A0A077YXY0_TRITR Loading...

Glucose-induced degradation protein 8 homolog

AlphaFold DB , UniProt , Accession A0A077YXY0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 224 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	41.2	Very low	52.9	Low	173 Å²	173	91.6 Å²	91.6	85%	0.852	49%	0.491	S	S	*	.				0	-51.7	0	-83.2	-162	-80.8	0	0	113.6	S3 C4 V5	M1-S3 PolarHBondContact O-N 3.35Å; M1-C4 PolarHBondContact O-N 3.31Å; M1-V5 WeakPolarHBondContact O-CB 3.31Å; M1-V5 VanDerWaalsContact O-CG2 3.3Å; M1-V5 WeakPolarHBondContact O-CG2 3.34Å; M1-V5 PolarHBondContact O-N 3.29Å
2	A	46.6	Very low	53	Low	77 Å²	77	88.5 Å²	88.5	64%	0.636	47%	0.474	S	S	*	.	H	α-helix	trans	-57.9	-39.8	-171.1	0	0	0	0	0	116.2	Q6	A2-Q6 VanDerWaalsContact O-CB 3.27Å; A2-Q6 WeakPolarHBondContact O-CB 3.12Å; A2-Q6 VanDerWaalsContact O-CG 3.31Å; A2-Q6 WeakPolarHBondContact O-CG 3.15Å; A2-Q6 PolarHBondContact O-N 3.19Å
3	S	54	Low	53	Low	83 Å²	83	92.1 Å²	92.1	58%	0.58	49%	0.492	S	S	*	.	H	α-helix	trans	-73	-44.1	179.9	67.5	0	0	0	0	112.8	M1 V5 Q6 D7	M1-S3 PolarHBondContact O-N 3.35Å; S3-V5 PolarHBondContact O-N 3.2Å; S3-Q6 PolarHBondContact O-N 2.74Å; S3-D7 PolarHBondContact O-N 3.1Å
4	C	48.9	Very low	53.4	Low	65 Å²	65	97.8 Å²	97.8	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-64.8	-41.3	179.5	-168.4	0	0	0	0	111.5	M1 D7 L8	M1-C4 PolarHBondContact O-N 3.31Å; C4-D7 PolarHBondContact O-N 3.29Å; C4-L8 WeakPolarHBondContact O-CB 3.2Å; C4-L8 PolarHBondContact O-N 3.2Å
5	V	51	Low	53.2	Low	34 Å²	34	99.2 Å²	99.2	21%	0.206	52%	0.519	C	S	.	.	H	α-helix	trans	-66.2	-39	173.5	176.9	0	0	0	0	111.1	M1 S3 M9 F193	M1-V5 WeakPolarHBondContact O-CB 3.31Å; M1-V5 VanDerWaalsContact O-CG2 3.3Å; M1-V5 WeakPolarHBondContact O-CG2 3.34Å; M1-V5 PolarHBondContact O-N 3.29Å; S3-V5 PolarHBondContact O-N 3.2Å; V5-M9 HydrophobicContact CG1-CG 4.46Å; V5-M9 HydrophobicContact CG1-SD 4.46Å; V5-M9 VanDerWaalsContact O-CB 3.23Å; V5-M9 WeakPolarHBondContact O-CB 3.42Å; V5-M9 VanDerWaalsContact O-CG 3.28Å; V5-M9 WeakPolarHBondContact O-CG 3.36Å; V5-M9 PolarHBondContact O-N 3.13Å; V5-F193 HydrophobicContact CG1-CD2 4.26Å
6	Q	51.8	Low	53.1	Low	117 Å²	117	100.1 Å²	100.1	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-66.5	-38.1	175.2	-86.3	-175.1	-10.4	0	0	113.4	A2 S3 K10	A2-Q6 VanDerWaalsContact O-CB 3.27Å; A2-Q6 WeakPolarHBondContact O-CB 3.12Å; A2-Q6 VanDerWaalsContact O-CG 3.31Å; A2-Q6 WeakPolarHBondContact O-CG 3.15Å; A2-Q6 PolarHBondContact O-N 3.19Å; S3-Q6 PolarHBondContact O-N 2.74Å; Q6-K10 WeakPolarHBondContact O-CB 3.49Å; Q6-K10 WeakPolarHBondContact O-CG 3.19Å; Q6-K10 PolarHBondContact O-N 3.13Å
7	D	58.3	Low	52.9	Low	94 Å²	94	101.8 Å²	101.8	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-73.5	-39.2	178.3	-78.8	-24.7	0	0	0	111.6	S3 C4 K10 K11	S3-D7 PolarHBondContact O-N 3.1Å; C4-D7 PolarHBondContact O-N 3.29Å; D7-K10 PolarHBondContact O-N 3.22Å; D7-K11 PolarHBondContact O-N 3.17Å
8	L	54.6	Low	52.8	Low	30 Å²	30	100.6 Å²	100.6	16%	0.157	54%	0.535	C	S	.	.	H	α-helix	trans	-64	-43.7	170.6	-161.8	82.1	0	0	0	110.7	C4 K10 K11 L12 L189 V190	C4-L8 WeakPolarHBondContact O-CB 3.2Å; C4-L8 PolarHBondContact O-N 3.2Å; L8-K10 VanDerWaalsContact C-N 3.35Å; L8-K10 PolarHBondContact O-N 3.46Å; L8-K11 WeakPolarHBondContact O-CB 3.17Å; L8-K11 PolarHBondContact O-N 3.21Å; L8-K11 VanDerWaalsContact O-N 3.16Å; L8-L12 HydrophobicContact CD2-CD1 3.96Å; L8-L12 HydrophobicContact CG-CD1 3.84Å; L8-L12 HydrophobicContact CG-CG 4.36Å; L8-L12 WeakPolarHBondContact O-CB 3.36Å; L8-L12 VanDerWaalsContact O-CG 3.28Å; L8-L12 WeakPolarHBondContact O-CG 3.45Å; L8-L12 PolarHBondContact O-N 2.97Å; L8-L189 HydrophobicContact CD2-CB 3.68Å; L8-L189 HydrophobicContact CD2-CD1 4.39Å; L8-V190 HydrophobicContact CD2-CG2 4.18Å
9	M	56.1	Low	52.6	Low	48 Å²	48	103 Å²	103	24%	0.236	55%	0.548	C	S	.	.	H	α-helix	trans	-57.9	-45.4	172.5	-86.1	-176.6	90.2	0	0	111.3	V5 K11 L12 L13 F193	V5-M9 HydrophobicContact CG1-CG 4.46Å; V5-M9 HydrophobicContact CG1-SD 4.46Å; V5-M9 VanDerWaalsContact O-CB 3.23Å; V5-M9 WeakPolarHBondContact O-CB 3.42Å; V5-M9 VanDerWaalsContact O-CG 3.28Å; V5-M9 WeakPolarHBondContact O-CG 3.36Å; V5-M9 PolarHBondContact O-N 3.13Å; M9-K11 VanDerWaalsContact C-N 3.29Å; M9-K11 PolarHBondContact O-N 3.1Å; M9-L12 PolarHBondContact O-N 3.39Å; M9-L13 HydrophobicContact CB-CD1 4.32Å; M9-L13 HydrophobicContact CE-CD1 4.14Å; M9-L13 WeakPolarHBondContact O-CB 3.3Å; M9-L13 WeakPolarHBondContact O-CD1 3.26Å; M9-L13 PolarHBondContact O-N 3.36Å; M9-F193 HydrophobicContact CE-CD2 4.36Å; M9-F193 HydrophobicContact CE-CE2 3.29Å; M9-F193 HydrophobicContact CE-CZ 3.62Å; M9-F193 HydrophobicContact CG-CD2 3.85Å; M9-F193 HydrophobicContact CG-CE2 3.6Å; M9-F193 HydrophobicContact CG-CZ 4.12Å; M9-F193 HydrophobicContact SD-CD2 3.88Å; M9-F193 HydrophobicContact SD-CE2 3.36Å; M9-F193 WeakPolarHBondContact SD-CE2 3.39Å; M9-F193 HydrophobicContact SD-CZ 4.2Å
10	K	60.7	Low	52.7	Low	125 Å²	125	102.5 Å²	102.5	54%	0.543	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-33.3	177.7	-81.2	174.6	-175	166.5	0	112.5	Q6 D7 L8 K14	Q6-K10 WeakPolarHBondContact O-CB 3.49Å; Q6-K10 WeakPolarHBondContact O-CG 3.19Å; Q6-K10 PolarHBondContact O-N 3.13Å; D7-K10 PolarHBondContact O-N 3.22Å; L8-K10 VanDerWaalsContact C-N 3.35Å; L8-K10 PolarHBondContact O-N 3.46Å; K10-K14 WeakPolarHBondContact O-CB 3.49Å; K10-K14 VanDerWaalsContact O-CG 3.27Å; K10-K14 WeakPolarHBondContact O-CG 3.43Å; K10-K14 PolarHBondContact O-N 3.38Å
11	K	58.9	Low	53.2	Low	162 Å²	162	100.6 Å²	100.6	70%	0.704	54%	0.54	S	S	*	.	H	α-helix	trans	-67.4	-54.1	171.6	-95.4	-177.5	169	-175.1	0	110.8	D7 L8 M9 L13 K14 D15	D7-K11 PolarHBondContact O-N 3.17Å; L8-K11 WeakPolarHBondContact O-CB 3.17Å; L8-K11 PolarHBondContact O-N 3.21Å; L8-K11 VanDerWaalsContact O-N 3.16Å; M9-K11 VanDerWaalsContact C-N 3.29Å; M9-K11 PolarHBondContact O-N 3.1Å; K11-L13 VanDerWaalsContact C-N 3.32Å; K11-L13 PolarHBondContact O-N 3.28Å; K11-K14 PolarHBondContact O-N 3.11Å; K11-K14 VanDerWaalsContact O-N 3.12Å; K11-D15 PolarHBondContact O-N 3.25Å
12	L	53.3	Low	54.4	Low	54 Å²	54	95.2 Å²	95.2	28%	0.283	52%	0.517	S	S	.	.	H	α-helix	trans	-63.8	-32.2	-178.7	-69	166.6	0	0	0	113.2	L8 M9 L18 V190	L8-L12 HydrophobicContact CD2-CD1 3.96Å; L8-L12 HydrophobicContact CG-CD1 3.84Å; L8-L12 HydrophobicContact CG-CG 4.36Å; L8-L12 WeakPolarHBondContact O-CB 3.36Å; L8-L12 VanDerWaalsContact O-CG 3.28Å; L8-L12 WeakPolarHBondContact O-CG 3.45Å; L8-L12 PolarHBondContact O-N 2.97Å; M9-L12 PolarHBondContact O-N 3.39Å; L12-L18 HydrophobicContact CD2-CD1 3.78Å; L12-L18 HydrophobicContact CD2-CD2 3.89Å; L12-L18 HydrophobicContact CD2-CG 4.28Å; L12-V190 HydrophobicContact CD1-CG2 4.09Å
13	L	54	Low	55.4	Low	135 Å²	135	96.9 Å²	96.9	71%	0.707	51%	0.512	S	S	*	.	H	α-helix	trans	-83.2	-18.4	175.5	-83.2	151.2	0	0	0	113.4	M9 K11	M9-L13 HydrophobicContact CB-CD1 4.32Å; M9-L13 HydrophobicContact CE-CD1 4.14Å; M9-L13 WeakPolarHBondContact O-CB 3.3Å; M9-L13 WeakPolarHBondContact O-CD1 3.26Å; M9-L13 PolarHBondContact O-N 3.36Å; K11-L13 VanDerWaalsContact C-N 3.32Å; K11-L13 PolarHBondContact O-N 3.28Å
14	K	58.8	Low	56.2	Low	172 Å²	172	96.7 Å²	96.7	75%	0.748	50%	0.502	S	S	*	.	H	α-helix	trans	-85.3	-31.5	178.2	-92.4	-177.3	169.9	-174	0	113	K10 K11 P16	K10-K14 WeakPolarHBondContact O-CB 3.49Å; K10-K14 VanDerWaalsContact O-CG 3.27Å; K10-K14 WeakPolarHBondContact O-CG 3.43Å; K10-K14 PolarHBondContact O-N 3.38Å; K11-K14 PolarHBondContact O-N 3.11Å; K11-K14 VanDerWaalsContact O-N 3.12Å; K14-P16 WeakPolarHBondContact O-CD 3.39Å
15	D	50.2	Low	57.5	Low	119 Å²	119	94.1 Å²	94.1	64%	0.636	49%	0.485	S	S	*	.			trans	-112.5	93.3	175.9	-81.1	-43.7	0	0	0	109.9	K11 D17	K11-D15 PolarHBondContact O-N 3.25Å; D15-D17 PolarHBondContact O-N 3.38Å
16	P	50.8	Low	58.7	Low	113 Å²	113	95.4 Å²	95.4	73%	0.734	49%	0.488	S	S	*	.			trans	-68.6	-10.6	174.8	27.7	-32.7	0	0	0	113.1	K14 L18	K14-P16 WeakPolarHBondContact O-CD 3.39Å; P16-L18 VanDerWaalsContact C-N 3.35Å; P16-L18 PolarHBondContact O-N 2.99Å
17	D	50	Low	59.7	Low	130 Å²	130	91.1 Å²	91.1	70%	0.695	47%	0.471	S	S	*	.			trans	-91	65.2	173.4	-68.8	-27.1	0	0	0	110.7	D15 D19	D15-D17 PolarHBondContact O-N 3.38Å; D17-D19 PolarHBondContact O-N 2.76Å
18	L	51.6	Low	60.7	Low	79 Å²	79	88 Å²	88	41%	0.414	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	7.2	161.3	-93.3	137	0	0	0	112.9	L12 P16 D20	L12-L18 HydrophobicContact CD2-CD1 3.78Å; L12-L18 HydrophobicContact CD2-CD2 3.89Å; L12-L18 HydrophobicContact CD2-CG 4.28Å; P16-L18 VanDerWaalsContact C-N 3.35Å; P16-L18 PolarHBondContact O-N 2.99Å; L18-D20 PolarHBondContact O-N 3.06Å
19	D	47.8	Very low	61.7	Low	147 Å²	147	87.5 Å²	87.5	79%	0.786	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-0.1	-179.8	-167.6	35.4	0	0	0	113.8	D17 S21	D17-D19 PolarHBondContact O-N 2.76Å; D19-S21 PolarHBondContact O-N 2.89Å
20	D	55.6	Low	62.7	Low	92 Å²	92	87.3 Å²	87.3	49%	0.492	45%	0.451	S	S	.	.			trans	-76.1	82.7	166.2	-141.4	-9.1	0	0	0	107.7	L18 T22 Q23	L18-D20 PolarHBondContact O-N 3.06Å; D20-T22 CarbonylContact O-C 3.56Å; D20-T22 PolarHBondContact O-N 3.24Å; D20-T22 PolarHBondContact OD1-OG1 3.12Å; D20-Q23 PolarHBondContact O-N 3.03Å
21	S	62.3	Low	63.6	Low	64 Å²	64	83.6 Å²	83.6	45%	0.448	44%	0.435	S	S	.	.	H	α-helix	trans	-31.8	-40.7	176.6	175.6	0	0	0	0	112.2	D19 Q23 M24 D25	D19-S21 PolarHBondContact O-N 2.89Å; S21-Q23 PolarHBondContact O-N 3.33Å; S21-M24 PolarHBondContact O-N 3.31Å; S21-D25 VanDerWaalsContact O-CB 3.32Å; S21-D25 WeakPolarHBondContact O-CB 3.38Å; S21-D25 PolarHBondContact O-N 3.27Å; S21-D25 VanDerWaalsContact O-OD2 3.06Å; S21-D25 PolarHBondContact OG-OD2 3.45Å
22	T	68	Low	64.4	Low	59 Å²	59	76.7 Å²	76.7	36%	0.362	41%	0.406	S	S	.	.	H	α-helix	trans	-54	-44.5	177.2	-32	0	0	0	0	114.4	D20 D25 E26 L49	D20-T22 CarbonylContact O-C 3.56Å; D20-T22 PolarHBondContact O-N 3.24Å; D20-T22 PolarHBondContact OD1-OG1 3.12Å; T22-D25 PolarHBondContact O-N 2.89Å; T22-E26 WeakPolarHBondContact O-CB 3.46Å; T22-E26 VanDerWaalsContact O-CG 3.25Å; T22-E26 WeakPolarHBondContact O-CG 3.38Å; T22-E26 PolarHBondContact O-N 3.39Å; T22-L49 HydrophobicContact CG2-CD2 3.83Å
23	Q	67.1	Low	65.4	Low	113 Å²	113	74.6 Å²	74.6	53%	0.528	40%	0.397	S	S	.	.	H	α-helix	trans	-70	-39.4	-179.7	-71.6	-175	20.5	0	0	112.2	D20 S21 E26 C27	D20-Q23 PolarHBondContact O-N 3.03Å; S21-Q23 PolarHBondContact O-N 3.33Å; Q23-E26 PolarHBondContact O-N 3.12Å; Q23-C27 PolarHBondContact O-N 3.2Å; Q23-C27 PolarHBondContact O-SG 3.36Å
24	M	69.8	Low	66.3	Low	78 Å²	78	68.9 Å²	68.9	38%	0.384	37%	0.366	S	S	.	.	H	α-helix	trans	-69.2	-42.3	174.9	-177	133.6	-84.5	0	0	110.7	S21 E26 C27 V28	S21-M24 PolarHBondContact O-N 3.31Å; M24-E26 PolarHBondContact O-N 3.07Å; M24-C27 PolarHBondContact O-N 3.05Å; M24-V28 HydrophobicContact CG-CG2 4.45Å; M24-V28 VanDerWaalsContact O-CG2 3.31Å; M24-V28 WeakPolarHBondContact O-CG2 3.37Å; M24-V28 PolarHBondContact O-N 3.21Å
25	D	76.6	Confident	66.8	Low	12 Å²	12	62.8 Å²	62.8	6%	0.064	35%	0.348	C	S	.	.	H	α-helix	trans	-58.4	-37.8	173.7	-69.8	-36.5	0	0	0	110.5	S21 T22 L29 F44 R48 L49	S21-D25 VanDerWaalsContact O-CB 3.32Å; S21-D25 WeakPolarHBondContact O-CB 3.38Å; S21-D25 PolarHBondContact O-N 3.27Å; S21-D25 VanDerWaalsContact O-OD2 3.06Å; S21-D25 PolarHBondContact OG-OD2 3.45Å; T22-D25 PolarHBondContact O-N 2.89Å; D25-L29 VanDerWaalsContact O-CB 3.22Å; D25-L29 WeakPolarHBondContact O-CB 3.38Å; D25-L29 PolarHBondContact O-N 2.84Å; D25-F44 HydrophobicContact CB-CE1 4.02Å; D25-F44 HydrophobicContact CB-CZ 4.31Å; D25-F44 WeakPolarHBondContact O-CE1 3.26Å; D25-F44 WeakPolarHBondContact OD1-CZ 3.43Å; D25-R48 HydrophobicContact CB-CB 4.45Å; D25-R48 IonicContact OD1-NH1 2.73Å; D25-R48 PolarHBondContact OD1-NH1 3.18Å; D25-R48 IonicContact OD2-NH1 3.21Å; D25-L49 HydrophobicContact CB-CD1 3.96Å; D25-L49 HydrophobicContact CB-CD2 4.2Å; D25-L49 HydrophobicContact CB-CG 4.04Å
26	E	77.1	Confident	67.7	Low	60 Å²	60	58.3 Å²	58.3	28%	0.28	33%	0.33	S	S	.	.	H	α-helix	trans	-66.8	-42.6	175	-78.5	175	-138.9	0	0	113.1	T22 Q23 M24 L29 E30 L49 R51	T22-E26 WeakPolarHBondContact O-CB 3.46Å; T22-E26 VanDerWaalsContact O-CG 3.25Å; T22-E26 WeakPolarHBondContact O-CG 3.38Å; T22-E26 PolarHBondContact O-N 3.39Å; Q23-E26 PolarHBondContact O-N 3.12Å; M24-E26 PolarHBondContact O-N 3.07Å; E26-L29 PolarHBondContact O-N 3.17Å; E26-E30 WeakPolarHBondContact O-CB 3.46Å; E26-E30 PolarHBondContact O-N 2.7Å; E26-L49 HydrophobicContact CG-CD1 4.01Å; E26-L49 HydrophobicContact CG-CD2 4.31Å; E26-R51 IonicContact OE1-CZ 3.25Å; E26-R51 IonicContact OE1-NE 2.79Å; E26-R51 IonicContact OE1-NH1 3.6Å; E26-R51 IonicContact OE1-NH2 3.81Å; E26-R51 PolarHBondContact OE1-NH2 2.96Å; E26-R51 IonicContact OE2-CZ 2.94Å; E26-R51 IonicContact OE2-NH1 2.84Å; E26-R51 PolarHBondContact OE2-NH1 3.23Å; E26-R51 IonicContact OE2-NH2 2.64Å; E26-R51 PolarHBondContact OE2-NH2 3.18Å
27	C	73	Confident	68.8	Low	28 Å²	28	58.2 Å²	58.2	19%	0.189	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-42.8	176.2	-66.3	0	0	0	0	111.3	Q23 M24 E30 F31 D186 F187	Q23-C27 PolarHBondContact O-N 3.2Å; Q23-C27 PolarHBondContact O-SG 3.36Å; M24-C27 PolarHBondContact O-N 3.05Å; C27-E30 PolarHBondContact O-N 3.35Å; C27-F31 WeakPolarHBondContact O-CB 3.47Å; C27-F31 PolarHBondContact O-N 3.07Å; C27-D186 HydrophobicContact CB-CB 4.43Å; C27-F187 HydrophobicContact CB-CB 4.21Å; C27-F187 HydrophobicContact CB-CD2 4.45Å
28	V	77.9	Confident	69.8	Low	28 Å²	28	54.3 Å²	54.3	17%	0.17	30%	0.301	C	S	.	.	H	α-helix	trans	-65.3	-42.7	176.8	172.2	0	0	0	0	110.4	M24 F31 L32 F44 F187	M24-V28 HydrophobicContact CG-CG2 4.45Å; M24-V28 VanDerWaalsContact O-CG2 3.31Å; M24-V28 WeakPolarHBondContact O-CG2 3.37Å; M24-V28 PolarHBondContact O-N 3.21Å; V28-F31 WeakPolarHBondContact O-CB 3.49Å; V28-F31 PolarHBondContact O-N 2.83Å; V28-L32 HydrophobicContact CG1-CD1 3.88Å; V28-L32 HydrophobicContact CG1-CG 4.21Å; V28-L32 WeakPolarHBondContact O-CB 2.89Å; V28-L32 VanDerWaalsContact O-CG 3.28Å; V28-L32 WeakPolarHBondContact O-CG 3.27Å; V28-L32 PolarHBondContact O-N 2.86Å; V28-F44 HydrophobicContact CB-CE1 4.17Å; V28-F44 HydrophobicContact CB-CZ 4.05Å; V28-F44 HydrophobicContact CG1-CD1 4.46Å; V28-F44 HydrophobicContact CG1-CD2 4.47Å; V28-F44 HydrophobicContact CG1-CE1 3.95Å; V28-F44 HydrophobicContact CG1-CE2 3.95Å; V28-F44 HydrophobicContact CG1-CZ 3.67Å; V28-F187 HydrophobicContact CG2-CD2 3.95Å; V28-F187 HydrophobicContact CG2-CE2 3.65Å; V28-F187 HydrophobicContact CG2-CZ 4.1Å
29	L	76.6	Confident	70.8	Confident	19 Å²	19	54.2 Å²	54.2	10%	0.099	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-49	176.2	-167.9	81.3	0	0	0	110.8	D25 E26 F31 L32 G33 H41 F44 K45 L49	D25-L29 VanDerWaalsContact O-CB 3.22Å; D25-L29 WeakPolarHBondContact O-CB 3.38Å; D25-L29 PolarHBondContact O-N 2.84Å; E26-L29 PolarHBondContact O-N 3.17Å; L29-F31 VanDerWaalsContact C-N 3.3Å; L29-F31 PolarHBondContact O-N 3.39Å; L29-L32 PolarHBondContact O-N 2.64Å; L29-G33 PolarHBondContact O-N 2.66Å; L29-H41 PolarHBondContact O-CD2 3.15Å; L29-H41 PolarHBondContact O-NE2 3.42Å; L29-F44 HydrophobicContact CB-CD1 4.44Å; L29-F44 HydrophobicContact CD1-CD1 3.9Å; L29-K45 HydrophobicContact CD1-CB 3.69Å; L29-K45 HydrophobicContact CD1-CG 4.21Å; L29-K45 HydrophobicContact CD2-CG 4.32Å; L29-L49 HydrophobicContact CB-CD1 4.04Å; L29-L49 HydrophobicContact CD2-CD1 3.95Å; L29-L49 HydrophobicContact CG-CD1 4.42Å
30	E	76.6	Confident	72.2	Confident	44 Å²	44	50.7 Å²	50.7	21%	0.206	30%	0.295	C	S	.	.	H	α-helix	trans	-56.7	-45.2	176.3	-178.9	176.9	-146.3	0	0	111.4	E26 C27 G33 R34 K182 D186	E26-E30 WeakPolarHBondContact O-CB 3.46Å; E26-E30 PolarHBondContact O-N 2.7Å; C27-E30 PolarHBondContact O-N 3.35Å; E30-G33 PolarHBondContact O-N 2.8Å; E30-R34 HydrophobicContact CG-CG 4.49Å; E30-R34 VanDerWaalsContact O-CG 3.27Å; E30-R34 WeakPolarHBondContact O-CG 3.36Å; E30-R34 PolarHBondContact O-N 3.32Å; E30-R34 IonicContact OE1-CZ 2.88Å; E30-R34 VanDerWaalsContact OE1-CZ 3.25Å; E30-R34 IonicContact OE1-NE 3.99Å; E30-R34 PolarHBondContact OE1-NE 3.32Å; E30-R34 IonicContact OE1-NH2 3.23Å; E30-R34 PolarHBondContact OE1-NH2 2.87Å; E30-K182 VanDerWaalsContact CD-NZ 3.33Å; E30-K182 WeakPolarHBondContact OE1-CE 3.25Å; E30-K182 IonicContact OE1-NZ 2.68Å; E30-K182 PolarHBondContact OE1-NZ 3.34Å; E30-K182 IonicContact OE2-NZ 2.98Å; E30-K182 PolarHBondContact OE2-NZ 3.37Å; E30-D186 PolarHBondContact OE2-N 3.16Å
31	F	80.5	Confident	73.2	Confident	48 Å²	48	46.6 Å²	46.6	21%	0.211	27%	0.273	C	S	.	.	H	α-helix	trans	-60.5	-51	176.6	172.2	-100.3	0	0	0	112.7	C27 V28 L29 G33 R34 A35 F187 D188	C27-F31 WeakPolarHBondContact O-CB 3.47Å; C27-F31 PolarHBondContact O-N 3.07Å; V28-F31 WeakPolarHBondContact O-CB 3.49Å; V28-F31 PolarHBondContact O-N 2.83Å; L29-F31 VanDerWaalsContact C-N 3.3Å; L29-F31 PolarHBondContact O-N 3.39Å; F31-G33 PolarHBondContact O-N 3.43Å; F31-R34 PolarHBondContact O-N 3.14Å; F31-R34 VanDerWaalsContact O-N 3.16Å; F31-A35 HydrophobicContact CE1-CB 4.43Å; F31-A35 HydrophobicContact CE2-CB 4.39Å; F31-A35 HydrophobicContact CZ-CB 4.24Å; F31-A35 VanDerWaalsContact O-CB 3.24Å; F31-A35 WeakPolarHBondContact O-CB 3.18Å; F31-A35 PolarHBondContact O-N 3.1Å; F31-F187 HydrophobicContact CB-CB 3.82Å; F31-F187 HydrophobicContact CB-CD1 3.93Å; F31-F187 HydrophobicContact CB-CG 4.2Å; F31-F187 AromaticContact CD1-CD1 3.98Å; F31-F187 HydrophobicContact CD1-CD1 3.98Å; F31-F187 HydrophobicContact CD1-CE1 4.26Å; F31-F187 AromaticContact CD2-CD1 3.98Å; F31-F187 HydrophobicContact CD2-CD1 3.98Å; F31-F187 HydrophobicContact CG-CB 4.37Å; F31-F187 AromaticContact CG-CD1 3.67Å; F31-F187 HydrophobicContact CG-CD1 3.67Å; F31-F187 HydrophobicContact CG-CE1 4.4Å; F31-F187 HydrophobicContact CG-CG 4.42Å; F31-D188 WeakPolarHBondContact CD2-OD1 3.41Å; F31-D188 WeakPolarHBondContact CE2-OD1 3.44Å
32	L	75.5	Confident	73.8	Confident	17 Å²	17	46.3 Å²	46.3	9%	0.089	27%	0.271	C	S	.	.	H	α-helix	trans	-59.6	-36.4	-179.5	-70.8	172.7	0	0	0	111.6	V28 L29 F37 V40 H41 F44	V28-L32 HydrophobicContact CG1-CD1 3.88Å; V28-L32 HydrophobicContact CG1-CG 4.21Å; V28-L32 WeakPolarHBondContact O-CB 2.89Å; V28-L32 VanDerWaalsContact O-CG 3.28Å; V28-L32 WeakPolarHBondContact O-CG 3.27Å; V28-L32 PolarHBondContact O-N 2.86Å; L29-L32 PolarHBondContact O-N 2.64Å; L32-F37 HydrophobicContact CD2-CB 3.99Å; L32-F37 HydrophobicContact CD2-CD2 4Å; L32-F37 HydrophobicContact CD2-CG 4.36Å; L32-F37 PolarHBondContact O-N 3.32Å; L32-V40 HydrophobicContact CD1-CG1 4Å; L32-V40 HydrophobicContact CD2-CB 4.4Å; L32-V40 HydrophobicContact CD2-CG1 4.03Å; L32-H41 HydrophobicContact CB-CB 3.99Å; L32-F44 HydrophobicContact CD1-CB 3.91Å; L32-F44 HydrophobicContact CD1-CD1 4.42Å; L32-F44 HydrophobicContact CD1-CD2 4.29Å; L32-F44 HydrophobicContact CD1-CG 3.96Å
33	G	73.6	Confident	74.3	Confident	9 Å²	9	48.8 Å²	48.8	9%	0.093	28%	0.278	C	S	.	.	H	α-helix	trans	-67.6	-45.6	176.4	0	0	0	0	0	112.1	L29 E30 F31 G36 H41	L29-G33 PolarHBondContact O-N 2.66Å; E30-G33 PolarHBondContact O-N 2.8Å; F31-G33 PolarHBondContact O-N 3.43Å; G33-G36 PolarHBondContact O-N 3.39Å; G33-H41 VanDerWaalsContact CA-CD2 3.44Å; G33-H41 WeakPolarHBondContact CA-CD2 3.43Å; G33-H41 PolarHBondContact N-CD2 2.92Å; G33-H41 VanDerWaalsContact N-CD2 3.26Å
34	R	72.7	Confident	74.8	Confident	16 Å²	16	45.2 Å²	45.2	6%	0.06	26%	0.261	C	S	.	.	H	α-helix	trans	-73.3	-30.1	-179.9	-66.9	-178.7	-173.6	-137.2	-0.6	114.1	E30 F31 G36 L176 L180 K182 G183 D184	E30-R34 HydrophobicContact CG-CG 4.49Å; E30-R34 VanDerWaalsContact O-CG 3.27Å; E30-R34 WeakPolarHBondContact O-CG 3.36Å; E30-R34 PolarHBondContact O-N 3.32Å; E30-R34 IonicContact OE1-CZ 2.88Å; E30-R34 VanDerWaalsContact OE1-CZ 3.25Å; E30-R34 IonicContact OE1-NE 3.99Å; E30-R34 PolarHBondContact OE1-NE 3.32Å; E30-R34 IonicContact OE1-NH2 3.23Å; E30-R34 PolarHBondContact OE1-NH2 2.87Å; F31-R34 PolarHBondContact O-N 3.14Å; F31-R34 VanDerWaalsContact O-N 3.16Å; R34-G36 PolarHBondContact O-N 3.06Å; R34-L176 HydrophobicContact CB-CD1 3.81Å; R34-L176 HydrophobicContact CG-CD1 3.57Å; R34-L176 HydrophobicContact CG-CD2 4.14Å; R34-L176 HydrophobicContact CG-CG 4.47Å; R34-L180 VanDerWaalsContact NH2-CD1 3.27Å; R34-K182 PolarHBondContact NH1-O 2.97Å; R34-K182 PolarHBondContact NH2-O 2.91Å; R34-G183 PolarHBondContact NH1-O 3.44Å; R34-D184 PolarHBondContact NH1-O 3.17Å
35	A	70.2	Confident	75.1	Confident	44 Å²	44	42.9 Å²	42.9	36%	0.364	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-1.4	178.1	0	0	0	0	0	113.4	F31 F37	F31-A35 HydrophobicContact CE1-CB 4.43Å; F31-A35 HydrophobicContact CE2-CB 4.39Å; F31-A35 HydrophobicContact CZ-CB 4.24Å; F31-A35 VanDerWaalsContact O-CB 3.24Å; F31-A35 WeakPolarHBondContact O-CB 3.18Å; F31-A35 PolarHBondContact O-N 3.1Å; A35-F37 VanDerWaalsContact C-N 3.32Å; A35-F37 HydrophobicContact CB-CD2 3.58Å; A35-F37 HydrophobicContact CB-CE2 3.67Å; A35-F37 PolarHBondContact O-N 3.24Å
36	G	68.6	Low	75.1	Confident	25 Å²	25	48 Å²	48	26%	0.258	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	10.8	178.7	0	0	0	0	0	114.4	G33 R34 S38 E66	G33-G36 PolarHBondContact O-N 3.39Å; R34-G36 PolarHBondContact O-N 3.06Å; G36-S38 PolarHBondContact O-N 2.95Å; G36-E66 WeakPolarHBondContact CA-OE2 3.35Å
37	F	73.7	Confident	75	Confident	110 Å²	110	51.4 Å²	51.4	48%	0.482	30%	0.297	S	S	.	.			trans	-77.7	57.6	178.2	-65	-58.9	0	0	0	112.1	L32 A35 A39 V40 H41	L32-F37 HydrophobicContact CD2-CB 3.99Å; L32-F37 HydrophobicContact CD2-CD2 4Å; L32-F37 HydrophobicContact CD2-CG 4.36Å; L32-F37 PolarHBondContact O-N 3.32Å; A35-F37 VanDerWaalsContact C-N 3.32Å; A35-F37 HydrophobicContact CB-CD2 3.58Å; A35-F37 HydrophobicContact CB-CE2 3.67Å; A35-F37 PolarHBondContact O-N 3.24Å; F37-A39 PolarHBondContact O-N 3.01Å; F37-V40 HydrophobicContact CB-CB 4.24Å; F37-V40 HydrophobicContact CB-CG2 4.47Å; F37-V40 PolarHBondContact O-N 3.13Å; F37-V40 VanDerWaalsContact O-N 3.12Å; F37-H41 VanDerWaalsContact O-CB 3.31Å; F37-H41 WeakPolarHBondContact O-CB 3.39Å; F37-H41 PolarHBondContact O-N 3.04Å
38	S	72.1	Confident	74.9	Confident	48 Å²	48	56.9 Å²	56.9	34%	0.336	31%	0.313	S	S	.	.	H	α-helix	trans	-46.7	-50.2	-172.1	165.8	0	0	0	0	115.2	G36 S42 R63	G36-S38 PolarHBondContact O-N 2.95Å; S38-S42 PolarHBondContact O-N 2.97Å; S38-S42 PolarHBondContact O-OG 3.34Å; S38-R63 VanDerWaalsContact CB-NE 3.27Å; S38-R63 PolarHBondContact OG-NE 3.08Å; S38-R63 PolarHBondContact OG-NH2 3.48Å
39	A	71.8	Confident	74.1	Confident	77 Å²	77	56 Å²	56	64%	0.636	31%	0.308	S	S	*	.	H	α-helix	trans	-68.2	-44.7	-177.7	0	0	0	0	0	111.3	F37 S42 Q43	F37-A39 PolarHBondContact O-N 3.01Å; A39-S42 PolarHBondContact O-N 3.01Å; A39-Q43 WeakPolarHBondContact O-CB 3.38Å; A39-Q43 PolarHBondContact O-N 3.38Å
40	V	77.4	Confident	73.1	Confident	74 Å²	74	60.6 Å²	60.6	45%	0.448	35%	0.348	S	S	.	.	H	α-helix	trans	-67	-41.2	178.4	-172	0	0	0	0	110.1	L32 F37 Q43 F44	L32-V40 HydrophobicContact CD1-CG1 4Å; L32-V40 HydrophobicContact CD2-CB 4.4Å; L32-V40 HydrophobicContact CD2-CG1 4.03Å; F37-V40 HydrophobicContact CB-CB 4.24Å; F37-V40 HydrophobicContact CB-CG2 4.47Å; F37-V40 PolarHBondContact O-N 3.13Å; F37-V40 VanDerWaalsContact O-N 3.12Å; V40-Q43 PolarHBondContact O-N 3.38Å; V40-F44 WeakPolarHBondContact O-CB 3.37Å; V40-F44 PolarHBondContact O-N 3.16Å
41	H	75.9	Confident	71.6	Confident	6 Å²	6	64.8 Å²	64.8	3%	0.028	36%	0.362	C	S	.	.	H	α-helix	trans	-57.1	-51.4	174.7	178.1	-88.7	0	0	0	111.6	L29 L32 G33 F37 Q43 F44 K45	L29-H41 PolarHBondContact O-CD2 3.15Å; L29-H41 PolarHBondContact O-NE2 3.42Å; L32-H41 HydrophobicContact CB-CB 3.99Å; G33-H41 VanDerWaalsContact CA-CD2 3.44Å; G33-H41 WeakPolarHBondContact CA-CD2 3.43Å; G33-H41 PolarHBondContact N-CD2 2.92Å; G33-H41 VanDerWaalsContact N-CD2 3.26Å; F37-H41 VanDerWaalsContact O-CB 3.31Å; F37-H41 WeakPolarHBondContact O-CB 3.39Å; F37-H41 PolarHBondContact O-N 3.04Å; H41-Q43 PolarHBondContact O-N 2.78Å; H41-F44 PolarHBondContact O-N 3.3Å; H41-K45 VanDerWaalsContact O-CB 3.29Å; H41-K45 WeakPolarHBondContact O-CB 3.34Å; H41-K45 PolarHBondContact O-N 3.17Å
42	S	74.6	Confident	69.9	Low	57 Å²	57	66.6 Å²	66.6	40%	0.399	38%	0.381	S	S	.	.	H	α-helix	trans	-63.8	-41.3	179.7	-66.3	0	0	0	0	112.2	S38 A39 T46	S38-S42 PolarHBondContact O-N 2.97Å; S38-S42 PolarHBondContact O-OG 3.34Å; A39-S42 PolarHBondContact O-N 3.01Å; S42-T46 WeakPolarHBondContact O-CB 3.34Å; S42-T46 PolarHBondContact O-N 3.37Å; S42-T46 PolarHBondContact O-OG1 3.49Å
43	Q	78.6	Confident	68.7	Low	112 Å²	112	68.8 Å²	68.8	52%	0.523	40%	0.401	S	S	.	.	H	α-helix	trans	-65.4	-48	176.2	-173.5	175.3	-1.1	0	0	111.2	A39 V40 H41 K45 T46 E47	A39-Q43 WeakPolarHBondContact O-CB 3.38Å; A39-Q43 PolarHBondContact O-N 3.38Å; V40-Q43 PolarHBondContact O-N 3.38Å; H41-Q43 PolarHBondContact O-N 2.78Å; Q43-K45 PolarHBondContact O-N 3.37Å; Q43-T46 PolarHBondContact O-N 2.7Å; Q43-T46 VanDerWaalsContact O-N 3.13Å; Q43-E47 HydrophobicContact CG-CG 4.38Å; Q43-E47 WeakPolarHBondContact CG-OE1 3.46Å; Q43-E47 PolarHBondContact NE2-OE1 2.98Å; Q43-E47 WeakPolarHBondContact O-CB 3.48Å; Q43-E47 WeakPolarHBondContact O-CG 3.46Å; Q43-E47 PolarHBondContact O-N 3.12Å
44	F	78.2	Confident	67.4	Low	38 Å²	38	75.2 Å²	75.2	17%	0.167	43%	0.434	C	S	.	.	H	α-helix	trans	-61.2	-43.3	178.9	-166	-86.9	0	0	0	111.6	D25 V28 L29 L32 V40 H41 T46 E47 R48	D25-F44 HydrophobicContact CB-CE1 4.02Å; D25-F44 HydrophobicContact CB-CZ 4.31Å; D25-F44 WeakPolarHBondContact O-CE1 3.26Å; D25-F44 WeakPolarHBondContact OD1-CZ 3.43Å; V28-F44 HydrophobicContact CB-CE1 4.17Å; V28-F44 HydrophobicContact CB-CZ 4.05Å; V28-F44 HydrophobicContact CG1-CD1 4.46Å; V28-F44 HydrophobicContact CG1-CD2 4.47Å; V28-F44 HydrophobicContact CG1-CE1 3.95Å; V28-F44 HydrophobicContact CG1-CE2 3.95Å; V28-F44 HydrophobicContact CG1-CZ 3.67Å; L29-F44 HydrophobicContact CB-CD1 4.44Å; L29-F44 HydrophobicContact CD1-CD1 3.9Å; L32-F44 HydrophobicContact CD1-CB 3.91Å; L32-F44 HydrophobicContact CD1-CD1 4.42Å; L32-F44 HydrophobicContact CD1-CD2 4.29Å; L32-F44 HydrophobicContact CD1-CG 3.96Å; V40-F44 WeakPolarHBondContact O-CB 3.37Å; V40-F44 PolarHBondContact O-N 3.16Å; H41-F44 PolarHBondContact O-N 3.3Å; F44-T46 PolarHBondContact O-N 3.18Å; F44-E47 PolarHBondContact O-N 3.43Å; F44-R48 HydrophobicContact CD1-CB 4.29Å; F44-R48 HydrophobicContact CD1-CG 4.38Å; F44-R48 HydrophobicContact CD2-CG 4.35Å; F44-R48 HydrophobicContact CE1-CB 4.05Å; F44-R48 HydrophobicContact CE1-CG 4.09Å; F44-R48 HydrophobicContact CE2-CG 4.07Å; F44-R48 HydrophobicContact CG-CG 4.5Å; F44-R48 HydrophobicContact CZ-CB 4.36Å; F44-R48 HydrophobicContact CZ-CG 3.93Å; F44-R48 WeakPolarHBondContact O-CB 3.48Å; F44-R48 PolarHBondContact O-N 2.91Å
45	K	76.7	Confident	66.5	Low	28 Å²	28	79.9 Å²	79.9	12%	0.122	46%	0.46	C	S	.	.	H	α-helix	trans	-54.2	-54.1	171.3	-163.2	175.9	-179.8	179.5	0	110	L29 H41 Q43 E47 L49 R51 D56	L29-K45 HydrophobicContact CD1-CB 3.69Å; L29-K45 HydrophobicContact CD1-CG 4.21Å; L29-K45 HydrophobicContact CD2-CG 4.32Å; H41-K45 VanDerWaalsContact O-CB 3.29Å; H41-K45 WeakPolarHBondContact O-CB 3.34Å; H41-K45 PolarHBondContact O-N 3.17Å; Q43-K45 PolarHBondContact O-N 3.37Å; K45-E47 VanDerWaalsContact C-N 3.32Å; K45-E47 PolarHBondContact O-N 3.45Å; K45-L49 CarbonylContact O-C 3.58Å; K45-L49 PolarHBondContact O-N 3.35Å; K45-R51 WeakPolarHBondContact CE-O 3.29Å; K45-D56 IonicContact NZ-OD1 3.32Å; K45-D56 PolarHBondContact NZ-OD1 2.86Å; K45-D56 IonicContact NZ-OD2 2.72Å
46	T	75.2	Confident	66.1	Low	120 Å²	120	80.5 Å²	80.5	74%	0.736	46%	0.457	S	S	*	.	H	α-helix	trans	-62.6	-37.8	-176.2	-51.7	0	0	0	0	112.7	S42 Q43 F44	S42-T46 WeakPolarHBondContact O-CB 3.34Å; S42-T46 PolarHBondContact O-N 3.37Å; S42-T46 PolarHBondContact O-OG1 3.49Å; Q43-T46 PolarHBondContact O-N 2.7Å; Q43-T46 VanDerWaalsContact O-N 3.13Å; F44-T46 PolarHBondContact O-N 3.18Å
47	E	75	Confident	66.2	Low	132 Å²	132	83.1 Å²	83.1	62%	0.617	47%	0.471	S	S	*	.	H	α-helix	trans	-82	-37.1	-176.5	-72.9	178.9	-173.3	0	0	113.9	Q43 F44 K45	Q43-E47 HydrophobicContact CG-CG 4.38Å; Q43-E47 WeakPolarHBondContact CG-OE1 3.46Å; Q43-E47 PolarHBondContact NE2-OE1 2.98Å; Q43-E47 WeakPolarHBondContact O-CB 3.48Å; Q43-E47 WeakPolarHBondContact O-CG 3.46Å; Q43-E47 PolarHBondContact O-N 3.12Å; F44-E47 PolarHBondContact O-N 3.43Å; K45-E47 VanDerWaalsContact C-N 3.32Å; K45-E47 PolarHBondContact O-N 3.45Å
48	R	70.6	Confident	65.8	Low	143 Å²	143	78.4 Å²	78.4	54%	0.54	45%	0.452	S	S	.	.	H	α-helix	trans	-110.4	-32.9	-168.7	-66.8	-78	-178.4	126.1	-7.4	114.2	D25 F44	D25-R48 HydrophobicContact CB-CB 4.45Å; D25-R48 IonicContact OD1-NH1 2.73Å; D25-R48 PolarHBondContact OD1-NH1 3.18Å; D25-R48 IonicContact OD2-NH1 3.21Å; F44-R48 HydrophobicContact CD1-CB 4.29Å; F44-R48 HydrophobicContact CD1-CG 4.38Å; F44-R48 HydrophobicContact CD2-CG 4.35Å; F44-R48 HydrophobicContact CE1-CB 4.05Å; F44-R48 HydrophobicContact CE1-CG 4.09Å; F44-R48 HydrophobicContact CE2-CG 4.07Å; F44-R48 HydrophobicContact CG-CG 4.5Å; F44-R48 HydrophobicContact CZ-CB 4.36Å; F44-R48 HydrophobicContact CZ-CG 3.93Å; F44-R48 WeakPolarHBondContact O-CB 3.48Å; F44-R48 PolarHBondContact O-N 2.91Å
49	L	62.4	Low	65.8	Low	10 Å²	10	77.2 Å²	77.2	5%	0.052	44%	0.442	C	S	.	.			trans	-135.3	96	-169.8	-69.5	170	0	0	0	109.8	T22 D25 E26 L29 K45 R51	T22-L49 HydrophobicContact CG2-CD2 3.83Å; D25-L49 HydrophobicContact CB-CD1 3.96Å; D25-L49 HydrophobicContact CB-CD2 4.2Å; D25-L49 HydrophobicContact CB-CG 4.04Å; E26-L49 HydrophobicContact CG-CD1 4.01Å; E26-L49 HydrophobicContact CG-CD2 4.31Å; L29-L49 HydrophobicContact CB-CD1 4.04Å; L29-L49 HydrophobicContact CD2-CD1 3.95Å; L29-L49 HydrophobicContact CG-CD1 4.42Å; K45-L49 CarbonylContact O-C 3.58Å; K45-L49 PolarHBondContact O-N 3.35Å; L49-R51 HydrophobicContact CB-CG 4.4Å; L49-R51 PolarHBondContact O-N 2.85Å
50	A	55.6	Low	66.3	Low	114 Å²	114	78.3 Å²	78.3	94%	0.942	43%	0.434	S	S	*	.			trans	-67.8	59.4	172.5	0	0	0	0	0	112
51	R	45.6	Very low	66.7	Low	132 Å²	132	75 Å²	75	50%	0.498	41%	0.414	S	S	.	.			trans	-100.5	139.7	-177.3	-79.8	-174	164.1	-161.1	-5.4	111.3	E26 K45 L49	E26-R51 IonicContact OE1-CZ 3.25Å; E26-R51 IonicContact OE1-NE 2.79Å; E26-R51 IonicContact OE1-NH1 3.6Å; E26-R51 IonicContact OE1-NH2 3.81Å; E26-R51 PolarHBondContact OE1-NH2 2.96Å; E26-R51 IonicContact OE2-CZ 2.94Å; E26-R51 IonicContact OE2-NH1 2.84Å; E26-R51 PolarHBondContact OE2-NH1 3.23Å; E26-R51 IonicContact OE2-NH2 2.64Å; E26-R51 PolarHBondContact OE2-NH2 3.18Å; K45-R51 WeakPolarHBondContact CE-O 3.29Å; L49-R51 HydrophobicContact CB-CG 4.4Å; L49-R51 PolarHBondContact O-N 2.85Å
52	S	43.2	Very low	67.1	Low	87 Å²	87	74.7 Å²	74.7	61%	0.608	41%	0.413	S	S	*	.			trans	-58.3	147.5	-179.2	-178.4	0	0	0	0	113	N54	S52-N54 PolarHBondContact O-N 3.46Å
53	A	50.9	Low	67.7	Low	62 Å²	62	74.5 Å²	74.5	51%	0.512	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-64.4	6.5	-176.5	0	0	0	0	0	116	D55 D56	A53-D55 VanDerWaalsContact C-N 3.34Å; A53-D55 PolarHBondContact O-N 3.45Å; A53-D56 WeakPolarHBondContact O-CB 3.36Å; A53-D56 PolarHBondContact O-N 3.17Å
54	N	46.9	Very low	68.3	Low	145 Å²	145	72.3 Å²	72.3	78%	0.775	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-79.1	-11.3	-166.9	-72.6	-10.3	0	0	0	115	S52 D56	S52-N54 PolarHBondContact O-N 3.46Å; N54-D56 VanDerWaalsContact C-N 3.34Å
55	D	54.1	Low	69	Low	114 Å²	114	70.5 Å²	70.5	61%	0.61	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-90.4	0.3	174.7	-131.2	8.9	0	0	0	113.1	A53 S57	A53-D55 VanDerWaalsContact C-N 3.34Å; A53-D55 PolarHBondContact O-N 3.45Å; D55-S57 VanDerWaalsContact C-N 3.3Å; D55-S57 PolarHBondContact O-N 2.86Å
56	D	62	Low	69.7	Low	56 Å²	56	70.3 Å²	70.3	30%	0.299	39%	0.385	S	S	.	.	H	α-helix	trans	-73.9	-17.6	-171.4	-68	-22.7	0	0	0	112.8	K45 A53 N54 L59 E60	K45-D56 IonicContact NZ-OD1 3.32Å; K45-D56 PolarHBondContact NZ-OD1 2.86Å; K45-D56 IonicContact NZ-OD2 2.72Å; A53-D56 WeakPolarHBondContact O-CB 3.36Å; A53-D56 PolarHBondContact O-N 3.17Å; N54-D56 VanDerWaalsContact C-N 3.34Å; D56-L59 PolarHBondContact O-N 3.49Å; D56-E60 WeakPolarHBondContact O-CB 3.5Å; D56-E60 PolarHBondContact O-N 3.32Å
57	S	68.9	Low	70.5	Confident	81 Å²	81	69.9 Å²	69.9	57%	0.566	37%	0.374	S	S	*	.	H	α-helix	trans	-64.4	-46	-176.9	167.6	0	0	0	0	113.8	D55 S61	D55-S57 VanDerWaalsContact C-N 3.3Å; D55-S57 PolarHBondContact O-N 2.86Å; S57-S61 PolarHBondContact O-N 2.93Å; S57-S61 VanDerWaalsContact O-N 3.11Å; S57-S61 PolarHBondContact O-OG 2.87Å
58	A	66	Low	71.6	Confident	10 Å²	10	65.2 Å²	65.2	8%	0.083	35%	0.353	C	S	.	.	H	α-helix	trans	-69.2	-42.5	179.9	0	0	0	0	0	110.4	S61 T62 E179	A58-S61 PolarHBondContact O-N 3.48Å; A58-T62 PolarHBondContact O-N 3.36Å; A58-T62 PolarHBondContact O-OG1 3.04Å; A58-E179 HydrophobicContact CB-CB 4.3Å; A58-E179 HydrophobicContact CB-CG 4.16Å
59	L	72.7	Confident	72.8	Confident	23 Å²	23	58.4 Å²	58.4	12%	0.12	33%	0.327	C	S	.	.	H	α-helix	trans	-65.8	-35.7	176.6	-64.4	178.5	0	0	0	112.8	D56 T62 R63	D56-L59 PolarHBondContact O-N 3.49Å; L59-T62 WeakPolarHBondContact O-CB 3.44Å; L59-T62 PolarHBondContact O-N 3.44Å; L59-R63 PolarHBondContact O-N 2.9Å
60	E	81.4	Confident	74.2	Confident	101 Å²	101	61.6 Å²	61.6	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-67	-40.9	175.3	-168.2	62.5	-163.8	0	0	110.9	D56 T62 R63 E64	D56-E60 WeakPolarHBondContact O-CB 3.5Å; D56-E60 PolarHBondContact O-N 3.32Å; E60-T62 VanDerWaalsContact C-N 3.3Å; E60-T62 PolarHBondContact O-N 3.39Å; E60-R63 WeakPolarHBondContact O-CB 3.37Å; E60-R63 PolarHBondContact O-N 3.48Å; E60-E64 PolarHBondContact O-N 2.96Å
61	S	86.5	Confident	76.1	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-39.6	174.5	-54.7	0	0	0	0	111.3	S57 A58 E64 I65 R84	S57-S61 PolarHBondContact O-N 2.93Å; S57-S61 VanDerWaalsContact O-N 3.11Å; S57-S61 PolarHBondContact O-OG 2.87Å; A58-S61 PolarHBondContact O-N 3.48Å; S61-E64 PolarHBondContact O-N 3.24Å; S61-I65 VanDerWaalsContact O-CG1 3.28Å; S61-I65 WeakPolarHBondContact O-CG1 3.28Å; S61-I65 PolarHBondContact O-N 3.43Å; S61-I65 VanDerWaalsContact O-N 3.09Å; S61-R84 PolarHBondContact OG-NH1 3.23Å
62	T	85.1	Confident	78.4	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-44.1	173.1	-62.4	0	0	0	0	111.7	A58 L59 E60 E64 I65 E66	A58-T62 PolarHBondContact O-N 3.36Å; A58-T62 PolarHBondContact O-OG1 3.04Å; L59-T62 WeakPolarHBondContact O-CB 3.44Å; L59-T62 PolarHBondContact O-N 3.44Å; E60-T62 VanDerWaalsContact C-N 3.3Å; E60-T62 PolarHBondContact O-N 3.39Å; T62-E64 PolarHBondContact O-N 2.96Å; T62-I65 PolarHBondContact O-N 3.05Å; T62-E66 HydrophobicContact CG2-CG 4.46Å; T62-E66 WeakPolarHBondContact CG2-OE1 3.47Å; T62-E66 WeakPolarHBondContact O-CB 3.46Å; T62-E66 VanDerWaalsContact O-CG 3.31Å; T62-E66 WeakPolarHBondContact O-CG 3.26Å; T62-E66 PolarHBondContact O-N 3.02Å
63	R	85.4	Confident	81	Confident	53 Å²	53	54.5 Å²	54.5	20%	0.2	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-42.6	175.9	-81.3	-173.2	178.9	89.8	-4.8	113	S38 L59 E60 I65 E66 Q67	S38-R63 VanDerWaalsContact CB-NE 3.27Å; S38-R63 PolarHBondContact OG-NE 3.08Å; S38-R63 PolarHBondContact OG-NH2 3.48Å; L59-R63 PolarHBondContact O-N 2.9Å; E60-R63 WeakPolarHBondContact O-CB 3.37Å; E60-R63 PolarHBondContact O-N 3.48Å; R63-I65 VanDerWaalsContact C-N 3.34Å; R63-E66 WeakPolarHBondContact O-CB 3.45Å; R63-E66 PolarHBondContact O-N 3.44Å; R63-Q67 WeakPolarHBondContact O-CB 3.3Å; R63-Q67 PolarHBondContact O-N 3.15Å
64	E	91.5	Very high	83.2	Confident	66 Å²	66	51.7 Å²	51.7	31%	0.308	27%	0.271	S	S	.	.	H	α-helix	trans	-64.8	-42	179.5	-162.6	73.3	-166.5	0	0	110.9	E60 S61 T62 Q67 H68 F80	E60-E64 PolarHBondContact O-N 2.96Å; S61-E64 PolarHBondContact O-N 3.24Å; T62-E64 PolarHBondContact O-N 2.96Å; E64-Q67 PolarHBondContact O-N 3.09Å; E64-H68 PolarHBondContact O-CD2 3.07Å; E64-H68 VanDerWaalsContact O-CD2 3.32Å; E64-H68 PolarHBondContact O-N 2.96Å; E64-H68 VanDerWaalsContact O-N 3.1Å; E64-H68 IonicContact OE1-NE2 3.18Å; E64-F80 HydrophobicContact CB-CE1 4.21Å; E64-F80 HydrophobicContact CB-CE2 4.02Å; E64-F80 HydrophobicContact CB-CZ 3.8Å; E64-F80 HydrophobicContact CG-CD2 3.95Å; E64-F80 HydrophobicContact CG-CE2 3.64Å; E64-F80 HydrophobicContact CG-CZ 3.97Å
65	I	92.5	Very high	85.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-47	174	-67.9	166.4	0	0	0	110.5	S61 T62 R63 Q67 H68 L69 F80 I81 L168 V171 W175	S61-I65 VanDerWaalsContact O-CG1 3.28Å; S61-I65 WeakPolarHBondContact O-CG1 3.28Å; S61-I65 PolarHBondContact O-N 3.43Å; S61-I65 VanDerWaalsContact O-N 3.09Å; T62-I65 PolarHBondContact O-N 3.05Å; R63-I65 VanDerWaalsContact C-N 3.34Å; I65-Q67 VanDerWaalsContact C-N 3.33Å; I65-Q67 PolarHBondContact O-N 3.38Å; I65-H68 PolarHBondContact O-N 3.38Å; I65-L69 HydrophobicContact CG2-CD1 3.74Å; I65-L69 HydrophobicContact CG2-CG 4.29Å; I65-L69 WeakPolarHBondContact O-CB 3.42Å; I65-L69 WeakPolarHBondContact O-CG 3.22Å; I65-L69 PolarHBondContact O-N 2.8Å; I65-F80 HydrophobicContact CD1-CD1 4.23Å; I65-F80 HydrophobicContact CD1-CE1 4.23Å; I65-F80 HydrophobicContact CG1-CD1 3.65Å; I65-F80 HydrophobicContact CG1-CE1 3.87Å; I65-I81 HydrophobicContact CD1-CD1 4.46Å; I65-I81 HydrophobicContact CD1-CG1 3.88Å; I65-I81 HydrophobicContact CG1-CG1 4.11Å; I65-L168 HydrophobicContact CG2-CD1 4.48Å; I65-V171 HydrophobicContact CG2-CG1 3.68Å; I65-W175 HydrophobicContact CD1-CB 4.45Å; I65-W175 HydrophobicContact CD1-CD2 3.7Å; I65-W175 HydrophobicContact CD1-CE3 3.85Å; I65-W175 HydrophobicContact CD1-CG 3.95Å; I65-W175 HydrophobicContact CD1-CZ3 4.43Å
66	E	91.4	Very high	87.6	Confident	23 Å²	23	44.3 Å²	44.3	11%	0.107	24%	0.235	C	C	.	.	H	α-helix	trans	-53.9	-49.1	175.3	-79.2	174.3	-174.6	0	0	111.8	G36 T62 R63 H68 L69 L70 L168 N172	G36-E66 WeakPolarHBondContact CA-OE2 3.35Å; T62-E66 HydrophobicContact CG2-CG 4.46Å; T62-E66 WeakPolarHBondContact CG2-OE1 3.47Å; T62-E66 WeakPolarHBondContact O-CB 3.46Å; T62-E66 VanDerWaalsContact O-CG 3.31Å; T62-E66 WeakPolarHBondContact O-CG 3.26Å; T62-E66 PolarHBondContact O-N 3.02Å; R63-E66 WeakPolarHBondContact O-CB 3.45Å; R63-E66 PolarHBondContact O-N 3.44Å; E66-H68 PolarHBondContact O-N 2.93Å; E66-L69 PolarHBondContact O-N 3.09Å; E66-L70 WeakPolarHBondContact O-CB 3.33Å; E66-L70 VanDerWaalsContact O-CG 3.26Å; E66-L70 WeakPolarHBondContact O-CG 3.44Å; E66-L70 PolarHBondContact O-N 3Å; E66-L168 HydrophobicContact CB-CD1 4.16Å; E66-L168 HydrophobicContact CB-CD2 4.39Å; E66-L168 HydrophobicContact CG-CD1 3.5Å; E66-L168 HydrophobicContact CG-CD2 3.83Å; E66-L168 HydrophobicContact CG-CG 4.15Å; E66-N172 PolarHBondContact OE1-ND2 3.43Å
67	Q	94	Very high	89.3	Confident	111 Å²	111	41.6 Å²	41.6	52%	0.519	22%	0.221	S	C	.	.	H	α-helix	trans	-61.1	-47.9	-178.3	-174.7	172.9	-3.7	0	0	111.6	R63 E64 I65 N71	R63-Q67 WeakPolarHBondContact O-CB 3.3Å; R63-Q67 PolarHBondContact O-N 3.15Å; E64-Q67 PolarHBondContact O-N 3.09Å; I65-Q67 VanDerWaalsContact C-N 3.33Å; I65-Q67 PolarHBondContact O-N 3.38Å; Q67-N71 WeakPolarHBondContact O-CB 3.47Å; Q67-N71 PolarHBondContact O-N 3.39Å; Q67-N71 PolarHBondContact O-ND2 3.11Å
68	H	96.2	Very high	90.6	Very high	35 Å²	35	38.9 Å²	38.9	16%	0.162	20%	0.2	C	C	.	.	H	α-helix	trans	-61.4	-47.7	177.2	-74.9	-50.1	0	0	0	112.1	E64 I65 E66 N71 G72 D73 S76 A77	E64-H68 PolarHBondContact O-CD2 3.07Å; E64-H68 VanDerWaalsContact O-CD2 3.32Å; E64-H68 PolarHBondContact O-N 2.96Å; E64-H68 VanDerWaalsContact O-N 3.1Å; E64-H68 IonicContact OE1-NE2 3.18Å; I65-H68 PolarHBondContact O-N 3.38Å; E66-H68 PolarHBondContact O-N 2.93Å; H68-N71 PolarHBondContact O-N 3.3Å; H68-G72 PolarHBondContact O-N 3.49Å; H68-D73 HydrophobicContact CB-CB 4.4Å; H68-D73 PolarHBondContact O-N 3.25Å; H68-S76 WeakPolarHBondContact ND1-CB 3.32Å; H68-A77 HydrophobicContact CB-CB 3.76Å
69	L	95.8	Very high	92.1	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-69	-39.7	-175.6	-67.2	-179.2	0	0	0	113	I65 E66 N71 G72 I74 A77 L99 R164 V167 L168 V171	I65-L69 HydrophobicContact CG2-CD1 3.74Å; I65-L69 HydrophobicContact CG2-CG 4.29Å; I65-L69 WeakPolarHBondContact O-CB 3.42Å; I65-L69 WeakPolarHBondContact O-CG 3.22Å; I65-L69 PolarHBondContact O-N 2.8Å; E66-L69 PolarHBondContact O-N 3.09Å; L69-N71 VanDerWaalsContact C-N 3.33Å; L69-N71 PolarHBondContact O-N 3.26Å; L69-G72 PolarHBondContact O-N 3.16Å; L69-I74 HydrophobicContact CD2-CD1 3.64Å; L69-I74 HydrophobicContact CD2-CG2 4.39Å; L69-A77 HydrophobicContact CD2-CB 3.47Å; L69-A77 VanDerWaalsContact CD2-CB 3.47Å; L69-A77 HydrophobicContact CG-CB 3.84Å; L69-L99 HydrophobicContact CD2-CD2 3.64Å; L69-R164 WeakPolarHBondContact O-CD 3.48Å; L69-V167 HydrophobicContact CD1-CG1 4.45Å; L69-V167 HydrophobicContact CD2-CG1 4.32Å; L69-L168 HydrophobicContact CB-CB 4.42Å; L69-L168 HydrophobicContact CB-CD1 4.38Å; L69-L168 HydrophobicContact CD1-CB 4.22Å; L69-L168 HydrophobicContact CD1-CD1 3.83Å; L69-V171 HydrophobicContact CD1-CB 4.04Å; L69-V171 HydrophobicContact CD1-CG1 4.26Å; L69-V171 HydrophobicContact CD1-CG2 4.09Å
70	L	92.8	Very high	93.2	Very high	77 Å²	77	46.4 Å²	46.4	40%	0.403	23%	0.225	S	C	.	.	H	α-helix	trans	-68.6	-33.2	178.4	-68.6	177.6	0	0	0	112.4	E66 G72 R164 I165 L168	E66-L70 WeakPolarHBondContact O-CB 3.33Å; E66-L70 VanDerWaalsContact O-CG 3.26Å; E66-L70 WeakPolarHBondContact O-CG 3.44Å; E66-L70 PolarHBondContact O-N 3Å; L70-G72 VanDerWaalsContact C-N 3.26Å; L70-G72 PolarHBondContact O-N 2.98Å; L70-R164 WeakPolarHBondContact O-CD 3.33Å; L70-R164 PolarHBondContact O-NH1 2.84Å; L70-I165 HydrophobicContact CD2-CG1 4.07Å; L70-L168 HydrophobicContact CD1-CD2 4.32Å; L70-L168 HydrophobicContact CD2-CD2 3.95Å; L70-L168 HydrophobicContact CG-CD2 4.04Å
71	N	94.8	Very high	93.9	Very high	92 Å²	92	41.6 Å²	41.6	49%	0.492	20%	0.203	S	C	.	.	H	α-helix	trans	-72.8	-19.4	174.1	-70.1	-19.1	0	0	0	112.9	Q67 H68 L69 R164	Q67-N71 WeakPolarHBondContact O-CB 3.47Å; Q67-N71 PolarHBondContact O-N 3.39Å; Q67-N71 PolarHBondContact O-ND2 3.11Å; H68-N71 PolarHBondContact O-N 3.3Å; L69-N71 VanDerWaalsContact C-N 3.33Å; L69-N71 PolarHBondContact O-N 3.26Å; N71-R164 PolarHBondContact O-NH1 3.41Å; N71-R164 PolarHBondContact O-NH2 3.28Å
72	G	95.1	Very high	94.3	Very high	10 Å²	10	44.4 Å²	44.4	10%	0.103	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	90	11	-174	0	0	0	0	0	113.4	H68 L69 L70 I74 E106	H68-G72 PolarHBondContact O-N 3.49Å; L69-G72 PolarHBondContact O-N 3.16Å; L70-G72 VanDerWaalsContact C-N 3.26Å; L70-G72 PolarHBondContact O-N 2.98Å; G72-I74 PolarHBondContact O-N 3.1Å; G72-E106 WeakPolarHBondContact O-CG 3.48Å
73	D	96.6	Very high	94.8	Very high	81 Å²	81	48.6 Å²	48.6	43%	0.433	25%	0.249	S	C	.	.			trans	-83.6	58.6	178.4	-61.7	-31.3	0	0	0	110.6	H68 D75 S76 A77	H68-D73 HydrophobicContact CB-CB 4.4Å; H68-D73 PolarHBondContact O-N 3.25Å; D73-D75 VanDerWaalsContact C-N 3.26Å; D73-D75 PolarHBondContact O-N 2.86Å; D73-S76 PolarHBondContact O-N 3.12Å; D73-S76 VanDerWaalsContact O-N 3.13Å; D73-A77 PolarHBondContact O-N 3.37Å; D73-A77 VanDerWaalsContact O-N 3.11Å
74	I	97.2	Very high	95.1	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.015	26%	0.264	C	S	.	.	H	α-helix	trans	-60.9	-37.8	-171	-48.3	-55.6	0	0	0	111.8	L69 G72 S76 A77 I78 L99 Q102 Q103 E106	L69-I74 HydrophobicContact CD2-CD1 3.64Å; L69-I74 HydrophobicContact CD2-CG2 4.39Å; G72-I74 PolarHBondContact O-N 3.1Å; I74-S76 VanDerWaalsContact C-N 3.34Å; I74-S76 PolarHBondContact O-N 3.48Å; I74-A77 WeakPolarHBondContact O-CB 3.49Å; I74-A77 PolarHBondContact O-N 3.19Å; I74-I78 HydrophobicContact CG2-CD1 4.19Å; I74-I78 WeakPolarHBondContact O-CG1 3.46Å; I74-I78 PolarHBondContact O-N 3.22Å; I74-L99 HydrophobicContact CG2-CB 4.27Å; I74-L99 HydrophobicContact CG2-CD2 3.73Å; I74-L99 WeakPolarHBondContact CG2-O 3.45Å; I74-Q102 HydrophobicContact CD1-CB 4.34Å; I74-Q102 HydrophobicContact CD1-CG 3.71Å; I74-Q102 HydrophobicContact CG1-CB 4.34Å; I74-Q102 HydrophobicContact CG1-CG 3.99Å; I74-Q103 HydrophobicContact CB-CB 3.93Å; I74-Q103 HydrophobicContact CB-CG 4.41Å; I74-Q103 HydrophobicContact CG1-CB 4.37Å; I74-Q103 HydrophobicContact CG2-CB 3.98Å; I74-E106 HydrophobicContact CD1-CG 4.47Å; I74-E106 HydrophobicContact CG1-CG 3.81Å
75	D	96.3	Very high	95.2	Very high	64 Å²	64	51.4 Å²	51.4	34%	0.342	26%	0.258	S	S	.	.	H	α-helix	trans	-61.6	-41.2	178.3	-169.7	80.3	0	0	0	112.6	D73 I78 R79 Q103	D73-D75 VanDerWaalsContact C-N 3.26Å; D73-D75 PolarHBondContact O-N 2.86Å; D75-I78 PolarHBondContact O-N 3.42Å; D75-R79 WeakPolarHBondContact O-CG 3.45Å; D75-R79 PolarHBondContact O-N 3.35Å; D75-R79 IonicContact OD2-CZ 3.02Å; D75-R79 IonicContact OD2-NE 3.89Å; D75-R79 PolarHBondContact OD2-NE 3.11Å; D75-R79 IonicContact OD2-NH2 2.63Å; D75-R79 PolarHBondContact OD2-NH2 3.19Å; D75-Q103 PolarHBondContact OD1-NE2 3.1Å
76	S	97.3	Very high	95.2	Very high	40 Å²	40	55.2 Å²	55.2	28%	0.28	28%	0.282	S	S	.	.	H	α-helix	trans	-67.1	-39.2	174.8	-66.6	0	0	0	0	111.4	H68 D73 I74 R79 F80	H68-S76 WeakPolarHBondContact ND1-CB 3.32Å; D73-S76 PolarHBondContact O-N 3.12Å; D73-S76 VanDerWaalsContact O-N 3.13Å; I74-S76 VanDerWaalsContact C-N 3.34Å; I74-S76 PolarHBondContact O-N 3.48Å; S76-R79 PolarHBondContact O-N 2.98Å; S76-F80 WeakPolarHBondContact O-CB 3.38Å; S76-F80 PolarHBondContact O-N 3.13Å
77	A	97.1	Very high	95.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.6	-46.1	174.6	0	0	0	0	0	111.6	H68 L69 D73 I74 F80 I81	H68-A77 HydrophobicContact CB-CB 3.76Å; L69-A77 HydrophobicContact CD2-CB 3.47Å; L69-A77 VanDerWaalsContact CD2-CB 3.47Å; L69-A77 HydrophobicContact CG-CB 3.84Å; D73-A77 PolarHBondContact O-N 3.37Å; D73-A77 VanDerWaalsContact O-N 3.11Å; I74-A77 WeakPolarHBondContact O-CB 3.49Å; I74-A77 PolarHBondContact O-N 3.19Å; A77-F80 PolarHBondContact O-N 3.35Å; A77-I81 WeakPolarHBondContact O-CD1 3.42Å; A77-I81 VanDerWaalsContact O-CG1 3.26Å; A77-I81 WeakPolarHBondContact O-CG1 3.34Å; A77-I81 PolarHBondContact O-N 2.9Å
78	I	96.8	Very high	95.4	Very high	24 Å²	24	56.3 Å²	56.3	12%	0.123	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-50.5	176.5	-68.1	167.3	0	0	0	110.1	I74 D75 F80 I81 V82 L89 L99 L100	I74-I78 HydrophobicContact CG2-CD1 4.19Å; I74-I78 WeakPolarHBondContact O-CG1 3.46Å; I74-I78 PolarHBondContact O-N 3.22Å; D75-I78 PolarHBondContact O-N 3.42Å; I78-F80 VanDerWaalsContact C-N 3.3Å; I78-F80 PolarHBondContact O-N 3.26Å; I78-I81 PolarHBondContact O-N 2.63Å; I78-V82 HydrophobicContact CG2-CG2 4.25Å; I78-V82 WeakPolarHBondContact O-CG2 3.39Å; I78-V82 PolarHBondContact O-N 3.45Å; I78-L89 HydrophobicContact CG2-CD1 4.15Å; I78-L99 HydrophobicContact CD1-CB 4.21Å; I78-L99 HydrophobicContact CG1-CB 4.3Å; I78-L99 HydrophobicContact CG1-CD1 4.15Å; I78-L99 HydrophobicContact CG1-CD2 4.4Å; I78-L100 HydrophobicContact CD1-CD2 4.24Å
79	R	97	Very high	95.3	Very high	158 Å²	158	54.8 Å²	54.8	60%	0.596	28%	0.281	S	S	*	.	H	α-helix	trans	-59.4	-41.1	179.2	-76.7	-170.3	-87	171.8	-4.7	112.1	D75 S76 S83	D75-R79 WeakPolarHBondContact O-CG 3.45Å; D75-R79 PolarHBondContact O-N 3.35Å; D75-R79 IonicContact OD2-CZ 3.02Å; D75-R79 IonicContact OD2-NE 3.89Å; D75-R79 PolarHBondContact OD2-NE 3.11Å; D75-R79 IonicContact OD2-NH2 2.63Å; D75-R79 PolarHBondContact OD2-NH2 3.19Å; S76-R79 PolarHBondContact O-N 2.98Å; R79-S83 VanDerWaalsContact O-CB 3.25Å; R79-S83 WeakPolarHBondContact O-CB 3.4Å; R79-S83 PolarHBondContact O-N 3.44Å; R79-S83 PolarHBondContact O-OG 3.35Å
80	F	96.1	Very high	95.1	Very high	32 Å²	32	60.4 Å²	60.4	14%	0.14	31%	0.311	C	S	.	.	H	α-helix	trans	-60.7	-50.1	176.2	-177.4	-92.3	0	0	0	111.2	E64 I65 S76 A77 I78 S83 R84	E64-F80 HydrophobicContact CB-CE1 4.21Å; E64-F80 HydrophobicContact CB-CE2 4.02Å; E64-F80 HydrophobicContact CB-CZ 3.8Å; E64-F80 HydrophobicContact CG-CD2 3.95Å; E64-F80 HydrophobicContact CG-CE2 3.64Å; E64-F80 HydrophobicContact CG-CZ 3.97Å; I65-F80 HydrophobicContact CD1-CD1 4.23Å; I65-F80 HydrophobicContact CD1-CE1 4.23Å; I65-F80 HydrophobicContact CG1-CD1 3.65Å; I65-F80 HydrophobicContact CG1-CE1 3.87Å; S76-F80 WeakPolarHBondContact O-CB 3.38Å; S76-F80 PolarHBondContact O-N 3.13Å; A77-F80 PolarHBondContact O-N 3.35Å; I78-F80 VanDerWaalsContact C-N 3.3Å; I78-F80 PolarHBondContact O-N 3.26Å; F80-S83 PolarHBondContact O-N 3.45Å; F80-S83 PolarHBondContact O-OG 3.48Å; F80-R84 PolarHBondContact O-N 2.92Å
81	I	95.6	Very high	95.2	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-60.4	-51.3	179.9	-66.4	161.6	0	0	0	110.5	I65 A77 I78 S83 R84 K85 L88 L89 V171 W175	I65-I81 HydrophobicContact CD1-CD1 4.46Å; I65-I81 HydrophobicContact CD1-CG1 3.88Å; I65-I81 HydrophobicContact CG1-CG1 4.11Å; A77-I81 WeakPolarHBondContact O-CD1 3.42Å; A77-I81 VanDerWaalsContact O-CG1 3.26Å; A77-I81 WeakPolarHBondContact O-CG1 3.34Å; A77-I81 PolarHBondContact O-N 2.9Å; I78-I81 PolarHBondContact O-N 2.63Å; I81-S83 VanDerWaalsContact C-N 3.29Å; I81-S83 PolarHBondContact O-N 3.24Å; I81-R84 PolarHBondContact O-N 2.9Å; I81-R84 VanDerWaalsContact O-N 3.14Å; I81-K85 CarbonylContact O-C 3.59Å; I81-K85 PolarHBondContact O-N 3.42Å; I81-L88 HydrophobicContact CG2-CB 4.48Å; I81-L88 HydrophobicContact CG2-CD2 4Å; I81-L89 HydrophobicContact CB-CD1 4.38Å; I81-L89 HydrophobicContact CG2-CD1 4.07Å; I81-L89 HydrophobicContact CG2-CD2 4.31Å; I81-L89 HydrophobicContact CG2-CG 3.9Å; I81-V171 HydrophobicContact CD1-CG1 3.54Å; I81-W175 HydrophobicContact CG1-CE3 4.5Å; I81-W175 HydrophobicContact CG2-CE3 4.38Å; I81-W175 HydrophobicContact CG2-CZ3 4.21Å
82	V	95.6	Very high	95.1	Very high	62 Å²	62	60.3 Å²	60.3	38%	0.376	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-36.3	-179.3	173.1	0	0	0	0	111.5	I78 R84 P86 L89	I78-V82 HydrophobicContact CG2-CG2 4.25Å; I78-V82 WeakPolarHBondContact O-CG2 3.39Å; I78-V82 PolarHBondContact O-N 3.45Å; V82-R84 PolarHBondContact O-N 2.99Å; V82-P86 VanDerWaalsContact O-CA 3.31Å; V82-P86 WeakPolarHBondContact O-CA 3.44Å; V82-P86 WeakPolarHBondContact O-CG 3.28Å; V82-L89 HydrophobicContact CG2-CD1 4.13Å
83	S	95.8	Very high	94.9	Very high	89 Å²	89	62.7 Å²	62.7	62%	0.622	33%	0.325	S	S	*	.	H	α-helix	trans	-64.1	-27.7	178.7	76.3	0	0	0	0	113.6	R79 F80 I81	R79-S83 VanDerWaalsContact O-CB 3.25Å; R79-S83 WeakPolarHBondContact O-CB 3.4Å; R79-S83 PolarHBondContact O-N 3.44Å; R79-S83 PolarHBondContact O-OG 3.35Å; F80-S83 PolarHBondContact O-N 3.45Å; F80-S83 PolarHBondContact O-OG 3.48Å; I81-S83 VanDerWaalsContact C-N 3.29Å; I81-S83 PolarHBondContact O-N 3.24Å
84	R	92.9	Very high	94.6	Very high	134 Å²	134	65 Å²	65	51%	0.506	34%	0.337	S	S	.	.	H	α-helix	trans	-100.5	-38.7	-178.9	-66.7	-152.3	-178.9	-150.1	4	113	S61 F80 I81 V82 W175	S61-R84 PolarHBondContact OG-NH1 3.23Å; F80-R84 PolarHBondContact O-N 2.92Å; I81-R84 PolarHBondContact O-N 2.9Å; I81-R84 VanDerWaalsContact O-N 3.14Å; V82-R84 PolarHBondContact O-N 2.99Å; R84-W175 HydrophobicContact CB-CH2 3.75Å; R84-W175 HydrophobicContact CB-CZ3 4.46Å
85	K	92.6	Very high	94.5	Very high	44 Å²	44	65.9 Å²	65.9	19%	0.191	34%	0.343	C	S	.	.			trans	-136.3	83.3	-179.6	-68.5	-173.7	158.3	168.3	0	109.6	I81 E87 L88 W175 S178 E179	I81-K85 CarbonylContact O-C 3.59Å; I81-K85 PolarHBondContact O-N 3.42Å; K85-E87 VanDerWaalsContact C-N 3.28Å; K85-E87 PolarHBondContact O-N 3.19Å; K85-L88 HydrophobicContact CB-CB 3.78Å; K85-L88 HydrophobicContact CB-CD2 4.31Å; K85-L88 HydrophobicContact CD-CD2 4.16Å; K85-L88 WeakPolarHBondContact O-CB 3.46Å; K85-L88 PolarHBondContact O-N 3.01Å; K85-L88 VanDerWaalsContact O-N 3.16Å; K85-W175 HydrophobicContact CB-CZ3 4.21Å; K85-W175 HydrophobicContact CD-CE3 4.33Å; K85-W175 HydrophobicContact CD-CH2 4.02Å; K85-W175 HydrophobicContact CD-CZ3 3.84Å; K85-W175 HydrophobicContact CG-CH2 4.1Å; K85-W175 HydrophobicContact CG-CZ3 4.04Å; K85-S178 PolarHBondContact NZ-O 3.2Å; K85-S178 VanDerWaalsContact NZ-O 3.09Å; K85-S178 PolarHBondContact NZ-OG 2.86Å; K85-E179 WeakPolarHBondContact CE-OE1 3.39Å; K85-E179 IonicContact NZ-OE1 2.59Å; K85-E179 PolarHBondContact NZ-OE1 3.43Å; K85-E179 IonicContact NZ-OE2 2.87Å
86	P	92.7	Very high	94.4	Very high	79 Å²	79	64.5 Å²	64.5	51%	0.513	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-40.4	-172.4	-24.1	32.3	0	0	0	113.3	V82	V82-P86 VanDerWaalsContact O-CA 3.31Å; V82-P86 WeakPolarHBondContact O-CA 3.44Å; V82-P86 WeakPolarHBondContact O-CG 3.28Å
87	E	94.1	Very high	94.2	Very high	139 Å²	139	63.6 Å²	63.6	65%	0.65	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-10.4	-174.4	-60.1	178.7	177.8	0	0	112.9	K85 L89 D90 D91	K85-E87 VanDerWaalsContact C-N 3.28Å; K85-E87 PolarHBondContact O-N 3.19Å; E87-L89 PolarHBondContact O-N 3.45Å; E87-D90 PolarHBondContact O-N 3.2Å; E87-D91 WeakPolarHBondContact O-CB 3.38Å; E87-D91 PolarHBondContact O-N 3.03Å
88	L	94.5	Very high	94.1	Very high	19 Å²	19	66.5 Å²	66.5	10%	0.099	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-41	-170.2	-174.5	65.2	0	0	0	112.8	I81 K85 N92 L174 W175	I81-L88 HydrophobicContact CG2-CB 4.48Å; I81-L88 HydrophobicContact CG2-CD2 4Å; K85-L88 HydrophobicContact CB-CB 3.78Å; K85-L88 HydrophobicContact CB-CD2 4.31Å; K85-L88 HydrophobicContact CD-CD2 4.16Å; K85-L88 WeakPolarHBondContact O-CB 3.46Å; K85-L88 PolarHBondContact O-N 3.01Å; K85-L88 VanDerWaalsContact O-N 3.16Å; L88-N92 WeakPolarHBondContact O-CB 3.38Å; L88-N92 PolarHBondContact O-ND2 3.29Å; L88-L174 HydrophobicContact CD1-CD1 3.93Å; L88-L174 HydrophobicContact CD1-CD2 4.32Å; L88-L174 HydrophobicContact CD1-CG 3.92Å; L88-L174 HydrophobicContact CD2-CG 4.32Å; L88-L174 HydrophobicContact CG-CD2 4.05Å; L88-L174 HydrophobicContact CG-CG 4.06Å; L88-W175 HydrophobicContact CD2-CE3 3.67Å; L88-W175 HydrophobicContact CD2-CZ3 4.14Å
89	L	94.4	Very high	94.1	Very high	3 Å²	3	65.3 Å²	65.3	2%	0.016	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-29.1	179	-64.8	-178.6	0	0	0	112.2	I78 I81 V82 E87 N92 V95 L96 L99 L174	I78-L89 HydrophobicContact CG2-CD1 4.15Å; I81-L89 HydrophobicContact CB-CD1 4.38Å; I81-L89 HydrophobicContact CG2-CD1 4.07Å; I81-L89 HydrophobicContact CG2-CD2 4.31Å; I81-L89 HydrophobicContact CG2-CG 3.9Å; V82-L89 HydrophobicContact CG2-CD1 4.13Å; E87-L89 PolarHBondContact O-N 3.45Å; L89-N92 CarbonylContact O-C 3.14Å; L89-N92 VanDerWaalsContact O-C 3.23Å; L89-N92 PolarHBondContact O-N 3.47Å; L89-V95 HydrophobicContact CD2-CG1 4.33Å; L89-L96 HydrophobicContact CB-CB 4.32Å; L89-L96 HydrophobicContact CB-CD1 4.39Å; L89-L96 HydrophobicContact CD1-CD1 4.16Å; L89-L99 HydrophobicContact CD1-CD1 4.18Å; L89-L99 HydrophobicContact CD2-CD1 3.95Å; L89-L174 HydrophobicContact CD2-CD2 4.42Å
90	D	92.9	Very high	94	Very high	118 Å²	118	58.6 Å²	58.6	63%	0.631	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-41.4	176.4	-70.4	-16.8	0	0	0	110.9	E87 N92	E87-D90 PolarHBondContact O-N 3.2Å; D90-N92 PolarHBondContact O-N 3.34Å
91	D	93.5	Very high	94	Very high	113 Å²	113	58.7 Å²	58.7	60%	0.604	31%	0.311	S	S	*	.	S	Bend	trans	-71.3	-17.3	175.1	-71.8	-18.4	0	0	0	113	E87 P93	E87-D91 WeakPolarHBondContact O-CB 3.38Å; E87-D91 PolarHBondContact O-N 3.03Å; D91-P93 VanDerWaalsContact C-CD 3.44Å; D91-P93 WeakPolarHBondContact O-CD 3.49Å
92	N	93.4	Very high	94.1	Very high	54 Å²	54	59 Å²	59	29%	0.289	31%	0.312	S	S	.	.			trans	-127.1	65.9	-174.9	-63.1	-88.9	0	0	0	111.4	L88 L89 D90 D94 V95 L96 L174	L88-N92 WeakPolarHBondContact O-CB 3.38Å; L88-N92 PolarHBondContact O-ND2 3.29Å; L89-N92 CarbonylContact O-C 3.14Å; L89-N92 VanDerWaalsContact O-C 3.23Å; L89-N92 PolarHBondContact O-N 3.47Å; D90-N92 PolarHBondContact O-N 3.34Å; N92-D94 PolarHBondContact O-N 2.84Å; N92-D94 VanDerWaalsContact O-N 3.08Å; N92-V95 HydrophobicContact CB-CB 4.42Å; N92-V95 HydrophobicContact CB-CG2 4.44Å; N92-V95 PolarHBondContact O-N 3.36Å; N92-L96 PolarHBondContact O-N 3.06Å; N92-L174 HydrophobicContact CB-CD1 4.25Å; N92-L174 HydrophobicContact CB-CD2 3.64Å; N92-L174 VanDerWaalsContact CG-CD1 3.49Å
93	P	91.2	Very high	94.1	Very high	60 Å²	60	57.2 Å²	57.2	39%	0.39	30%	0.3	S	S	.	.	H	α-helix	trans	-63.1	-21.2	-171.5	25	-35.7	0	0	0	114.3	D91 F97 K127	D91-P93 VanDerWaalsContact C-CD 3.44Å; D91-P93 WeakPolarHBondContact O-CD 3.49Å; P93-F97 WeakPolarHBondContact O-CB 3.28Å; P93-F97 PolarHBondContact O-N 3.34Å; P93-K127 PolarHBondContact O-NZ 3.3Å
94	D	90.7	Very high	94.1	Very high	129 Å²	129	53 Å²	53	69%	0.69	27%	0.27	S	S	*	.	H	α-helix	trans	-72.1	-41	175.6	-66.5	-31.5	0	0	0	111.7	N92 F97 I98	N92-D94 PolarHBondContact O-N 2.84Å; N92-D94 VanDerWaalsContact O-N 3.08Å; D94-F97 WeakPolarHBondContact O-CB 3.49Å; D94-F97 PolarHBondContact O-N 3.37Å; D94-I98 WeakPolarHBondContact O-CG1 3.43Å; D94-I98 PolarHBondContact O-N 3.42Å
95	V	93.6	Very high	94.3	Very high	22 Å²	22	46.8 Å²	46.8	13%	0.133	25%	0.247	C	C	.	.	H	α-helix	trans	-70	-41.7	176.9	177.7	0	0	0	0	110.1	L89 N92 F97 I98 L99 V171 L174	L89-V95 HydrophobicContact CD2-CG1 4.33Å; N92-V95 HydrophobicContact CB-CB 4.42Å; N92-V95 HydrophobicContact CB-CG2 4.44Å; N92-V95 PolarHBondContact O-N 3.36Å; V95-F97 VanDerWaalsContact C-N 3.28Å; V95-F97 PolarHBondContact O-N 2.91Å; V95-I98 PolarHBondContact O-N 2.61Å; V95-L99 HydrophobicContact CG1-CD1 4.42Å; V95-L99 PolarHBondContact O-N 3.43Å; V95-V171 HydrophobicContact CG1-CG2 3.87Å; V95-L174 HydrophobicContact CB-CD2 3.93Å; V95-L174 HydrophobicContact CG1-CD2 3.89Å; V95-L174 HydrophobicContact CG2-CD2 3.94Å
96	L	94.7	Very high	94.5	Very high	35 Å²	35	45.5 Å²	45.5	18%	0.183	24%	0.242	C	C	.	.	H	α-helix	trans	-58.1	-42.2	172	179.6	59.3	0	0	0	111.3	L89 N92 I98 L99 L100	L89-L96 HydrophobicContact CB-CB 4.32Å; L89-L96 HydrophobicContact CB-CD1 4.39Å; L89-L96 HydrophobicContact CD1-CD1 4.16Å; N92-L96 PolarHBondContact O-N 3.06Å; L96-I98 PolarHBondContact O-N 3.39Å; L96-L99 WeakPolarHBondContact O-CB 3.47Å; L96-L99 PolarHBondContact O-N 3.32Å; L96-L100 HydrophobicContact CD1-CD1 4.12Å; L96-L100 HydrophobicContact CD1-CG 4.08Å; L96-L100 HydrophobicContact CG-CD1 3.91Å; L96-L100 HydrophobicContact CG-CG 4.33Å; L96-L100 VanDerWaalsContact O-CG 3.28Å; L96-L100 WeakPolarHBondContact O-CG 3.26Å; L96-L100 PolarHBondContact O-N 3.42Å
97	F	93.4	Very high	94.7	Very high	21 Å²	21	43.2 Å²	43.2	9%	0.092	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-43.3	176.7	176.9	-103.4	0	0	0	112.4	P93 D94 V95 L99 L100 K101 L124 K127 V134 L138	P93-F97 WeakPolarHBondContact O-CB 3.28Å; P93-F97 PolarHBondContact O-N 3.34Å; D94-F97 WeakPolarHBondContact O-CB 3.49Å; D94-F97 PolarHBondContact O-N 3.37Å; V95-F97 VanDerWaalsContact C-N 3.28Å; V95-F97 PolarHBondContact O-N 2.91Å; F97-L99 VanDerWaalsContact C-N 3.32Å; F97-L99 PolarHBondContact O-N 3.19Å; F97-L100 PolarHBondContact O-N 2.95Å; F97-K101 HydrophobicContact CE1-CD 4.18Å; F97-K101 HydrophobicContact CZ-CB 4.44Å; F97-K101 HydrophobicContact CZ-CD 4.24Å; F97-K101 VanDerWaalsContact O-CB 3.3Å; F97-K101 WeakPolarHBondContact O-CB 3.34Å; F97-K101 PolarHBondContact O-N 3.32Å; F97-L124 HydrophobicContact CD2-CD2 3.88Å; F97-L124 HydrophobicContact CE2-CD2 3.62Å; F97-K127 HydrophobicContact CB-CD 4.02Å; F97-K127 HydrophobicContact CD2-CB 4.07Å; F97-K127 HydrophobicContact CD2-CD 3.58Å; F97-K127 HydrophobicContact CD2-CG 4.48Å; F97-K127 HydrophobicContact CE2-CB 4.3Å; F97-K127 HydrophobicContact CG-CD 4.18Å; F97-V134 HydrophobicContact CE1-CG1 3.97Å; F97-V134 HydrophobicContact CE1-CG2 3.98Å; F97-V134 HydrophobicContact CE2-CG1 3.77Å; F97-V134 HydrophobicContact CZ-CB 4.33Å; F97-V134 HydrophobicContact CZ-CG1 3.31Å; F97-V134 HydrophobicContact CZ-CG2 4.2Å; F97-L138 HydrophobicContact CE2-CD1 4.38Å; F97-L138 HydrophobicContact CZ-CD1 4.41Å; F97-L138 HydrophobicContact CZ-CD2 4.4Å; F97-L138 HydrophobicContact CZ-CG 4.46Å
98	I	94.2	Very high	94.7	Very high	60 Å²	60	36.9 Å²	36.9	31%	0.308	20%	0.196	S	C	.	.	H	α-helix	trans	-61.4	-41.6	177.1	-69	166.5	0	0	0	111	D94 V95 L96 Q102 V167	D94-I98 WeakPolarHBondContact O-CG1 3.43Å; D94-I98 PolarHBondContact O-N 3.42Å; V95-I98 PolarHBondContact O-N 2.61Å; L96-I98 PolarHBondContact O-N 3.39Å; I98-Q102 PolarHBondContact O-N 2.96Å; I98-V167 HydrophobicContact CG2-CB 4.16Å; I98-V167 HydrophobicContact CG2-CG1 4.2Å; I98-V167 HydrophobicContact CG2-CG2 3.6Å
99	L	96.8	Very high	94.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.5	-53.9	173.9	-81.3	163.1	0	0	0	111.6	L69 I74 I78 L89 V95 L96 F97 K101 Q102 Q103 V167 V171	L69-L99 HydrophobicContact CD2-CD2 3.64Å; I74-L99 HydrophobicContact CG2-CB 4.27Å; I74-L99 HydrophobicContact CG2-CD2 3.73Å; I74-L99 WeakPolarHBondContact CG2-O 3.45Å; I78-L99 HydrophobicContact CD1-CB 4.21Å; I78-L99 HydrophobicContact CG1-CB 4.3Å; I78-L99 HydrophobicContact CG1-CD1 4.15Å; I78-L99 HydrophobicContact CG1-CD2 4.4Å; L89-L99 HydrophobicContact CD1-CD1 4.18Å; L89-L99 HydrophobicContact CD2-CD1 3.95Å; V95-L99 HydrophobicContact CG1-CD1 4.42Å; V95-L99 PolarHBondContact O-N 3.43Å; L96-L99 WeakPolarHBondContact O-CB 3.47Å; L96-L99 PolarHBondContact O-N 3.32Å; F97-L99 VanDerWaalsContact C-N 3.32Å; F97-L99 PolarHBondContact O-N 3.19Å; L99-K101 VanDerWaalsContact C-N 3.3Å; L99-K101 PolarHBondContact O-N 3.43Å; L99-Q102 WeakPolarHBondContact O-CB 3.29Å; L99-Q102 PolarHBondContact O-N 3.27Å; L99-Q103 PolarHBondContact O-N 3.15Å; L99-V167 HydrophobicContact CD2-CG1 3.72Å; L99-V167 HydrophobicContact CG-CG1 4.17Å; L99-V171 HydrophobicContact CD1-CG2 3.87Å; L99-V171 HydrophobicContact CD2-CG2 3.92Å; L99-V171 HydrophobicContact CG-CG2 3.89Å
100	L	95.7	Very high	94.7	Very high	16 Å²	16	42 Å²	42	8%	0.084	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-40	-179.9	-65.7	169.9	0	0	0	111.6	I78 L96 F97 Q102 Q103 F104 F119 L124	I78-L100 HydrophobicContact CD1-CD2 4.24Å; L96-L100 HydrophobicContact CD1-CD1 4.12Å; L96-L100 HydrophobicContact CD1-CG 4.08Å; L96-L100 HydrophobicContact CG-CD1 3.91Å; L96-L100 HydrophobicContact CG-CG 4.33Å; L96-L100 VanDerWaalsContact O-CG 3.28Å; L96-L100 WeakPolarHBondContact O-CG 3.26Å; L96-L100 PolarHBondContact O-N 3.42Å; F97-L100 PolarHBondContact O-N 2.95Å; L100-Q102 VanDerWaalsContact C-N 3.32Å; L100-Q102 PolarHBondContact O-N 3.17Å; L100-Q103 WeakPolarHBondContact O-CB 3.43Å; L100-Q103 PolarHBondContact O-N 3.48Å; L100-F104 PolarHBondContact O-N 2.89Å; L100-F119 HydrophobicContact CB-CE1 4.38Å; L100-F119 HydrophobicContact CB-CZ 4.26Å; L100-F119 HydrophobicContact CD2-CE2 4.35Å; L100-F119 HydrophobicContact CD2-CZ 3.64Å; L100-F119 WeakPolarHBondContact O-CE1 3.45Å; L100-L124 HydrophobicContact CB-CD2 3.71Å
101	K	95.5	Very high	94.7	Very high	34 Å²	34	44.2 Å²	44.2	15%	0.148	23%	0.229	C	C	.	.	H	α-helix	trans	-60.3	-42.8	174.5	-171.5	175.9	82.6	177	0	111.3	F97 L99 F104 V105 D137 L138 I141	F97-K101 HydrophobicContact CE1-CD 4.18Å; F97-K101 HydrophobicContact CZ-CB 4.44Å; F97-K101 HydrophobicContact CZ-CD 4.24Å; F97-K101 VanDerWaalsContact O-CB 3.3Å; F97-K101 WeakPolarHBondContact O-CB 3.34Å; F97-K101 PolarHBondContact O-N 3.32Å; L99-K101 VanDerWaalsContact C-N 3.3Å; L99-K101 PolarHBondContact O-N 3.43Å; K101-F104 PolarHBondContact O-N 3.13Å; K101-V105 WeakPolarHBondContact O-CG2 3.11Å; K101-V105 PolarHBondContact O-N 3.48Å; K101-V105 VanDerWaalsContact O-N 3.15Å; K101-D137 IonicContact NZ-OD2 2.8Å; K101-D137 PolarHBondContact NZ-OD2 3.48Å; K101-L138 HydrophobicContact CG-CD2 4.36Å; K101-I141 HydrophobicContact CD-CD1 3.7Å; K101-I141 HydrophobicContact CG-CD1 3.52Å
102	Q	97.2	Very high	94.7	Very high	7 Å²	7	43.7 Å²	43.7	3%	0.033	22%	0.223	C	C	.	.	H	α-helix	trans	-65.6	-43.2	175.9	-170.9	61.6	30.7	0	0	111.2	I74 I98 L99 L100 F104 V105 E106 V167	I74-Q102 HydrophobicContact CD1-CB 4.34Å; I74-Q102 HydrophobicContact CD1-CG 3.71Å; I74-Q102 HydrophobicContact CG1-CB 4.34Å; I74-Q102 HydrophobicContact CG1-CG 3.99Å; I98-Q102 PolarHBondContact O-N 2.96Å; L99-Q102 WeakPolarHBondContact O-CB 3.29Å; L99-Q102 PolarHBondContact O-N 3.27Å; L100-Q102 VanDerWaalsContact C-N 3.32Å; L100-Q102 PolarHBondContact O-N 3.17Å; Q102-F104 VanDerWaalsContact C-N 3.26Å; Q102-F104 PolarHBondContact O-N 3.44Å; Q102-V105 CarbonylContact O-C 3.58Å; Q102-V105 WeakPolarHBondContact O-CA 3.47Å; Q102-V105 WeakPolarHBondContact O-CB 3.42Å; Q102-V105 PolarHBondContact O-N 3.01Å; Q102-E106 HydrophobicContact CG-CG 4.5Å; Q102-E106 PolarHBondContact NE2-OE1 2.76Å; Q102-E106 WeakPolarHBondContact O-CG 3.31Å; Q102-E106 PolarHBondContact O-N 2.98Å; Q102-V167 HydrophobicContact CB-CG2 3.72Å; Q102-V167 HydrophobicContact CG-CG2 3.93Å
103	Q	96.7	Very high	94.5	Very high	25 Å²	25	43.7 Å²	43.7	12%	0.117	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-40.6	176	-175.1	169.3	5.2	0	0	111.9	I74 D75 L99 L100 V105 E106 L107 F119	I74-Q103 HydrophobicContact CB-CB 3.93Å; I74-Q103 HydrophobicContact CB-CG 4.41Å; I74-Q103 HydrophobicContact CG1-CB 4.37Å; I74-Q103 HydrophobicContact CG2-CB 3.98Å; D75-Q103 PolarHBondContact OD1-NE2 3.1Å; L99-Q103 PolarHBondContact O-N 3.15Å; L100-Q103 WeakPolarHBondContact O-CB 3.43Å; L100-Q103 PolarHBondContact O-N 3.48Å; Q103-V105 PolarHBondContact O-N 3.22Å; Q103-E106 PolarHBondContact O-N 3.37Å; Q103-L107 WeakPolarHBondContact O-CG 3.35Å; Q103-L107 PolarHBondContact O-N 3.39Å; Q103-F119 HydrophobicContact CB-CE1 4.2Å; Q103-F119 HydrophobicContact CB-CZ 3.83Å; Q103-F119 VanDerWaalsContact CD-CZ 3.48Å; Q103-F119 HydrophobicContact CG-CE1 4.3Å; Q103-F119 HydrophobicContact CG-CE2 3.91Å; Q103-F119 HydrophobicContact CG-CZ 3.7Å
104	F	96.3	Very high	94.6	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-60.7	-44.2	173.9	179.7	-143.6	0	0	0	112	L100 K101 Q102 E106 L107 I108 A116 F119 A120 L124 L138 I141 M145	L100-F104 PolarHBondContact O-N 2.89Å; K101-F104 PolarHBondContact O-N 3.13Å; Q102-F104 VanDerWaalsContact C-N 3.26Å; Q102-F104 PolarHBondContact O-N 3.44Å; F104-E106 VanDerWaalsContact C-N 3.32Å; F104-E106 PolarHBondContact O-N 3.15Å; F104-L107 PolarHBondContact O-N 3.42Å; F104-I108 HydrophobicContact CD2-CD1 4.2Å; F104-I108 HydrophobicContact CD2-CG1 4.37Å; F104-I108 HydrophobicContact CE1-CD1 4.3Å; F104-I108 HydrophobicContact CE2-CD1 3.82Å; F104-I108 HydrophobicContact CE2-CG1 4.12Å; F104-I108 HydrophobicContact CZ-CD1 3.87Å; F104-I108 WeakPolarHBondContact O-CG1 3.43Å; F104-I108 PolarHBondContact O-N 3.01Å; F104-I108 VanDerWaalsContact O-N 3.14Å; F104-A116 HydrophobicContact CD2-CB 3.94Å; F104-A116 WeakPolarHBondContact CD2-O 3.47Å; F104-A116 HydrophobicContact CE2-CB 3.7Å; F104-A116 WeakPolarHBondContact CE2-O 3.4Å; F104-F119 HydrophobicContact CB-CD1 3.99Å; F104-F119 HydrophobicContact CB-CE1 4.08Å; F104-A120 HydrophobicContact CD1-CB 4.39Å; F104-A120 HydrophobicContact CD2-CB 4.16Å; F104-A120 HydrophobicContact CE1-CB 4.04Å; F104-A120 HydrophobicContact CE2-CB 3.8Å; F104-A120 HydrophobicContact CG-CB 4.46Å; F104-A120 HydrophobicContact CZ-CB 3.74Å; F104-L124 HydrophobicContact CB-CD1 3.72Å; F104-L124 HydrophobicContact CD1-CD1 3.75Å; F104-L124 HydrophobicContact CG-CD1 3.93Å; F104-L138 HydrophobicContact CD1-CD2 4.45Å; F104-I141 HydrophobicContact CD1-CB 4.35Å; F104-I141 HydrophobicContact CD1-CG2 3.47Å; F104-I141 VanDerWaalsContact CD1-CG2 3.47Å; F104-I141 HydrophobicContact CE1-CB 4.13Å; F104-I141 HydrophobicContact CE1-CG2 3.46Å; F104-I141 VanDerWaalsContact CE1-CG2 3.46Å; F104-I141 HydrophobicContact CG-CG2 4.29Å; F104-I141 HydrophobicContact CZ-CG2 4.26Å; F104-M145 HydrophobicContact CE2-SD 4.33Å; F104-M145 HydrophobicContact CZ-CE 4.25Å; F104-M145 HydrophobicContact CZ-SD 4.47Å
105	V	96.4	Very high	94.8	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-39.6	173.4	173	0	0	0	0	111.8	K101 Q102 Q103 I108 R109 I141 Y158 M159	K101-V105 WeakPolarHBondContact O-CG2 3.11Å; K101-V105 PolarHBondContact O-N 3.48Å; K101-V105 VanDerWaalsContact O-N 3.15Å; Q102-V105 CarbonylContact O-C 3.58Å; Q102-V105 WeakPolarHBondContact O-CA 3.47Å; Q102-V105 WeakPolarHBondContact O-CB 3.42Å; Q102-V105 PolarHBondContact O-N 3.01Å; Q103-V105 PolarHBondContact O-N 3.22Å; V105-I108 PolarHBondContact O-N 2.76Å; V105-R109 PolarHBondContact O-N 2.98Å; V105-I141 HydrophobicContact CG2-CD1 4.02Å; V105-I141 HydrophobicContact CG2-CG1 4.18Å; V105-I141 HydrophobicContact CG2-CG2 3.78Å; V105-Y158 WeakPolarHBondContact CG1-O 3.47Å; V105-M159 HydrophobicContact CG1-SD 3.87Å
106	E	96.6	Very high	94.9	Very high	17 Å²	17	42.3 Å²	42.3	8%	0.079	23%	0.225	C	C	.	.	H	α-helix	trans	-64.8	-40.1	177.4	-61.7	-55.9	149.9	0	0	112.2	G72 I74 Q102 Q103 F104 I108 R109 S110 R164	G72-E106 WeakPolarHBondContact O-CG 3.48Å; I74-E106 HydrophobicContact CD1-CG 4.47Å; I74-E106 HydrophobicContact CG1-CG 3.81Å; Q102-E106 HydrophobicContact CG-CG 4.5Å; Q102-E106 PolarHBondContact NE2-OE1 2.76Å; Q102-E106 WeakPolarHBondContact O-CG 3.31Å; Q102-E106 PolarHBondContact O-N 2.98Å; Q103-E106 PolarHBondContact O-N 3.37Å; F104-E106 VanDerWaalsContact C-N 3.32Å; F104-E106 PolarHBondContact O-N 3.15Å; E106-I108 VanDerWaalsContact C-N 3.32Å; E106-I108 PolarHBondContact O-N 2.92Å; E106-R109 WeakPolarHBondContact O-CB 3.4Å; E106-R109 PolarHBondContact O-N 2.78Å; E106-R109 VanDerWaalsContact O-N 3.12Å; E106-R109 IonicContact OE1-CZ 3.88Å; E106-R109 IonicContact OE1-NH1 2.66Å; E106-R109 PolarHBondContact OE1-NH1 3.21Å; E106-R109 IonicContact OE2-CZ 3.8Å; E106-R109 IonicContact OE2-NH1 2.64Å; E106-R109 PolarHBondContact OE2-NH1 3.32Å; E106-S110 PolarHBondContact O-N 3Å; E106-S110 PolarHBondContact O-OG 3.3Å; E106-R164 IonicContact OE1-CZ 3.62Å; E106-R164 IonicContact OE1-NE 2.86Å; E106-R164 PolarHBondContact OE1-NE 3.32Å; E106-R164 IonicContact OE1-NH2 3.53Å; E106-R164 IonicContact OE2-CZ 3.54Å; E106-R164 IonicContact OE2-NE 3.59Å; E106-R164 IonicContact OE2-NH2 2.7Å; E106-R164 PolarHBondContact OE2-NH2 2.8Å
107	L	96.2	Very high	94.8	Very high	31 Å²	31	44.6 Å²	44.6	16%	0.162	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-40.8	174.6	-69.6	169.1	0	0	0	111.7	Q103 F104 R109 S110 K111 E112 A115 A116 F119	Q103-L107 WeakPolarHBondContact O-CG 3.35Å; Q103-L107 PolarHBondContact O-N 3.39Å; F104-L107 PolarHBondContact O-N 3.42Å; L107-R109 VanDerWaalsContact C-N 3.34Å; L107-S110 PolarHBondContact O-N 3.39Å; L107-K111 PolarHBondContact O-N 2.77Å; L107-E112 PolarHBondContact O-N 3.03Å; L107-E112 VanDerWaalsContact O-N 3.11Å; L107-A115 HydrophobicContact CD2-CB 4.45Å; L107-A116 HydrophobicContact CB-CB 3.72Å; L107-F119 HydrophobicContact CD1-CB 3.67Å; L107-F119 HydrophobicContact CD1-CD1 4.21Å; L107-F119 HydrophobicContact CD1-CD2 4.13Å; L107-F119 HydrophobicContact CD1-CG 3.74Å
108	I	95.5	Very high	94.9	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.036	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-41	173.8	-62.8	172.2	0	0	0	110.5	F104 V105 E106 S110 K111 A116 I141 L144 M145 P150	F104-I108 HydrophobicContact CD2-CD1 4.2Å; F104-I108 HydrophobicContact CD2-CG1 4.37Å; F104-I108 HydrophobicContact CE1-CD1 4.3Å; F104-I108 HydrophobicContact CE2-CD1 3.82Å; F104-I108 HydrophobicContact CE2-CG1 4.12Å; F104-I108 HydrophobicContact CZ-CD1 3.87Å; F104-I108 WeakPolarHBondContact O-CG1 3.43Å; F104-I108 PolarHBondContact O-N 3.01Å; F104-I108 VanDerWaalsContact O-N 3.14Å; V105-I108 PolarHBondContact O-N 2.76Å; E106-I108 VanDerWaalsContact C-N 3.32Å; E106-I108 PolarHBondContact O-N 2.92Å; I108-S110 VanDerWaalsContact C-N 3.29Å; I108-S110 PolarHBondContact O-N 3.45Å; I108-K111 PolarHBondContact O-N 3.29Å; I108-A116 HydrophobicContact CG1-CB 4.01Å; I108-I141 HydrophobicContact CD1-CG2 3.62Å; I108-I141 WeakPolarHBondContact CD1-O 3.49Å; I108-L144 HydrophobicContact CG2-CB 4.05Å; I108-M145 HydrophobicContact CD1-CG 3.74Å; I108-M145 HydrophobicContact CD1-SD 4.28Å; I108-M145 HydrophobicContact CG1-CG 3.72Å; I108-M145 HydrophobicContact CG1-SD 4.13Å; I108-M145 HydrophobicContact CG2-CG 4.21Å; I108-P150 HydrophobicContact CG2-CG 4.26Å
109	R	94.5	Very high	95	Very high	54 Å²	54	45.2 Å²	45.2	20%	0.204	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-38.8	177.1	-167.4	174.8	-75.6	125	-2.4	112.1	V105 E106 L107 K111 M159	V105-R109 PolarHBondContact O-N 2.98Å; E106-R109 WeakPolarHBondContact O-CB 3.4Å; E106-R109 PolarHBondContact O-N 2.78Å; E106-R109 VanDerWaalsContact O-N 3.12Å; E106-R109 IonicContact OE1-CZ 3.88Å; E106-R109 IonicContact OE1-NH1 2.66Å; E106-R109 PolarHBondContact OE1-NH1 3.21Å; E106-R109 IonicContact OE2-CZ 3.8Å; E106-R109 IonicContact OE2-NH1 2.64Å; E106-R109 PolarHBondContact OE2-NH1 3.32Å; L107-R109 VanDerWaalsContact C-N 3.34Å; R109-K111 PolarHBondContact O-N 2.93Å; R109-M159 HydrophobicContact CB-CE 3.66Å; R109-M159 HydrophobicContact CG-CE 3.77Å; R109-M159 VanDerWaalsContact NH2-C 3.28Å; R109-M159 PolarHBondContact NH2-O 3.14Å
110	S	94.1	Very high	94.8	Very high	76 Å²	76	46 Å²	46	53%	0.531	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-0.3	175.4	-62.1	0	0	0	0	114.2	E106 L107 I108 E112	E106-S110 PolarHBondContact O-N 3Å; E106-S110 PolarHBondContact O-OG 3.3Å; L107-S110 PolarHBondContact O-N 3.39Å; I108-S110 VanDerWaalsContact C-N 3.29Å; I108-S110 PolarHBondContact O-N 3.45Å; S110-E112 WeakPolarHBondContact CB-OE1 3.32Å; S110-E112 PolarHBondContact O-N 3.47Å
111	K	92.7	Very high	94.7	Very high	164 Å²	164	50.6 Å²	50.6	71%	0.713	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	28.5	-176.1	-55.6	-173.6	174.8	-169.9	0	113.7	L107 I108 R109 A113	L107-K111 PolarHBondContact O-N 2.77Å; I108-K111 PolarHBondContact O-N 3.29Å; R109-K111 PolarHBondContact O-N 2.93Å; K111-A113 PolarHBondContact O-N 2.87Å
112	E	92.6	Very high	94.6	Very high	101 Å²	101	54.3 Å²	54.3	47%	0.472	29%	0.293	S	S	.	.			trans	-93.5	65.3	178.4	-64.6	-178.8	-124.7	0	0	110.6	L107 S110 D114 A115 A116	L107-E112 PolarHBondContact O-N 3.03Å; L107-E112 VanDerWaalsContact O-N 3.11Å; S110-E112 WeakPolarHBondContact CB-OE1 3.32Å; S110-E112 PolarHBondContact O-N 3.47Å; E112-D114 PolarHBondContact O-N 3.32Å; E112-A115 HydrophobicContact CB-CB 4.13Å; E112-A115 PolarHBondContact O-N 3.45Å; E112-A116 WeakPolarHBondContact O-CB 3.39Å; E112-A116 PolarHBondContact O-N 2.84Å
113	A	89.9	Confident	94.4	Very high	54 Å²	54	60.3 Å²	60.3	45%	0.446	32%	0.316	S	S	.	.	H	α-helix	trans	-57.2	-43.8	-170.1	0	0	0	0	0	113.7	K111 A116 L117	K111-A113 PolarHBondContact O-N 2.87Å; A113-A116 PolarHBondContact O-N 3.36Å; A113-L117 WeakPolarHBondContact O-CB 3.28Å; A113-L117 PolarHBondContact O-N 2.87Å
114	D	92.7	Very high	94.2	Very high	140 Å²	140	59.2 Å²	59.2	75%	0.749	31%	0.311	S	S	*	.	H	α-helix	trans	-64.8	-44.1	-179.6	-65.4	-37.4	0	0	0	111.6	E112 L117 V118	E112-D114 PolarHBondContact O-N 3.32Å; D114-L117 PolarHBondContact O-N 3.09Å; D114-V118 WeakPolarHBondContact O-CG2 3.48Å; D114-V118 PolarHBondContact O-N 2.98Å
115	A	95.3	Very high	93.6	Very high	42 Å²	42	62.1 Å²	62.1	35%	0.347	33%	0.331	S	S	.	.	H	α-helix	trans	-65.5	-41.6	177.7	0	0	0	0	0	111.3	L107 E112 L117 V118 F119	L107-A115 HydrophobicContact CD2-CB 4.45Å; E112-A115 HydrophobicContact CB-CB 4.13Å; E112-A115 PolarHBondContact O-N 3.45Å; A115-L117 VanDerWaalsContact C-N 3.31Å; A115-L117 PolarHBondContact O-N 3.33Å; A115-V118 PolarHBondContact O-N 3.36Å; A115-F119 WeakPolarHBondContact O-CB 3.28Å; A115-F119 PolarHBondContact O-N 2.85Å
116	A	95.1	Very high	93.1	Very high	0 Å²	0	70 Å²	70	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-59.9	-42.7	175.8	0	0	0	0	0	111.4	F104 L107 I108 E112 A113 F119 A120 M145	F104-A116 HydrophobicContact CD2-CB 3.94Å; F104-A116 WeakPolarHBondContact CD2-O 3.47Å; F104-A116 HydrophobicContact CE2-CB 3.7Å; F104-A116 WeakPolarHBondContact CE2-O 3.4Å; L107-A116 HydrophobicContact CB-CB 3.72Å; I108-A116 HydrophobicContact CG1-CB 4.01Å; E112-A116 WeakPolarHBondContact O-CB 3.39Å; E112-A116 PolarHBondContact O-N 2.84Å; A113-A116 PolarHBondContact O-N 3.36Å; A116-F119 PolarHBondContact O-N 2.98Å; A116-A120 WeakPolarHBondContact O-CB 3.48Å; A116-A120 PolarHBondContact O-N 2.92Å; A116-M145 HydrophobicContact CB-SD 4.13Å
117	L	93.7	Very high	92.3	Very high	84 Å²	84	72.8 Å²	72.8	44%	0.44	38%	0.38	S	S	.	.	H	α-helix	trans	-67.1	-45.8	-178.8	-153.4	111.6	0	0	0	112	A113 D114 A115 F119 A120 Q121 M145	A113-L117 WeakPolarHBondContact O-CB 3.28Å; A113-L117 PolarHBondContact O-N 2.87Å; D114-L117 PolarHBondContact O-N 3.09Å; A115-L117 VanDerWaalsContact C-N 3.31Å; A115-L117 PolarHBondContact O-N 3.33Å; L117-F119 VanDerWaalsContact C-N 3.34Å; L117-A120 PolarHBondContact O-N 2.78Å; L117-Q121 WeakPolarHBondContact O-CG 3.31Å; L117-Q121 PolarHBondContact O-N 3.05Å; L117-Q121 VanDerWaalsContact O-N 3.09Å; L117-M145 HydrophobicContact CD1-CE 3.86Å
118	V	95.7	Very high	91.5	Very high	75 Å²	75	71.6 Å²	71.6	46%	0.455	37%	0.374	S	S	.	.	H	α-helix	trans	-60.7	-46.5	174.8	172.7	0	0	0	0	110.1	D114 A115 A120 Q121 D122	D114-V118 WeakPolarHBondContact O-CG2 3.48Å; D114-V118 PolarHBondContact O-N 2.98Å; A115-V118 PolarHBondContact O-N 3.36Å; V118-A120 VanDerWaalsContact C-N 3.35Å; V118-A120 PolarHBondContact O-N 3.16Å; V118-Q121 PolarHBondContact O-N 3.16Å; V118-Q121 VanDerWaalsContact O-N 3.15Å; V118-D122 PolarHBondContact O-N 3.23Å
119	F	95.7	Very high	90.7	Very high	19 Å²	19	76.6 Å²	76.6	8%	0.083	41%	0.405	C	S	.	.	H	α-helix	trans	-58.9	-44.5	178.4	-176.9	-86.8	0	0	0	112.4	L100 Q103 F104 L107 A115 A116 L117 Q121 D122 Y123 L124	L100-F119 HydrophobicContact CB-CE1 4.38Å; L100-F119 HydrophobicContact CB-CZ 4.26Å; L100-F119 HydrophobicContact CD2-CE2 4.35Å; L100-F119 HydrophobicContact CD2-CZ 3.64Å; L100-F119 WeakPolarHBondContact O-CE1 3.45Å; Q103-F119 HydrophobicContact CB-CE1 4.2Å; Q103-F119 HydrophobicContact CB-CZ 3.83Å; Q103-F119 VanDerWaalsContact CD-CZ 3.48Å; Q103-F119 HydrophobicContact CG-CE1 4.3Å; Q103-F119 HydrophobicContact CG-CE2 3.91Å; Q103-F119 HydrophobicContact CG-CZ 3.7Å; F104-F119 HydrophobicContact CB-CD1 3.99Å; F104-F119 HydrophobicContact CB-CE1 4.08Å; L107-F119 HydrophobicContact CD1-CB 3.67Å; L107-F119 HydrophobicContact CD1-CD1 4.21Å; L107-F119 HydrophobicContact CD1-CD2 4.13Å; L107-F119 HydrophobicContact CD1-CG 3.74Å; A115-F119 WeakPolarHBondContact O-CB 3.28Å; A115-F119 PolarHBondContact O-N 2.85Å; A116-F119 PolarHBondContact O-N 2.98Å; L117-F119 VanDerWaalsContact C-N 3.34Å; F119-Q121 VanDerWaalsContact C-N 3.31Å; F119-Q121 PolarHBondContact O-N 3.39Å; F119-D122 PolarHBondContact O-N 3.42Å; F119-Y123 HydrophobicContact CD1-CD2 4.49Å; F119-Y123 AromaticContact CD2-CD2 3.47Å; F119-Y123 HydrophobicContact CD2-CD2 3.47Å; F119-Y123 VanDerWaalsContact CD2-CD2 3.47Å; F119-Y123 AromaticContact CD2-CE2 3.79Å; F119-Y123 HydrophobicContact CD2-CE2 3.79Å; F119-Y123 HydrophobicContact CD2-CG 4.39Å; F119-Y123 AromaticContact CE2-CD2 3.61Å; F119-Y123 HydrophobicContact CE2-CD2 3.61Å; F119-Y123 HydrophobicContact CE2-CE2 4Å; F119-Y123 HydrophobicContact CE2-CG 4.13Å; F119-Y123 AromaticContact CG-CD2 3.95Å; F119-Y123 HydrophobicContact CG-CD2 3.95Å; F119-Y123 HydrophobicContact CZ-CD2 4.19Å; F119-Y123 HydrophobicContact CZ-CG 4.35Å; F119-Y123 WeakPolarHBondContact O-CB 3.26Å; F119-Y123 WeakPolarHBondContact O-CD2 3.44Å; F119-Y123 PolarHBondContact O-N 2.83Å; F119-L124 HydrophobicContact CD1-CD1 4.45Å; F119-L124 HydrophobicContact CE1-CD1 4.29Å
120	A	93.3	Very high	90	Very high	16 Å²	16	81.3 Å²	81.3	13%	0.132	43%	0.434	C	S	.	.	I	π-helix	trans	-63.4	-38.5	177.8	0	0	0	0	0	112.3	F104 A116 L117 V118 L124 S125	F104-A120 HydrophobicContact CD1-CB 4.39Å; F104-A120 HydrophobicContact CD2-CB 4.16Å; F104-A120 HydrophobicContact CE1-CB 4.04Å; F104-A120 HydrophobicContact CE2-CB 3.8Å; F104-A120 HydrophobicContact CG-CB 4.46Å; F104-A120 HydrophobicContact CZ-CB 3.74Å; A116-A120 WeakPolarHBondContact O-CB 3.48Å; A116-A120 PolarHBondContact O-N 2.92Å; L117-A120 PolarHBondContact O-N 2.78Å; V118-A120 VanDerWaalsContact C-N 3.35Å; V118-A120 PolarHBondContact O-N 3.16Å; A120-L124 HydrophobicContact CB-CD1 4.47Å; A120-L124 WeakPolarHBondContact O-CB 3.35Å; A120-L124 PolarHBondContact O-N 3.32Å; A120-L124 VanDerWaalsContact O-N 3.16Å; A120-S125 PolarHBondContact O-N 2.98Å; A120-S125 VanDerWaalsContact O-N 3.09Å
121	Q	92.9	Very high	89.6	Confident	112 Å²	112	81.3 Å²	81.3	52%	0.523	43%	0.429	S	S	.	.	I	π-helix	trans	-66.1	-45.5	176.6	-71.9	174.6	6.5	0	0	111.8	L117 V118 F119 S125	L117-Q121 WeakPolarHBondContact O-CG 3.31Å; L117-Q121 PolarHBondContact O-N 3.05Å; L117-Q121 VanDerWaalsContact O-N 3.09Å; V118-Q121 PolarHBondContact O-N 3.16Å; V118-Q121 VanDerWaalsContact O-N 3.15Å; F119-Q121 VanDerWaalsContact C-N 3.31Å; F119-Q121 PolarHBondContact O-N 3.39Å; Q121-S125 VanDerWaalsContact O-CB 3.28Å; Q121-S125 WeakPolarHBondContact O-CB 3.43Å; Q121-S125 PolarHBondContact O-OG 3.16Å
122	D	93.8	Very high	89.4	Confident	112 Å²	112	78.6 Å²	78.6	60%	0.599	43%	0.426	S	S	*	.	I	π-helix	trans	-77.1	-37.6	-173.3	-70.3	-14.6	0	0	0	112.9	V118 F119	V118-D122 PolarHBondContact O-N 3.23Å; F119-D122 PolarHBondContact O-N 3.42Å
123	Y	92.4	Very high	89.2	Confident	134 Å²	134	79.1 Å²	79.1	53%	0.525	43%	0.428	S	S	.	.	I	π-helix	trans	-112.2	-22	-168.1	-63	-79.6	0	0	0	115.2	F119	F119-Y123 HydrophobicContact CD1-CD2 4.49Å; F119-Y123 AromaticContact CD2-CD2 3.47Å; F119-Y123 HydrophobicContact CD2-CD2 3.47Å; F119-Y123 VanDerWaalsContact CD2-CD2 3.47Å; F119-Y123 AromaticContact CD2-CE2 3.79Å; F119-Y123 HydrophobicContact CD2-CE2 3.79Å; F119-Y123 HydrophobicContact CD2-CG 4.39Å; F119-Y123 AromaticContact CE2-CD2 3.61Å; F119-Y123 HydrophobicContact CE2-CD2 3.61Å; F119-Y123 HydrophobicContact CE2-CE2 4Å; F119-Y123 HydrophobicContact CE2-CG 4.13Å; F119-Y123 AromaticContact CG-CD2 3.95Å; F119-Y123 HydrophobicContact CG-CD2 3.95Å; F119-Y123 HydrophobicContact CZ-CD2 4.19Å; F119-Y123 HydrophobicContact CZ-CG 4.35Å; F119-Y123 WeakPolarHBondContact O-CB 3.26Å; F119-Y123 WeakPolarHBondContact O-CD2 3.44Å; F119-Y123 PolarHBondContact O-N 2.83Å
124	L	92.2	Very high	89.2	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.01	41%	0.413	C	S	.	.	I	π-helix	trans	-113.5	-24.7	-172.1	-62.7	172.4	0	0	0	113.6	F97 L100 F104 F119 A120 E126 K127 A128 L138	F97-L124 HydrophobicContact CD2-CD2 3.88Å; F97-L124 HydrophobicContact CE2-CD2 3.62Å; L100-L124 HydrophobicContact CB-CD2 3.71Å; F104-L124 HydrophobicContact CB-CD1 3.72Å; F104-L124 HydrophobicContact CD1-CD1 3.75Å; F104-L124 HydrophobicContact CG-CD1 3.93Å; F119-L124 HydrophobicContact CD1-CD1 4.45Å; F119-L124 HydrophobicContact CE1-CD1 4.29Å; A120-L124 HydrophobicContact CB-CD1 4.47Å; A120-L124 WeakPolarHBondContact O-CB 3.35Å; A120-L124 PolarHBondContact O-N 3.32Å; A120-L124 VanDerWaalsContact O-N 3.16Å; L124-E126 PolarHBondContact O-N 3Å; L124-K127 PolarHBondContact O-N 3.3Å; L124-A128 PolarHBondContact O-N 3.21Å; L124-L138 HydrophobicContact CB-CD1 4.09Å; L124-L138 HydrophobicContact CB-CD2 4.32Å; L124-L138 HydrophobicContact CD1-CD2 3.81Å; L124-L138 HydrophobicContact CG-CD2 4.46Å
125	S	85.4	Confident	89	Confident	62 Å²	62	74.4 Å²	74.4	43%	0.434	40%	0.396	S	S	.	.	H	α-helix	trans	-57.9	-48.9	-172.6	64.3	0	0	0	0	113.3	A120 Q121 K127 A128 V129	A120-S125 PolarHBondContact O-N 2.98Å; A120-S125 VanDerWaalsContact O-N 3.09Å; Q121-S125 VanDerWaalsContact O-CB 3.28Å; Q121-S125 WeakPolarHBondContact O-CB 3.43Å; Q121-S125 PolarHBondContact O-OG 3.16Å; S125-K127 PolarHBondContact O-N 2.84Å; S125-A128 WeakPolarHBondContact O-CB 3.19Å; S125-A128 PolarHBondContact O-N 2.89Å; S125-V129 WeakPolarHBondContact O-CG2 3.34Å
126	E	85	Confident	88.9	Confident	167 Å²	167	76.1 Å²	76.1	78%	0.78	40%	0.396	S	S	*	.	H	α-helix	trans	-65	-38.7	-176.3	-168.3	179	-175.7	0	0	112.3	L124 A128 V129	L124-E126 PolarHBondContact O-N 3Å; E126-A128 PolarHBondContact O-N 2.9Å; E126-V129 PolarHBondContact O-N 2.73Å
127	K	79.8	Confident	88.7	Confident	76 Å²	76	77.6 Å²	77.6	33%	0.33	41%	0.405	S	S	.	.	H	α-helix	trans	-68.7	-22.2	179	-73.8	178.7	178.7	-92.6	0	112.8	P93 F97 L124 S125	P93-K127 PolarHBondContact O-NZ 3.3Å; F97-K127 HydrophobicContact CB-CD 4.02Å; F97-K127 HydrophobicContact CD2-CB 4.07Å; F97-K127 HydrophobicContact CD2-CD 3.58Å; F97-K127 HydrophobicContact CD2-CG 4.48Å; F97-K127 HydrophobicContact CE2-CB 4.3Å; F97-K127 HydrophobicContact CG-CD 4.18Å; L124-K127 PolarHBondContact O-N 3.3Å; S125-K127 PolarHBondContact O-N 2.84Å
128	A	78.8	Confident	88.7	Confident	6 Å²	6	74.3 Å²	74.3	5%	0.05	39%	0.387	C	S	.	.	H	α-helix	trans	-81.1	-27.7	-179.6	0	0	0	0	0	113.7	L124 S125 E126 N130 N131 V134 L135 L138	L124-A128 PolarHBondContact O-N 3.21Å; S125-A128 WeakPolarHBondContact O-CB 3.19Å; S125-A128 PolarHBondContact O-N 2.89Å; E126-A128 PolarHBondContact O-N 2.9Å; A128-N130 VanDerWaalsContact C-N 3.26Å; A128-N130 PolarHBondContact O-N 2.94Å; A128-N130 VanDerWaalsContact O-N 3.17Å; A128-N131 PolarHBondContact O-N 3.39Å; A128-V134 HydrophobicContact CB-CG1 4.21Å; A128-L135 HydrophobicContact CB-CB 4.48Å; A128-L135 HydrophobicContact CB-CD1 3.91Å; A128-L138 HydrophobicContact CB-CD1 3.68Å
129	V	79.1	Confident	88.6	Confident	113 Å²	113	76.4 Å²	76.4	69%	0.685	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-37.4	-169.5	-179.7	0	0	0	0	112.7	S125 E126	S125-V129 WeakPolarHBondContact O-CG2 3.34Å; E126-V129 PolarHBondContact O-N 2.73Å
130	N	79.1	Confident	88.5	Confident	153 Å²	153	78.7 Å²	78.7	82%	0.818	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-0.3	-172.7	-62.7	-38.5	0	0	0	113.8	A128	A128-N130 VanDerWaalsContact C-N 3.26Å; A128-N130 PolarHBondContact O-N 2.94Å; A128-N130 VanDerWaalsContact O-N 3.17Å
131	N	86.3	Confident	88.6	Confident	76 Å²	76	77.9 Å²	77.9	41%	0.406	40%	0.396	S	S	.	.			trans	-132.6	101.7	-176.1	-173.8	-23.6	0	0	0	110.9	A128 Q133 V134 L135	A128-N131 PolarHBondContact O-N 3.39Å; N131-Q133 VanDerWaalsContact C-N 3.25Å; N131-Q133 PolarHBondContact O-N 2.85Å; N131-Q133 PolarHBondContact OD1-N 3.14Å; N131-Q133 VanDerWaalsContact OD1-N 3.1Å; N131-V134 HydrophobicContact CB-CB 3.94Å; N131-V134 HydrophobicContact CB-CG2 3.98Å; N131-V134 WeakPolarHBondContact ND2-CG2 3.35Å; N131-V134 WeakPolarHBondContact O-CB 3.24Å; N131-V134 PolarHBondContact O-N 2.84Å; N131-V134 VanDerWaalsContact O-N 3.11Å; N131-V134 PolarHBondContact OD1-N 3.33Å; N131-L135 PolarHBondContact O-N 3.02Å
132	T	87.9	Confident	88.6	Confident	106 Å²	106	74.9 Å²	74.9	65%	0.65	39%	0.386	S	S	*	.	H	α-helix	trans	-56.4	-38.8	-178.4	-45.6	0	0	0	0	112.5	V134 L135 E136	T132-V134 PolarHBondContact O-N 3.34Å; T132-L135 PolarHBondContact O-N 3.04Å; T132-E136 WeakPolarHBondContact O-CG 3.33Å; T132-E136 PolarHBondContact O-N 2.87Å
133	Q	88.6	Confident	88.5	Confident	112 Å²	112	70.6 Å²	70.6	52%	0.523	37%	0.368	S	S	.	.	H	α-helix	trans	-68.4	-38	-179.4	-168	60.6	63.7	0	0	111.9	N131 E136 D137	N131-Q133 VanDerWaalsContact C-N 3.25Å; N131-Q133 PolarHBondContact O-N 2.85Å; N131-Q133 PolarHBondContact OD1-N 3.14Å; N131-Q133 VanDerWaalsContact OD1-N 3.1Å; Q133-E136 PolarHBondContact NE2-OE2 2.95Å; Q133-D137 PolarHBondContact O-N 3.39Å
134	V	89.5	Confident	88.7	Confident	21 Å²	21	64.2 Å²	64.2	13%	0.127	34%	0.343	C	S	.	.	H	α-helix	trans	-65.6	-42.5	174.7	165.8	0	0	0	0	110.6	F97 A128 N131 T132 D137 L138	F97-V134 HydrophobicContact CE1-CG1 3.97Å; F97-V134 HydrophobicContact CE1-CG2 3.98Å; F97-V134 HydrophobicContact CE2-CG1 3.77Å; F97-V134 HydrophobicContact CZ-CB 4.33Å; F97-V134 HydrophobicContact CZ-CG1 3.31Å; F97-V134 HydrophobicContact CZ-CG2 4.2Å; A128-V134 HydrophobicContact CB-CG1 4.21Å; N131-V134 HydrophobicContact CB-CB 3.94Å; N131-V134 HydrophobicContact CB-CG2 3.98Å; N131-V134 WeakPolarHBondContact ND2-CG2 3.35Å; N131-V134 WeakPolarHBondContact O-CB 3.24Å; N131-V134 PolarHBondContact O-N 2.84Å; N131-V134 VanDerWaalsContact O-N 3.11Å; N131-V134 PolarHBondContact OD1-N 3.33Å; T132-V134 PolarHBondContact O-N 3.34Å; V134-D137 WeakPolarHBondContact O-CB 3.28Å; V134-D137 PolarHBondContact O-N 3.48Å; V134-L138 HydrophobicContact CG1-CD1 3.89Å; V134-L138 HydrophobicContact CG1-CG 4.36Å; V134-L138 WeakPolarHBondContact O-CG 3.33Å; V134-L138 PolarHBondContact O-N 3.2Å
135	L	90.2	Very high	88.7	Confident	74 Å²	74	66.8 Å²	66.8	39%	0.387	36%	0.356	S	S	.	.	H	α-helix	trans	-60.7	-47.9	178.1	-173.9	67.5	0	0	0	111.4	A128 N131 T132 D137 L138 E139	A128-L135 HydrophobicContact CB-CB 4.48Å; A128-L135 HydrophobicContact CB-CD1 3.91Å; N131-L135 PolarHBondContact O-N 3.02Å; T132-L135 PolarHBondContact O-N 3.04Å; L135-D137 VanDerWaalsContact C-N 3.3Å; L135-D137 PolarHBondContact O-N 2.96Å; L135-L138 PolarHBondContact O-N 2.99Å; L135-L138 VanDerWaalsContact O-N 3.16Å; L135-E139 WeakPolarHBondContact O-CG 3.31Å; L135-E139 PolarHBondContact O-N 3.38Å
136	E	91.8	Very high	89	Confident	78 Å²	78	68.2 Å²	68.2	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-58.5	-41	176.8	-74.4	-179.2	-170.8	0	0	112.7	T132 Q133 K140	T132-E136 WeakPolarHBondContact O-CG 3.33Å; T132-E136 PolarHBondContact O-N 2.87Å; Q133-E136 PolarHBondContact NE2-OE2 2.95Å; E136-K140 WeakPolarHBondContact O-CD 3.24Å; E136-K140 VanDerWaalsContact O-CG 3.26Å; E136-K140 WeakPolarHBondContact O-CG 3.47Å; E136-K140 PolarHBondContact O-N 3.09Å; E136-K140 VanDerWaalsContact O-N 3.12Å
137	D	91.7	Very high	89.4	Confident	32 Å²	32	63.8 Å²	63.8	17%	0.171	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-46.4	176.1	-102.6	13.3	0	0	0	111	K101 Q133 V134 L135 K140 I141 Y158	K101-D137 IonicContact NZ-OD2 2.8Å; K101-D137 PolarHBondContact NZ-OD2 3.48Å; Q133-D137 PolarHBondContact O-N 3.39Å; V134-D137 WeakPolarHBondContact O-CB 3.28Å; V134-D137 PolarHBondContact O-N 3.48Å; L135-D137 VanDerWaalsContact C-N 3.3Å; L135-D137 PolarHBondContact O-N 2.96Å; D137-K140 PolarHBondContact O-N 3.1Å; D137-I141 VanDerWaalsContact O-CG1 3.27Å; D137-I141 WeakPolarHBondContact O-CG1 3.37Å; D137-I141 PolarHBondContact O-N 3.38Å; D137-Y158 PolarHBondContact OD1-OH 2.99Å
138	L	93.3	Very high	89.8	Confident	14 Å²	14	68.9 Å²	68.9	7%	0.073	38%	0.375	C	S	.	.	H	α-helix	trans	-68.2	-36.7	-179.9	-68.9	175.2	0	0	0	112.3	F97 K101 F104 L124 A128 V134 L135 I141 C142	F97-L138 HydrophobicContact CE2-CD1 4.38Å; F97-L138 HydrophobicContact CZ-CD1 4.41Å; F97-L138 HydrophobicContact CZ-CD2 4.4Å; F97-L138 HydrophobicContact CZ-CG 4.46Å; K101-L138 HydrophobicContact CG-CD2 4.36Å; F104-L138 HydrophobicContact CD1-CD2 4.45Å; L124-L138 HydrophobicContact CB-CD1 4.09Å; L124-L138 HydrophobicContact CB-CD2 4.32Å; L124-L138 HydrophobicContact CD1-CD2 3.81Å; L124-L138 HydrophobicContact CG-CD2 4.46Å; A128-L138 HydrophobicContact CB-CD1 3.68Å; V134-L138 HydrophobicContact CG1-CD1 3.89Å; V134-L138 HydrophobicContact CG1-CG 4.36Å; V134-L138 WeakPolarHBondContact O-CG 3.33Å; V134-L138 PolarHBondContact O-N 3.2Å; L135-L138 PolarHBondContact O-N 2.99Å; L135-L138 VanDerWaalsContact O-N 3.16Å; L138-I141 PolarHBondContact O-N 2.73Å; L138-C142 WeakPolarHBondContact O-CB 3.23Å; L138-C142 PolarHBondContact O-N 3.03Å; L138-C142 PolarHBondContact O-SG 2.89Å; L138-C142 VanDerWaalsContact O-SG 3.38Å
139	E	92.8	Very high	90.5	Very high	119 Å²	119	72.6 Å²	72.6	56%	0.556	39%	0.394	S	S	*	.	H	α-helix	trans	-62.3	-42.7	174.3	-75.5	178.4	169.5	0	0	111.8	L135 C142 G143	L135-E139 WeakPolarHBondContact O-CG 3.31Å; L135-E139 PolarHBondContact O-N 3.38Å; E139-C142 PolarHBondContact O-N 2.97Å; E139-G143 PolarHBondContact O-N 2.83Å
140	K	94.6	Very high	91.2	Very high	67 Å²	67	67.9 Å²	67.9	29%	0.291	37%	0.365	S	S	.	.	H	α-helix	trans	-63.9	-43.4	175.3	-68.6	164.2	-169.9	164.3	0	111.4	E136 D137 G143 L144 F155 Y158	E136-K140 WeakPolarHBondContact O-CD 3.24Å; E136-K140 VanDerWaalsContact O-CG 3.26Å; E136-K140 WeakPolarHBondContact O-CG 3.47Å; E136-K140 PolarHBondContact O-N 3.09Å; E136-K140 VanDerWaalsContact O-N 3.12Å; D137-K140 PolarHBondContact O-N 3.1Å; K140-G143 PolarHBondContact O-N 3.34Å; K140-L144 PolarHBondContact O-N 3.46Å; K140-F155 HydrophobicContact CB-CD1 3.99Å; K140-F155 HydrophobicContact CB-CE1 4.25Å; K140-F155 HydrophobicContact CB-CG 4.16Å; K140-F155 HydrophobicContact CG-CD1 3.99Å; K140-F155 HydrophobicContact CG-CE1 3.85Å; K140-F155 HydrophobicContact CG-CZ 4.36Å; K140-F155 VanDerWaalsContact O-CD2 3.3Å; K140-F155 WeakPolarHBondContact O-CD2 3.48Å; K140-Y158 HydrophobicContact CB-CE2 3.72Å; K140-Y158 HydrophobicContact CD-CE2 4.1Å; K140-Y158 WeakPolarHBondContact CD-OH 3.22Å
141	I	94.6	Very high	91.8	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-64.7	-43.2	176.4	-65	165.5	0	0	0	110.2	K101 F104 V105 I108 D137 L138 G143 L144 Y158	K101-I141 HydrophobicContact CD-CD1 3.7Å; K101-I141 HydrophobicContact CG-CD1 3.52Å; F104-I141 HydrophobicContact CD1-CB 4.35Å; F104-I141 HydrophobicContact CD1-CG2 3.47Å; F104-I141 VanDerWaalsContact CD1-CG2 3.47Å; F104-I141 HydrophobicContact CE1-CB 4.13Å; F104-I141 HydrophobicContact CE1-CG2 3.46Å; F104-I141 VanDerWaalsContact CE1-CG2 3.46Å; F104-I141 HydrophobicContact CG-CG2 4.29Å; F104-I141 HydrophobicContact CZ-CG2 4.26Å; V105-I141 HydrophobicContact CG2-CD1 4.02Å; V105-I141 HydrophobicContact CG2-CG1 4.18Å; V105-I141 HydrophobicContact CG2-CG2 3.78Å; I108-I141 HydrophobicContact CD1-CG2 3.62Å; I108-I141 WeakPolarHBondContact CD1-O 3.49Å; D137-I141 VanDerWaalsContact O-CG1 3.27Å; D137-I141 WeakPolarHBondContact O-CG1 3.37Å; D137-I141 PolarHBondContact O-N 3.38Å; L138-I141 PolarHBondContact O-N 2.73Å; I141-G143 VanDerWaalsContact C-N 3.26Å; I141-G143 PolarHBondContact O-N 3.48Å; I141-L144 HydrophobicContact CG2-CD1 4.34Å; I141-L144 WeakPolarHBondContact O-CB 3.46Å; I141-L144 PolarHBondContact O-N 3.26Å; I141-L144 VanDerWaalsContact O-N 3.07Å; I141-Y158 HydrophobicContact CD1-CD1 3.91Å; I141-Y158 HydrophobicContact CD1-CE1 4.16Å; I141-Y158 HydrophobicContact CD1-CG 4.45Å; I141-Y158 HydrophobicContact CG1-CD1 3.75Å; I141-Y158 HydrophobicContact CG1-CD2 4.2Å; I141-Y158 HydrophobicContact CG1-CE1 4.11Å; I141-Y158 HydrophobicContact CG1-CG 3.81Å
142	C	93	Very high	92.1	Very high	49 Å²	49	66.4 Å²	66.4	33%	0.331	36%	0.362	S	S	.	.	H	α-helix	trans	-59.5	-40	173.2	-79.7	0	0	0	0	111.7	L138 E139 L144 M145	L138-C142 WeakPolarHBondContact O-CB 3.23Å; L138-C142 PolarHBondContact O-N 3.03Å; L138-C142 PolarHBondContact O-SG 2.89Å; L138-C142 VanDerWaalsContact O-SG 3.38Å; E139-C142 PolarHBondContact O-N 2.97Å; C142-L144 PolarHBondContact O-N 3.1Å; C142-M145 HydrophobicContact CB-CE 4.13Å; C142-M145 WeakPolarHBondContact O-CB 3.37Å; C142-M145 PolarHBondContact O-N 3.49Å
143	G	93.2	Very high	92.4	Very high	21 Å²	21	62 Å²	62	22%	0.216	34%	0.335	C	S	.	.	H	α-helix	trans	-57.9	-27.7	175.6	0	0	0	0	0	113.6	E139 K140 I141 M145 A146 F147	E139-G143 PolarHBondContact O-N 2.83Å; K140-G143 PolarHBondContact O-N 3.34Å; I141-G143 VanDerWaalsContact C-N 3.26Å; I141-G143 PolarHBondContact O-N 3.48Å; G143-M145 PolarHBondContact O-N 3.2Å; G143-A146 WeakPolarHBondContact O-CB 3.47Å; G143-A146 PolarHBondContact O-N 2.94Å; G143-A146 VanDerWaalsContact O-N 3.13Å; G143-F147 WeakPolarHBondContact O-CD2 3.45Å; G143-F147 WeakPolarHBondContact O-CE2 3.34Å
144	L	95	Very high	92.6	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58.2	-33.7	174.3	-69.1	167.3	0	0	0	112.7	I108 K140 I141 C142 A146 F147 P150 S153 F155 M159	I108-L144 HydrophobicContact CG2-CB 4.05Å; K140-L144 PolarHBondContact O-N 3.46Å; I141-L144 HydrophobicContact CG2-CD1 4.34Å; I141-L144 WeakPolarHBondContact O-CB 3.46Å; I141-L144 PolarHBondContact O-N 3.26Å; I141-L144 VanDerWaalsContact O-N 3.07Å; C142-L144 PolarHBondContact O-N 3.1Å; L144-A146 PolarHBondContact O-N 2.77Å; L144-F147 PolarHBondContact O-N 3.35Å; L144-F147 VanDerWaalsContact O-N 3.1Å; L144-P150 HydrophobicContact CB-CB 4.22Å; L144-P150 HydrophobicContact CD2-CB 4.07Å; L144-S153 WeakPolarHBondContact CD2-OG 3.44Å; L144-F155 HydrophobicContact CD2-CB 3.63Å; L144-F155 HydrophobicContact CG-CB 4.04Å; L144-M159 HydrophobicContact CD1-CG 4.1Å; L144-M159 HydrophobicContact CD1-SD 3.94Å; L144-M159 HydrophobicContact CD2-CG 4.05Å
145	M	92.2	Very high	92.9	Very high	56 Å²	56	65.3 Å²	65.3	28%	0.276	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.9	-179.4	-61.6	-173.6	-66	0	0	112.8	F104 I108 A116 L117 C142 G143 F147	F104-M145 HydrophobicContact CE2-SD 4.33Å; F104-M145 HydrophobicContact CZ-CE 4.25Å; F104-M145 HydrophobicContact CZ-SD 4.47Å; I108-M145 HydrophobicContact CD1-CG 3.74Å; I108-M145 HydrophobicContact CD1-SD 4.28Å; I108-M145 HydrophobicContact CG1-CG 3.72Å; I108-M145 HydrophobicContact CG1-SD 4.13Å; I108-M145 HydrophobicContact CG2-CG 4.21Å; A116-M145 HydrophobicContact CB-SD 4.13Å; L117-M145 HydrophobicContact CD1-CE 3.86Å; C142-M145 HydrophobicContact CB-CE 4.13Å; C142-M145 WeakPolarHBondContact O-CB 3.37Å; C142-M145 PolarHBondContact O-N 3.49Å; G143-M145 PolarHBondContact O-N 3.2Å; M145-F147 VanDerWaalsContact C-N 3.26Å; M145-F147 PolarHBondContact O-N 3.11Å
146	A	92	Very high	93.1	Very high	92 Å²	92	62.5 Å²	62.5	76%	0.76	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-11	177.1	0	0	0	0	0	113.2	G143 L144	G143-A146 WeakPolarHBondContact O-CB 3.47Å; G143-A146 PolarHBondContact O-N 2.94Å; G143-A146 VanDerWaalsContact O-N 3.13Å; L144-A146 PolarHBondContact O-N 2.77Å
147	F	93	Very high	93.2	Very high	74 Å²	74	64.2 Å²	64.2	33%	0.325	35%	0.346	S	S	.	.	S	Bend	trans	-98.7	134.7	-179.9	-63.6	-89.2	0	0	0	111.1	G143 L144 M145 N149 S153 M154 F155	G143-F147 WeakPolarHBondContact O-CD2 3.45Å; G143-F147 WeakPolarHBondContact O-CE2 3.34Å; L144-F147 PolarHBondContact O-N 3.35Å; L144-F147 VanDerWaalsContact O-N 3.1Å; M145-F147 VanDerWaalsContact C-N 3.26Å; M145-F147 PolarHBondContact O-N 3.11Å; F147-N149 PolarHBondContact O-N 3.29Å; F147-S153 VanDerWaalsContact CG-CB 3.49Å; F147-M154 HydrophobicContact CE2-CG 4.49Å; F147-M154 HydrophobicContact CZ-CE 4.12Å; F147-M154 HydrophobicContact CZ-CG 3.99Å; F147-M154 HydrophobicContact CZ-SD 4.45Å; F147-F155 HydrophobicContact CE2-CD2 4.17Å; F147-F155 HydrophobicContact CE2-CE2 4.37Å
148	E	89.9	Confident	93.4	Very high	184 Å²	184	64 Å²	64	86%	0.86	34%	0.343	S	S	*	.	S	Bend	trans	-64.5	-31.4	174.4	-168.3	170.9	-164.1	0	0	112.2
149	N	92.7	Very high	93.4	Very high	84 Å²	84	63.8 Å²	63.8	45%	0.449	34%	0.341	S	S	.	.	S	Bend	trans	-125.4	92.1	169.4	-171.9	-3	0	0	0	111	F147 E151 S152	F147-N149 PolarHBondContact O-N 3.29Å; N149-E151 PolarHBondContact O-N 3.21Å; N149-E151 PolarHBondContact OD1-N 3.43Å; N149-S152 PolarHBondContact ND2-OG 3.44Å; N149-S152 PolarHBondContact O-N 2.85Å
150	P	93	Very high	93.5	Very high	13 Å²	13	62.5 Å²	62.5	8%	0.084	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-57.5	-30.8	-179.3	-26.3	34.7	0	0	0	114.1	I108 L144 S152 S153 M159	I108-P150 HydrophobicContact CG2-CG 4.26Å; L144-P150 HydrophobicContact CB-CB 4.22Å; L144-P150 HydrophobicContact CD2-CB 4.07Å; P150-S152 PolarHBondContact O-N 3.37Å; P150-S153 VanDerWaalsContact O-CB 3.31Å; P150-S153 WeakPolarHBondContact O-CB 3.29Å; P150-S153 PolarHBondContact O-N 2.99Å; P150-S153 PolarHBondContact O-OG 2.72Å; P150-M159 HydrophobicContact CB-CE 4.05Å; P150-M159 HydrophobicContact CB-CG 4.04Å; P150-M159 HydrophobicContact CB-SD 4.19Å
151	E	93	Very high	93.3	Very high	104 Å²	104	64 Å²	64	49%	0.486	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-71.7	-16.1	-176.9	-56.6	-170.4	173	0	0	114	N149 A156 M159	N149-E151 PolarHBondContact O-N 3.21Å; N149-E151 PolarHBondContact OD1-N 3.43Å; E151-A156 WeakPolarHBondContact O-CB 3.44Å; E151-M159 HydrophobicContact CG-CB 4.15Å; E151-M159 HydrophobicContact CG-CE 4.18Å
152	S	92.9	Very high	93.2	Very high	95 Å²	95	68.2 Å²	68.2	66%	0.664	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-108.6	6.7	176.4	-57.1	0	0	0	0	112.5	N149 P150	N149-S152 PolarHBondContact ND2-OG 3.44Å; N149-S152 PolarHBondContact O-N 2.85Å; P150-S152 PolarHBondContact O-N 3.37Å
153	S	93.4	Very high	93.2	Very high	14 Å²	14	66.5 Å²	66.5	10%	0.098	35%	0.354	C	S	.	.	S	Bend	trans	-77.2	171.2	-178.3	75	0	0	0	0	112.7	L144 F147 P150 F155 A156	L144-S153 WeakPolarHBondContact CD2-OG 3.44Å; F147-S153 VanDerWaalsContact CG-CB 3.49Å; P150-S153 VanDerWaalsContact O-CB 3.31Å; P150-S153 WeakPolarHBondContact O-CB 3.29Å; P150-S153 PolarHBondContact O-N 2.99Å; P150-S153 PolarHBondContact O-OG 2.72Å; S153-F155 PolarHBondContact O-N 2.9Å; S153-F155 VanDerWaalsContact O-N 3.17Å; S153-F155 PolarHBondContact OG-N 3.45Å; S153-F155 VanDerWaalsContact OG-N 3.13Å; S153-A156 WeakPolarHBondContact O-CB 3.25Å; S153-A156 PolarHBondContact O-N 3.38Å; S153-A156 VanDerWaalsContact O-N 3.1Å; S153-A156 PolarHBondContact OG-N 3.26Å
154	M	93.8	Very high	93.3	Very high	148 Å²	148	67.7 Å²	67.7	73%	0.729	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.8	170.3	64.1	-179.7	67.6	0	0	113.6	F147	F147-M154 HydrophobicContact CE2-CG 4.49Å; F147-M154 HydrophobicContact CZ-CE 4.12Å; F147-M154 HydrophobicContact CZ-CG 3.99Å; F147-M154 HydrophobicContact CZ-SD 4.45Å
155	F	94.2	Very high	93	Very high	54 Å²	54	71.6 Å²	71.6	24%	0.237	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	16.3	177.9	-50.2	-50.7	0	0	0	112.1	K140 L144 F147 S153 E157 Y158	K140-F155 HydrophobicContact CB-CD1 3.99Å; K140-F155 HydrophobicContact CB-CE1 4.25Å; K140-F155 HydrophobicContact CB-CG 4.16Å; K140-F155 HydrophobicContact CG-CD1 3.99Å; K140-F155 HydrophobicContact CG-CE1 3.85Å; K140-F155 HydrophobicContact CG-CZ 4.36Å; K140-F155 VanDerWaalsContact O-CD2 3.3Å; K140-F155 WeakPolarHBondContact O-CD2 3.48Å; L144-F155 HydrophobicContact CD2-CB 3.63Å; L144-F155 HydrophobicContact CG-CB 4.04Å; F147-F155 HydrophobicContact CE2-CD2 4.17Å; F147-F155 HydrophobicContact CE2-CE2 4.37Å; S153-F155 PolarHBondContact O-N 2.9Å; S153-F155 VanDerWaalsContact O-N 3.17Å; S153-F155 PolarHBondContact OG-N 3.45Å; S153-F155 VanDerWaalsContact OG-N 3.13Å; F155-E157 PolarHBondContact O-N 3.16Å; F155-Y158 HydrophobicContact CB-CD2 4.23Å; F155-Y158 WeakPolarHBondContact O-CD2 3.14Å; F155-Y158 PolarHBondContact O-N 3.36Å; F155-Y158 VanDerWaalsContact O-N 3.12Å
156	A	94.6	Very high	93	Very high	14 Å²	14	75.7 Å²	75.7	12%	0.116	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-54.8	-17.6	-178.1	0	0	0	0	0	114.6	E151 S153 Y158 M159 K160	E151-A156 WeakPolarHBondContact O-CB 3.44Å; S153-A156 WeakPolarHBondContact O-CB 3.25Å; S153-A156 PolarHBondContact O-N 3.38Å; S153-A156 VanDerWaalsContact O-N 3.1Å; S153-A156 PolarHBondContact OG-N 3.26Å; A156-Y158 VanDerWaalsContact C-N 3.29Å; A156-Y158 PolarHBondContact O-N 3.28Å; A156-M159 WeakPolarHBondContact O-CB 3.42Å; A156-M159 PolarHBondContact O-N 3Å; A156-K160 WeakPolarHBondContact O-CG 3.31Å; A156-K160 PolarHBondContact O-N 3.34Å
157	E	95.1	Very high	93.1	Very high	114 Å²	114	71.5 Å²	71.5	53%	0.533	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-54.7	-41.3	174.3	-169.4	-177.6	148.3	0	0	112.9	F155 M159 K160 Y162 Q163	F155-E157 PolarHBondContact O-N 3.16Å; E157-M159 PolarHBondContact O-N 2.8Å; E157-K160 WeakPolarHBondContact O-CB 3.49Å; E157-K160 PolarHBondContact O-N 3.35Å; E157-Y162 WeakPolarHBondContact CG-OH 3.47Å; E157-Y162 PolarHBondContact OE1-OH 3.18Å; E157-Q163 PolarHBondContact O-NE2 3.17Å
158	Y	94.8	Very high	93	Very high	29 Å²	29	68.5 Å²	68.5	11%	0.114	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-69.9	-22.2	177.9	-62.4	-81.2	0	0	0	112	V105 D137 K140 I141 F155 A156 K160	V105-Y158 WeakPolarHBondContact CG1-O 3.47Å; D137-Y158 PolarHBondContact OD1-OH 2.99Å; K140-Y158 HydrophobicContact CB-CE2 3.72Å; K140-Y158 HydrophobicContact CD-CE2 4.1Å; K140-Y158 WeakPolarHBondContact CD-OH 3.22Å; I141-Y158 HydrophobicContact CD1-CD1 3.91Å; I141-Y158 HydrophobicContact CD1-CE1 4.16Å; I141-Y158 HydrophobicContact CD1-CG 4.45Å; I141-Y158 HydrophobicContact CG1-CD1 3.75Å; I141-Y158 HydrophobicContact CG1-CD2 4.2Å; I141-Y158 HydrophobicContact CG1-CE1 4.11Å; I141-Y158 HydrophobicContact CG1-CG 3.81Å; F155-Y158 HydrophobicContact CB-CD2 4.23Å; F155-Y158 WeakPolarHBondContact O-CD2 3.14Å; F155-Y158 PolarHBondContact O-N 3.36Å; F155-Y158 VanDerWaalsContact O-N 3.12Å; A156-Y158 VanDerWaalsContact C-N 3.29Å; A156-Y158 PolarHBondContact O-N 3.28Å; Y158-K160 VanDerWaalsContact C-N 3.31Å
159	M	94.2	Very high	92.9	Very high	8 Å²	8	63.8 Å²	63.8	4%	0.039	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-83.9	-4.3	177.9	-62.1	-59.3	-70.7	0	0	113.2	V105 R109 L144 P150 E151 A156 E157	V105-M159 HydrophobicContact CG1-SD 3.87Å; R109-M159 HydrophobicContact CB-CE 3.66Å; R109-M159 HydrophobicContact CG-CE 3.77Å; R109-M159 VanDerWaalsContact NH2-C 3.28Å; R109-M159 PolarHBondContact NH2-O 3.14Å; L144-M159 HydrophobicContact CD1-CG 4.1Å; L144-M159 HydrophobicContact CD1-SD 3.94Å; L144-M159 HydrophobicContact CD2-CG 4.05Å; P150-M159 HydrophobicContact CB-CE 4.05Å; P150-M159 HydrophobicContact CB-CG 4.04Å; P150-M159 HydrophobicContact CB-SD 4.19Å; E151-M159 HydrophobicContact CG-CB 4.15Å; E151-M159 HydrophobicContact CG-CE 4.18Å; A156-M159 WeakPolarHBondContact O-CB 3.42Å; A156-M159 PolarHBondContact O-N 3Å; E157-M159 PolarHBondContact O-N 2.8Å
160	K	94.4	Very high	92.7	Very high	92 Å²	92	61.1 Å²	61.1	40%	0.4	31%	0.307	S	S	.	.	S	Bend	trans	-75.1	146.8	-175.7	-62.7	-57.9	-177.4	-173.9	0	112.7	A156 E157 Y158 Y162 Q163	A156-K160 WeakPolarHBondContact O-CG 3.31Å; A156-K160 PolarHBondContact O-N 3.34Å; E157-K160 WeakPolarHBondContact O-CB 3.49Å; E157-K160 PolarHBondContact O-N 3.35Å; Y158-K160 VanDerWaalsContact C-N 3.31Å; K160-Y162 HydrophobicContact CB-CD1 3.36Å; K160-Y162 HydrophobicContact CB-CE1 3.34Å; K160-Y162 HydrophobicContact CB-CG 4.46Å; K160-Y162 HydrophobicContact CG-CD1 4.19Å; K160-Y162 HydrophobicContact CG-CE1 3.79Å; K160-Y162 PolarHBondContact O-N 2.9Å; K160-Y162 VanDerWaalsContact O-N 3.16Å; K160-Q163 WeakPolarHBondContact O-CB 3.27Å; K160-Q163 WeakPolarHBondContact O-CG 3.21Å; K160-Q163 PolarHBondContact O-N 2.94Å; K160-Q163 VanDerWaalsContact O-N 3.13Å
161	P	91.3	Very high	92.7	Very high	98 Å²	98	60.7 Å²	60.7	64%	0.636	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-31.9	179.6	-26.4	34.4	0	0	0	114.3	Q163 R164	P161-Q163 PolarHBondContact O-N 3.31Å; P161-Q163 VanDerWaalsContact O-N 3.1Å; P161-R164 WeakPolarHBondContact O-CB 3.42Å; P161-R164 PolarHBondContact O-N 2.91Å; P161-R164 VanDerWaalsContact O-N 3.07Å
162	Y	90.8	Very high	92.5	Very high	90 Å²	90	56 Å²	56	35%	0.353	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-19.6	-178.8	78.8	-97.1	0	0	0	113.4	E157 K160 R164 I165 R166	E157-Y162 WeakPolarHBondContact CG-OH 3.47Å; E157-Y162 PolarHBondContact OE1-OH 3.18Å; K160-Y162 HydrophobicContact CB-CD1 3.36Å; K160-Y162 HydrophobicContact CB-CE1 3.34Å; K160-Y162 HydrophobicContact CB-CG 4.46Å; K160-Y162 HydrophobicContact CG-CD1 4.19Å; K160-Y162 HydrophobicContact CG-CE1 3.79Å; K160-Y162 PolarHBondContact O-N 2.9Å; K160-Y162 VanDerWaalsContact O-N 3.16Å; Y162-R164 VanDerWaalsContact C-N 3.28Å; Y162-R164 PolarHBondContact O-N 2.97Å; Y162-I165 WeakPolarHBondContact O-CB 3.35Å; Y162-I165 PolarHBondContact O-N 3.21Å; Y162-R166 HydrophobicContact CD2-CG 4.21Å; Y162-R166 WeakPolarHBondContact O-CG 3.31Å; Y162-R166 PolarHBondContact O-N 2.89Å
163	Q	93.5	Very high	92.1	Very high	12 Å²	12	55 Å²	55	6%	0.056	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-37.6	175.2	-60	-65.3	-6.2	0	0	111.3	E157 K160 P161 I165 R166 V167	E157-Q163 PolarHBondContact O-NE2 3.17Å; K160-Q163 WeakPolarHBondContact O-CB 3.27Å; K160-Q163 WeakPolarHBondContact O-CG 3.21Å; K160-Q163 PolarHBondContact O-N 2.94Å; K160-Q163 VanDerWaalsContact O-N 3.13Å; P161-Q163 PolarHBondContact O-N 3.31Å; P161-Q163 VanDerWaalsContact O-N 3.1Å; Q163-I165 VanDerWaalsContact C-N 3.32Å; Q163-I165 PolarHBondContact O-N 3.45Å; Q163-R166 PolarHBondContact O-N 3.15Å; Q163-V167 VanDerWaalsContact O-CG2 3.26Å; Q163-V167 WeakPolarHBondContact O-CG2 3.48Å; Q163-V167 PolarHBondContact O-N 2.61Å
164	R	94.7	Very high	91.9	Very high	46 Å²	46	55.1 Å²	55.1	17%	0.174	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-40.6	173.4	-65.2	179.5	-179.4	175.5	-3.7	111.5	L69 L70 N71 E106 P161 Y162 R166 V167 L168	L69-R164 WeakPolarHBondContact O-CD 3.48Å; L70-R164 WeakPolarHBondContact O-CD 3.33Å; L70-R164 PolarHBondContact O-NH1 2.84Å; N71-R164 PolarHBondContact O-NH1 3.41Å; N71-R164 PolarHBondContact O-NH2 3.28Å; E106-R164 IonicContact OE1-CZ 3.62Å; E106-R164 IonicContact OE1-NE 2.86Å; E106-R164 PolarHBondContact OE1-NE 3.32Å; E106-R164 IonicContact OE1-NH2 3.53Å; E106-R164 IonicContact OE2-CZ 3.54Å; E106-R164 IonicContact OE2-NE 3.59Å; E106-R164 IonicContact OE2-NH2 2.7Å; E106-R164 PolarHBondContact OE2-NH2 2.8Å; P161-R164 WeakPolarHBondContact O-CB 3.42Å; P161-R164 PolarHBondContact O-N 2.91Å; P161-R164 VanDerWaalsContact O-N 3.07Å; Y162-R164 VanDerWaalsContact C-N 3.28Å; Y162-R164 PolarHBondContact O-N 2.97Å; R164-R166 PolarHBondContact O-N 3.03Å; R164-V167 PolarHBondContact O-N 2.81Å; R164-L168 VanDerWaalsContact O-CB 3.29Å; R164-L168 WeakPolarHBondContact O-CB 3.32Å; R164-L168 PolarHBondContact O-N 2.81Å
165	I	90	Very high	91.7	Very high	83 Å²	83	48.2 Å²	48.2	43%	0.426	24%	0.235	S	C	.	.	H	α-helix	trans	-64.9	-39.5	177	-57.2	175.3	0	0	0	111	L70 Y162 Q163 L168 N169	L70-I165 HydrophobicContact CD2-CG1 4.07Å; Y162-I165 WeakPolarHBondContact O-CB 3.35Å; Y162-I165 PolarHBondContact O-N 3.21Å; Q163-I165 VanDerWaalsContact C-N 3.32Å; Q163-I165 PolarHBondContact O-N 3.45Å; I165-L168 WeakPolarHBondContact O-CB 3.45Å; I165-L168 PolarHBondContact O-N 3.13Å; I165-N169 VanDerWaalsContact O-CG 3.25Å; I165-N169 PolarHBondContact O-N 3.13Å; I165-N169 PolarHBondContact O-ND2 3.39Å
166	R	90.8	Very high	91.1	Very high	141 Å²	141	45.7 Å²	45.7	53%	0.532	22%	0.224	S	C	.	.	H	α-helix	trans	-62.7	-45.3	176.1	-71.5	176.2	66	-161.7	8.9	112.1	Y162 Q163 R164 L168 N169 A170	Y162-R166 HydrophobicContact CD2-CG 4.21Å; Y162-R166 WeakPolarHBondContact O-CG 3.31Å; Y162-R166 PolarHBondContact O-N 2.89Å; Q163-R166 PolarHBondContact O-N 3.15Å; R164-R166 PolarHBondContact O-N 3.03Å; R166-L168 VanDerWaalsContact C-N 3.33Å; R166-N169 PolarHBondContact O-N 2.72Å; R166-A170 PolarHBondContact O-N 3.42Å
167	V	94.3	Very high	90.6	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.03	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-46	176.4	176.3	0	0	0	0	109.5	L69 I98 L99 Q102 Q163 R164 N169 A170 V171	L69-V167 HydrophobicContact CD1-CG1 4.45Å; L69-V167 HydrophobicContact CD2-CG1 4.32Å; I98-V167 HydrophobicContact CG2-CB 4.16Å; I98-V167 HydrophobicContact CG2-CG1 4.2Å; I98-V167 HydrophobicContact CG2-CG2 3.6Å; L99-V167 HydrophobicContact CD2-CG1 3.72Å; L99-V167 HydrophobicContact CG-CG1 4.17Å; Q102-V167 HydrophobicContact CB-CG2 3.72Å; Q102-V167 HydrophobicContact CG-CG2 3.93Å; Q163-V167 VanDerWaalsContact O-CG2 3.26Å; Q163-V167 WeakPolarHBondContact O-CG2 3.48Å; Q163-V167 PolarHBondContact O-N 2.61Å; R164-V167 PolarHBondContact O-N 2.81Å; V167-N169 PolarHBondContact O-N 2.94Å; V167-A170 PolarHBondContact O-N 3.44Å; V167-V171 HydrophobicContact CG1-CG2 4.34Å; V167-V171 WeakPolarHBondContact O-CG2 3.19Å; V167-V171 PolarHBondContact O-N 3.07Å
168	L	92.4	Very high	90.2	Very high	11 Å²	11	46 Å²	46	6%	0.058	23%	0.231	C	C	.	.	H	α-helix	trans	-54.5	-51.3	176.5	173.6	59.2	0	0	0	112.1	I65 E66 L69 L70 R164 I165 R166 A170 V171 N172	I65-L168 HydrophobicContact CG2-CD1 4.48Å; E66-L168 HydrophobicContact CB-CD1 4.16Å; E66-L168 HydrophobicContact CB-CD2 4.39Å; E66-L168 HydrophobicContact CG-CD1 3.5Å; E66-L168 HydrophobicContact CG-CD2 3.83Å; E66-L168 HydrophobicContact CG-CG 4.15Å; L69-L168 HydrophobicContact CB-CB 4.42Å; L69-L168 HydrophobicContact CB-CD1 4.38Å; L69-L168 HydrophobicContact CD1-CB 4.22Å; L69-L168 HydrophobicContact CD1-CD1 3.83Å; L70-L168 HydrophobicContact CD1-CD2 4.32Å; L70-L168 HydrophobicContact CD2-CD2 3.95Å; L70-L168 HydrophobicContact CG-CD2 4.04Å; R164-L168 VanDerWaalsContact O-CB 3.29Å; R164-L168 WeakPolarHBondContact O-CB 3.32Å; R164-L168 PolarHBondContact O-N 2.81Å; I165-L168 WeakPolarHBondContact O-CB 3.45Å; I165-L168 PolarHBondContact O-N 3.13Å; R166-L168 VanDerWaalsContact C-N 3.33Å; L168-A170 VanDerWaalsContact C-N 3.29Å; L168-A170 PolarHBondContact O-N 3.21Å; L168-V171 PolarHBondContact O-N 3.01Å; L168-V171 VanDerWaalsContact O-N 3.16Å; L168-N172 WeakPolarHBondContact CD1-OD1 3.48Å; L168-N172 WeakPolarHBondContact O-CB 3.42Å; L168-N172 PolarHBondContact O-N 3.22Å
169	N	87.1	Confident	89.6	Confident	84 Å²	84	48.3 Å²	48.3	45%	0.449	24%	0.243	S	C	.	.	H	α-helix	trans	-60.4	-39.9	-179.5	-70.2	-15.5	0	0	0	112.1	I165 R166 V167 N173	I165-N169 VanDerWaalsContact O-CG 3.25Å; I165-N169 PolarHBondContact O-N 3.13Å; I165-N169 PolarHBondContact O-ND2 3.39Å; R166-N169 PolarHBondContact O-N 2.72Å; V167-N169 PolarHBondContact O-N 2.94Å; N169-N173 VanDerWaalsContact O-CB 3.28Å; N169-N173 WeakPolarHBondContact O-CB 3.47Å; N169-N173 PolarHBondContact O-N 3.29Å; N169-N173 PolarHBondContact O-ND2 2.9Å
170	A	89.3	Confident	88.6	Confident	29 Å²	29	51.4 Å²	51.4	24%	0.24	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-44.7	176.6	0	0	0	0	0	111.7	R166 V167 L168 L174	R166-A170 PolarHBondContact O-N 3.42Å; V167-A170 PolarHBondContact O-N 3.44Å; L168-A170 VanDerWaalsContact C-N 3.29Å; L168-A170 PolarHBondContact O-N 3.21Å; A170-L174 PolarHBondContact O-N 3.04Å; A170-L174 VanDerWaalsContact O-N 3.16Å
171	V	93	Very high	87.6	Confident	3 Å²	3	50 Å²	50	2%	0.018	27%	0.27	C	S	.	.	H	α-helix	trans	-70.1	-45.6	-179.7	176.7	0	0	0	0	111.6	I65 L69 I81 V95 L99 V167 L168 N173 L174 W175	I65-V171 HydrophobicContact CG2-CG1 3.68Å; L69-V171 HydrophobicContact CD1-CB 4.04Å; L69-V171 HydrophobicContact CD1-CG1 4.26Å; L69-V171 HydrophobicContact CD1-CG2 4.09Å; I81-V171 HydrophobicContact CD1-CG1 3.54Å; V95-V171 HydrophobicContact CG1-CG2 3.87Å; L99-V171 HydrophobicContact CD1-CG2 3.87Å; L99-V171 HydrophobicContact CD2-CG2 3.92Å; L99-V171 HydrophobicContact CG-CG2 3.89Å; V167-V171 HydrophobicContact CG1-CG2 4.34Å; V167-V171 WeakPolarHBondContact O-CG2 3.19Å; V167-V171 PolarHBondContact O-N 3.07Å; L168-V171 PolarHBondContact O-N 3.01Å; L168-V171 VanDerWaalsContact O-N 3.16Å; V171-N173 VanDerWaalsContact C-N 3.35Å; V171-N173 PolarHBondContact O-N 3.08Å; V171-L174 PolarHBondContact O-N 2.79Å; V171-W175 WeakPolarHBondContact O-CB 3.22Å; V171-W175 PolarHBondContact O-N 3.48Å
172	N	87.9	Confident	86.6	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.032	25%	0.253	C	S	.	.	H	α-helix	trans	-59.7	-45.8	177.9	-84.5	5.6	0	0	0	111.2	E66 L168 L174 W175 L176	E66-N172 PolarHBondContact OE1-ND2 3.43Å; L168-N172 WeakPolarHBondContact CD1-OD1 3.48Å; L168-N172 WeakPolarHBondContact O-CB 3.42Å; L168-N172 PolarHBondContact O-N 3.22Å; N172-L174 VanDerWaalsContact C-N 3.32Å; N172-L174 PolarHBondContact O-N 3.36Å; N172-W175 PolarHBondContact O-N 3.21Å; N172-L176 VanDerWaalsContact O-CB 3.32Å; N172-L176 WeakPolarHBondContact O-CB 3.4Å; N172-L176 WeakPolarHBondContact O-CD1 3.36Å; N172-L176 WeakPolarHBondContact O-CG 3.36Å; N172-L176 PolarHBondContact O-N 2.98Å
173	N	84.8	Confident	85.4	Confident	74 Å²	74	44.9 Å²	44.9	40%	0.396	24%	0.244	S	C	.	.	H	α-helix	trans	-60.4	-42.7	177.1	-75.7	-30.6	0	0	0	111.8	N169 V171 L177	N169-N173 VanDerWaalsContact O-CB 3.28Å; N169-N173 WeakPolarHBondContact O-CB 3.47Å; N169-N173 PolarHBondContact O-N 3.29Å; N169-N173 PolarHBondContact O-ND2 2.9Å; V171-N173 VanDerWaalsContact C-N 3.35Å; V171-N173 PolarHBondContact O-N 3.08Å; N173-L177 WeakPolarHBondContact O-CB 3.4Å; N173-L177 PolarHBondContact O-N 3.22Å
174	L	89.9	Confident	84.1	Confident	17 Å²	17	46.1 Å²	46.1	9%	0.089	25%	0.251	C	S	.	.	H	α-helix	trans	-65	-45.9	176.4	176.6	60.4	0	0	0	111.7	L88 L89 N92 V95 A170 V171 N172 L177 S178	L88-L174 HydrophobicContact CD1-CD1 3.93Å; L88-L174 HydrophobicContact CD1-CD2 4.32Å; L88-L174 HydrophobicContact CD1-CG 3.92Å; L88-L174 HydrophobicContact CD2-CG 4.32Å; L88-L174 HydrophobicContact CG-CD2 4.05Å; L88-L174 HydrophobicContact CG-CG 4.06Å; L89-L174 HydrophobicContact CD2-CD2 4.42Å; N92-L174 HydrophobicContact CB-CD1 4.25Å; N92-L174 HydrophobicContact CB-CD2 3.64Å; N92-L174 VanDerWaalsContact CG-CD1 3.49Å; V95-L174 HydrophobicContact CB-CD2 3.93Å; V95-L174 HydrophobicContact CG1-CD2 3.89Å; V95-L174 HydrophobicContact CG2-CD2 3.94Å; A170-L174 PolarHBondContact O-N 3.04Å; A170-L174 VanDerWaalsContact O-N 3.16Å; V171-L174 PolarHBondContact O-N 2.79Å; N172-L174 VanDerWaalsContact C-N 3.32Å; N172-L174 PolarHBondContact O-N 3.36Å; L174-L177 PolarHBondContact O-N 3.29Å; L174-S178 PolarHBondContact O-N 3.31Å
175	W	89.3	Confident	83	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-59.3	-51.8	178.9	-177	-95.8	0	0	0	111	I65 I81 R84 K85 L88 V171 N172 L177 S178 E179	I65-W175 HydrophobicContact CD1-CB 4.45Å; I65-W175 HydrophobicContact CD1-CD2 3.7Å; I65-W175 HydrophobicContact CD1-CE3 3.85Å; I65-W175 HydrophobicContact CD1-CG 3.95Å; I65-W175 HydrophobicContact CD1-CZ3 4.43Å; I81-W175 HydrophobicContact CG1-CE3 4.5Å; I81-W175 HydrophobicContact CG2-CE3 4.38Å; I81-W175 HydrophobicContact CG2-CZ3 4.21Å; R84-W175 HydrophobicContact CB-CH2 3.75Å; R84-W175 HydrophobicContact CB-CZ3 4.46Å; K85-W175 HydrophobicContact CB-CZ3 4.21Å; K85-W175 HydrophobicContact CD-CE3 4.33Å; K85-W175 HydrophobicContact CD-CH2 4.02Å; K85-W175 HydrophobicContact CD-CZ3 3.84Å; K85-W175 HydrophobicContact CG-CH2 4.1Å; K85-W175 HydrophobicContact CG-CZ3 4.04Å; L88-W175 HydrophobicContact CD2-CE3 3.67Å; L88-W175 HydrophobicContact CD2-CZ3 4.14Å; V171-W175 WeakPolarHBondContact O-CB 3.22Å; V171-W175 PolarHBondContact O-N 3.48Å; N172-W175 PolarHBondContact O-N 3.21Å; W175-L177 PolarHBondContact O-N 2.67Å; W175-S178 CarbonylContact O-C 3.6Å; W175-S178 PolarHBondContact O-N 2.95Å; W175-S178 PolarHBondContact O-OG 3.48Å; W175-E179 HydrophobicContact CZ2-CG 4.43Å; W175-E179 PolarHBondContact O-N 2.84Å
176	L	81.9	Confident	82.1	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-39.4	179.4	-68.2	166.9	0	0	0	112.2	R34 N172 S178 E179 L180	R34-L176 HydrophobicContact CB-CD1 3.81Å; R34-L176 HydrophobicContact CG-CD1 3.57Å; R34-L176 HydrophobicContact CG-CD2 4.14Å; R34-L176 HydrophobicContact CG-CG 4.47Å; N172-L176 VanDerWaalsContact O-CB 3.32Å; N172-L176 WeakPolarHBondContact O-CB 3.4Å; N172-L176 WeakPolarHBondContact O-CD1 3.36Å; N172-L176 WeakPolarHBondContact O-CG 3.36Å; N172-L176 PolarHBondContact O-N 2.98Å; L176-S178 PolarHBondContact O-N 3.33Å; L176-E179 PolarHBondContact O-N 3.34Å; L176-L180 HydrophobicContact CD2-CD1 4.08Å; L176-L180 WeakPolarHBondContact O-CB 3.32Å; L176-L180 PolarHBondContact O-N 2.77Å
177	L	83.7	Confident	81.3	Confident	89 Å²	89	37.4 Å²	37.4	47%	0.466	22%	0.218	S	C	.	.	H	α-helix	trans	-58.6	-39.3	173	-177.1	67.4	0	0	0	111.3	N173 L174 W175 G181	N173-L177 WeakPolarHBondContact O-CB 3.4Å; N173-L177 PolarHBondContact O-N 3.22Å; L174-L177 PolarHBondContact O-N 3.29Å; W175-L177 PolarHBondContact O-N 2.67Å; L177-G181 WeakPolarHBondContact O-CA 3.43Å; L177-G181 PolarHBondContact O-N 2.81Å
178	S	85.8	Confident	80.2	Confident	46 Å²	46	39 Å²	39	32%	0.322	23%	0.226	S	C	.	.	H	α-helix	trans	-77.6	-26.6	179.4	77.3	0	0	0	0	114.5	K85 L174 W175 L176	K85-S178 PolarHBondContact NZ-O 3.2Å; K85-S178 VanDerWaalsContact NZ-O 3.09Å; K85-S178 PolarHBondContact NZ-OG 2.86Å; L174-S178 PolarHBondContact O-N 3.31Å; W175-S178 CarbonylContact O-C 3.6Å; W175-S178 PolarHBondContact O-N 2.95Å; W175-S178 PolarHBondContact O-OG 3.48Å; L176-S178 PolarHBondContact O-N 3.33Å
179	E	82	Confident	79.2	Confident	77 Å²	77	39 Å²	39	36%	0.36	23%	0.226	S	C	.	.	H	α-helix	trans	-83.6	-45.5	176.7	-74.5	-63.8	148.2	0	0	111.7	A58 K85 W175 L176	A58-E179 HydrophobicContact CB-CB 4.3Å; A58-E179 HydrophobicContact CB-CG 4.16Å; K85-E179 WeakPolarHBondContact CE-OE1 3.39Å; K85-E179 IonicContact NZ-OE1 2.59Å; K85-E179 PolarHBondContact NZ-OE1 3.43Å; K85-E179 IonicContact NZ-OE2 2.87Å; W175-E179 HydrophobicContact CZ2-CG 4.43Å; W175-E179 PolarHBondContact O-N 2.84Å; L176-E179 PolarHBondContact O-N 3.34Å
180	L	73.3	Confident	78.7	Confident	72 Å²	72	36.4 Å²	36.4	38%	0.377	21%	0.213	S	C	.	.	H	α-helix	trans	-110.9	-5.7	-166.2	-56.1	175.7	0	0	0	113.2	R34 L176 K182	R34-L180 VanDerWaalsContact NH2-CD1 3.27Å; L176-L180 HydrophobicContact CD2-CD1 4.08Å; L176-L180 WeakPolarHBondContact O-CB 3.32Å; L176-L180 PolarHBondContact O-N 2.77Å; L180-K182 HydrophobicContact CB-CG 4.48Å; L180-K182 PolarHBondContact O-N 2.89Å
181	G	74.8	Confident	78.2	Confident	62 Å²	62	39.4 Å²	39.4	64%	0.639	22%	0.221	S	C	*	.	S	Bend	trans	72.1	-0.7	-174.2	0	0	0	0	0	114.6	L177	L177-G181 WeakPolarHBondContact O-CA 3.43Å; L177-G181 PolarHBondContact O-N 2.81Å
182	K	70.4	Confident	77.3	Confident	65 Å²	65	43.2 Å²	43.2	28%	0.283	24%	0.237	S	C	.	.			trans	-140	128.6	176.3	52.8	164.9	-176.1	163.9	0	111.2	E30 R34 L180 D186	E30-K182 VanDerWaalsContact CD-NZ 3.33Å; E30-K182 WeakPolarHBondContact OE1-CE 3.25Å; E30-K182 IonicContact OE1-NZ 2.68Å; E30-K182 PolarHBondContact OE1-NZ 3.34Å; E30-K182 IonicContact OE2-NZ 2.98Å; E30-K182 PolarHBondContact OE2-NZ 3.37Å; R34-K182 PolarHBondContact NH1-O 2.97Å; R34-K182 PolarHBondContact NH2-O 2.91Å; L180-K182 HydrophobicContact CB-CG 4.48Å; L180-K182 PolarHBondContact O-N 2.89Å; K182-D186 IonicContact NZ-OD1 3.86Å; K182-D186 PolarHBondContact NZ-OD1 3.33Å; K182-D186 IonicContact NZ-OD2 3.54Å; K182-D186 PolarHBondContact NZ-OD2 2.68Å
183	G	64.4	Low	76.6	Confident	16 Å²	16	45.2 Å²	45.2	17%	0.165	25%	0.246	C	C	.	.	S	Bend	trans	-80.8	-36.8	-178.1	0	0	0	0	0	114.8	R34	R34-G183 PolarHBondContact NH1-O 3.44Å
184	D	67.3	Low	76.4	Confident	38 Å²	38	43.9 Å²	43.9	20%	0.203	24%	0.238	C	C	.	.	S	Bend	trans	-91.7	144.8	176.9	-70	-43.7	0	0	0	111.5	R34 D188 L189 K192	R34-D184 PolarHBondContact NH1-O 3.17Å; D184-D188 HydrophobicContact CB-CB 4.07Å; D184-L189 HydrophobicContact CB-CD2 3.92Å; D184-L189 HydrophobicContact CB-CG 3.91Å; D184-K192 IonicContact OD1-NZ 3.13Å; D184-K192 PolarHBondContact OD1-NZ 3.28Å; D184-K192 IonicContact OD2-NZ 2.77Å; D184-K192 PolarHBondContact OD2-NZ 2.8Å
185	S	70.8	Confident	75.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.263	C	S	.	.			trans	-67.1	158.2	166.5	64.8	0	0	0	0	110.5	F187 D188 L189	S185-F187 PolarHBondContact O-N 3.04Å; S185-D188 WeakPolarHBondContact CB-OD2 3.44Å; S185-D188 PolarHBondContact N-OD2 3.23Å; S185-D188 VanDerWaalsContact N-OD2 3.13Å; S185-D188 WeakPolarHBondContact O-CB 3.07Å; S185-D188 PolarHBondContact O-N 2.94Å; S185-D188 VanDerWaalsContact O-N 3.13Å; S185-D188 PolarHBondContact OG-N 3.02Å; S185-D188 PolarHBondContact OG-OD2 3.24Å; S185-L189 WeakPolarHBondContact O-CG 3.44Å; S185-L189 PolarHBondContact O-N 2.64Å
186	D	70.6	Confident	75.6	Confident	47 Å²	47	56.1 Å²	56.1	25%	0.251	29%	0.289	S	S	.	.	H	α-helix	trans	-60.6	-30.7	174.6	-67.8	-11.5	0	0	0	111	C27 E30 K182 L189 V190	C27-D186 HydrophobicContact CB-CB 4.43Å; E30-D186 PolarHBondContact OE2-N 3.16Å; K182-D186 IonicContact NZ-OD1 3.86Å; K182-D186 PolarHBondContact NZ-OD1 3.33Å; K182-D186 IonicContact NZ-OD2 3.54Å; K182-D186 PolarHBondContact NZ-OD2 2.68Å; D186-L189 PolarHBondContact O-N 3.35Å; D186-V190 VanDerWaalsContact O-CG2 3.31Å; D186-V190 WeakPolarHBondContact O-CG2 3.31Å; D186-V190 PolarHBondContact O-N 3.23Å
187	F	73.4	Confident	75.3	Confident	40 Å²	40	57 Å²	57	18%	0.175	30%	0.297	C	S	.	.	H	α-helix	trans	-69.9	-40.8	174.6	-162.1	-107.9	0	0	0	113.3	C27 V28 F31 S185 L189 V190 F191	C27-F187 HydrophobicContact CB-CB 4.21Å; C27-F187 HydrophobicContact CB-CD2 4.45Å; V28-F187 HydrophobicContact CG2-CD2 3.95Å; V28-F187 HydrophobicContact CG2-CE2 3.65Å; V28-F187 HydrophobicContact CG2-CZ 4.1Å; F31-F187 HydrophobicContact CB-CB 3.82Å; F31-F187 HydrophobicContact CB-CD1 3.93Å; F31-F187 HydrophobicContact CB-CG 4.2Å; F31-F187 AromaticContact CD1-CD1 3.98Å; F31-F187 HydrophobicContact CD1-CD1 3.98Å; F31-F187 HydrophobicContact CD1-CE1 4.26Å; F31-F187 AromaticContact CD2-CD1 3.98Å; F31-F187 HydrophobicContact CD2-CD1 3.98Å; F31-F187 HydrophobicContact CG-CB 4.37Å; F31-F187 AromaticContact CG-CD1 3.67Å; F31-F187 HydrophobicContact CG-CD1 3.67Å; F31-F187 HydrophobicContact CG-CE1 4.4Å; F31-F187 HydrophobicContact CG-CG 4.42Å; S185-F187 PolarHBondContact O-N 3.04Å; F187-L189 VanDerWaalsContact C-N 3.27Å; F187-L189 PolarHBondContact O-N 2.88Å; F187-V190 WeakPolarHBondContact O-CB 3.46Å; F187-V190 PolarHBondContact O-N 3.23Å; F187-V190 VanDerWaalsContact O-N 3.15Å; F187-F191 AromaticContact CD1-CD2 3.82Å; F187-F191 HydrophobicContact CD1-CD2 3.82Å; F187-F191 AromaticContact CD1-CE2 3.97Å; F187-F191 HydrophobicContact CD1-CE2 3.97Å; F187-F191 AromaticContact CE1-CD2 3.61Å; F187-F191 HydrophobicContact CE1-CD2 3.61Å; F187-F191 AromaticContact CE1-CE2 3.26Å; F187-F191 HydrophobicContact CE1-CE2 3.26Å; F187-F191 HydrophobicContact CE1-CZ 4.45Å; F187-F191 HydrophobicContact CE2-CE2 4.37Å; F187-F191 HydrophobicContact CZ-CD2 4.11Å; F187-F191 AromaticContact CZ-CE2 3.5Å; F187-F191 HydrophobicContact CZ-CE2 3.5Å; F187-F191 VanDerWaalsContact CZ-CE2 3.5Å; F187-F191 PolarHBondContact O-N 2.79Å
188	D	72.1	Confident	75.5	Confident	40 Å²	40	54.4 Å²	54.4	21%	0.214	28%	0.282	C	S	.	.	H	α-helix	trans	-59.4	-42.3	172.8	-72.8	-54.8	0	0	0	110.8	F31 D184 S185 V190 F191 K192	F31-D188 WeakPolarHBondContact CD2-OD1 3.41Å; F31-D188 WeakPolarHBondContact CE2-OD1 3.44Å; D184-D188 HydrophobicContact CB-CB 4.07Å; S185-D188 WeakPolarHBondContact CB-OD2 3.44Å; S185-D188 PolarHBondContact N-OD2 3.23Å; S185-D188 VanDerWaalsContact N-OD2 3.13Å; S185-D188 WeakPolarHBondContact O-CB 3.07Å; S185-D188 PolarHBondContact O-N 2.94Å; S185-D188 VanDerWaalsContact O-N 3.13Å; S185-D188 PolarHBondContact OG-N 3.02Å; S185-D188 PolarHBondContact OG-OD2 3.24Å; D188-V190 VanDerWaalsContact C-N 3.32Å; D188-V190 PolarHBondContact O-N 2.84Å; D188-F191 PolarHBondContact O-N 3.29Å; D188-K192 WeakPolarHBondContact O-CB 3.04Å; D188-K192 VanDerWaalsContact O-CG 3.31Å; D188-K192 WeakPolarHBondContact O-CG 3.41Å; D188-K192 PolarHBondContact O-N 2.66Å
189	L	71.4	Confident	75.3	Confident	11 Å²	11	54.8 Å²	54.8	6%	0.058	29%	0.285	C	S	.	.	H	α-helix	trans	-63.5	-39.4	176.4	-66.9	173.6	0	0	0	111.4	L8 D184 S185 D186 F187 F193	L8-L189 HydrophobicContact CD2-CB 3.68Å; L8-L189 HydrophobicContact CD2-CD1 4.39Å; D184-L189 HydrophobicContact CB-CD2 3.92Å; D184-L189 HydrophobicContact CB-CG 3.91Å; S185-L189 WeakPolarHBondContact O-CG 3.44Å; S185-L189 PolarHBondContact O-N 2.64Å; D186-L189 PolarHBondContact O-N 3.35Å; F187-L189 VanDerWaalsContact C-N 3.27Å; F187-L189 PolarHBondContact O-N 2.88Å; L189-F193 VanDerWaalsContact O-CB 3.22Å; L189-F193 WeakPolarHBondContact O-CB 3.43Å; L189-F193 PolarHBondContact O-N 3.06Å
190	V	76.5	Confident	75.1	Confident	29 Å²	29	52.7 Å²	52.7	18%	0.176	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-44.9	173.7	170.1	0	0	0	0	111.1	L8 L12 D186 F187 D188 F193 I194	L8-V190 HydrophobicContact CD2-CG2 4.18Å; L12-V190 HydrophobicContact CD1-CG2 4.09Å; D186-V190 VanDerWaalsContact O-CG2 3.31Å; D186-V190 WeakPolarHBondContact O-CG2 3.31Å; D186-V190 PolarHBondContact O-N 3.23Å; F187-V190 WeakPolarHBondContact O-CB 3.46Å; F187-V190 PolarHBondContact O-N 3.23Å; F187-V190 VanDerWaalsContact O-N 3.15Å; D188-V190 VanDerWaalsContact C-N 3.32Å; D188-V190 PolarHBondContact O-N 2.84Å; V190-F193 WeakPolarHBondContact O-CB 3.14Å; V190-F193 PolarHBondContact O-N 3.01Å; V190-I194 HydrophobicContact CG1-CD1 3.86Å; V190-I194 HydrophobicContact CG1-CG1 4.41Å; V190-I194 WeakPolarHBondContact O-CG1 3.38Å; V190-I194 PolarHBondContact O-N 3.45Å
191	F	78.9	Confident	75.6	Confident	92 Å²	92	51.8 Å²	51.8	40%	0.404	27%	0.273	S	S	.	.	H	α-helix	trans	-62.5	-48.7	177.3	-101.5	-79.4	0	0	0	112.4	F187 D188 F193 I194 E195 L211	F187-F191 AromaticContact CD1-CD2 3.82Å; F187-F191 HydrophobicContact CD1-CD2 3.82Å; F187-F191 AromaticContact CD1-CE2 3.97Å; F187-F191 HydrophobicContact CD1-CE2 3.97Å; F187-F191 AromaticContact CE1-CD2 3.61Å; F187-F191 HydrophobicContact CE1-CD2 3.61Å; F187-F191 AromaticContact CE1-CE2 3.26Å; F187-F191 HydrophobicContact CE1-CE2 3.26Å; F187-F191 HydrophobicContact CE1-CZ 4.45Å; F187-F191 HydrophobicContact CE2-CE2 4.37Å; F187-F191 HydrophobicContact CZ-CD2 4.11Å; F187-F191 AromaticContact CZ-CE2 3.5Å; F187-F191 HydrophobicContact CZ-CE2 3.5Å; F187-F191 VanDerWaalsContact CZ-CE2 3.5Å; F187-F191 PolarHBondContact O-N 2.79Å; D188-F191 PolarHBondContact O-N 3.29Å; F191-F193 PolarHBondContact O-N 3.35Å; F191-I194 PolarHBondContact O-N 3.09Å; F191-I194 VanDerWaalsContact O-N 3.16Å; F191-E195 PolarHBondContact O-N 2.94Å; F191-L211 HydrophobicContact CD1-CD2 4.42Å; F191-L211 HydrophobicContact CE1-CD2 3.53Å; F191-L211 HydrophobicContact CZ-CD2 3.97Å
192	K	74.3	Confident	76.1	Confident	82 Å²	82	53 Å²	53	36%	0.357	26%	0.262	S	S	.	.	H	α-helix	trans	-58.4	-37.2	174.6	-69.8	175.9	-167.4	179.5	0	111.3	D184 D188 W196	D184-K192 IonicContact OD1-NZ 3.13Å; D184-K192 PolarHBondContact OD1-NZ 3.28Å; D184-K192 IonicContact OD2-NZ 2.77Å; D184-K192 PolarHBondContact OD2-NZ 2.8Å; D188-K192 WeakPolarHBondContact O-CB 3.04Å; D188-K192 VanDerWaalsContact O-CG 3.31Å; D188-K192 WeakPolarHBondContact O-CG 3.41Å; D188-K192 PolarHBondContact O-N 2.66Å; K192-W196 WeakPolarHBondContact O-CB 3.28Å; K192-W196 PolarHBondContact O-N 2.89Å
193	F	72.9	Confident	76.9	Confident	48 Å²	48	57.6 Å²	57.6	21%	0.211	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-46.4	175.3	170.8	-104.7	0	0	0	112.4	V5 M9 L189 V190 F191 W196 A197	V5-F193 HydrophobicContact CG1-CD2 4.26Å; M9-F193 HydrophobicContact CE-CD2 4.36Å; M9-F193 HydrophobicContact CE-CE2 3.29Å; M9-F193 HydrophobicContact CE-CZ 3.62Å; M9-F193 HydrophobicContact CG-CD2 3.85Å; M9-F193 HydrophobicContact CG-CE2 3.6Å; M9-F193 HydrophobicContact CG-CZ 4.12Å; M9-F193 HydrophobicContact SD-CD2 3.88Å; M9-F193 HydrophobicContact SD-CE2 3.36Å; M9-F193 WeakPolarHBondContact SD-CE2 3.39Å; M9-F193 HydrophobicContact SD-CZ 4.2Å; L189-F193 VanDerWaalsContact O-CB 3.22Å; L189-F193 WeakPolarHBondContact O-CB 3.43Å; L189-F193 PolarHBondContact O-N 3.06Å; V190-F193 WeakPolarHBondContact O-CB 3.14Å; V190-F193 PolarHBondContact O-N 3.01Å; F191-F193 PolarHBondContact O-N 3.35Å; F193-W196 HydrophobicContact CD2-CE3 4.03Å; F193-W196 HydrophobicContact CD2-CZ3 4.43Å; F193-W196 AromaticContact CE2-CE3 3.85Å; F193-W196 HydrophobicContact CE2-CE3 3.85Å; F193-W196 AromaticContact CE2-CZ3 3.85Å; F193-W196 HydrophobicContact CE2-CZ3 3.85Å; F193-W196 PolarHBondContact O-N 2.81Å; F193-A197 HydrophobicContact CZ-CB 4.34Å; F193-A197 WeakPolarHBondContact O-CB 3.37Å; F193-A197 PolarHBondContact O-N 3.41Å
194	I	81.3	Confident	77.9	Confident	47 Å²	47	65.5 Å²	65.5	24%	0.241	31%	0.309	C	S	.	.	H	α-helix	trans	-59	-49.7	176.2	-70.5	167.6	0	0	0	109.3	V190 F191 W196 A197 Q198 L211	V190-I194 HydrophobicContact CG1-CD1 3.86Å; V190-I194 HydrophobicContact CG1-CG1 4.41Å; V190-I194 WeakPolarHBondContact O-CG1 3.38Å; V190-I194 PolarHBondContact O-N 3.45Å; F191-I194 PolarHBondContact O-N 3.09Å; F191-I194 VanDerWaalsContact O-N 3.16Å; I194-W196 VanDerWaalsContact C-N 3.31Å; I194-W196 PolarHBondContact O-N 2.93Å; I194-A197 PolarHBondContact O-N 3.01Å; I194-A197 VanDerWaalsContact O-N 3.14Å; I194-Q198 HydrophobicContact CG2-CG 4.18Å; I194-Q198 WeakPolarHBondContact O-CB 3.45Å; I194-Q198 VanDerWaalsContact O-CG 3.24Å; I194-Q198 WeakPolarHBondContact O-CG 3.28Å; I194-Q198 PolarHBondContact O-N 3.03Å; I194-L211 HydrophobicContact CD1-CD1 4.37Å; I194-L211 HydrophobicContact CG2-CB 4.49Å; I194-L211 HydrophobicContact CG2-CD1 4.24Å
195	E	79.4	Confident	78.7	Confident	130 Å²	130	70.8 Å²	70.8	61%	0.607	34%	0.337	S	S	*	.	H	α-helix	trans	-57.3	-43.9	179.5	-167	-176.4	-179.3	0	0	112.1	F191 S199	F191-E195 PolarHBondContact O-N 2.94Å; E195-S199 PolarHBondContact O-N 3.16Å; E195-S199 PolarHBondContact O-OG 3.25Å
196	W	81.6	Confident	79.3	Confident	145 Å²	145	74.6 Å²	74.6	55%	0.549	36%	0.357	S	S	.	.	H	α-helix	trans	-62.2	-48.7	173.5	174.3	79.6	0	0	0	112.4	K192 F193 I194 Q198 S199 V200	K192-W196 WeakPolarHBondContact O-CB 3.28Å; K192-W196 PolarHBondContact O-N 2.89Å; F193-W196 HydrophobicContact CD2-CE3 4.03Å; F193-W196 HydrophobicContact CD2-CZ3 4.43Å; F193-W196 AromaticContact CE2-CE3 3.85Å; F193-W196 HydrophobicContact CE2-CE3 3.85Å; F193-W196 AromaticContact CE2-CZ3 3.85Å; F193-W196 HydrophobicContact CE2-CZ3 3.85Å; F193-W196 PolarHBondContact O-N 2.81Å; I194-W196 VanDerWaalsContact C-N 3.31Å; I194-W196 PolarHBondContact O-N 2.93Å; W196-Q198 VanDerWaalsContact C-N 3.31Å; W196-Q198 PolarHBondContact O-N 3.28Å; W196-S199 WeakPolarHBondContact O-CB 3.23Å; W196-S199 PolarHBondContact O-N 2.94Å; W196-S199 VanDerWaalsContact O-N 3.1Å; W196-V200 HydrophobicContact CD2-CG2 4.13Å; W196-V200 HydrophobicContact CH2-CG2 4.35Å; W196-V200 HydrophobicContact CZ2-CG2 3.76Å; W196-V200 WeakPolarHBondContact O-CG2 3.49Å; W196-V200 PolarHBondContact O-N 2.59Å
197	A	77.6	Confident	79.8	Confident	22 Å²	22	78.4 Å²	78.4	18%	0.182	38%	0.384	C	S	.	.	H	α-helix	trans	-61	-41.8	-179.4	0	0	0	0	0	111.4	F193 I194 S199 V200 L201	F193-A197 HydrophobicContact CZ-CB 4.34Å; F193-A197 WeakPolarHBondContact O-CB 3.37Å; F193-A197 PolarHBondContact O-N 3.41Å; I194-A197 PolarHBondContact O-N 3.01Å; I194-A197 VanDerWaalsContact O-N 3.14Å; A197-S199 VanDerWaalsContact C-N 3.33Å; A197-S199 PolarHBondContact O-N 3.21Å; A197-V200 PolarHBondContact O-N 3.5Å; A197-L201 WeakPolarHBondContact O-CB 3.27Å; A197-L201 VanDerWaalsContact O-CG 3.23Å; A197-L201 WeakPolarHBondContact O-CG 3.31Å; A197-L201 PolarHBondContact O-N 2.84Å
198	Q	85.9	Confident	80.2	Confident	34 Å²	34	78.7 Å²	78.7	16%	0.159	39%	0.385	C	S	.	.	H	α-helix	trans	-62.2	-41.1	174.7	-67	-169.7	140.8	0	0	111.7	I194 W196 L201 Q202 F208 K210	I194-Q198 HydrophobicContact CG2-CG 4.18Å; I194-Q198 WeakPolarHBondContact O-CB 3.45Å; I194-Q198 VanDerWaalsContact O-CG 3.24Å; I194-Q198 WeakPolarHBondContact O-CG 3.28Å; I194-Q198 PolarHBondContact O-N 3.03Å; W196-Q198 VanDerWaalsContact C-N 3.31Å; W196-Q198 PolarHBondContact O-N 3.28Å; Q198-L201 PolarHBondContact O-N 3.38Å; Q198-Q202 WeakPolarHBondContact O-CB 3.34Å; Q198-Q202 VanDerWaalsContact O-CG 3.29Å; Q198-Q202 WeakPolarHBondContact O-CG 3.27Å; Q198-Q202 PolarHBondContact O-N 2.97Å; Q198-F208 HydrophobicContact CB-CE2 3.6Å; Q198-F208 HydrophobicContact CB-CZ 3.8Å; Q198-F208 HydrophobicContact CG-CD2 4.12Å; Q198-F208 HydrophobicContact CG-CE2 3.45Å; Q198-F208 VanDerWaalsContact CG-CE2 3.45Å; Q198-F208 HydrophobicContact CG-CZ 4.19Å; Q198-F208 WeakPolarHBondContact O-CZ 3.33Å; Q198-K210 VanDerWaalsContact OE1-CA 3.25Å
199	S	81.8	Confident	80.5	Confident	53 Å²	53	82.7 Å²	82.7	37%	0.371	41%	0.414	S	S	.	.	H	α-helix	trans	-63.4	-44.9	177.8	-59.4	0	0	0	0	111.4	E195 W196 A197 L201 Q202 E203	E195-S199 PolarHBondContact O-N 3.16Å; E195-S199 PolarHBondContact O-OG 3.25Å; W196-S199 WeakPolarHBondContact O-CB 3.23Å; W196-S199 PolarHBondContact O-N 2.94Å; W196-S199 VanDerWaalsContact O-N 3.1Å; A197-S199 VanDerWaalsContact C-N 3.33Å; A197-S199 PolarHBondContact O-N 3.21Å; S199-L201 PolarHBondContact O-N 3.46Å; S199-Q202 PolarHBondContact O-N 3.19Å; S199-E203 WeakPolarHBondContact O-CG 3.3Å; S199-E203 PolarHBondContact O-N 2.87Å
200	V	78.9	Confident	80.7	Confident	33 Å²	33	88.4 Å²	88.4	20%	0.2	44%	0.438	C	S	.	.	H	α-helix	trans	-64.2	-40.9	176.8	173.9	0	0	0	0	112.2	W196 A197 E203 R204	W196-V200 HydrophobicContact CD2-CG2 4.13Å; W196-V200 HydrophobicContact CH2-CG2 4.35Å; W196-V200 HydrophobicContact CZ2-CG2 3.76Å; W196-V200 WeakPolarHBondContact O-CG2 3.49Å; W196-V200 PolarHBondContact O-N 2.59Å; A197-V200 PolarHBondContact O-N 3.5Å; V200-E203 PolarHBondContact O-N 3.27Å; V200-R204 WeakPolarHBondContact O-CB 3.18Å; V200-R204 WeakPolarHBondContact O-CG 3.44Å; V200-R204 PolarHBondContact O-N 3.23Å; V200-R204 VanDerWaalsContact O-N 3.09Å
201	L	82.8	Confident	80.5	Confident	54 Å²	54	91.6 Å²	91.6	28%	0.283	45%	0.453	S	S	.	.	H	α-helix	trans	-68.8	-36	178.2	-68.6	169.3	0	0	0	111.8	A197 Q198 S199 R204 N205 I206 F208	A197-L201 WeakPolarHBondContact O-CB 3.27Å; A197-L201 VanDerWaalsContact O-CG 3.23Å; A197-L201 WeakPolarHBondContact O-CG 3.31Å; A197-L201 PolarHBondContact O-N 2.84Å; Q198-L201 PolarHBondContact O-N 3.38Å; S199-L201 PolarHBondContact O-N 3.46Å; L201-R204 CarbonylContact O-C 3.23Å; L201-R204 PolarHBondContact O-N 3.12Å; L201-N205 PolarHBondContact O-N 3.2Å; L201-N205 VanDerWaalsContact O-N 3.15Å; L201-I206 HydrophobicContact CD2-CB 3.93Å; L201-I206 HydrophobicContact CD2-CD1 3.94Å; L201-I206 HydrophobicContact CD2-CG2 3.98Å; L201-I206 PolarHBondContact O-N 2.77Å; L201-F208 HydrophobicContact CB-CD1 3.35Å; L201-F208 HydrophobicContact CB-CE1 3.54Å; L201-F208 HydrophobicContact CB-CG 4.07Å; L201-F208 HydrophobicContact CB-CZ 4.39Å; L201-F208 HydrophobicContact CD1-CB 3.86Å; L201-F208 HydrophobicContact CD1-CD1 3.95Å; L201-F208 HydrophobicContact CD1-CD2 4.33Å; L201-F208 HydrophobicContact CD1-CG 3.78Å; L201-F208 HydrophobicContact CG-CD1 4.27Å
202	Q	85.9	Confident	79.6	Confident	88 Å²	88	90.1 Å²	90.1	41%	0.411	46%	0.458	S	S	.	.	H	α-helix	trans	-62.9	-49.3	172	-76.2	175	33.1	0	0	111.5	Q198 S199 R204 N205 F208 K210	Q198-Q202 WeakPolarHBondContact O-CB 3.34Å; Q198-Q202 VanDerWaalsContact O-CG 3.29Å; Q198-Q202 WeakPolarHBondContact O-CG 3.27Å; Q198-Q202 PolarHBondContact O-N 2.97Å; S199-Q202 PolarHBondContact O-N 3.19Å; Q202-R204 PolarHBondContact O-N 3.28Å; Q202-N205 PolarHBondContact O-N 3.36Å; Q202-F208 HydrophobicContact CG-CE1 3.65Å; Q202-F208 HydrophobicContact CG-CZ 3.63Å; Q202-K210 VanDerWaalsContact NE2-NZ 3.2Å
203	E	87.1	Confident	78.6	Confident	161 Å²	161	92 Å²	92	75%	0.752	47%	0.472	S	S	*	.	H	α-helix	trans	-57.3	-34.7	177.3	-75.6	178.4	-179	0	0	112.3	S199 V200 N205	S199-E203 WeakPolarHBondContact O-CG 3.3Å; S199-E203 PolarHBondContact O-N 2.87Å; V200-E203 PolarHBondContact O-N 3.27Å; E203-N205 VanDerWaalsContact C-N 3.35Å
204	R	85.1	Confident	77.4	Confident	181 Å²	181	98.7 Å²	98.7	68%	0.683	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	3.2	179.2	-67.3	-173.5	178.1	-169.5	0.8	114.3	V200 L201 Q202 I206	V200-R204 WeakPolarHBondContact O-CB 3.18Å; V200-R204 WeakPolarHBondContact O-CG 3.44Å; V200-R204 PolarHBondContact O-N 3.23Å; V200-R204 VanDerWaalsContact O-N 3.09Å; L201-R204 CarbonylContact O-C 3.23Å; L201-R204 PolarHBondContact O-N 3.12Å; Q202-R204 PolarHBondContact O-N 3.28Å; R204-I206 HydrophobicContact CB-CD1 3.95Å; R204-I206 HydrophobicContact CB-CG1 4Å; R204-I206 PolarHBondContact O-N 3.37Å
205	N	85	Confident	75.6	Confident	149 Å²	149	100.6 Å²	100.6	80%	0.797	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	34	-175.9	-78.8	-36.9	0	0	0	113.7	L201 Q202 E203	L201-N205 PolarHBondContact O-N 3.2Å; L201-N205 VanDerWaalsContact O-N 3.15Å; Q202-N205 PolarHBondContact O-N 3.36Å; E203-N205 VanDerWaalsContact C-N 3.35Å
206	I	82.6	Confident	73.9	Confident	81 Å²	81	98.3 Å²	98.3	42%	0.415	52%	0.523	S	S	.	.			trans	-89	128.5	174.6	-60.9	172.9	0	0	0	107.1	L201 R204 F208	L201-I206 HydrophobicContact CD2-CB 3.93Å; L201-I206 HydrophobicContact CD2-CD1 3.94Å; L201-I206 HydrophobicContact CD2-CG2 3.98Å; L201-I206 PolarHBondContact O-N 2.77Å; R204-I206 HydrophobicContact CB-CD1 3.95Å; R204-I206 HydrophobicContact CB-CG1 4Å; R204-I206 PolarHBondContact O-N 3.37Å; I206-F208 VanDerWaalsContact O-CD1 3.26Å; I206-F208 WeakPolarHBondContact O-CD1 3.17Å
207	P	81.3	Confident	71.9	Confident	126 Å²	126	96.7 Å²	96.7	82%	0.818	53%	0.525	S	S	*	.			trans	-70.2	133.3	175.6	26.5	-31.6	0	0	0	110.8
208	F	82	Confident	69.9	Low	47 Å²	47	105 Å²	105	21%	0.206	56%	0.56	C	S	.	*			trans	-149.1	152.6	177	66.1	-83.6	0	0	0	110.3	Q198 L201 Q202 I206 K210	Q198-F208 HydrophobicContact CB-CE2 3.6Å; Q198-F208 HydrophobicContact CB-CZ 3.8Å; Q198-F208 HydrophobicContact CG-CD2 4.12Å; Q198-F208 HydrophobicContact CG-CE2 3.45Å; Q198-F208 VanDerWaalsContact CG-CE2 3.45Å; Q198-F208 HydrophobicContact CG-CZ 4.19Å; Q198-F208 WeakPolarHBondContact O-CZ 3.33Å; L201-F208 HydrophobicContact CB-CD1 3.35Å; L201-F208 HydrophobicContact CB-CE1 3.54Å; L201-F208 HydrophobicContact CB-CG 4.07Å; L201-F208 HydrophobicContact CB-CZ 4.39Å; L201-F208 HydrophobicContact CD1-CB 3.86Å; L201-F208 HydrophobicContact CD1-CD1 3.95Å; L201-F208 HydrophobicContact CD1-CD2 4.33Å; L201-F208 HydrophobicContact CD1-CG 3.78Å; L201-F208 HydrophobicContact CG-CD1 4.27Å; Q202-F208 HydrophobicContact CG-CE1 3.65Å; Q202-F208 HydrophobicContact CG-CZ 3.63Å; I206-F208 VanDerWaalsContact O-CD1 3.26Å; I206-F208 WeakPolarHBondContact O-CD1 3.17Å; F208-K210 HydrophobicContact CD2-CG 4.38Å; F208-K210 HydrophobicContact CE2-CB 4.47Å; F208-K210 HydrophobicContact CE2-CG 3.59Å; F208-K210 HydrophobicContact CZ-CG 4.02Å; F208-K210 PolarHBondContact O-N 2.8Å
209	P	77.8	Confident	67.7	Low	124 Å²	124	106 Å²	106	81%	0.805	58%	0.581	S	S	*	*			trans	-70.5	121.4	171.9	27.4	-30.8	0	0	0	109.7
210	K	76.3	Confident	65.3	Low	130 Å²	130	112 Å²	112	57%	0.565	60%	0.602	S	S	*	*			trans	-74.8	139.9	173.2	-72.1	-174.4	-179.3	-167.5	0	109.8	Q198 Q202 F208 A212	Q198-K210 VanDerWaalsContact OE1-CA 3.25Å; Q202-K210 VanDerWaalsContact NE2-NZ 3.2Å; F208-K210 HydrophobicContact CD2-CG 4.38Å; F208-K210 HydrophobicContact CE2-CB 4.47Å; F208-K210 HydrophobicContact CE2-CG 3.59Å; F208-K210 HydrophobicContact CZ-CG 4.02Å; F208-K210 PolarHBondContact O-N 2.8Å; K210-A212 PolarHBondContact O-N 3.16Å
211	L	71.2	Confident	63.1	Low	96 Å²	96	121.8 Å²	121.8	50%	0.503	64%	0.635	S	S	.	*			trans	-59.6	112.4	161.9	-132.6	88	0	0	0	106.9	F191 I194	F191-L211 HydrophobicContact CD1-CD2 4.42Å; F191-L211 HydrophobicContact CE1-CD2 3.53Å; F191-L211 HydrophobicContact CZ-CD2 3.97Å; I194-L211 HydrophobicContact CD1-CD1 4.37Å; I194-L211 HydrophobicContact CG2-CB 4.49Å; I194-L211 HydrophobicContact CG2-CD1 4.24Å
212	A	60.9	Low	60.7	Low	61 Å²	61	128 Å²	128	50%	0.504	66%	0.663	S	S	.	*			trans	-71.2	135	179.2	0	0	0	0	0	109.2	K210 Y214	K210-A212 PolarHBondContact O-N 3.16Å; A212-Y214 VanDerWaalsContact C-N 3.3Å; A212-Y214 HydrophobicContact CB-CD2 4.48Å; A212-Y214 HydrophobicContact CB-CE2 4.3Å; A212-Y214 VanDerWaalsContact O-CD2 3.28Å; A212-Y214 WeakPolarHBondContact O-CD2 3.41Å; A212-Y214 PolarHBondContact O-N 2.92Å
213	D	54	Low	58.1	Low	121 Å²	121	131.2 Å²	131.2	65%	0.647	68%	0.683	S	S	*	*			trans	-73.1	89	170.8	-166.1	-3.1	0	0	0	108.2	A215 A216	D213-A215 PolarHBondContact O-N 3.43Å; D213-A215 VanDerWaalsContact O-N 3.08Å; D213-A215 PolarHBondContact OD1-N 3.32Å; D213-A216 PolarHBondContact O-N 2.85Å
214	Y	47.1	Very low	56.1	Low	190 Å²	190	133.1 Å²	133.1	75%	0.745	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-62.3	-13.4	-178.4	-80.1	-84.4	0	0	0	112.9	A212 A216	A212-Y214 VanDerWaalsContact C-N 3.3Å; A212-Y214 HydrophobicContact CB-CD2 4.48Å; A212-Y214 HydrophobicContact CB-CE2 4.3Å; A212-Y214 VanDerWaalsContact O-CD2 3.28Å; A212-Y214 WeakPolarHBondContact O-CD2 3.41Å; A212-Y214 PolarHBondContact O-N 2.92Å; Y214-A216 VanDerWaalsContact C-N 3.25Å; Y214-A216 PolarHBondContact O-N 3.43Å
215	A	43.3	Very low	54.6	Low	86 Å²	86	130.8 Å²	130.8	71%	0.711	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-71.8	-18.8	172.7	0	0	0	0	0	113	D213	D213-A215 PolarHBondContact O-N 3.43Å; D213-A215 VanDerWaalsContact O-N 3.08Å; D213-A215 PolarHBondContact OD1-N 3.32Å
216	A	42.9	Very low	53	Low	82 Å²	82	129.8 Å²	129.8	68%	0.678	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-91.1	-6.9	-180	0	0	0	0	0	114	D213 Y214	D213-A216 PolarHBondContact O-N 2.85Å; Y214-A216 VanDerWaalsContact C-N 3.25Å; Y214-A216 PolarHBondContact O-N 3.43Å
217	D	40.2	Very low	51.4	Low	111 Å²	111	132.5 Å²	132.5	59%	0.594	73%	0.728	S	S	*	*			trans	-99.7	15.5	-169.1	-153.4	30.2	0	0	0	114.7	G219	D217-G219 PolarHBondContact O-N 2.85Å
218	E	36.7	Very low	49.6	Very low	196 Å²	196	132.9 Å²	132.9	92%	0.916	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	22.1	169.4	-69	-159	157.1	0	0	113.6
219	G	38.3	Very low	47.6	Very low	57 Å²	57	138.3 Å²	138.3	59%	0.588	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-22.6	-176.9	0	0	0	0	0	116.7	D217	D217-G219 PolarHBondContact O-N 2.85Å
220	H	32.8	Very low	45.6	Very low	177 Å²	177	139.2 Å²	139.2	82%	0.819	75%	0.752	S	S	*	*			trans	-137.2	54.9	-168.4	-78.3	-9.1	0	0	0	114.2
221	R	31.8	Very low	43.4	Very low	239 Å²	239	139.9 Å²	139.9	90%	0.902	77%	0.765	S	S	*	*			trans	-125.4	70.7	158.4	-75.5	-171.8	-179.6	132.3	2.6	110.6
222	E	32.1	Very low	41.2	Very low	186 Å²	186	143.2 Å²	143.2	87%	0.869	79%	0.785	S	S	*	*	S	Bend	trans	-160.4	136.3	152.5	-105.5	164.3	-155.4	0	0	107.6
223	D	32.4	Very low	39.6	Very low	154 Å²	154	150.1 Å²	150.1	82%	0.824	81%	0.809	S	S	*	*			trans	86.8	78.4	176	-56.7	-16.2	0	0	0	119.7
224	S	43.8	Very low	38.3	Very low	202 Å²	202	152.7 Å²	152.7	100%	1.413	82%	0.823	S	S	*	*				-165.5	0	128.8	-77.6	0	0	0	0	112

Retrieved 224 of 224 residues in 123.7 ms (Link to these results)

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