PolarHBondContact O-N 2.83Å; W459-A462 VanDerWaalsContact O-N 3.1Å; W459-E463 WeakPolarHBondContact O-CB 3.46Å; W459-E463 PolarHBondContact O-N 3.46Å
460	D	89.1	Confident	87.7	Confident	70 Å²	70	91 Å²	91	37%	0.374	45%	0.447	S	S	.	.	H	α-helix	trans	-57.5	-39.8	176	-77.3	-0.3	0	0	0	111.5	V417 K456 R464	V417-D460 HydrophobicContact CG1-CB 3.94Å; V417-D460 HydrophobicContact CG2-CB 4.03Å; K456-D460 WeakPolarHBondContact O-CB 3.44Å; K456-D460 PolarHBondContact O-N 3.01Å; D460-R464 WeakPolarHBondContact O-CB 3.21Å; D460-R464 VanDerWaalsContact O-CG 3.27Å; D460-R464 WeakPolarHBondContact O-CG 3.24Å; D460-R464 PolarHBondContact O-N 3.28Å
461	T	88.5	Confident	87.7	Confident	10 Å²	10	91.7 Å²	91.7	6%	0.061	45%	0.45	C	S	.	.	H	α-helix	trans	-68	-41.4	178.7	-57.5	0	0	0	0	111	V417 I457 R458 W459 R465 I471	V417-T461 VanDerWaalsContact CG1-OG1 3.25Å; V417-T461 WeakPolarHBondContact CG1-OG1 3.41Å; I457-T461 VanDerWaalsContact O-CB 3.23Å; I457-T461 WeakPolarHBondContact O-CB 3.4Å; I457-T461 PolarHBondContact O-N 2.72Å; I457-T461 PolarHBondContact O-OG1 3.02Å; R458-T461 PolarHBondContact O-N 2.91Å; W459-T461 PolarHBondContact O-N 3.18Å; T461-R465 WeakPolarHBondContact O-CB 3.4Å; T461-R465 VanDerWaalsContact O-CG 3.22Å; T461-R465 WeakPolarHBondContact O-CG 3.5Å; T461-R465 PolarHBondContact O-N 2.73Å; T461-I471 HydrophobicContact CG2-CD1 4.01Å
462	A	91.2	Very high	87.7	Confident	50 Å²	50	87.8 Å²	87.8	41%	0.413	43%	0.431	S	S	.	.	H	α-helix	trans	-65	-47.2	176.8	0	0	0	0	0	111.4	R458 W459 R464 R465 A466	R458-A462 WeakPolarHBondContact O-CB 3.33Å; R458-A462 PolarHBondContact O-N 3.35Å; W459-A462 PolarHBondContact O-N 2.83Å; W459-A462 VanDerWaalsContact O-N 3.1Å; A462-R464 PolarHBondContact O-N 3.14Å; A462-R465 PolarHBondContact O-N 2.98Å; A462-A466 WeakPolarHBondContact O-CB 3.43Å; A462-A466 PolarHBondContact O-N 2.93Å
463	E	87.6	Confident	87.5	Confident	107 Å²	107	87.2 Å²	87.2	50%	0.5	42%	0.423	S	S	.	.	H	α-helix	trans	-59.4	-47.4	179.2	-169.6	-167.9	170.7	0	0	111.4	W459 R465 A466 Q467	W459-E463 WeakPolarHBondContact O-CB 3.46Å; W459-E463 PolarHBondContact O-N 3.46Å; E463-R465 PolarHBondContact O-N 3.31Å; E463-A466 WeakPolarHBondContact O-CB 3.46Å; E463-A466 PolarHBondContact O-N 2.81Å; E463-A466 VanDerWaalsContact O-N 3.16Å; E463-Q467 WeakPolarHBondContact O-CG 3.41Å; E463-Q467 PolarHBondContact O-N 3.36Å; E463-Q467 PolarHBondContact OE1-NE2 2.93Å
464	R	84.6	Confident	87.5	Confident	70 Å²	70	89.4 Å²	89.4	26%	0.264	43%	0.433	S	S	.	.	H	α-helix	trans	-68.8	-33.3	179.1	-69.3	-50.7	-171.7	102	16.5	113.2	V417 D418 D460 A462 A466 Q467 G468 V469 I471	V417-R464 HydrophobicContact CG2-CG 3.78Å; D418-R464 IonicContact OD1-CZ 2.65Å; D418-R464 IonicContact OD1-NE 2.95Å; D418-R464 IonicContact OD1-NH1 3.49Å; D418-R464 PolarHBondContact OD1-NH1 3.18Å; D418-R464 IonicContact OD1-NH2 3.45Å; D418-R464 PolarHBondContact OD1-NH2 2.81Å; D418-R464 IonicContact OD2-CZ 3.29Å; D418-R464 IonicContact OD2-NH1 3.18Å; D418-R464 PolarHBondContact OD2-NH1 3.29Å; D418-R464 IonicContact OD2-NH2 3.64Å; D418-R464 PolarHBondContact OD2-NH2 2.97Å; D460-R464 WeakPolarHBondContact O-CB 3.21Å; D460-R464 VanDerWaalsContact O-CG 3.27Å; D460-R464 WeakPolarHBondContact O-CG 3.24Å; D460-R464 PolarHBondContact O-N 3.28Å; A462-R464 PolarHBondContact O-N 3.14Å; R464-A466 VanDerWaalsContact C-N 3.33Å; R464-Q467 PolarHBondContact O-N 3.19Å; R464-G468 PolarHBondContact O-N 3.1Å; R464-V469 HydrophobicContact CB-CB 4.36Å; R464-V469 VanDerWaalsContact O-CB 3.29Å; R464-V469 WeakPolarHBondContact O-CB 3.42Å; R464-V469 PolarHBondContact O-N 2.89Å; R464-I471 HydrophobicContact CB-CD1 3.53Å; R464-I471 HydrophobicContact CB-CG1 4.44Å; R464-I471 HydrophobicContact CG-CD1 4.44Å
465	R	87.5	Confident	87.6	Confident	136 Å²	136	89.5 Å²	89.5	51%	0.513	43%	0.434	S	S	.	.	H	α-helix	trans	-65.4	-39.1	171	-76	174.9	-171.6	167.8	5.6	110.9	T461 A462 E463 Q467 G468 I471 D473	T461-R465 WeakPolarHBondContact O-CB 3.4Å; T461-R465 VanDerWaalsContact O-CG 3.22Å; T461-R465 WeakPolarHBondContact O-CG 3.5Å; T461-R465 PolarHBondContact O-N 2.73Å; A462-R465 PolarHBondContact O-N 2.98Å; E463-R465 PolarHBondContact O-N 3.31Å; R465-Q467 VanDerWaalsContact C-N 3.33Å; R465-G468 WeakPolarHBondContact O-CA 3.41Å; R465-G468 PolarHBondContact O-N 3.32Å; R465-I471 HydrophobicContact CG-CD1 4.39Å; R465-D473 IonicContact NH2-OD2 3.96Å
466	A	87.3	Confident	87.6	Confident	90 Å²	90	84.8 Å²	84.8	74%	0.744	43%	0.427	S	S	*	.	H	α-helix	trans	-64.6	-36.2	174.2	0	0	0	0	0	112.2	A462 E463 R464 G468	A462-A466 WeakPolarHBondContact O-CB 3.43Å; A462-A466 PolarHBondContact O-N 2.93Å; E463-A466 WeakPolarHBondContact O-CB 3.46Å; E463-A466 PolarHBondContact O-N 2.81Å; E463-A466 VanDerWaalsContact O-N 3.16Å; R464-A466 VanDerWaalsContact C-N 3.33Å; A466-G468 PolarHBondContact O-N 3.2Å; A466-G468 VanDerWaalsContact O-N 3.1Å
467	Q	80.3	Confident	87.6	Confident	108 Å²	108	82.6 Å²	82.6	51%	0.505	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	1.9	169.9	-66.4	172.1	8	0	0	113.7	E463 R464 R465 V469	E463-Q467 WeakPolarHBondContact O-CG 3.41Å; E463-Q467 PolarHBondContact O-N 3.36Å; E463-Q467 PolarHBondContact OE1-NE2 2.93Å; R464-Q467 PolarHBondContact O-N 3.19Å; R465-Q467 VanDerWaalsContact C-N 3.33Å; Q467-V469 VanDerWaalsContact C-N 3.35Å; Q467-V469 HydrophobicContact CB-CG2 4.43Å; Q467-V469 PolarHBondContact O-N 3.03Å
468	G	81.8	Confident	87.6	Confident	56 Å²	56	81.4 Å²	81.4	58%	0.577	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	6.5	178.9	0	0	0	0	0	115	R464 R465 A466 K470	R464-G468 PolarHBondContact O-N 3.1Å; R465-G468 WeakPolarHBondContact O-CA 3.41Å; R465-G468 PolarHBondContact O-N 3.32Å; A466-G468 PolarHBondContact O-N 3.2Å; A466-G468 VanDerWaalsContact O-N 3.1Å; G468-K470 PolarHBondContact O-N 2.8Å
469	V	84.4	Confident	87.7	Confident	42 Å²	42	77.5 Å²	77.5	26%	0.255	40%	0.404	S	S	.	.			trans	-75.8	119.4	179.3	-175.3	0	0	0	0	109.9	V421 R464 Q467 I471	V421-V469 HydrophobicContact CG1-CG1 4.19Å; V421-V469 HydrophobicContact CG2-CG1 3.55Å; R464-V469 HydrophobicContact CB-CB 4.36Å; R464-V469 VanDerWaalsContact O-CB 3.29Å; R464-V469 WeakPolarHBondContact O-CB 3.42Å; R464-V469 PolarHBondContact O-N 2.89Å; Q467-V469 VanDerWaalsContact C-N 3.35Å; Q467-V469 HydrophobicContact CB-CG2 4.43Å; Q467-V469 PolarHBondContact O-N 3.03Å; V469-I471 HydrophobicContact CG1-CG1 4.37Å; V469-I471 PolarHBondContact O-N 3.27Å
470	K	87	Confident	87.7	Confident	174 Å²	174	74.8 Å²	74.8	76%	0.757	40%	0.397	S	S	*	.			trans	-76.8	82.7	-179.9	-64	-177.3	-178.2	179.9	0	111.8	G468	G468-K470 PolarHBondContact O-N 2.8Å
471	I	87.2	Confident	87.8	Confident	19 Å²	19	72 Å²	72	10%	0.097	39%	0.385	C	S	.	.			trans	-72.9	128.7	175.4	-57.9	174.2	0	0	0	109.9	V417 L420 V421 T461 R464 R465 V469 D473	V417-I471 HydrophobicContact CB-CD1 4.11Å; V417-I471 HydrophobicContact CG2-CD1 4.46Å; L420-I471 HydrophobicContact CB-CG2 4.22Å; V421-I471 HydrophobicContact CG2-CG1 4.44Å; T461-I471 HydrophobicContact CG2-CD1 4.01Å; R464-I471 HydrophobicContact CB-CD1 3.53Å; R464-I471 HydrophobicContact CB-CG1 4.44Å; R464-I471 HydrophobicContact CG-CD1 4.44Å; R465-I471 HydrophobicContact CG-CD1 4.39Å; V469-I471 HydrophobicContact CG1-CG1 4.37Å; V469-I471 PolarHBondContact O-N 3.27Å; I471-D473 WeakPolarHBondContact CG2-OD1 3.14Å; I471-D473 WeakPolarHBondContact CG2-OD2 3.45Å
472	K	86.8	Confident	87.8	Confident	52 Å²	52	74.1 Å²	74.1	23%	0.226	40%	0.396	C	S	.	.			trans	-113.8	78.8	-177.5	-64.8	-178.8	-179.9	175.2	0	111.1	L420 G422 Y425 L428 L478	L420-K472 PolarHBondContact O-N 3.22Å; L420-K472 VanDerWaalsContact O-N 3.14Å; G422-K472 PolarHBondContact O-NZ 3.36Å; Y425-K472 PolarHBondContact OH-NZ 2.88Å; L428-K472 HydrophobicContact CD1-CD 4.21Å; K472-L478 HydrophobicContact CB-CD2 3.98Å; K472-L478 HydrophobicContact CD-CD2 4.39Å
473	D	86.3	Confident	87.8	Confident	29 Å²	29	78.2 Å²	78.2	16%	0.155	40%	0.404	C	S	.	.			trans	-93	-22.6	-176.9	-58.6	-36.9	0	0	0	113.4	L420 V432 R465 I471 P475	L420-D473 WeakPolarHBondContact CB-OD1 3.5Å; L420-D473 VanDerWaalsContact CD2-OD1 3.24Å; L420-D473 WeakPolarHBondContact CD2-OD1 3.37Å; V432-D473 VanDerWaalsContact CG1-O 3.3Å; V432-D473 WeakPolarHBondContact CG1-O 3.37Å; V432-D473 WeakPolarHBondContact CG2-O 3.31Å; R465-D473 IonicContact NH2-OD2 3.96Å; I471-D473 WeakPolarHBondContact CG2-OD1 3.14Å; I471-D473 WeakPolarHBondContact CG2-OD2 3.45Å; D473-P475 VanDerWaalsContact O-CD 3.27Å; D473-P475 WeakPolarHBondContact O-CD 3.32Å
474	D	88.7	Confident	88	Confident	85 Å²	85	82.2 Å²	82.2	46%	0.455	42%	0.415	S	S	.	.			trans	-73.2	114.4	-173.3	-59	-36.4	0	0	0	112.2	S476 L477 L478	D474-S476 PolarHBondContact O-N 2.59Å; D474-L477 HydrophobicContact CB-CB 4.11Å; D474-L477 HydrophobicContact CB-CD1 3.99Å; D474-L477 HydrophobicContact CB-CG 3.96Å; D474-L477 PolarHBondContact O-N 3.01Å; D474-L477 WeakPolarHBondContact OD2-CD1 3.42Å; D474-L478 WeakPolarHBondContact O-CG 2.97Å; D474-L478 PolarHBondContact O-N 3.44Å; D474-L478 VanDerWaalsContact O-N 3.09Å
475	P	89.3	Confident	88.3	Confident	58 Å²	58	84.6 Å²	84.6	38%	0.377	42%	0.424	S	S	.	.	H	α-helix	trans	-64.1	-31.8	-177.2	25.2	-33.3	0	0	0	111.9	L429 V432 D473 L478 K479	L429-P475 HydrophobicContact CD1-CB 3.79Å; V432-P475 HydrophobicContact CG1-CB 4.34Å; D473-P475 VanDerWaalsContact O-CD 3.27Å; D473-P475 WeakPolarHBondContact O-CD 3.32Å; P475-L478 PolarHBondContact O-N 2.97Å; P475-K479 WeakPolarHBondContact O-CB 3.28Å; P475-K479 WeakPolarHBondContact O-CG 3.36Å; P475-K479 PolarHBondContact O-N 3.32Å
476	S	91.3	Very high	88.4	Confident	68 Å²	68	82.7 Å²	82.7	48%	0.476	42%	0.423	S	S	.	.	H	α-helix	trans	-64.8	-43.5	178.2	69.7	0	0	0	0	112.1	D474 K479 K480	D474-S476 PolarHBondContact O-N 2.59Å; S476-K479 PolarHBondContact O-N 2.91Å; S476-K480 WeakPolarHBondContact O-CB 3.37Å; S476-K480 WeakPolarHBondContact O-CG 3.43Å; S476-K480 PolarHBondContact O-N 3.25Å
477	L	90.7	Very high	88.7	Confident	97 Å²	97	84 Å²	84	51%	0.508	41%	0.412	S	S	.	.	H	α-helix	trans	-70	-36.8	177.1	-65	-177.4	0	0	0	111.5	D474 K480 G481	D474-L477 HydrophobicContact CB-CB 4.11Å; D474-L477 HydrophobicContact CB-CD1 3.99Å; D474-L477 HydrophobicContact CB-CG 3.96Å; D474-L477 PolarHBondContact O-N 3.01Å; D474-L477 WeakPolarHBondContact OD2-CD1 3.42Å; L477-K480 HydrophobicContact CD2-CD 4.39Å; L477-K480 PolarHBondContact O-N 2.93Å; L477-G481 PolarHBondContact O-N 3.39Å
478	L	89.8	Confident	89.1	Confident	3 Å²	3	86.3 Å²	86.3	2%	0.016	42%	0.42	C	S	.	.	H	α-helix	trans	-63.2	-45.4	174.7	-68.2	175.9	0	0	0	111.6	Y425 L428 L429 V432 K472 D474 P475 G481 L482	Y425-L478 HydrophobicContact CD1-CD2 3.69Å; Y425-L478 HydrophobicContact CE1-CD2 4.29Å; L428-L478 HydrophobicContact CB-CD1 3.88Å; L428-L478 HydrophobicContact CB-CD2 3.83Å; L428-L478 HydrophobicContact CD1-CD2 3.96Å; L429-L478 HydrophobicContact CB-CD1 4.44Å; L429-L478 HydrophobicContact CD1-CB 4.31Å; V432-L478 HydrophobicContact CG2-CD1 3.8Å; K472-L478 HydrophobicContact CB-CD2 3.98Å; K472-L478 HydrophobicContact CD-CD2 4.39Å; D474-L478 WeakPolarHBondContact O-CG 2.97Å; D474-L478 PolarHBondContact O-N 3.44Å; D474-L478 VanDerWaalsContact O-N 3.09Å; P475-L478 PolarHBondContact O-N 2.97Å; L478-G481 PolarHBondContact O-N 2.96Å; L478-L482 WeakPolarHBondContact O-CB 3.41Å; L478-L482 PolarHBondContact O-N 3.39Å
479	K	90.3	Very high	89.5	Confident	122 Å²	122	90 Å²	90	53%	0.53	42%	0.42	S	S	.	.	H	α-helix	trans	-60.5	-45.4	173.7	-73.5	176.9	-178.2	180	0	111.4	L429 P475 S476 G481 L482 K483	L429-K479 HydrophobicContact CD1-CG 4.2Å; L429-K479 HydrophobicContact CD2-CG 3.93Å; P475-K479 WeakPolarHBondContact O-CB 3.28Å; P475-K479 WeakPolarHBondContact O-CG 3.36Å; P475-K479 PolarHBondContact O-N 3.32Å; S476-K479 PolarHBondContact O-N 2.91Å; K479-G481 PolarHBondContact O-N 3.4Å; K479-L482 PolarHBondContact O-N 3.01Å; K479-K483 PolarHBondContact O-N 3.43Å
480	K	92.8	Very high	89.8	Confident	124 Å²	124	92 Å²	92	54%	0.539	43%	0.427	S	S	.	.	H	α-helix	trans	-59.1	-45	174.3	-75.7	175.5	-179.5	177.8	0	111.9	S476 L477 L482 K483 R484	S476-K480 WeakPolarHBondContact O-CB 3.37Å; S476-K480 WeakPolarHBondContact O-CG 3.43Å; S476-K480 PolarHBondContact O-N 3.25Å; L477-K480 HydrophobicContact CD2-CD 4.39Å; L477-K480 PolarHBondContact O-N 2.93Å; K480-L482 VanDerWaalsContact C-N 3.33Å; K480-L482 PolarHBondContact O-N 3.01Å; K480-K483 PolarHBondContact O-N 3.08Å; K480-R484 WeakPolarHBondContact O-CG 3.39Å; K480-R484 PolarHBondContact O-N 3.03Å
481	G	89.8	Confident	90	Very high	11 Å²	11	92.2 Å²	92.2	11%	0.113	42%	0.423	C	S	.	.	H	α-helix	trans	-61.5	-39.3	177.1	0	0	0	0	0	112.9	L477 L478 K479 R485	L477-G481 PolarHBondContact O-N 3.39Å; L478-G481 PolarHBondContact O-N 2.96Å; K479-G481 PolarHBondContact O-N 3.4Å; G481-R485 PolarHBondContact O-N 3.28Å; G481-R485 VanDerWaalsContact O-N 3.13Å
482	L	89.5	Confident	90.1	Very high	56 Å²	56	94.2 Å²	94.2	29%	0.293	44%	0.439	S	S	.	.	H	α-helix	trans	-66.6	-46.2	175.8	-161	147.5	0	0	0	111.4	L478 K479 K480 R484 R485 L486	L478-L482 WeakPolarHBondContact O-CB 3.41Å; L478-L482 PolarHBondContact O-N 3.39Å; K479-L482 PolarHBondContact O-N 3.01Å; K480-L482 VanDerWaalsContact C-N 3.33Å; K480-L482 PolarHBondContact O-N 3.01Å; L482-R484 VanDerWaalsContact C-N 3.34Å; L482-R484 PolarHBondContact O-N 2.87Å; L482-R485 PolarHBondContact O-N 3.48Å; L482-R485 VanDerWaalsContact O-N 3.13Å; L482-L486 HydrophobicContact CD2-CD1 3.57Å; L482-L486 HydrophobicContact CD2-CG 4.01Å; L482-L486 WeakPolarHBondContact O-CG 3.29Å; L482-L486 PolarHBondContact O-N 3.43Å
483	K	91.4	Very high	90.2	Very high	135 Å²	135	100.6 Å²	100.6	59%	0.587	46%	0.462	S	S	*	.	H	α-helix	trans	-58	-43.4	175.2	-171.6	174	-175.9	173.3	0	112.2	K479 K480 R485 L486 K487	K479-K483 PolarHBondContact O-N 3.43Å; K480-K483 PolarHBondContact O-N 3.08Å; K483-R485 PolarHBondContact O-N 3.29Å; K483-L486 PolarHBondContact O-N 3.42Å; K483-K487 PolarHBondContact O-N 2.92Å
484	R	92	Very high	90.5	Very high	192 Å²	192	105.4 Å²	105.4	73%	0.725	48%	0.481	S	S	*	.	H	α-helix	trans	-59.3	-44.3	174.9	-73.3	177.4	-177.9	-179	0.7	111.8	K480 L482 K488	K480-R484 WeakPolarHBondContact O-CG 3.39Å; K480-R484 PolarHBondContact O-N 3.03Å; L482-R484 VanDerWaalsContact C-N 3.34Å; L482-R484 PolarHBondContact O-N 2.87Å; R484-K488 PolarHBondContact O-N 3.12Å; R484-K488 VanDerWaalsContact O-N 3.07Å
485	R	90.3	Very high	90.7	Very high	119 Å²	119	106.7 Å²	106.7	45%	0.449	48%	0.484	S	S	.	.	H	α-helix	trans	-65	-40.4	177.2	-76.3	-177.4	70.9	-179.1	-1	112.6	H423 Y425 G481 L482 K483 K488 K489	H423-R485 PolarHBondContact O-NH1 2.71Å; Y425-R485 HydrophobicContact CE2-CG 4.47Å; G481-R485 PolarHBondContact O-N 3.28Å; G481-R485 VanDerWaalsContact O-N 3.13Å; L482-R485 PolarHBondContact O-N 3.48Å; L482-R485 VanDerWaalsContact O-N 3.13Å; K483-R485 PolarHBondContact O-N 3.29Å; R485-K488 PolarHBondContact O-N 3.05Å; R485-K489 WeakPolarHBondContact O-CG 3.35Å; R485-K489 PolarHBondContact O-N 3.11Å
486	L	89.8	Confident	90.4	Very high	97 Å²	97	111.7 Å²	111.7	51%	0.508	50%	0.496	S	S	.	.	H	α-helix	trans	-64.9	-47.1	177.2	-69.7	179.4	0	0	0	111.5	L482 K483 K488 K489 E490	L482-L486 HydrophobicContact CD2-CD1 3.57Å; L482-L486 HydrophobicContact CD2-CG 4.01Å; L482-L486 WeakPolarHBondContact O-CG 3.29Å; L482-L486 PolarHBondContact O-N 3.43Å; K483-L486 PolarHBondContact O-N 3.42Å; L486-K488 VanDerWaalsContact C-N 3.29Å; L486-K488 PolarHBondContact O-N 3.08Å; L486-K489 WeakPolarHBondContact O-CB 3.34Å; L486-K489 PolarHBondContact O-N 3.48Å; L486-K489 VanDerWaalsContact O-N 3.1Å; L486-E490 PolarHBondContact O-N 3.47Å
487	K	93.1	Very high	90.4	Very high	117 Å²	117	111.2 Å²	111.2	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-56.6	-41.6	174.7	-75.6	-170.2	173.8	-167.9	0	112.4	K483 E490 R491	K483-K487 PolarHBondContact O-N 2.92Å; K487-E490 PolarHBondContact O-N 2.96Å; K487-R491 WeakPolarHBondContact O-CG 3.42Å; K487-R491 PolarHBondContact O-N 3.47Å
488	K	88.9	Confident	90.5	Very high	156 Å²	156	112.9 Å²	112.9	68%	0.678	50%	0.501	S	S	*	.	H	α-helix	trans	-63	-44	176.4	-170.8	171.8	-177.7	172.3	0	111.8	R484 R485 L486 E490 R491 S492	R484-K488 PolarHBondContact O-N 3.12Å; R484-K488 VanDerWaalsContact O-N 3.07Å; R485-K488 PolarHBondContact O-N 3.05Å; L486-K488 VanDerWaalsContact C-N 3.29Å; L486-K488 PolarHBondContact O-N 3.08Å; K488-E490 VanDerWaalsContact C-N 3.34Å; K488-E490 PolarHBondContact O-N 3.49Å; K488-R491 PolarHBondContact O-N 2.78Å; K488-S492 PolarHBondContact O-N 2.99Å; K488-S492 PolarHBondContact O-OG 3.37Å
489	K	89.9	Confident	90.6	Very high	133 Å²	133	119.3 Å²	119.3	58%	0.578	53%	0.525	S	S	*	.	H	α-helix	trans	-61.7	-41.3	176	-74.2	-178.7	175.9	-172.2	0	112.2	R485 L486 S492 R493	R485-K489 WeakPolarHBondContact O-CG 3.35Å; R485-K489 PolarHBondContact O-N 3.11Å; L486-K489 WeakPolarHBondContact O-CB 3.34Å; L486-K489 PolarHBondContact O-N 3.48Å; L486-K489 VanDerWaalsContact O-N 3.1Å; K489-S492 PolarHBondContact O-N 3.31Å; K489-R493 WeakPolarHBondContact O-CB 3.39Å; K489-R493 PolarHBondContact O-N 3.25Å
490	E	90.4	Very high	90.7	Very high	85 Å²	85	117.2 Å²	117.2	40%	0.397	52%	0.522	S	S	.	.	H	α-helix	trans	-64.1	-46.5	178.5	-166.6	-163.3	150.2	0	0	111.8	L486 K487 K488 S492 R493 K494	L486-E490 PolarHBondContact O-N 3.47Å; K487-E490 PolarHBondContact O-N 2.96Å; K488-E490 VanDerWaalsContact C-N 3.34Å; K488-E490 PolarHBondContact O-N 3.49Å; E490-S492 VanDerWaalsContact C-N 3.32Å; E490-S492 PolarHBondContact O-N 3.44Å; E490-R493 WeakPolarHBondContact O-CB 3.48Å; E490-R493 PolarHBondContact O-N 3.02Å; E490-R493 VanDerWaalsContact O-N 3.1Å; E490-K494 PolarHBondContact O-N 3.39Å; E490-K494 WeakPolarHBondContact OE1-CE 3.3Å; E490-K494 IonicContact OE1-NZ 2.75Å; E490-K494 PolarHBondContact OE1-NZ 3.25Å
491	R	91.6	Very high	90.5	Very high	179 Å²	179	113.9 Å²	113.9	68%	0.675	51%	0.514	S	S	*	.	H	α-helix	trans	-56.2	-46.9	173.5	-71.8	178.3	-179.1	-172.3	-1.9	111.4	K487 K488 R493 K494 Q495	K487-R491 WeakPolarHBondContact O-CG 3.42Å; K487-R491 PolarHBondContact O-N 3.47Å; K488-R491 PolarHBondContact O-N 2.78Å; R491-R493 VanDerWaalsContact C-N 3.31Å; R491-R493 PolarHBondContact O-N 2.9Å; R491-K494 PolarHBondContact O-N 2.86Å; R491-Q495 WeakPolarHBondContact O-CG 3.46Å; R491-Q495 PolarHBondContact O-N 3.02Å
492	S	89.1	Confident	90.7	Very high	60 Å²	60	115.4 Å²	115.4	42%	0.42	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-35.7	176.3	-61.6	0	0	0	0	112.9	K488 K489 E490 W496	K488-S492 PolarHBondContact O-N 2.99Å; K488-S492 PolarHBondContact O-OG 3.37Å; K489-S492 PolarHBondContact O-N 3.31Å; E490-S492 VanDerWaalsContact C-N 3.32Å; E490-S492 PolarHBondContact O-N 3.44Å; S492-W496 WeakPolarHBondContact O-CB 3.45Å; S492-W496 PolarHBondContact O-N 3.46Å
493	R	90	Very high	90.8	Very high	187 Å²	187	117.6 Å²	117.6	71%	0.706	54%	0.542	S	S	*	.	H	α-helix	trans	-67.3	-43.9	176.3	-169.6	178	73.8	178.9	3.2	111.6	K489 E490 R491 W496 A497	K489-R493 WeakPolarHBondContact O-CB 3.39Å; K489-R493 PolarHBondContact O-N 3.25Å; E490-R493 WeakPolarHBondContact O-CB 3.48Å; E490-R493 PolarHBondContact O-N 3.02Å; E490-R493 VanDerWaalsContact O-N 3.1Å; R491-R493 VanDerWaalsContact C-N 3.31Å; R491-R493 PolarHBondContact O-N 2.9Å; R493-W496 PolarHBondContact O-N 3.44Å; R493-A497 PolarHBondContact O-N 2.77Å
494	K	92.7	Very high	90.8	Very high	130 Å²	130	115.3 Å²	115.3	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-60	-51.7	175.8	-75.7	173.9	167	166.1	0	111.3	E490 R491 W496 A497 E498	E490-K494 PolarHBondContact O-N 3.39Å; E490-K494 WeakPolarHBondContact OE1-CE 3.3Å; E490-K494 IonicContact OE1-NZ 2.75Å; E490-K494 PolarHBondContact OE1-NZ 3.25Å; R491-K494 PolarHBondContact O-N 2.86Å; K494-W496 PolarHBondContact O-N 3.12Å; K494-A497 PolarHBondContact O-N 3.46Å; K494-A497 VanDerWaalsContact O-N 3.15Å; K494-E498 PolarHBondContact O-N 3.39Å
495	Q	91.6	Very high	90.8	Very high	111 Å²	111	113.4 Å²	113.4	52%	0.519	53%	0.526	S	S	.	.	H	α-helix	trans	-62.2	-28.4	176.2	-70.7	177.1	-13.7	0	0	113.4	R491 R499	R491-Q495 WeakPolarHBondContact O-CG 3.46Å; R491-Q495 PolarHBondContact O-N 3.02Å; Q495-R499 VanDerWaalsContact O-CG 3.3Å; Q495-R499 WeakPolarHBondContact O-CG 3.36Å; Q495-R499 PolarHBondContact O-N 2.93Å; Q495-R499 PolarHBondContact O-NE 2.99Å
496	W	83.4	Confident	90.9	Very high	163 Å²	163	110.1 Å²	110.1	62%	0.617	52%	0.524	S	S	*	.	H	α-helix	trans	-72.8	-46.2	173.3	-178	-94.1	0	0	0	111.7	S492 R493 K494 E498 R499 V500	S492-W496 WeakPolarHBondContact O-CB 3.45Å; S492-W496 PolarHBondContact O-N 3.46Å; R493-W496 PolarHBondContact O-N 3.44Å; K494-W496 PolarHBondContact O-N 3.12Å; W496-E498 VanDerWaalsContact C-N 3.34Å; W496-E498 PolarHBondContact O-N 3.36Å; W496-R499 PolarHBondContact O-N 2.87Å; W496-V500 WeakPolarHBondContact O-CG2 3.25Å; W496-V500 PolarHBondContact O-N 3.2Å
497	A	91.9	Very high	91	Very high	58 Å²	58	110.5 Å²	110.5	48%	0.479	52%	0.524	S	S	.	.	H	α-helix	trans	-60.6	-42.9	177.7	0	0	0	0	0	112	R493 K494 R499 V500 S501	R493-A497 PolarHBondContact O-N 2.77Å; K494-A497 PolarHBondContact O-N 3.46Å; K494-A497 VanDerWaalsContact O-N 3.15Å; A497-R499 VanDerWaalsContact C-N 3.34Å; A497-R499 PolarHBondContact O-N 3Å; A497-V500 PolarHBondContact O-N 3.08Å; A497-S501 PolarHBondContact O-N 3.05Å
498	E	92.2	Very high	90.9	Very high	132 Å²	132	109.4 Å²	109.4	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-58.4	-45.7	174.7	-173.9	176.7	-169.4	0	0	111.5	K494 W496 V500 S501 A502	K494-E498 PolarHBondContact O-N 3.39Å; W496-E498 VanDerWaalsContact C-N 3.34Å; W496-E498 PolarHBondContact O-N 3.36Å; E498-V500 PolarHBondContact O-N 3.4Å; E498-S501 PolarHBondContact O-N 3.26Å; E498-S501 PolarHBondContact O-OG 3.01Å; E498-A502 WeakPolarHBondContact O-CB 3.26Å; E498-A502 PolarHBondContact O-N 2.77Å
499	R	92.4	Very high	91.1	Very high	139 Å²	139	108.7 Å²	108.7	53%	0.525	52%	0.518	S	S	.	.	H	α-helix	trans	-61.5	-42.9	175.9	-77.1	-176.7	-74.4	172.3	-6.1	112.9	Q495 W496 A497 A502 V503	Q495-R499 VanDerWaalsContact O-CG 3.3Å; Q495-R499 WeakPolarHBondContact O-CG 3.36Å; Q495-R499 PolarHBondContact O-N 2.93Å; Q495-R499 PolarHBondContact O-NE 2.99Å; W496-R499 PolarHBondContact O-N 2.87Å; A497-R499 VanDerWaalsContact C-N 3.34Å; A497-R499 PolarHBondContact O-N 3Å; R499-A502 PolarHBondContact O-N 3.28Å; R499-V503 WeakPolarHBondContact O-CG2 3.43Å; R499-V503 PolarHBondContact O-N 3.39Å; R499-V503 VanDerWaalsContact O-N 3.09Å
500	V	92	Very high	91.2	Very high	78 Å²	78	109.7 Å²	109.7	47%	0.473	52%	0.523	S	S	.	.	H	α-helix	trans	-63.3	-44.7	176.6	174.2	0	0	0	0	110.8	W496 A497 E498 A502 V503 E504	W496-V500 WeakPolarHBondContact O-CG2 3.25Å; W496-V500 PolarHBondContact O-N 3.2Å; A497-V500 PolarHBondContact O-N 3.08Å; E498-V500 PolarHBondContact O-N 3.4Å; V500-A502 VanDerWaalsContact C-N 3.33Å; V500-A502 PolarHBondContact O-N 2.8Å; V500-V503 PolarHBondContact O-N 3.35Å; V500-E504 PolarHBondContact O-N 3.1Å
501	S	89.4	Confident	91.3	Very high	53 Å²	53	109.3 Å²	109.3	37%	0.371	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-36.3	177.4	77.2	0	0	0	0	113	A497 E498 E504 R505	A497-S501 PolarHBondContact O-N 3.05Å; E498-S501 PolarHBondContact O-N 3.26Å; E498-S501 PolarHBondContact O-OG 3.01Å; S501-E504 PolarHBondContact O-N 2.87Å; S501-R505 WeakPolarHBondContact O-CG 3.41Å; S501-R505 PolarHBondContact O-N 3.4Å
502	A	92.8	Very high	91.4	Very high	44 Å²	44	106 Å²	106	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-66.2	-40.1	175.8	0	0	0	0	0	111.6	E498 R499 V500 A506	E498-A502 WeakPolarHBondContact O-CB 3.26Å; E498-A502 PolarHBondContact O-N 2.77Å; R499-A502 PolarHBondContact O-N 3.28Å; V500-A502 VanDerWaalsContact C-N 3.33Å; V500-A502 PolarHBondContact O-N 2.8Å; A502-A506 PolarHBondContact O-N 3.17Å; A502-A506 VanDerWaalsContact O-N 3.1Å
503	V	92.2	Very high	91.7	Very high	101 Å²	101	107.8 Å²	107.8	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-46.6	174.9	171.2	0	0	0	0	111	R499 V500 R505 A506 M507	R499-V503 WeakPolarHBondContact O-CG2 3.43Å; R499-V503 PolarHBondContact O-N 3.39Å; R499-V503 VanDerWaalsContact O-N 3.09Å; V500-V503 PolarHBondContact O-N 3.35Å; V503-R505 PolarHBondContact O-N 2.95Å; V503-A506 PolarHBondContact O-N 2.8Å; V503-M507 PolarHBondContact O-N 3.41Å
504	E	90.7	Very high	91.8	Very high	88 Å²	88	106.3 Å²	106.3	41%	0.411	51%	0.511	S	S	.	.	H	α-helix	trans	-61.4	-46.2	179.6	-174.3	56.2	-148.2	0	0	111.5	V500 S501 A506 M507 Q508	V500-E504 PolarHBondContact O-N 3.1Å; S501-E504 PolarHBondContact O-N 2.87Å; E504-A506 VanDerWaalsContact C-N 3.3Å; E504-A506 PolarHBondContact O-N 3.34Å; E504-M507 PolarHBondContact O-N 3.3Å; E504-M507 VanDerWaalsContact O-N 3.13Å; E504-Q508 WeakPolarHBondContact O-CG 3.48Å; E504-Q508 PolarHBondContact O-N 3.33Å; E504-Q508 PolarHBondContact OE1-NE2 3.24Å
505	R	92.4	Very high	91.8	Very high	152 Å²	152	108.4 Å²	108.4	57%	0.574	52%	0.516	S	S	*	.	H	α-helix	trans	-57.4	-41.7	174.1	-75.8	-173	-67.3	161.2	-3.3	112.4	S501 V503 K509	S501-R505 WeakPolarHBondContact O-CG 3.41Å; S501-R505 PolarHBondContact O-N 3.4Å; V503-R505 PolarHBondContact O-N 2.95Å; R505-K509 WeakPolarHBondContact O-CG 3.34Å; R505-K509 PolarHBondContact O-N 3.45Å
506	A	92.3	Very high	91.9	Very high	49 Å²	49	109.7 Å²	109.7	41%	0.405	52%	0.519	S	S	.	.	H	α-helix	trans	-67.6	-38.3	177.7	0	0	0	0	0	112.2	A502 V503 E504 K510	A502-A506 PolarHBondContact O-N 3.17Å; A502-A506 VanDerWaalsContact O-N 3.1Å; V503-A506 PolarHBondContact O-N 2.8Å; E504-A506 VanDerWaalsContact C-N 3.3Å; E504-A506 PolarHBondContact O-N 3.34Å; A506-K510 WeakPolarHBondContact O-CG 3.33Å; A506-K510 PolarHBondContact O-N 2.98Å
507	M	91.2	Very high	92.3	Very high	105 Å²	105	105.8 Å²	105.8	52%	0.517	51%	0.51	S	S	.	.	H	α-helix	trans	-64.3	-45.3	175.1	-179.3	168.3	169.9	0	0	111.3	V503 E504 K510 Q511	V503-M507 PolarHBondContact O-N 3.41Å; E504-M507 PolarHBondContact O-N 3.3Å; E504-M507 VanDerWaalsContact O-N 3.13Å; M507-K510 WeakPolarHBondContact O-CB 3.33Å; M507-K510 PolarHBondContact O-N 3.23Å; M507-Q511 WeakPolarHBondContact O-CG 3.4Å; M507-Q511 PolarHBondContact O-N 3.07Å
508	Q	91.7	Very high	92.3	Very high	95 Å²	95	106.9 Å²	106.9	44%	0.444	51%	0.508	S	S	.	.	H	α-helix	trans	-60	-47.3	176.6	-71.1	175.7	2.7	0	0	111.8	E504 K510 Q511 E512	E504-Q508 WeakPolarHBondContact O-CG 3.48Å; E504-Q508 PolarHBondContact O-N 3.33Å; E504-Q508 PolarHBondContact OE1-NE2 3.24Å; Q508-K510 PolarHBondContact O-N 3.18Å; Q508-Q511 PolarHBondContact O-N 3.1Å; Q508-E512 WeakPolarHBondContact O-CG 3.44Å; Q508-E512 PolarHBondContact O-N 3.17Å
509	K	93.6	Very high	92.2	Very high	140 Å²	140	109.5 Å²	109.5	61%	0.609	51%	0.512	S	S	*	.	H	α-helix	trans	-53.2	-40.9	174.4	-76.5	179.4	178.8	-171.3	0	112.6	R505 I513	R505-K509 WeakPolarHBondContact O-CG 3.34Å; R505-K509 PolarHBondContact O-N 3.45Å; K509-I513 VanDerWaalsContact O-CG1 3.3Å; K509-I513 WeakPolarHBondContact O-CG1 3.49Å; K509-I513 PolarHBondContact O-N 3.08Å; K509-I513 VanDerWaalsContact O-N 3.07Å
510	K	92.6	Very high	92.2	Very high	155 Å²	155	111.1 Å²	111.1	67%	0.674	52%	0.518	S	S	*	.	H	α-helix	trans	-68.4	-42.6	176.5	-70.6	-179.7	179.1	-174.3	0	112.5	A506 M507 Q508 E512 I513 R514	A506-K510 WeakPolarHBondContact O-CG 3.33Å; A506-K510 PolarHBondContact O-N 2.98Å; M507-K510 WeakPolarHBondContact O-CB 3.33Å; M507-K510 PolarHBondContact O-N 3.23Å; Q508-K510 PolarHBondContact O-N 3.18Å; K510-E512 VanDerWaalsContact C-N 3.3Å; K510-E512 PolarHBondContact O-N 3.39Å; K510-I513 PolarHBondContact O-N 2.94Å; K510-R514 PolarHBondContact O-N 3.12Å
511	Q	91.2	Very high	92.2	Very high	77 Å²	77	116.1 Å²	116.1	36%	0.36	53%	0.528	S	S	.	.	H	α-helix	trans	-64.2	-36.8	176.8	-66.9	-63.3	-11.7	0	0	111.5	M507 Q508 R514 R515	M507-Q511 WeakPolarHBondContact O-CG 3.4Å; M507-Q511 PolarHBondContact O-N 3.07Å; Q508-Q511 PolarHBondContact O-N 3.1Å; Q511-R514 WeakPolarHBondContact O-CB 3.48Å; Q511-R514 PolarHBondContact O-N 3.4Å; Q511-R515 WeakPolarHBondContact O-CG 3.27Å; Q511-R515 PolarHBondContact O-N 2.87Å
512	E	94.4	Very high	92.2	Very high	108 Å²	108	118 Å²	118	51%	0.505	53%	0.533	S	S	.	.	H	α-helix	trans	-62.6	-46.2	172.6	-73.3	178.1	177.5	0	0	112.3	Q508 K510 R514 R515 K516	Q508-E512 WeakPolarHBondContact O-CG 3.44Å; Q508-E512 PolarHBondContact O-N 3.17Å; K510-E512 VanDerWaalsContact C-N 3.3Å; K510-E512 PolarHBondContact O-N 3.39Å; E512-R514 VanDerWaalsContact C-N 3.3Å; E512-R514 PolarHBondContact O-N 3.17Å; E512-R515 PolarHBondContact O-N 3.18Å; E512-K516 WeakPolarHBondContact O-CG 3.27Å; E512-K516 PolarHBondContact O-N 3.29Å
513	I	94.2	Very high	92.1	Very high	99 Å²	99	120.6 Å²	120.6	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-58.3	-44.7	174.1	-67.8	164.3	0	0	0	110.4	K509 K510 R515 K516 N517	K509-I513 VanDerWaalsContact O-CG1 3.3Å; K509-I513 WeakPolarHBondContact O-CG1 3.49Å; K509-I513 PolarHBondContact O-N 3.08Å; K509-I513 VanDerWaalsContact O-N 3.07Å; K510-I513 PolarHBondContact O-N 2.94Å; I513-R515 PolarHBondContact O-N 3.17Å; I513-K516 PolarHBondContact O-N 3.22Å; I513-N517 WeakPolarHBondContact O-CB 3.46Å; I513-N517 VanDerWaalsContact O-CG 3.27Å; I513-N517 PolarHBondContact O-N 2.78Å
514	R	92.7	Very high	92	Very high	156 Å²	156	122 Å²	122	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-59.7	-46.7	176.6	-176	-178.8	-180	-177.1	1.9	111.7	K510 Q511 E512 K516 N517 I518	K510-R514 PolarHBondContact O-N 3.12Å; Q511-R514 WeakPolarHBondContact O-CB 3.48Å; Q511-R514 PolarHBondContact O-N 3.4Å; E512-R514 VanDerWaalsContact C-N 3.3Å; E512-R514 PolarHBondContact O-N 3.17Å; R514-K516 PolarHBondContact O-N 3.21Å; R514-N517 PolarHBondContact O-N 3Å; R514-I518 HydrophobicContact CG-CD1 3.93Å; R514-I518 HydrophobicContact CG-CG1 4.49Å; R514-I518 WeakPolarHBondContact O-CG1 3.47Å; R514-I518 PolarHBondContact O-N 3.43Å
515	R	92.9	Very high	91.8	Very high	174 Å²	174	125 Å²	125	66%	0.657	55%	0.549	S	S	*	.	H	α-helix	trans	-60.6	-43.9	176.9	-73.2	174.8	-176.5	-173.9	0.8	111.4	Q511 E512 I513 N517 I518 R519	Q511-R515 WeakPolarHBondContact O-CG 3.27Å; Q511-R515 PolarHBondContact O-N 2.87Å; E512-R515 PolarHBondContact O-N 3.18Å; I513-R515 PolarHBondContact O-N 3.17Å; R515-N517 VanDerWaalsContact C-N 3.35Å; R515-N517 PolarHBondContact O-N 2.99Å; R515-I518 PolarHBondContact O-N 2.73Å; R515-R519 WeakPolarHBondContact O-CB 3.37Å; R515-R519 WeakPolarHBondContact O-CG 3.31Å; R515-R519 PolarHBondContact O-N 3.17Å
516	K	93.2	Very high	91.5	Very high	137 Å²	137	124.7 Å²	124.7	60%	0.596	55%	0.552	S	S	*	*	H	α-helix	trans	-59.9	-43.6	174.6	-73.8	-179.2	179.4	-179.1	0	111.6	E512 I513 R514 R519 R520	E512-K516 WeakPolarHBondContact O-CG 3.27Å; E512-K516 PolarHBondContact O-N 3.29Å; I513-K516 PolarHBondContact O-N 3.22Å; R514-K516 PolarHBondContact O-N 3.21Å; K516-R519 PolarHBondContact O-N 3.38Å; K516-R520 WeakPolarHBondContact O-CG 3.15Å; K516-R520 PolarHBondContact O-N 3.26Å
517	N	93.3	Very high	91.2	Very high	81 Å²	81	128.2 Å²	128.2	43%	0.433	56%	0.558	S	S	.	*	H	α-helix	trans	-66.8	-41.3	178.1	-70.6	-8.8	0	0	0	112.7	I513 R514 R515 R520 R521	I513-N517 WeakPolarHBondContact O-CB 3.46Å; I513-N517 VanDerWaalsContact O-CG 3.27Å; I513-N517 PolarHBondContact O-N 2.78Å; R514-N517 PolarHBondContact O-N 3Å; R515-N517 VanDerWaalsContact C-N 3.35Å; R515-N517 PolarHBondContact O-N 2.99Å; N517-R520 PolarHBondContact O-N 2.95Å; N517-R521 PolarHBondContact O-N 3.41Å
518	I	91.8	Very high	90.7	Very high	82 Å²	82	129.1 Å²	129.1	42%	0.421	56%	0.56	S	S	.	*	H	α-helix	trans	-62.4	-45.7	175	-69.3	168	0	0	0	110.2	R514 R515 R520 R521 I522	R514-I518 HydrophobicContact CG-CD1 3.93Å; R514-I518 HydrophobicContact CG-CG1 4.49Å; R514-I518 WeakPolarHBondContact O-CG1 3.47Å; R514-I518 PolarHBondContact O-N 3.43Å; R515-I518 PolarHBondContact O-N 2.73Å; I518-R520 PolarHBondContact O-N 3.19Å; I518-R521 PolarHBondContact O-N 2.82Å; I518-R521 VanDerWaalsContact O-N 3.16Å; I518-I522 HydrophobicContact CG2-CD1 3.8Å; I518-I522 HydrophobicContact CG2-CG1 4.38Å; I518-I522 WeakPolarHBondContact O-CG1 3.38Å; I518-I522 PolarHBondContact O-N 2.81Å
519	R	90.2	Very high	90.2	Very high	187 Å²	187	132.7 Å²	132.7	71%	0.706	57%	0.569	S	S	*	*	H	α-helix	trans	-57.2	-47.1	175.2	-76.8	-177.6	-178.8	-176.4	0.1	111.6	R515 K516 R521 I522 E523	R515-R519 WeakPolarHBondContact O-CB 3.37Å; R515-R519 WeakPolarHBondContact O-CG 3.31Å; R515-R519 PolarHBondContact O-N 3.17Å; K516-R519 PolarHBondContact O-N 3.38Å; R519-R521 VanDerWaalsContact C-N 3.32Å; R519-R521 PolarHBondContact O-N 2.69Å; R519-I522 PolarHBondContact O-N 3.21Å; R519-E523 WeakPolarHBondContact O-CB 3.34Å; R519-E523 PolarHBondContact O-N 2.78Å
520	R	91.7	Very high	89.3	Confident	173 Å²	173	128.7 Å²	128.7	65%	0.653	56%	0.562	S	S	*	*	H	α-helix	trans	-56.1	-43.6	174.9	-77.1	-178	178.8	-177.5	-1.3	112.4	K516 N517 I518 E523 Q524	K516-R520 WeakPolarHBondContact O-CG 3.15Å; K516-R520 PolarHBondContact O-N 3.26Å; N517-R520 PolarHBondContact O-N 2.95Å; I518-R520 PolarHBondContact O-N 3.19Å; R520-E523 PolarHBondContact O-N 3.47Å; R520-Q524 WeakPolarHBondContact O-CB 3.44Å; R520-Q524 VanDerWaalsContact O-CG 3.3Å; R520-Q524 WeakPolarHBondContact O-CG 3.37Å; R520-Q524 PolarHBondContact O-N 3.36Å
521	R	92.3	Very high	88.4	Confident	183 Å²	183	129 Å²	129	69%	0.691	56%	0.564	S	S	*	*	H	α-helix	trans	-66.1	-40.6	177.2	-74.4	-173.7	177.7	-178.4	-1.3	113.1	N517 I518 R519 Q524 K525	N517-R521 PolarHBondContact O-N 3.41Å; I518-R521 PolarHBondContact O-N 2.82Å; I518-R521 VanDerWaalsContact O-N 3.16Å; R519-R521 VanDerWaalsContact C-N 3.32Å; R519-R521 PolarHBondContact O-N 2.69Å; R521-Q524 PolarHBondContact O-N 2.99Å; R521-K525 PolarHBondContact O-N 3.43Å
522	I	89.9	Confident	87.6	Confident	91 Å²	91	131.5 Å²	131.5	47%	0.467	58%	0.575	S	S	.	*	H	α-helix	trans	-63.4	-45.1	176.4	-67.6	168.2	0	0	0	109.9	I518 R519 K525 K526	I518-I522 HydrophobicContact CG2-CD1 3.8Å; I518-I522 HydrophobicContact CG2-CG1 4.38Å; I518-I522 WeakPolarHBondContact O-CG1 3.38Å; I518-I522 PolarHBondContact O-N 2.81Å; R519-I522 PolarHBondContact O-N 3.21Å; I522-K525 PolarHBondContact O-N 3.11Å; I522-K526 PolarHBondContact O-N 3.25Å
523	E	90.7	Very high	86.2	Confident	100 Å²	100	134.6 Å²	134.6	47%	0.467	59%	0.589	S	S	.	*	H	α-helix	trans	-64.2	-40.2	178.6	-159.4	-169.8	143.4	0	0	111.9	R519 R520 K526 K527	R519-E523 WeakPolarHBondContact O-CB 3.34Å; R519-E523 PolarHBondContact O-N 2.78Å; R520-E523 PolarHBondContact O-N 3.47Å; E523-K526 PolarHBondContact O-N 2.87Å; E523-K527 WeakPolarHBondContact O-CG 3.37Å; E523-K527 PolarHBondContact O-N 2.98Å; E523-K527 VanDerWaalsContact OE1-CE 3.32Å; E523-K527 WeakPolarHBondContact OE1-CE 3.43Å; E523-K527 IonicContact OE1-NZ 2.81Å; E523-K527 PolarHBondContact OE1-NZ 3.27Å
524	Q	88.1	Confident	84.2	Confident	131 Å²	131	139.7 Å²	139.7	61%	0.612	62%	0.616	S	S	*	*	H	α-helix	trans	-60	-44.3	172	-77.4	174.6	-20.2	0	0	112.3	R520 R521 K526 K527 F528	R520-Q524 WeakPolarHBondContact O-CB 3.44Å; R520-Q524 VanDerWaalsContact O-CG 3.3Å; R520-Q524 WeakPolarHBondContact O-CG 3.37Å; R520-Q524 PolarHBondContact O-N 3.36Å; R521-Q524 PolarHBondContact O-N 2.99Å; Q524-K526 PolarHBondContact O-N 3.5Å; Q524-K527 PolarHBondContact O-N 2.88Å; Q524-F528 PolarHBondContact O-N 3.24Å
525	K	87.5	Confident	83.8	Confident	149 Å²	149	138.9 Å²	138.9	65%	0.648	62%	0.618	S	S	*	*	H	α-helix	trans	-62.8	-39.6	175.7	-76.7	-171.9	175.3	-167.8	0	112.6	R521 I522 F528 R529	R521-K525 PolarHBondContact O-N 3.43Å; I522-K525 PolarHBondContact O-N 3.11Å; K525-F528 PolarHBondContact O-N 3.06Å; K525-R529 PolarHBondContact O-N 3.29Å
526	K	87	Confident	83.3	Confident	147 Å²	147	137 Å²	137	64%	0.639	62%	0.616	S	S	*	*	H	α-helix	trans	-62.8	-44.3	175	-73	-174.5	176.6	-168.8	0	111.5	I522 E523 Q524 F528 R529 A530	I522-K526 PolarHBondContact O-N 3.25Å; E523-K526 PolarHBondContact O-N 2.87Å; Q524-K526 PolarHBondContact O-N 3.5Å; K526-F528 VanDerWaalsContact C-N 3.3Å; K526-F528 PolarHBondContact O-N 2.89Å; K526-R529 PolarHBondContact O-N 3.35Å; K526-A530 WeakPolarHBondContact O-CB 3.38Å; K526-A530 PolarHBondContact O-N 3.34Å
527	K	84.4	Confident	82.8	Confident	123 Å²	123	137 Å²	137	54%	0.535	62%	0.617	S	S	.	*	H	α-helix	trans	-61.7	-36.4	175.1	-71.2	176	-174.8	171	0	112.4	E523 Q524 K531	E523-K527 WeakPolarHBondContact O-CG 3.37Å; E523-K527 PolarHBondContact O-N 2.98Å; E523-K527 VanDerWaalsContact OE1-CE 3.32Å; E523-K527 WeakPolarHBondContact OE1-CE 3.43Å; E523-K527 IonicContact OE1-NZ 2.81Å; E523-K527 PolarHBondContact OE1-NZ 3.27Å; Q524-K527 PolarHBondContact O-N 2.88Å; K527-K531 WeakPolarHBondContact O-CG 3.5Å; K527-K531 PolarHBondContact O-N 2.92Å
528	F	81.2	Confident	82.1	Confident	124 Å²	124	140.3 Å²	140.3	54%	0.544	63%	0.628	S	S	.	*	H	α-helix	trans	-67.5	-49.7	175.6	-173.4	-93.3	0	0	0	112.1	Q524 K525 K526 A530 K531 E532	Q524-F528 PolarHBondContact O-N 3.24Å; K525-F528 PolarHBondContact O-N 3.06Å; K526-F528 VanDerWaalsContact C-N 3.3Å; K526-F528 PolarHBondContact O-N 2.89Å; F528-A530 VanDerWaalsContact C-N 3.31Å; F528-A530 PolarHBondContact O-N 3.17Å; F528-K531 WeakPolarHBondContact O-CB 3.5Å; F528-K531 PolarHBondContact O-N 2.96Å; F528-E532 HydrophobicContact CE1-CG 4.13Å; F528-E532 WeakPolarHBondContact CE1-OE1 3.49Å; F528-E532 PolarHBondContact O-N 2.95Å
529	R	80.8	Confident	81.5	Confident	169 Å²	169	143.9 Å²	143.9	64%	0.638	64%	0.641	S	S	*	*	H	α-helix	trans	-60.2	-38.9	176.6	-71.3	-176.1	-178.6	-173.9	-2.9	112.9	K525 K526 K531 E532 H533	K525-R529 PolarHBondContact O-N 3.29Å; K526-R529 PolarHBondContact O-N 3.35Å; R529-K531 PolarHBondContact O-N 3.27Å; R529-E532 PolarHBondContact O-N 3.12Å; R529-E532 VanDerWaalsContact O-N 3.1Å; R529-H533 PolarHBondContact O-CD2 3.29Å; R529-H533 VanDerWaalsContact O-CD2 3.29Å; R529-H533 PolarHBondContact O-N 3.07Å
530	A	75.9	Confident	81	Confident	57 Å²	57	141.1 Å²	141.1	47%	0.471	64%	0.636	S	S	.	*	H	α-helix	trans	-62.4	-28.6	176.3	0	0	0	0	0	112.7	K526 F528	K526-A530 WeakPolarHBondContact O-CB 3.38Å; K526-A530 PolarHBondContact O-N 3.34Å; F528-A530 VanDerWaalsContact C-N 3.31Å; F528-A530 PolarHBondContact O-N 3.17Å
531	K	74.2	Confident	80.2	Confident	162 Å²	162	138.8 Å²	138.8	70%	0.704	64%	0.635	S	S	*	*	H	α-helix	trans	-79.1	-20.7	174	-72.2	-178	176.8	-167.4	0	113.9	K527 F528 R529	K527-K531 WeakPolarHBondContact O-CG 3.5Å; K527-K531 PolarHBondContact O-N 2.92Å; F528-K531 WeakPolarHBondContact O-CB 3.5Å; F528-K531 PolarHBondContact O-N 2.96Å; R529-K531 PolarHBondContact O-N 3.27Å
532	E	74.3	Confident	79.3	Confident	129 Å²	129	135.4 Å²	135.4	60%	0.603	63%	0.631	S	S	*	*	H	α-helix	trans	-81.4	-21.4	175.5	-73.6	-178.4	142.1	0	0	112.7	F528 R529	F528-E532 HydrophobicContact CE1-CG 4.13Å; F528-E532 WeakPolarHBondContact CE1-OE1 3.49Å; F528-E532 PolarHBondContact O-N 2.95Å; R529-E532 PolarHBondContact O-N 3.12Å; R529-E532 VanDerWaalsContact O-N 3.1Å
533	H	63.7	Low	78.4	Confident	172 Å²	172	139.1 Å²	139.1	80%	0.796	65%	0.645	S	S	*	*			trans	-93.5	2.5	177.8	-74.6	-71.2	0	0	0	113.9	R529	R529-H533 PolarHBondContact O-CD2 3.29Å; R529-H533 VanDerWaalsContact O-CD2 3.29Å; R529-H533 PolarHBondContact O-N 3.07Å
534	L	52.9	Low	77.3	Confident	206 Å²	206	142.6 Å²	142.6	100%	1.079	66%	0.661	S	S	*	*			trans	-107.8	0	170.7	-93.4	152.4	0	0	0	107.7

Retrieved 534 of 534 residues in 379.1 ms (Link to these results)

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