G4M013_SCHMA Loading...

DUF2428 domain-containing protein

AlphaFold DB , UniProt , Accession G4M013, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 436 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	28.1	Very low	34.1	Very low	237 Å²	237	118.1 Å²	118.1	100%	1.167	66%	0.661	S	S	*	*				0	116.5	0	-76.4	176.1	169.4	0	0	106.4	Y3	M1-Y3 PolarHBondContact O-N 2.99Å
2	S	25.9	Very low	35	Very low	98 Å²	98	113.2 Å²	113.2	69%	0.685	64%	0.638	S	S	*	*			trans	-56.6	126.5	169	36.9	0	0	0	0	107.9	E4	S2-E4 PolarHBondContact O-N 2.88Å
3	Y	26.7	Very low	35.6	Very low	126 Å²	126	114.1 Å²	114.1	49%	0.494	65%	0.651	S	S	.	*			trans	-63.6	95.5	161	-93.9	-87.3	0	0	0	105.7	M1 S5 F52	M1-Y3 PolarHBondContact O-N 2.99Å; Y3-S5 VanDerWaalsContact C-N 3.33Å; Y3-S5 PolarHBondContact O-N 2.89Å; Y3-F52 AromaticContact CD1-CD2 3.41Å; Y3-F52 HydrophobicContact CD1-CD2 3.41Å; Y3-F52 VanDerWaalsContact CD1-CD2 3.41Å; Y3-F52 AromaticContact CD1-CE2 3.39Å; Y3-F52 HydrophobicContact CD1-CE2 3.39Å; Y3-F52 HydrophobicContact CD1-CG 4.38Å; Y3-F52 HydrophobicContact CD1-CZ 4.34Å; Y3-F52 HydrophobicContact CD2-CD2 4.09Å; Y3-F52 HydrophobicContact CE1-CD1 4.32Å; Y3-F52 AromaticContact CE1-CD2 3.24Å; Y3-F52 HydrophobicContact CE1-CD2 3.24Å; Y3-F52 HydrophobicContact CE1-CE1 4.28Å; Y3-F52 AromaticContact CE1-CE2 3.18Å; Y3-F52 HydrophobicContact CE1-CE2 3.18Å; Y3-F52 AromaticContact CE1-CG 3.85Å; Y3-F52 HydrophobicContact CE1-CG 3.85Å; Y3-F52 AromaticContact CE1-CZ 3.74Å; Y3-F52 HydrophobicContact CE1-CZ 3.74Å; Y3-F52 HydrophobicContact CE2-CB 4.04Å; Y3-F52 AromaticContact CE2-CD2 3.93Å; Y3-F52 HydrophobicContact CE2-CD2 3.93Å; Y3-F52 HydrophobicContact CE2-CG 4.03Å; Y3-F52 AromaticContact CG-CD2 3.84Å; Y3-F52 HydrophobicContact CG-CD2 3.84Å; Y3-F52 HydrophobicContact CG-CE2 4.25Å; Y3-F52 AromaticContact CZ-CD2 3.5Å; Y3-F52 AromaticContact CZ-CE2 3.89Å; Y3-F52 AromaticContact CZ-CG 3.63Å
4	E	27.1	Very low	36.4	Very low	168 Å²	168	118.4 Å²	118.4	79%	0.785	67%	0.671	S	S	*	*			trans	-61.7	104	163.9	-76.9	178.7	165	0	0	106	S2 S6	S2-E4 PolarHBondContact O-N 2.88Å; E4-S6 PolarHBondContact O-N 3.23Å
5	S	31.1	Very low	36.9	Very low	108 Å²	108	113 Å²	113	76%	0.755	64%	0.644	S	S	*	*			trans	-57.4	134.7	164.1	40.3	0	0	0	0	109.2	Y3	Y3-S5 VanDerWaalsContact C-N 3.33Å; Y3-S5 PolarHBondContact O-N 2.89Å
6	S	29.7	Very low	37.8	Very low	70 Å²	70	110.6 Å²	110.6	49%	0.49	63%	0.629	S	S	.	*			trans	79.1	84.6	165	-155.1	0	0	0	0	117.6	E4 D8 D9	E4-S6 PolarHBondContact O-N 3.23Å; S6-D8 PolarHBondContact O-N 2.95Å; S6-D9 PolarHBondContact OG-OD2 2.89Å
7	P	36.5	Very low	38.9	Very low	104 Å²	104	107.1 Å²	107.1	68%	0.675	61%	0.613	S	S	*	*	S	Bend	trans	-77.3	104.6	138.9	28.5	-19.3	0	0	0	108.1
8	D	40.9	Very low	39.9	Very low	130 Å²	130	101.3 Å²	101.3	70%	0.695	58%	0.579	S	S	*	*			trans	39.6	85.2	164.4	-68.7	-34.5	0	0	0	115.5	S6 T10	S6-D8 PolarHBondContact O-N 2.95Å; D8-T10 PolarHBondContact O-N 3.34Å
9	D	43.3	Very low	40.8	Very low	107 Å²	107	98.5 Å²	98.5	57%	0.572	57%	0.565	S	S	*	*			trans	-62.4	12.9	170.8	-82.1	-48.8	0	0	0	115	S6 C11	S6-D9 PolarHBondContact OG-OD2 2.89Å; D9-C11 PolarHBondContact O-N 2.71Å
10	T	45.2	Very low	41.7	Very low	110 Å²	110	97.9 Å²	97.9	68%	0.675	55%	0.553	S	S	*	*			trans	-79.1	90.4	178.3	50.2	0	0	0	0	110.3	D8	D8-T10 PolarHBondContact O-N 3.34Å
11	C	40.7	Very low	42.4	Very low	41 Å²	41	97 Å²	97	28%	0.277	54%	0.543	S	S	.	.			trans	-44.2	129.9	158	-161.5	0	0	0	0	109.1	D9 S15	D9-C11 PolarHBondContact O-N 2.71Å; C11-S15 PolarHBondContact SG-O 2.68Å; C11-S15 VanDerWaalsContact SG-O 3.36Å; C11-S15 PolarHBondContact SG-OG 2.82Å
12	P	44.7	Very low	44	Very low	59 Å²	59	85.9 Å²	85.9	38%	0.383	49%	0.488	S	S	.	.			trans	-48.9	137.9	174.6	-22.6	24.6	0	0	0	110.8	N14 S15	P12-N14 PolarHBondContact O-N 3.21Å; P12-N14 VanDerWaalsContact O-N 3.13Å; P12-S15 WeakPolarHBondContact CD-OG 3.14Å; P12-S15 PolarHBondContact O-N 2.72Å; P12-S15 PolarHBondContact O-OG 3.06Å
13	P	42.4	Very low	45.7	Very low	125 Å²	125	84.7 Å²	84.7	81%	0.812	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	125.3	173.6	22.6	-30	0	0	0	108.6
14	N	47.8	Very low	47.5	Very low	174 Å²	174	81.4 Å²	81.4	93%	0.93	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	0.2	-174.9	-53.1	-22.8	0	0	0	118.1	P12	P12-N14 PolarHBondContact O-N 3.21Å; P12-N14 VanDerWaalsContact O-N 3.13Å
15	S	42.8	Very low	49	Very low	38 Å²	38	76.2 Å²	76.2	27%	0.266	44%	0.44	S	S	.	.	S	Bend	trans	-84	133	167	59.2	0	0	0	0	110.5	C11 P12 S17	C11-S15 PolarHBondContact SG-O 2.68Å; C11-S15 VanDerWaalsContact SG-O 3.36Å; C11-S15 PolarHBondContact SG-OG 2.82Å; P12-S15 WeakPolarHBondContact CD-OG 3.14Å; P12-S15 PolarHBondContact O-N 2.72Å; P12-S15 PolarHBondContact O-OG 3.06Å; S15-S17 PolarHBondContact O-N 3.25Å
16	D	52.7	Low	50.4	Low	74 Å²	74	73.1 Å²	73.1	40%	0.396	41%	0.412	S	S	.	.			trans	-63.5	119.7	170.1	-159.7	-36.7	0	0	0	108.3	F18 T19 W20 R67	D16-F18 PolarHBondContact O-N 2.88Å; D16-T19 HydrophobicContact CB-CG2 4.42Å; D16-T19 PolarHBondContact O-N 3.37Å; D16-T19 PolarHBondContact O-OG1 2.84Å; D16-W20 PolarHBondContact O-N 3.34Å; D16-R67 IonicContact OD1-CZ 2.64Å; D16-R67 IonicContact OD1-NH1 3.9Å; D16-R67 PolarHBondContact OD1-NH1 3.21Å; D16-R67 IonicContact OD1-NH2 2.68Å; D16-R67 PolarHBondContact OD1-NH2 3.4Å; D16-R67 VanDerWaalsContact OD1-NH2 3.14Å; D16-R67 IonicContact OD2-CZ 3.39Å; D16-R67 IonicContact OD2-NH1 3.14Å; D16-R67 IonicContact OD2-NH2 3.39Å; D16-R67 PolarHBondContact OD2-NH2 2.96Å
17	S	55.2	Low	52	Low	52 Å²	52	71.5 Å²	71.5	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-48.8	-30.9	-173.3	69	0	0	0	0	112.7	S15 K21	S15-S17 PolarHBondContact O-N 3.25Å; S17-K21 WeakPolarHBondContact O-CB 3.4Å; S17-K21 WeakPolarHBondContact O-CG 3.41Å; S17-K21 PolarHBondContact O-N 3.08Å
18	F	57.3	Low	53.1	Low	2 Å²	2	69.4 Å²	69.4	1%	0.009	39%	0.389	C	S	.	.	H	α-helix	trans	-69	-50.1	179.9	-173.9	-106.4	0	0	0	114	D16 W20 K21 V22 V63 T64 R67 D80 I83 V84	D16-F18 PolarHBondContact O-N 2.88Å; F18-W20 PolarHBondContact O-N 3.3Å; F18-W20 VanDerWaalsContact O-N 3.15Å; F18-K21 PolarHBondContact O-N 2.81Å; F18-V22 HydrophobicContact CD1-CG2 4.42Å; F18-V22 HydrophobicContact CD2-CG2 3.87Å; F18-V22 HydrophobicContact CE1-CG2 4.01Å; F18-V22 HydrophobicContact CE2-CG2 3.4Å; F18-V22 VanDerWaalsContact CE2-CG2 3.4Å; F18-V22 HydrophobicContact CG-CG2 4.35Å; F18-V22 HydrophobicContact CZ-CG2 3.48Å; F18-V22 VanDerWaalsContact CZ-CG2 3.48Å; F18-V22 PolarHBondContact O-N 3.19Å; F18-V63 HydrophobicContact CD2-CG1 4.23Å; F18-V63 HydrophobicContact CE2-CG1 4.41Å; F18-T64 HydrophobicContact CE2-CG2 4.5Å; F18-T64 HydrophobicContact CZ-CG2 4.13Å; F18-R67 VanDerWaalsContact CB-CZ 3.48Å; F18-R67 VanDerWaalsContact CB-NH1 3.31Å; F18-R67 HydrophobicContact CD1-CG 4.45Å; F18-R67 HydrophobicContact CD2-CB 4.47Å; F18-R67 HydrophobicContact CD2-CG 4.48Å; F18-R67 HydrophobicContact CE1-CG 4.47Å; F18-R67 HydrophobicContact CE2-CB 4.19Å; F18-R67 HydrophobicContact CG-CG 4.45Å; F18-R67 HydrophobicContact CZ-CB 4.36Å; F18-R67 HydrophobicContact CZ-CG 4.49Å; F18-D80 HydrophobicContact CD1-CB 4.27Å; F18-D80 HydrophobicContact CE1-CB 4.21Å; F18-I83 HydrophobicContact CE1-CG2 4.48Å; F18-V84 HydrophobicContact CE1-CG2 3.84Å; F18-V84 HydrophobicContact CZ-CG2 3.51Å
19	T	57.8	Low	54	Low	49 Å²	49	64.3 Å²	64.3	30%	0.301	36%	0.36	S	S	.	.	H	α-helix	trans	-62.2	-23.4	-179.3	58.7	0	0	0	0	113	D16 P23 I83	D16-T19 HydrophobicContact CB-CG2 4.42Å; D16-T19 PolarHBondContact O-N 3.37Å; D16-T19 PolarHBondContact O-OG1 2.84Å; T19-P23 WeakPolarHBondContact O-CD 3.32Å; T19-P23 WeakPolarHBondContact O-CG 3.36Å; T19-I83 HydrophobicContact CG2-CD1 3.95Å
20	W	57.3	Low	54.8	Low	85 Å²	85	64 Å²	64	32%	0.322	35%	0.354	S	S	.	.	H	α-helix	trans	-91	-41.9	173.6	-173.6	83.9	0	0	0	112.9	D16 F18 P23 K24	D16-W20 PolarHBondContact O-N 3.34Å; F18-W20 PolarHBondContact O-N 3.3Å; F18-W20 VanDerWaalsContact O-N 3.15Å; W20-P23 WeakPolarHBondContact O-CD 3.45Å; W20-K24 HydrophobicContact CE3-CD 4.18Å; W20-K24 HydrophobicContact CH2-CD 3.39Å; W20-K24 HydrophobicContact CZ2-CD 3.85Å; W20-K24 HydrophobicContact CZ3-CD 3.54Å; W20-K24 WeakPolarHBondContact O-CB 3.5Å; W20-K24 PolarHBondContact O-N 3.21Å
21	K	58.3	Low	55.4	Low	80 Å²	80	61.8 Å²	61.8	35%	0.348	34%	0.343	S	S	.	.	H	α-helix	trans	-60	-51.4	179.3	-82.1	176.6	178.3	-166.5	0	111.4	S17 F18 K24 Y25	S17-K21 WeakPolarHBondContact O-CB 3.4Å; S17-K21 WeakPolarHBondContact O-CG 3.41Å; S17-K21 PolarHBondContact O-N 3.08Å; F18-K21 PolarHBondContact O-N 2.81Å; K21-K24 PolarHBondContact O-N 3.24Å; K21-K24 VanDerWaalsContact O-N 3.17Å; K21-Y25 HydrophobicContact CB-CD2 3.91Å; K21-Y25 HydrophobicContact CB-CE2 3.77Å; K21-Y25 HydrophobicContact CD-CE2 4.28Å; K21-Y25 HydrophobicContact CG-CD2 4.49Å; K21-Y25 HydrophobicContact CG-CE2 3.88Å; K21-Y25 WeakPolarHBondContact O-CD2 3.17Å; K21-Y25 PolarHBondContact O-N 2.95Å
22	V	60.9	Low	56.1	Low	4 Å²	4	60.1 Å²	60.1	2%	0.024	33%	0.332	C	S	.	.	H	α-helix	trans	-59.8	-50	-173.4	175.5	0	0	0	0	112.6	F18 K24 W26 L60 I83 F87	F18-V22 HydrophobicContact CD1-CG2 4.42Å; F18-V22 HydrophobicContact CD2-CG2 3.87Å; F18-V22 HydrophobicContact CE1-CG2 4.01Å; F18-V22 HydrophobicContact CE2-CG2 3.4Å; F18-V22 VanDerWaalsContact CE2-CG2 3.4Å; F18-V22 HydrophobicContact CG-CG2 4.35Å; F18-V22 HydrophobicContact CZ-CG2 3.48Å; F18-V22 VanDerWaalsContact CZ-CG2 3.48Å; F18-V22 PolarHBondContact O-N 3.19Å; V22-K24 PolarHBondContact O-N 3.28Å; V22-W26 VanDerWaalsContact O-CB 3.27Å; V22-W26 WeakPolarHBondContact O-CB 3.48Å; V22-W26 PolarHBondContact O-N 2.9Å; V22-L60 HydrophobicContact CG2-CD1 4.21Å; V22-I83 HydrophobicContact CB-CG2 4.37Å; V22-I83 HydrophobicContact CG1-CG2 4.09Å; V22-F87 HydrophobicContact CG1-CB 4.05Å; V22-F87 HydrophobicContact CG1-CD2 3.67Å; V22-F87 HydrophobicContact CG1-CE2 4.34Å; V22-F87 HydrophobicContact CG1-CG 3.9Å
23	P	61.8	Low	56.5	Low	73 Å²	73	59.7 Å²	59.7	47%	0.474	33%	0.326	S	S	.	.	H	α-helix	trans	-64.3	-36.1	175.2	-23.8	35.8	0	0	0	113.8	T19 W20 W26 G27	T19-P23 WeakPolarHBondContact O-CD 3.32Å; T19-P23 WeakPolarHBondContact O-CG 3.36Å; W20-P23 WeakPolarHBondContact O-CD 3.45Å; P23-W26 PolarHBondContact O-N 3.36Å; P23-G27 PolarHBondContact O-N 2.61Å
24	K	63.5	Low	57.1	Low	56 Å²	56	60.1 Å²	60.1	24%	0.243	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-56.2	176.1	177.5	179.4	174	-175.5	0	110.5	W20 K21 V22 W26 G27 D28	W20-K24 HydrophobicContact CE3-CD 4.18Å; W20-K24 HydrophobicContact CH2-CD 3.39Å; W20-K24 HydrophobicContact CZ2-CD 3.85Å; W20-K24 HydrophobicContact CZ3-CD 3.54Å; W20-K24 WeakPolarHBondContact O-CB 3.5Å; W20-K24 PolarHBondContact O-N 3.21Å; K21-K24 PolarHBondContact O-N 3.24Å; K21-K24 VanDerWaalsContact O-N 3.17Å; V22-K24 PolarHBondContact O-N 3.28Å; K24-W26 PolarHBondContact O-N 3.07Å; K24-G27 CarbonylContact O-C 3.6Å; K24-G27 VanDerWaalsContact O-CA 3.29Å; K24-G27 WeakPolarHBondContact O-CA 3.34Å; K24-G27 PolarHBondContact O-N 3.26Å; K24-D28 PolarHBondContact O-N 3.18Å
25	Y	59.1	Low	57.4	Low	60 Å²	60	55.2 Å²	55.2	24%	0.235	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-33.3	178.7	-71.6	-72.1	0	0	0	112.4	K21 D28 Y29 L60	K21-Y25 HydrophobicContact CB-CD2 3.91Å; K21-Y25 HydrophobicContact CB-CE2 3.77Å; K21-Y25 HydrophobicContact CD-CE2 4.28Å; K21-Y25 HydrophobicContact CG-CD2 4.49Å; K21-Y25 HydrophobicContact CG-CE2 3.88Å; K21-Y25 WeakPolarHBondContact O-CD2 3.17Å; K21-Y25 PolarHBondContact O-N 2.95Å; Y25-D28 PolarHBondContact O-N 3.11Å; Y25-Y29 VanDerWaalsContact O-CB 3.3Å; Y25-Y29 WeakPolarHBondContact O-CB 3.4Å; Y25-Y29 PolarHBondContact O-N 3.42Å; Y25-L60 HydrophobicContact CD2-CD1 3.66Å; Y25-L60 HydrophobicContact CE2-CD1 4.47Å; Y25-L60 HydrophobicContact CG-CD1 4.04Å; Y25-L60 HydrophobicContact CG-CD2 4.27Å
26	W	60.9	Low	57.7	Low	43 Å²	43	54.4 Å²	54.4	16%	0.163	28%	0.284	C	S	.	.	H	α-helix	trans	-65	-40	171.2	-176.9	-122.3	0	0	0	112.3	V22 P23 K24 Y29 K30 F87 A90 L91	V22-W26 VanDerWaalsContact O-CB 3.27Å; V22-W26 WeakPolarHBondContact O-CB 3.48Å; V22-W26 PolarHBondContact O-N 2.9Å; P23-W26 PolarHBondContact O-N 3.36Å; K24-W26 PolarHBondContact O-N 3.07Å; W26-Y29 AromaticContact CE3-CD1 3.79Å; W26-Y29 HydrophobicContact CE3-CD1 3.79Å; W26-Y29 HydrophobicContact CE3-CG 4.48Å; W26-Y29 HydrophobicContact CH2-CD1 4.2Å; W26-Y29 HydrophobicContact CH2-CE1 4.24Å; W26-Y29 AromaticContact CZ3-CD1 3.45Å; W26-Y29 HydrophobicContact CZ3-CD1 3.45Å; W26-Y29 VanDerWaalsContact CZ3-CD1 3.45Å; W26-Y29 AromaticContact CZ3-CE1 3.75Å; W26-Y29 HydrophobicContact CZ3-CE1 3.75Å; W26-Y29 HydrophobicContact CZ3-CG 4.44Å; W26-K30 VanDerWaalsContact CE2-CE 3.43Å; W26-K30 HydrophobicContact CZ2-CD 4.43Å; W26-K30 VanDerWaalsContact CZ2-CE 3.48Å; W26-K30 HydrophobicContact CZ2-CG 4.44Å; W26-K30 VanDerWaalsContact NE1-CE 3.26Å; W26-K30 WeakPolarHBondContact O-CB 3.47Å; W26-K30 WeakPolarHBondContact O-CG 3.26Å; W26-K30 PolarHBondContact O-N 3.22Å; W26-F87 HydrophobicContact CB-CD2 4.45Å; W26-F87 HydrophobicContact CB-CE2 4.29Å; W26-F87 HydrophobicContact CD2-CD2 4.48Å; W26-F87 HydrophobicContact CD2-CE2 4.36Å; W26-F87 HydrophobicContact CE3-CD2 4.2Å; W26-F87 AromaticContact CE3-CE2 3.74Å; W26-F87 HydrophobicContact CE3-CE2 3.74Å; W26-F87 HydrophobicContact CZ3-CE2 4.45Å; W26-A90 HydrophobicContact CH2-CB 3.86Å; W26-A90 HydrophobicContact CZ2-CB 3.51Å; W26-L91 HydrophobicContact CE3-CD2 4.49Å; W26-L91 HydrophobicContact CH2-CD2 4.22Å; W26-L91 HydrophobicContact CZ3-CD2 3.54Å; W26-L91 HydrophobicContact CZ3-CG 3.98Å
27	G	63.4	Low	57.4	Low	35 Å²	35	56.8 Å²	56.8	36%	0.361	29%	0.287	S	S	.	.	H	α-helix	trans	-59.8	-45.3	171	0	0	0	0	0	111.9	P23 K24 K30 S31	P23-G27 PolarHBondContact O-N 2.61Å; K24-G27 CarbonylContact O-C 3.6Å; K24-G27 VanDerWaalsContact O-CA 3.29Å; K24-G27 WeakPolarHBondContact O-CA 3.34Å; K24-G27 PolarHBondContact O-N 3.26Å; G27-K30 PolarHBondContact O-N 3.06Å; G27-S31 VanDerWaalsContact O-CB 3.24Å; G27-S31 WeakPolarHBondContact O-CB 3.5Å; G27-S31 PolarHBondContact O-N 2.73Å
28	D	59.7	Low	57.1	Low	60 Å²	60	60.9 Å²	60.9	32%	0.321	31%	0.305	S	S	.	.	H	α-helix	trans	-66.3	-42.8	178.5	-63.6	-25.5	0	0	0	111.1	K24 Y25 S31 A32 F52	K24-D28 PolarHBondContact O-N 3.18Å; Y25-D28 PolarHBondContact O-N 3.11Å; D28-S31 CarbonylContact O-C 3.53Å; D28-S31 WeakPolarHBondContact O-CB 3.41Å; D28-S31 PolarHBondContact O-N 3.47Å; D28-A32 VanDerWaalsContact O-CB 3.29Å; D28-A32 WeakPolarHBondContact O-CB 3.37Å; D28-A32 PolarHBondContact O-N 2.91Å; D28-F52 HydrophobicContact CB-CZ 4.45Å
29	Y	58.4	Low	56.8	Low	23 Å²	23	63 Å²	63	9%	0.09	32%	0.316	C	S	.	.	H	α-helix	trans	-60.9	-46.7	173.2	177.2	-101.7	0	0	0	112	Y25 W26 S31 A32 L33 F57 L91	Y25-Y29 VanDerWaalsContact O-CB 3.3Å; Y25-Y29 WeakPolarHBondContact O-CB 3.4Å; Y25-Y29 PolarHBondContact O-N 3.42Å; W26-Y29 AromaticContact CE3-CD1 3.79Å; W26-Y29 HydrophobicContact CE3-CD1 3.79Å; W26-Y29 HydrophobicContact CE3-CG 4.48Å; W26-Y29 HydrophobicContact CH2-CD1 4.2Å; W26-Y29 HydrophobicContact CH2-CE1 4.24Å; W26-Y29 AromaticContact CZ3-CD1 3.45Å; W26-Y29 HydrophobicContact CZ3-CD1 3.45Å; W26-Y29 VanDerWaalsContact CZ3-CD1 3.45Å; W26-Y29 AromaticContact CZ3-CE1 3.75Å; W26-Y29 HydrophobicContact CZ3-CE1 3.75Å; W26-Y29 HydrophobicContact CZ3-CG 4.44Å; Y29-S31 VanDerWaalsContact C-N 3.33Å; Y29-S31 PolarHBondContact O-N 3.49Å; Y29-A32 PolarHBondContact O-N 3.42Å; Y29-L33 HydrophobicContact CD1-CD1 3.87Å; Y29-L33 HydrophobicContact CE1-CD1 3.31Å; Y29-L33 HydrophobicContact CE1-CG 4.14Å; Y29-L33 WeakPolarHBondContact O-CB 3.18Å; Y29-L33 WeakPolarHBondContact O-CG 2.67Å; Y29-L33 PolarHBondContact O-N 3.29Å; Y29-F57 HydrophobicContact CD2-CD2 4.05Å; Y29-F57 HydrophobicContact CD2-CE2 4.12Å; Y29-F57 HydrophobicContact CE2-CD2 4.46Å; Y29-F57 HydrophobicContact CE2-CE2 4.33Å; Y29-F57 HydrophobicContact CG-CE2 4.45Å; Y29-L91 HydrophobicContact CE1-CD2 4.21Å
30	K	60.6	Low	56.4	Low	100 Å²	100	66.2 Å²	66.2	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-38.6	174.8	-82.1	-174.7	167.9	-179.6	0	112.1	W26 G27 K34	W26-K30 VanDerWaalsContact CE2-CE 3.43Å; W26-K30 HydrophobicContact CZ2-CD 4.43Å; W26-K30 VanDerWaalsContact CZ2-CE 3.48Å; W26-K30 HydrophobicContact CZ2-CG 4.44Å; W26-K30 VanDerWaalsContact NE1-CE 3.26Å; W26-K30 WeakPolarHBondContact O-CB 3.47Å; W26-K30 WeakPolarHBondContact O-CG 3.26Å; W26-K30 PolarHBondContact O-N 3.22Å; G27-K30 PolarHBondContact O-N 3.06Å; K30-K34 WeakPolarHBondContact O-CG 3.04Å; K30-K34 PolarHBondContact O-N 2.98Å
31	S	58.3	Low	56.1	Low	64 Å²	64	66.4 Å²	66.4	45%	0.448	35%	0.347	S	S	.	.	H	α-helix	trans	-66.2	-44.6	176.9	-169.8	0	0	0	0	110.6	G27 D28 Y29 K34 T35	G27-S31 VanDerWaalsContact O-CB 3.24Å; G27-S31 WeakPolarHBondContact O-CB 3.5Å; G27-S31 PolarHBondContact O-N 2.73Å; D28-S31 CarbonylContact O-C 3.53Å; D28-S31 WeakPolarHBondContact O-CB 3.41Å; D28-S31 PolarHBondContact O-N 3.47Å; Y29-S31 VanDerWaalsContact C-N 3.33Å; Y29-S31 PolarHBondContact O-N 3.49Å; S31-K34 CarbonylContact O-C 3.57Å; S31-K34 WeakPolarHBondContact O-CB 2.94Å; S31-K34 PolarHBondContact O-N 3.5Å; S31-K34 VanDerWaalsContact O-N 3.12Å; S31-T35 PolarHBondContact O-N 2.94Å; S31-T35 PolarHBondContact O-OG1 3.41Å
32	A	54.8	Low	55.8	Low	6 Å²	6	66.8 Å²	66.8	5%	0.05	35%	0.353	C	S	.	.	H	α-helix	trans	-59	-51.1	174.3	0	0	0	0	0	110.3	D28 Y29 K34 T35 F36 F52	D28-A32 VanDerWaalsContact O-CB 3.29Å; D28-A32 WeakPolarHBondContact O-CB 3.37Å; D28-A32 PolarHBondContact O-N 2.91Å; Y29-A32 PolarHBondContact O-N 3.42Å; A32-K34 PolarHBondContact O-N 3.23Å; A32-T35 PolarHBondContact O-N 2.72Å; A32-F36 HydrophobicContact CB-CD2 4.23Å; A32-F36 HydrophobicContact CB-CE2 3.69Å; A32-F36 HydrophobicContact CB-CZ 4.46Å; A32-F36 WeakPolarHBondContact O-CB 3.4Å; A32-F36 WeakPolarHBondContact O-CD2 3.37Å; A32-F36 VanDerWaalsContact O-CG 3.24Å; A32-F36 WeakPolarHBondContact O-CG 3.48Å; A32-F36 PolarHBondContact O-N 2.67Å; A32-F52 HydrophobicContact CB-CD1 3.91Å; A32-F52 HydrophobicContact CB-CE1 3.9Å
33	L	53.4	Low	55.4	Low	50 Å²	50	74.6 Å²	74.6	26%	0.262	39%	0.39	S	S	.	.	H	α-helix	trans	-52	-40.3	173.5	-80.7	173.9	0	0	0	112.7	Y29 R37 L114	Y29-L33 HydrophobicContact CD1-CD1 3.87Å; Y29-L33 HydrophobicContact CE1-CD1 3.31Å; Y29-L33 HydrophobicContact CE1-CG 4.14Å; Y29-L33 WeakPolarHBondContact O-CB 3.18Å; Y29-L33 WeakPolarHBondContact O-CG 2.67Å; Y29-L33 PolarHBondContact O-N 3.29Å; L33-R37 WeakPolarHBondContact O-CG 3.45Å; L33-R37 PolarHBondContact O-N 3.04Å; L33-L114 HydrophobicContact CD2-CD2 4.2Å
34	K	55.5	Low	55	Low	135 Å²	135	76.1 Å²	76.1	59%	0.587	39%	0.394	S	S	*	.	H	α-helix	trans	-70.2	-45.8	175.2	-76.2	179.1	-179.3	-179.2	0	112.6	K30 S31 A32 F36 R37	K30-K34 WeakPolarHBondContact O-CG 3.04Å; K30-K34 PolarHBondContact O-N 2.98Å; S31-K34 CarbonylContact O-C 3.57Å; S31-K34 WeakPolarHBondContact O-CB 2.94Å; S31-K34 PolarHBondContact O-N 3.5Å; S31-K34 VanDerWaalsContact O-N 3.12Å; A32-K34 PolarHBondContact O-N 3.23Å; K34-F36 VanDerWaalsContact C-N 3.26Å; K34-F36 PolarHBondContact O-N 3.41Å; K34-R37 WeakPolarHBondContact O-CA 3.47Å; K34-R37 WeakPolarHBondContact O-CB 3.28Å; K34-R37 PolarHBondContact O-N 3.15Å
35	T	52.9	Low	54.2	Low	70 Å²	70	75.2 Å²	75.2	43%	0.429	39%	0.389	S	S	.	.	H	α-helix	trans	-61.1	-38.9	178.2	-56.3	0	0	0	0	110.5	S31 A32 R37 N38 I39	S31-T35 PolarHBondContact O-N 2.94Å; S31-T35 PolarHBondContact O-OG1 3.41Å; A32-T35 PolarHBondContact O-N 2.72Å; T35-R37 VanDerWaalsContact C-N 3.26Å; T35-R37 PolarHBondContact O-N 3.41Å; T35-N38 PolarHBondContact O-N 3.44Å; T35-I39 PolarHBondContact O-N 3.16Å
36	F	49	Very low	53.8	Low	22 Å²	22	78 Å²	78	10%	0.096	41%	0.407	C	S	.	.	H	α-helix	trans	-62.2	-28.4	172.3	-65.3	-53.8	0	0	0	112.9	A32 K34 N38 I39 R45 A48 V49	A32-F36 HydrophobicContact CB-CD2 4.23Å; A32-F36 HydrophobicContact CB-CE2 3.69Å; A32-F36 HydrophobicContact CB-CZ 4.46Å; A32-F36 WeakPolarHBondContact O-CB 3.4Å; A32-F36 WeakPolarHBondContact O-CD2 3.37Å; A32-F36 VanDerWaalsContact O-CG 3.24Å; A32-F36 WeakPolarHBondContact O-CG 3.48Å; A32-F36 PolarHBondContact O-N 2.67Å; K34-F36 VanDerWaalsContact C-N 3.26Å; K34-F36 PolarHBondContact O-N 3.41Å; F36-N38 PolarHBondContact O-N 3.07Å; F36-I39 HydrophobicContact CD1-CD1 4.01Å; F36-I39 HydrophobicContact CE1-CD1 4.5Å; F36-R45 PolarHBondContact O-NE 3.23Å; F36-R45 VanDerWaalsContact O-NE 3.08Å; F36-R45 PolarHBondContact O-NH2 3.46Å; F36-A48 HydrophobicContact CE1-CB 4.17Å; F36-V49 HydrophobicContact CD1-CG2 3.76Å; F36-V49 HydrophobicContact CD2-CG2 4.43Å; F36-V49 HydrophobicContact CE1-CB 4.33Å; F36-V49 HydrophobicContact CE1-CG2 3.51Å; F36-V49 HydrophobicContact CE2-CG2 4.23Å; F36-V49 HydrophobicContact CG-CG2 4.26Å; F36-V49 HydrophobicContact CZ-CB 4.43Å; F36-V49 HydrophobicContact CZ-CG2 3.79Å
37	R	47.8	Very low	53.4	Low	123 Å²	123	80 Å²	80	46%	0.464	42%	0.421	S	S	.	.	H	α-helix	trans	-59.8	-28.2	171.5	-63.3	179.2	177.5	-165.2	-4.4	112	L33 K34 T35 E101	L33-R37 WeakPolarHBondContact O-CG 3.45Å; L33-R37 PolarHBondContact O-N 3.04Å; K34-R37 WeakPolarHBondContact O-CA 3.47Å; K34-R37 WeakPolarHBondContact O-CB 3.28Å; K34-R37 PolarHBondContact O-N 3.15Å; T35-R37 VanDerWaalsContact C-N 3.26Å; T35-R37 PolarHBondContact O-N 3.41Å; R37-E101 IonicContact CZ-OE2 3.25Å; R37-E101 IonicContact NH1-OE2 3.2Å; R37-E101 PolarHBondContact NH1-OE2 3.31Å; R37-E101 IonicContact NH2-OE2 2.77Å
38	N	49.1	Very low	52.7	Low	139 Å²	139	79.9 Å²	79.9	74%	0.743	42%	0.416	S	S	*	.	H	α-helix	trans	-100.2	-11.2	-170.5	-66.5	-14.7	0	0	0	115.1	T35 F36	T35-N38 PolarHBondContact O-N 3.44Å; F36-N38 PolarHBondContact O-N 3.07Å
39	I	51.3	Low	52.1	Low	47 Å²	47	78.1 Å²	78.1	24%	0.241	41%	0.408	C	S	.	.			trans	-76.9	130.8	176.5	-60	170.3	0	0	0	108.7	T35 F36 N41 R45	T35-I39 PolarHBondContact O-N 3.16Å; F36-I39 HydrophobicContact CD1-CD1 4.01Å; F36-I39 HydrophobicContact CE1-CD1 4.5Å; I39-N41 WeakPolarHBondContact CG2-O 3.23Å; I39-R45 HydrophobicContact CB-CG 3.79Å; I39-R45 HydrophobicContact CD1-CG 4.29Å; I39-R45 HydrophobicContact CG2-CB 4.27Å; I39-R45 HydrophobicContact CG2-CG 3.66Å; I39-R45 PolarHBondContact O-NE 2.87Å; I39-R45 VanDerWaalsContact O-NE 3.08Å; I39-R45 PolarHBondContact O-NH1 3.21Å; I39-R45 PolarHBondContact O-NH2 3.13Å
40	S	48.1	Very low	51.6	Low	115 Å²	115	79.7 Å²	79.7	80%	0.804	42%	0.42	S	S	*	.			trans	-100.6	-12.3	-179.6	55.3	0	0	0	0	114.3
41	N	50.4	Low	51.2	Low	89 Å²	89	81.4 Å²	81.4	48%	0.476	43%	0.427	S	S	.	.			trans	-104.1	126.7	-175	-158.1	22.6	0	0	0	110.4	I39 D44 R45	I39-N41 WeakPolarHBondContact CG2-O 3.23Å; N41-D44 PolarHBondContact ND2-OD2 3.09Å; N41-R45 WeakPolarHBondContact O-CB 3.49Å; N41-R45 PolarHBondContact O-N 2.95Å
42	D	52.3	Low	50.7	Low	89 Å²	89	79.8 Å²	79.8	48%	0.476	41%	0.412	S	S	.	.	H	α-helix	trans	-74.6	-37.7	-167	-66.3	-27.4	0	0	0	113.6	R45 L46	D42-R45 VanDerWaalsContact O-CB 3.25Å; D42-R45 WeakPolarHBondContact O-CB 3.41Å; D42-R45 PolarHBondContact O-N 2.91Å; D42-L46 PolarHBondContact O-N 3Å
43	E	52.4	Low	50.6	Low	168 Å²	168	80.5 Å²	80.5	79%	0.785	42%	0.418	S	S	*	.	H	α-helix	trans	-68	-47.2	178.9	-81	-174.4	158.1	0	0	112.8	R45 L46 D47	E43-R45 PolarHBondContact O-N 3.31Å; E43-L46 PolarHBondContact O-N 2.9Å; E43-D47 PolarHBondContact O-N 3.34Å
44	D	54	Low	50.7	Low	104 Å²	104	82.5 Å²	82.5	56%	0.556	43%	0.426	S	S	*	.	H	α-helix	trans	-63	-30.2	175.5	-68.2	-46.8	0	0	0	111.3	N41 A48	N41-D44 PolarHBondContact ND2-OD2 3.09Å; D44-A48 WeakPolarHBondContact O-CB 3.44Å; D44-A48 PolarHBondContact O-N 2.63Å
45	R	47.8	Very low	51	Low	38 Å²	38	81.9 Å²	81.9	14%	0.143	43%	0.429	C	S	.	.	H	α-helix	trans	-64.3	-52.2	173.7	-119.3	167.8	174.9	172.8	6.6	111	F36 I39 N41 D42 E43 V49	F36-R45 PolarHBondContact O-NE 3.23Å; F36-R45 VanDerWaalsContact O-NE 3.08Å; F36-R45 PolarHBondContact O-NH2 3.46Å; I39-R45 HydrophobicContact CB-CG 3.79Å; I39-R45 HydrophobicContact CD1-CG 4.29Å; I39-R45 HydrophobicContact CG2-CB 4.27Å; I39-R45 HydrophobicContact CG2-CG 3.66Å; I39-R45 PolarHBondContact O-NE 2.87Å; I39-R45 VanDerWaalsContact O-NE 3.08Å; I39-R45 PolarHBondContact O-NH1 3.21Å; I39-R45 PolarHBondContact O-NH2 3.13Å; N41-R45 WeakPolarHBondContact O-CB 3.49Å; N41-R45 PolarHBondContact O-N 2.95Å; D42-R45 VanDerWaalsContact O-CB 3.25Å; D42-R45 WeakPolarHBondContact O-CB 3.41Å; D42-R45 PolarHBondContact O-N 2.91Å; E43-R45 PolarHBondContact O-N 3.31Å; R45-V49 WeakPolarHBondContact O-CB 3.19Å; R45-V49 WeakPolarHBondContact O-CG2 3.27Å; R45-V49 PolarHBondContact O-N 3.38Å
46	L	49.1	Very low	51.3	Low	117 Å²	117	82 Å²	82	61%	0.613	43%	0.425	S	S	*	.	H	α-helix	trans	-64.4	-43	-174.2	-166.2	73.3	0	0	0	112.1	D42 E43 V49 T50	D42-L46 PolarHBondContact O-N 3Å; E43-L46 PolarHBondContact O-N 2.9Å; L46-V49 WeakPolarHBondContact O-CB 3.48Å; L46-V49 PolarHBondContact O-N 2.59Å; L46-T50 WeakPolarHBondContact O-CB 3.34Å; L46-T50 PolarHBondContact O-N 3.07Å; L46-T50 PolarHBondContact O-OG1 3.34Å
47	D	52.3	Low	51.7	Low	87 Å²	87	81.6 Å²	81.6	47%	0.465	42%	0.423	S	S	.	.	H	α-helix	trans	-71.4	-40.8	-179	-164	45.3	0	0	0	112	E43 V49 T50 K51	E43-D47 PolarHBondContact O-N 3.34Å; D47-V49 VanDerWaalsContact C-N 3.33Å; D47-T50 PolarHBondContact O-N 2.91Å; D47-K51 PolarHBondContact O-N 3.43Å; D47-K51 VanDerWaalsContact O-N 3.16Å; D47-K51 IonicContact OD1-NZ 3.31Å; D47-K51 PolarHBondContact OD1-NZ 2.96Å; D47-K51 IonicContact OD2-NZ 3Å; D47-K51 PolarHBondContact OD2-NZ 3.27Å
48	A	49.9	Very low	52.4	Low	31 Å²	31	77.5 Å²	77.5	26%	0.256	41%	0.413	S	S	.	.	H	α-helix	trans	-65.9	-37.4	174.8	0	0	0	0	0	112.3	F36 D44 F52	F36-A48 HydrophobicContact CE1-CB 4.17Å; D44-A48 WeakPolarHBondContact O-CB 3.44Å; D44-A48 PolarHBondContact O-N 2.63Å; A48-F52 PolarHBondContact O-N 3.42Å
49	V	45.9	Very low	53.2	Low	23 Å²	23	76.4 Å²	76.4	14%	0.139	40%	0.404	C	S	.	.	H	α-helix	trans	-58.2	-54.5	171.9	143	0	0	0	0	110.9	F36 R45 L46 D47 K51 A53 L114	F36-V49 HydrophobicContact CD1-CG2 3.76Å; F36-V49 HydrophobicContact CD2-CG2 4.43Å; F36-V49 HydrophobicContact CE1-CB 4.33Å; F36-V49 HydrophobicContact CE1-CG2 3.51Å; F36-V49 HydrophobicContact CE2-CG2 4.23Å; F36-V49 HydrophobicContact CG-CG2 4.26Å; F36-V49 HydrophobicContact CZ-CB 4.43Å; F36-V49 HydrophobicContact CZ-CG2 3.79Å; R45-V49 WeakPolarHBondContact O-CB 3.19Å; R45-V49 WeakPolarHBondContact O-CG2 3.27Å; R45-V49 PolarHBondContact O-N 3.38Å; L46-V49 WeakPolarHBondContact O-CB 3.48Å; L46-V49 PolarHBondContact O-N 2.59Å; D47-V49 VanDerWaalsContact C-N 3.33Å; V49-K51 VanDerWaalsContact C-N 3.34Å; V49-K51 PolarHBondContact O-N 3.39Å; V49-A53 WeakPolarHBondContact O-CB 3.3Å; V49-A53 PolarHBondContact O-N 3.15Å; V49-L114 HydrophobicContact CB-CD1 3.88Å; V49-L114 HydrophobicContact CG1-CD1 3.01Å; V49-L114 HydrophobicContact CG2-CD1 3.65Å
50	T	49.4	Very low	53.7	Low	57 Å²	57	74.5 Å²	74.5	35%	0.35	39%	0.394	S	S	.	.	H	α-helix	trans	-68.3	-38.1	-169.5	-46.5	0	0	0	0	110.7	L46 D47 E54	L46-T50 WeakPolarHBondContact O-CB 3.34Å; L46-T50 PolarHBondContact O-N 3.07Å; L46-T50 PolarHBondContact O-OG1 3.34Å; D47-T50 PolarHBondContact O-N 2.91Å; T50-E54 PolarHBondContact O-N 3.31Å
51	K	51.1	Low	54.4	Low	136 Å²	136	69 Å²	69	59%	0.591	36%	0.356	S	S	*	.	H	α-helix	trans	-75.5	-44.4	-177.8	-80.9	173.4	-178.6	143.4	0	114.8	D47 V49	D47-K51 PolarHBondContact O-N 3.43Å; D47-K51 VanDerWaalsContact O-N 3.16Å; D47-K51 IonicContact OD1-NZ 3.31Å; D47-K51 PolarHBondContact OD1-NZ 2.96Å; D47-K51 IonicContact OD2-NZ 3Å; D47-K51 PolarHBondContact OD2-NZ 3.27Å; V49-K51 VanDerWaalsContact C-N 3.34Å; V49-K51 PolarHBondContact O-N 3.39Å
52	F	48.8	Very low	55.2	Low	30 Å²	30	67.2 Å²	67.2	13%	0.132	35%	0.35	C	S	.	.	H	α-helix	trans	-81.7	-31.8	-178.5	-165.8	-102.6	0	0	0	111.7	Y3 D28 A32 A48 E56	Y3-F52 AromaticContact CD1-CD2 3.41Å; Y3-F52 HydrophobicContact CD1-CD2 3.41Å; Y3-F52 VanDerWaalsContact CD1-CD2 3.41Å; Y3-F52 AromaticContact CD1-CE2 3.39Å; Y3-F52 HydrophobicContact CD1-CE2 3.39Å; Y3-F52 HydrophobicContact CD1-CG 4.38Å; Y3-F52 HydrophobicContact CD1-CZ 4.34Å; Y3-F52 HydrophobicContact CD2-CD2 4.09Å; Y3-F52 HydrophobicContact CE1-CD1 4.32Å; Y3-F52 AromaticContact CE1-CD2 3.24Å; Y3-F52 HydrophobicContact CE1-CD2 3.24Å; Y3-F52 HydrophobicContact CE1-CE1 4.28Å; Y3-F52 AromaticContact CE1-CE2 3.18Å; Y3-F52 HydrophobicContact CE1-CE2 3.18Å; Y3-F52 AromaticContact CE1-CG 3.85Å; Y3-F52 HydrophobicContact CE1-CG 3.85Å; Y3-F52 AromaticContact CE1-CZ 3.74Å; Y3-F52 HydrophobicContact CE1-CZ 3.74Å; Y3-F52 HydrophobicContact CE2-CB 4.04Å; Y3-F52 AromaticContact CE2-CD2 3.93Å; Y3-F52 HydrophobicContact CE2-CD2 3.93Å; Y3-F52 HydrophobicContact CE2-CG 4.03Å; Y3-F52 AromaticContact CG-CD2 3.84Å; Y3-F52 HydrophobicContact CG-CD2 3.84Å; Y3-F52 HydrophobicContact CG-CE2 4.25Å; Y3-F52 AromaticContact CZ-CD2 3.5Å; Y3-F52 AromaticContact CZ-CE2 3.89Å; Y3-F52 AromaticContact CZ-CG 3.63Å; D28-F52 HydrophobicContact CB-CZ 4.45Å; A32-F52 HydrophobicContact CB-CD1 3.91Å; A32-F52 HydrophobicContact CB-CE1 3.9Å; A48-F52 PolarHBondContact O-N 3.42Å; F52-E56 WeakPolarHBondContact CE2-OE2 3.41Å; F52-E56 VanDerWaalsContact CZ-OE2 3.29Å; F52-E56 WeakPolarHBondContact CZ-OE2 3.01Å
53	A	53.1	Low	55.8	Low	21 Å²	21	65.8 Å²	65.8	17%	0.174	35%	0.345	C	S	.	.	H	α-helix	trans	-88.9	-22.9	-170.9	0	0	0	0	0	115.1	V49 F57	V49-A53 WeakPolarHBondContact O-CB 3.3Å; V49-A53 PolarHBondContact O-N 3.15Å; A53-F57 WeakPolarHBondContact O-CB 3.35Å
54	E	55.4	Low	56.3	Low	91 Å²	91	57.8 Å²	57.8	43%	0.425	31%	0.307	S	S	.	.	S	Bend	trans	-89.8	-56.6	-175.4	-68.5	-172.5	168.3	0	0	112.5	T50 S58 M121	T50-E54 PolarHBondContact O-N 3.31Å; E54-S58 WeakPolarHBondContact O-CB 3.47Å; E54-S58 PolarHBondContact O-N 3.01Å; E54-M121 HydrophobicContact CB-SD 4.25Å; E54-M121 HydrophobicContact CG-SD 4.38Å; E54-M121 WeakPolarHBondContact O-CE 3.44Å
55	N	60.8	Low	56.9	Low	123 Å²	123	53 Å²	53	66%	0.658	28%	0.281	S	S	*	.	H	α-helix	trans	-72	-50.8	-170.8	-70.4	-21	0	0	0	113.6	F57 S58 E59	N55-F57 VanDerWaalsContact C-N 3.33Å; N55-F57 PolarHBondContact O-N 3.2Å; N55-S58 WeakPolarHBondContact O-CB 3.37Å; N55-S58 PolarHBondContact O-N 2.77Å; N55-E59 PolarHBondContact O-N 3.18Å
56	E	58.9	Low	57.9	Low	73 Å²	73	54.1 Å²	54.1	34%	0.341	29%	0.29	S	S	.	.	H	α-helix	trans	-66.6	-38.3	-178.3	-64.4	-174.3	178.6	0	0	111.5	F52 E59 L60	F52-E56 WeakPolarHBondContact CE2-OE2 3.41Å; F52-E56 VanDerWaalsContact CZ-OE2 3.29Å; F52-E56 WeakPolarHBondContact CZ-OE2 3.01Å; E56-E59 PolarHBondContact O-N 3.17Å; E56-L60 WeakPolarHBondContact O-CB 3.37Å; E56-L60 PolarHBondContact O-N 3.44Å
57	F	57.9	Low	58.7	Low	13 Å²	13	51.7 Å²	51.7	6%	0.057	27%	0.273	C	S	.	.	H	α-helix	trans	-71.7	-38.4	178.2	-166.4	-112.3	0	0	0	111.9	Y29 A53 N55 L60 I61 F87 L91 A118 M121	Y29-F57 HydrophobicContact CD2-CD2 4.05Å; Y29-F57 HydrophobicContact CD2-CE2 4.12Å; Y29-F57 HydrophobicContact CE2-CD2 4.46Å; Y29-F57 HydrophobicContact CE2-CE2 4.33Å; Y29-F57 HydrophobicContact CG-CE2 4.45Å; A53-F57 WeakPolarHBondContact O-CB 3.35Å; N55-F57 VanDerWaalsContact C-N 3.33Å; N55-F57 PolarHBondContact O-N 3.2Å; F57-L60 HydrophobicContact CD2-CD2 4.35Å; F57-L60 HydrophobicContact CE2-CD2 4.46Å; F57-L60 PolarHBondContact O-N 3.35Å; F57-I61 HydrophobicContact CD1-CD1 3.53Å; F57-I61 HydrophobicContact CD1-CG1 4.38Å; F57-I61 HydrophobicContact CE1-CD1 3.28Å; F57-I61 HydrophobicContact CE1-CG1 4.1Å; F57-I61 HydrophobicContact CG-CD1 4.33Å; F57-I61 HydrophobicContact CZ-CD1 3.89Å; F57-I61 HydrophobicContact CZ-CG1 4.25Å; F57-I61 WeakPolarHBondContact O-CB 3.29Å; F57-I61 VanDerWaalsContact O-CG1 3.27Å; F57-I61 WeakPolarHBondContact O-CG1 3.39Å; F57-I61 PolarHBondContact O-N 3.23Å; F57-F87 HydrophobicContact CE2-CZ 4.16Å; F57-L91 HydrophobicContact CE1-CD2 4.36Å; F57-L91 HydrophobicContact CE2-CD1 4.26Å; F57-L91 HydrophobicContact CE2-CD2 3.76Å; F57-L91 HydrophobicContact CZ-CD1 3.59Å; F57-L91 HydrophobicContact CZ-CD2 3.28Å; F57-L91 HydrophobicContact CZ-CG 4.06Å; F57-A118 HydrophobicContact CE1-CB 4.33Å; F57-M121 HydrophobicContact CB-CE 4.18Å; F57-M121 HydrophobicContact CD1-CE 3.59Å; F57-M121 HydrophobicContact CG-CE 4.39Å
58	S	63.5	Low	59.1	Low	36 Å²	36	47.6 Å²	47.6	25%	0.252	25%	0.251	S	S	.	.	H	α-helix	trans	-57.8	-47	169.5	166.6	0	0	0	0	111.5	E54 N55 I61 S62 Q125	E54-S58 WeakPolarHBondContact O-CB 3.47Å; E54-S58 PolarHBondContact O-N 3.01Å; N55-S58 WeakPolarHBondContact O-CB 3.37Å; N55-S58 PolarHBondContact O-N 2.77Å; S58-I61 PolarHBondContact O-N 2.9Å; S58-S62 WeakPolarHBondContact O-CB 3.41Å; S58-S62 PolarHBondContact O-N 3.41Å; S58-Q125 PolarHBondContact O-OE1 2.9Å; S58-Q125 PolarHBondContact OG-NE2 3.3Å
59	E	64.8	Low	59.8	Low	116 Å²	116	46.8 Å²	46.8	54%	0.542	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-44.1	177.7	-172.7	179.1	173.8	0	0	111.4	N55 E56 S62 V63	N55-E59 PolarHBondContact O-N 3.18Å; E56-E59 PolarHBondContact O-N 3.17Å; E59-S62 PolarHBondContact O-N 3.09Å; E59-V63 HydrophobicContact CG-CG2 4.5Å; E59-V63 WeakPolarHBondContact O-CG2 3.28Å; E59-V63 PolarHBondContact O-N 3.09Å
60	L	62.5	Low	60.7	Low	8 Å²	8	49.1 Å²	49.1	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-59.6	-48.2	175.2	176.4	66.4	0	0	0	111.8	V22 Y25 E56 F57 S62 V63 T64 F87	V22-L60 HydrophobicContact CG2-CD1 4.21Å; Y25-L60 HydrophobicContact CD2-CD1 3.66Å; Y25-L60 HydrophobicContact CE2-CD1 4.47Å; Y25-L60 HydrophobicContact CG-CD1 4.04Å; Y25-L60 HydrophobicContact CG-CD2 4.27Å; E56-L60 WeakPolarHBondContact O-CB 3.37Å; E56-L60 PolarHBondContact O-N 3.44Å; F57-L60 HydrophobicContact CD2-CD2 4.35Å; F57-L60 HydrophobicContact CE2-CD2 4.46Å; F57-L60 PolarHBondContact O-N 3.35Å; L60-S62 VanDerWaalsContact C-N 3.32Å; L60-S62 PolarHBondContact O-N 3.03Å; L60-V63 PolarHBondContact O-N 3.4Å; L60-T64 WeakPolarHBondContact O-CB 3.5Å; L60-T64 PolarHBondContact O-N 2.95Å; L60-T64 PolarHBondContact O-OG1 3.45Å; L60-F87 HydrophobicContact CD2-CE1 4.31Å; L60-F87 HydrophobicContact CD2-CE2 3.78Å; L60-F87 HydrophobicContact CD2-CZ 3.38Å; L60-F87 HydrophobicContact CG-CE1 4.49Å; L60-F87 HydrophobicContact CG-CZ 4.01Å
61	I	63	Low	61	Low	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.8	-48.9	176.5	-72	162.8	0	0	0	109.1	F57 S58 V63 T64 L65 F122 Q125	F57-I61 HydrophobicContact CD1-CD1 3.53Å; F57-I61 HydrophobicContact CD1-CG1 4.38Å; F57-I61 HydrophobicContact CE1-CD1 3.28Å; F57-I61 HydrophobicContact CE1-CG1 4.1Å; F57-I61 HydrophobicContact CG-CD1 4.33Å; F57-I61 HydrophobicContact CZ-CD1 3.89Å; F57-I61 HydrophobicContact CZ-CG1 4.25Å; F57-I61 WeakPolarHBondContact O-CB 3.29Å; F57-I61 VanDerWaalsContact O-CG1 3.27Å; F57-I61 WeakPolarHBondContact O-CG1 3.39Å; F57-I61 PolarHBondContact O-N 3.23Å; S58-I61 PolarHBondContact O-N 2.9Å; I61-V63 PolarHBondContact O-N 3Å; I61-T64 PolarHBondContact O-N 3.31Å; I61-L65 HydrophobicContact CG2-CD1 3.49Å; I61-L65 VanDerWaalsContact CG2-CD1 3.49Å; I61-L65 HydrophobicContact CG2-CG 4.04Å; I61-L65 WeakPolarHBondContact O-CB 3.44Å; I61-L65 WeakPolarHBondContact O-CG 3.3Å; I61-L65 PolarHBondContact O-N 3.39Å; I61-F122 HydrophobicContact CD1-CB 3.9Å; I61-F122 HydrophobicContact CD1-CD2 4.04Å; I61-F122 HydrophobicContact CD1-CG 4.48Å; I61-F122 HydrophobicContact CG1-CD2 4.08Å; I61-F122 HydrophobicContact CG2-CD2 3.99Å; I61-F122 HydrophobicContact CG2-CE2 4.47Å; I61-Q125 HydrophobicContact CG2-CB 4.02Å
62	S	66.2	Low	61	Low	51 Å²	51	45.1 Å²	45.1	36%	0.357	26%	0.255	S	S	.	.	H	α-helix	trans	-57.6	-51.9	179.3	-168	0	0	0	0	112.1	S58 E59 L60 T64 L65 D66	S58-S62 WeakPolarHBondContact O-CB 3.41Å; S58-S62 PolarHBondContact O-N 3.41Å; E59-S62 PolarHBondContact O-N 3.09Å; L60-S62 VanDerWaalsContact C-N 3.32Å; L60-S62 PolarHBondContact O-N 3.03Å; S62-T64 VanDerWaalsContact C-N 3.28Å; S62-T64 PolarHBondContact O-N 2.98Å; S62-L65 PolarHBondContact O-N 3.21Å; S62-D66 WeakPolarHBondContact O-CB 3.2Å; S62-D66 PolarHBondContact O-N 2.86Å
63	V	64.8	Low	61	Low	59 Å²	59	52.2 Å²	52.2	36%	0.358	28%	0.281	S	S	.	.	H	α-helix	trans	-62	-39.2	-179.6	171.6	0	0	0	0	111.2	F18 E59 L60 I61 R67	F18-V63 HydrophobicContact CD2-CG1 4.23Å; F18-V63 HydrophobicContact CE2-CG1 4.41Å; E59-V63 HydrophobicContact CG-CG2 4.5Å; E59-V63 WeakPolarHBondContact O-CG2 3.28Å; E59-V63 PolarHBondContact O-N 3.09Å; L60-V63 PolarHBondContact O-N 3.4Å; I61-V63 PolarHBondContact O-N 3Å; V63-R67 WeakPolarHBondContact O-CB 3.46Å; V63-R67 PolarHBondContact O-N 3.06Å; V63-R67 VanDerWaalsContact O-N 3.08Å
64	T	64.3	Low	60.8	Low	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-66.5	-42.5	177.9	-58.1	0	0	0	0	111.1	F18 L60 I61 S62 F68 V84 F87 F88	F18-T64 HydrophobicContact CE2-CG2 4.5Å; F18-T64 HydrophobicContact CZ-CG2 4.13Å; L60-T64 WeakPolarHBondContact O-CB 3.5Å; L60-T64 PolarHBondContact O-N 2.95Å; L60-T64 PolarHBondContact O-OG1 3.45Å; I61-T64 PolarHBondContact O-N 3.31Å; S62-T64 VanDerWaalsContact C-N 3.28Å; S62-T64 PolarHBondContact O-N 2.98Å; T64-F68 VanDerWaalsContact O-CB 3.3Å; T64-F68 WeakPolarHBondContact O-CB 3.4Å; T64-F68 PolarHBondContact O-N 3.04Å; T64-V84 HydrophobicContact CG2-CB 3.92Å; T64-V84 HydrophobicContact CG2-CG1 3.48Å; T64-V84 VanDerWaalsContact CG2-CG1 3.48Å; T64-V84 HydrophobicContact CG2-CG2 3.65Å; T64-F87 HydrophobicContact CG2-CD1 4.06Å; T64-F88 HydrophobicContact CG2-CE1 3.87Å; T64-F88 HydrophobicContact CG2-CE2 4.28Å; T64-F88 HydrophobicContact CG2-CZ 3.57Å
65	L	64.9	Low	60.3	Low	3 Å²	3	58 Å²	58	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-67.6	-45.8	175.9	-70.1	172.6	0	0	0	112.2	I61 S62 R67 F68 M69 F88 Q125 F126 K129	I61-L65 HydrophobicContact CG2-CD1 3.49Å; I61-L65 VanDerWaalsContact CG2-CD1 3.49Å; I61-L65 HydrophobicContact CG2-CG 4.04Å; I61-L65 WeakPolarHBondContact O-CB 3.44Å; I61-L65 WeakPolarHBondContact O-CG 3.3Å; I61-L65 PolarHBondContact O-N 3.39Å; S62-L65 PolarHBondContact O-N 3.21Å; L65-R67 PolarHBondContact O-N 3.21Å; L65-F68 WeakPolarHBondContact O-CB 3.45Å; L65-F68 PolarHBondContact O-N 3.47Å; L65-M69 VanDerWaalsContact O-CB 3.31Å; L65-M69 WeakPolarHBondContact O-CB 3.47Å; L65-M69 WeakPolarHBondContact O-CG 3.25Å; L65-M69 PolarHBondContact O-N 3.42Å; L65-F88 HydrophobicContact CD2-CE1 4.45Å; L65-F88 HydrophobicContact CD2-CE2 3.68Å; L65-F88 HydrophobicContact CD2-CZ 3.42Å; L65-F88 VanDerWaalsContact CD2-CZ 3.42Å; L65-F88 HydrophobicContact CG-CZ 3.88Å; L65-Q125 HydrophobicContact CD1-CB 4.44Å; L65-F126 HydrophobicContact CD1-CB 4.44Å; L65-F126 HydrophobicContact CD2-CB 4.49Å; L65-F126 HydrophobicContact CD2-CD2 3.45Å; L65-F126 VanDerWaalsContact CD2-CD2 3.45Å; L65-F126 HydrophobicContact CD2-CE2 4.11Å; L65-F126 HydrophobicContact CD2-CG 4.4Å; L65-K129 HydrophobicContact CB-CG 4.38Å; L65-K129 HydrophobicContact CD1-CB 4.3Å
66	D	69.3	Low	59.5	Low	61 Å²	61	58 Å²	58	33%	0.326	31%	0.31	S	S	.	.	H	α-helix	trans	-57.4	-41.5	178.1	-72.1	-27.7	0	0	0	110.5	S62 A70 K129	S62-D66 WeakPolarHBondContact O-CB 3.2Å; S62-D66 PolarHBondContact O-N 2.86Å; D66-A70 WeakPolarHBondContact O-CB 3.36Å; D66-A70 PolarHBondContact O-N 2.88Å; D66-K129 WeakPolarHBondContact OD1-CE 3.49Å; D66-K129 IonicContact OD1-NZ 2.92Å; D66-K129 PolarHBondContact OD1-NZ 3.15Å
67	R	66	Low	58.9	Low	67 Å²	67	60.1 Å²	60.1	25%	0.253	33%	0.328	S	S	.	.	H	α-helix	trans	-73.5	-37.5	178.9	-166.1	140.5	175.7	160.8	1.9	113.4	D16 F18 V63 L65 M69 S71 D80	D16-R67 IonicContact OD1-CZ 2.64Å; D16-R67 IonicContact OD1-NH1 3.9Å; D16-R67 PolarHBondContact OD1-NH1 3.21Å; D16-R67 IonicContact OD1-NH2 2.68Å; D16-R67 PolarHBondContact OD1-NH2 3.4Å; D16-R67 VanDerWaalsContact OD1-NH2 3.14Å; D16-R67 IonicContact OD2-CZ 3.39Å; D16-R67 IonicContact OD2-NH1 3.14Å; D16-R67 IonicContact OD2-NH2 3.39Å; D16-R67 PolarHBondContact OD2-NH2 2.96Å; F18-R67 VanDerWaalsContact CB-CZ 3.48Å; F18-R67 VanDerWaalsContact CB-NH1 3.31Å; F18-R67 HydrophobicContact CD1-CG 4.45Å; F18-R67 HydrophobicContact CD2-CB 4.47Å; F18-R67 HydrophobicContact CD2-CG 4.48Å; F18-R67 HydrophobicContact CE1-CG 4.47Å; F18-R67 HydrophobicContact CE2-CB 4.19Å; F18-R67 HydrophobicContact CG-CG 4.45Å; F18-R67 HydrophobicContact CZ-CB 4.36Å; F18-R67 HydrophobicContact CZ-CG 4.49Å; V63-R67 WeakPolarHBondContact O-CB 3.46Å; V63-R67 PolarHBondContact O-N 3.06Å; V63-R67 VanDerWaalsContact O-N 3.08Å; L65-R67 PolarHBondContact O-N 3.21Å; R67-M69 VanDerWaalsContact C-N 3.34Å; R67-S71 PolarHBondContact O-N 3.2Å; R67-D80 IonicContact CZ-OD2 3.72Å; R67-D80 VanDerWaalsContact CZ-OD2 3.29Å; R67-D80 IonicContact NE-OD2 3.61Å; R67-D80 PolarHBondContact NE-OD2 2.67Å; R67-D80 IonicContact NH2-OD1 2.86Å; R67-D80 IonicContact NH2-OD2 2.69Å; R67-D80 PolarHBondContact NH2-OD2 2.9Å
68	F	61.3	Low	58.8	Low	1 Å²	1	62.7 Å²	62.7	0%	0.004	34%	0.342	C	S	.	.	H	α-helix	trans	-61	-45.4	173.4	-167	-115.9	0	0	0	111.4	T64 L65 S71 V84 I151 C152	T64-F68 VanDerWaalsContact O-CB 3.3Å; T64-F68 WeakPolarHBondContact O-CB 3.4Å; T64-F68 PolarHBondContact O-N 3.04Å; L65-F68 WeakPolarHBondContact O-CB 3.45Å; L65-F68 PolarHBondContact O-N 3.47Å; F68-S71 PolarHBondContact O-N 2.77Å; F68-S71 PolarHBondContact O-OG 2.95Å; F68-V84 HydrophobicContact CB-CB 4.36Å; F68-V84 HydrophobicContact CB-CG1 3.79Å; F68-V84 HydrophobicContact CB-CG2 4.19Å; F68-V84 HydrophobicContact CD2-CB 3.56Å; F68-V84 HydrophobicContact CD2-CG1 3.34Å; F68-V84 HydrophobicContact CD2-CG2 4.1Å; F68-V84 HydrophobicContact CE2-CB 4.15Å; F68-V84 HydrophobicContact CE2-CG1 3.92Å; F68-V84 HydrophobicContact CG-CB 4.28Å; F68-V84 HydrophobicContact CG-CG1 3.66Å; F68-I151 HydrophobicContact CD2-CG2 4.36Å; F68-I151 HydrophobicContact CE1-CB 3.94Å; F68-I151 HydrophobicContact CE1-CG2 3.77Å; F68-I151 HydrophobicContact CE2-CB 4.46Å; F68-I151 HydrophobicContact CE2-CG2 3.49Å; F68-I151 VanDerWaalsContact CE2-CG2 3.49Å; F68-I151 HydrophobicContact CZ-CB 3.87Å; F68-I151 HydrophobicContact CZ-CG2 3.16Å; F68-C152 HydrophobicContact CE1-CB 4.43Å; F68-C152 VanDerWaalsContact CE1-SG 3.53Å
69	M	64.6	Low	58.5	Low	13 Å²	13	64.3 Å²	64.3	6%	0.064	35%	0.354	C	S	.	.	H	α-helix	trans	-75.4	-31.1	-179.3	-66.9	-63.9	-138.4	0	0	112.8	L65 R67 S71 I130 I133 S148 V149 C152	L65-M69 VanDerWaalsContact O-CB 3.31Å; L65-M69 WeakPolarHBondContact O-CB 3.47Å; L65-M69 WeakPolarHBondContact O-CG 3.25Å; L65-M69 PolarHBondContact O-N 3.42Å; R67-M69 VanDerWaalsContact C-N 3.34Å; M69-S71 PolarHBondContact O-N 3.4Å; M69-I130 HydrophobicContact CE-CB 4.29Å; M69-I130 HydrophobicContact CE-CG1 3.53Å; M69-I133 HydrophobicContact CB-CD1 3.61Å; M69-I133 HydrophobicContact CE-CD1 3.43Å; M69-I133 VanDerWaalsContact CE-CD1 3.43Å; M69-I133 HydrophobicContact CG-CD1 3.53Å; M69-I133 HydrophobicContact SD-CD1 3.61Å; M69-S148 WeakPolarHBondContact O-CB 3.47Å; M69-V149 HydrophobicContact CE-CG2 4.41Å; M69-C152 WeakPolarHBondContact CE-SG 3.3Å; M69-C152 PolarHBondContact SD-SG 3.45Å
70	A	64.1	Low	58	Low	73 Å²	73	59.3 Å²	59.3	60%	0.603	33%	0.331	S	S	*	.	H	α-helix	trans	-69.4	-13.5	174.1	0	0	0	0	0	113.2	D66 S72	D66-A70 WeakPolarHBondContact O-CB 3.36Å; D66-A70 PolarHBondContact O-N 2.88Å; A70-S72 PolarHBondContact O-N 3.49Å
71	S	56.5	Low	57.8	Low	19 Å²	19	59.5 Å²	59.5	13%	0.133	33%	0.334	C	S	.	.			trans	-73.1	68.9	170.6	74.7	0	0	0	0	110.3	R67 F68 M69 R73 I151	R67-S71 PolarHBondContact O-N 3.2Å; F68-S71 PolarHBondContact O-N 2.77Å; F68-S71 PolarHBondContact O-OG 2.95Å; M69-S71 PolarHBondContact O-N 3.4Å; S71-R73 PolarHBondContact O-N 2.88Å; S71-I151 VanDerWaalsContact OG-CD1 3.31Å; S71-I151 WeakPolarHBondContact OG-CD1 3.32Å
72	S	50.4	Low	57.7	Low	89 Å²	89	63 Å²	63	62%	0.622	35%	0.353	S	S	*	.			trans	-67.8	-0.1	-171.7	57.3	0	0	0	0	115	A70	A70-S72 PolarHBondContact O-N 3.49Å
73	R	48.2	Very low	57.4	Low	180 Å²	180	63.1 Å²	63.1	68%	0.679	35%	0.348	S	S	*	.			trans	-111.2	102.9	-176.7	-66.3	-171.3	-176.6	-166.1	0.5	110.4	S71 M75 L76	S71-R73 PolarHBondContact O-N 2.88Å; R73-M75 PolarHBondContact O-N 2.92Å; R73-L76 PolarHBondContact O-N 3.22Å; R73-L76 VanDerWaalsContact O-N 3.15Å
74	T	48.5	Very low	57.3	Low	62 Å²	62	60.3 Å²	60.3	38%	0.38	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.2	-27.7	166	44.6	0	0	0	0	113.4	D202	T74-D202 PolarHBondContact OG1-OD1 3.32Å
75	M	46.6	Very low	57.2	Low	170 Å²	170	62.1 Å²	62.1	84%	0.837	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-16.4	-176	-72.2	-155.1	173.6	0	0	116.9	R73	R73-M75 PolarHBondContact O-N 2.92Å
76	L	43.5	Very low	57.2	Low	123 Å²	123	69 Å²	69	64%	0.644	37%	0.366	S	S	*	.			trans	-118.2	104.8	-177.4	-88.5	149.3	0	0	0	109.6	R73 N78	R73-L76 PolarHBondContact O-N 3.22Å; R73-L76 VanDerWaalsContact O-N 3.15Å; L76-N78 PolarHBondContact O-N 2.95Å
77	V	46.9	Very low	57	Low	119 Å²	119	66.6 Å²	66.6	72%	0.721	35%	0.352	S	S	*	.			trans	-60.4	88.3	162	-174.5	0	0	0	0	107.2	I82	V77-I82 HydrophobicContact CG1-CD1 3.51Å; V77-I82 HydrophobicContact CG1-CG1 3.49Å; V77-I82 VanDerWaalsContact CG1-CG1 3.49Å
78	N	54.8	Low	57.2	Low	66 Å²	66	63.4 Å²	63.4	35%	0.353	34%	0.34	S	S	.	.			trans	-68.5	136.8	173.9	-175.9	-5.5	0	0	0	107.4	L76 D80 G81 I82	L76-N78 PolarHBondContact O-N 2.95Å; N78-D80 PolarHBondContact ND2-OD2 2.91Å; N78-D80 PolarHBondContact O-N 3.02Å; N78-D80 PolarHBondContact OD1-N 3.44Å; N78-D80 VanDerWaalsContact OD1-N 3.15Å; N78-G81 PolarHBondContact O-N 2.98Å; N78-I82 PolarHBondContact O-N 3.42Å
79	S	56.9	Low	57.5	Low	70 Å²	70	67.2 Å²	67.2	49%	0.49	36%	0.357	S	S	.	.	H	α-helix	trans	-49.2	-33.6	171.9	47.3	0	0	0	0	111.7	I82 I83	S79-I82 PolarHBondContact O-N 3.32Å; S79-I83 WeakPolarHBondContact O-CD1 2.97Å; S79-I83 VanDerWaalsContact O-CG1 3.24Å; S79-I83 WeakPolarHBondContact O-CG1 3.46Å; S79-I83 PolarHBondContact O-N 2.9Å
80	D	55.5	Low	57.5	Low	11 Å²	11	68.1 Å²	68.1	6%	0.059	37%	0.366	C	S	.	.	H	α-helix	trans	-62.5	-44.7	175.7	-65.1	-14.7	0	0	0	112.4	F18 R67 N78 I82 I83 V84	F18-D80 HydrophobicContact CD1-CB 4.27Å; F18-D80 HydrophobicContact CE1-CB 4.21Å; R67-D80 IonicContact CZ-OD2 3.72Å; R67-D80 VanDerWaalsContact CZ-OD2 3.29Å; R67-D80 IonicContact NE-OD2 3.61Å; R67-D80 PolarHBondContact NE-OD2 2.67Å; R67-D80 IonicContact NH2-OD1 2.86Å; R67-D80 IonicContact NH2-OD2 2.69Å; R67-D80 PolarHBondContact NH2-OD2 2.9Å; N78-D80 PolarHBondContact ND2-OD2 2.91Å; N78-D80 PolarHBondContact O-N 3.02Å; N78-D80 PolarHBondContact OD1-N 3.44Å; N78-D80 VanDerWaalsContact OD1-N 3.15Å; D80-I82 VanDerWaalsContact C-N 3.3Å; D80-I82 PolarHBondContact O-N 2.97Å; D80-I83 PolarHBondContact O-N 3.14Å; D80-V84 WeakPolarHBondContact O-CG2 3.35Å; D80-V84 PolarHBondContact O-N 3.22Å
81	G	57.7	Low	57.5	Low	12 Å²	12	64.8 Å²	64.8	12%	0.124	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-38.1	178.5	0	0	0	0	0	112.1	N78 Y85	N78-G81 PolarHBondContact O-N 2.98Å; G81-Y85 WeakPolarHBondContact O-CB 3.29Å; G81-Y85 PolarHBondContact O-N 3.25Å
82	I	60.9	Low	57.9	Low	74 Å²	74	65 Å²	65	38%	0.379	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-49.1	173	-63.9	178.7	0	0	0	110.6	V77 N78 S79 D80 V84 Y85 Y86	V77-I82 HydrophobicContact CG1-CD1 3.51Å; V77-I82 HydrophobicContact CG1-CG1 3.49Å; V77-I82 VanDerWaalsContact CG1-CG1 3.49Å; N78-I82 PolarHBondContact O-N 3.42Å; S79-I82 PolarHBondContact O-N 3.32Å; D80-I82 VanDerWaalsContact C-N 3.3Å; D80-I82 PolarHBondContact O-N 2.97Å; I82-V84 VanDerWaalsContact C-N 3.33Å; I82-V84 PolarHBondContact O-N 2.54Å; I82-Y85 PolarHBondContact O-N 3.34Å; I82-Y86 HydrophobicContact CG2-CD2 3.5Å; I82-Y86 HydrophobicContact CG2-CE2 3.5Å; I82-Y86 VanDerWaalsContact O-CD2 3.23Å; I82-Y86 WeakPolarHBondContact O-CD2 3.12Å; I82-Y86 PolarHBondContact O-N 3.13Å
83	I	60.4	Low	58.6	Low	53 Å²	53	63.2 Å²	63.2	27%	0.272	32%	0.321	S	S	.	.	H	α-helix	trans	-59.8	-45.7	-179.6	-69.4	165.2	0	0	0	110.3	F18 T19 V22 S79 D80 Y86 F87	F18-I83 HydrophobicContact CE1-CG2 4.48Å; T19-I83 HydrophobicContact CG2-CD1 3.95Å; V22-I83 HydrophobicContact CB-CG2 4.37Å; V22-I83 HydrophobicContact CG1-CG2 4.09Å; S79-I83 WeakPolarHBondContact O-CD1 2.97Å; S79-I83 VanDerWaalsContact O-CG1 3.24Å; S79-I83 WeakPolarHBondContact O-CG1 3.46Å; S79-I83 PolarHBondContact O-N 2.9Å; D80-I83 PolarHBondContact O-N 3.14Å; I83-Y86 PolarHBondContact O-N 3.33Å; I83-F87 VanDerWaalsContact O-CB 3.28Å; I83-F87 WeakPolarHBondContact O-CB 3.23Å; I83-F87 PolarHBondContact O-N 3.42Å
84	V	61.1	Low	59	Low	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-59.2	-51	176.2	172.5	0	0	0	0	111	F18 T64 F68 D80 I82 Y86 F87 F88	F18-V84 HydrophobicContact CE1-CG2 3.84Å; F18-V84 HydrophobicContact CZ-CG2 3.51Å; T64-V84 HydrophobicContact CG2-CB 3.92Å; T64-V84 HydrophobicContact CG2-CG1 3.48Å; T64-V84 VanDerWaalsContact CG2-CG1 3.48Å; T64-V84 HydrophobicContact CG2-CG2 3.65Å; F68-V84 HydrophobicContact CB-CB 4.36Å; F68-V84 HydrophobicContact CB-CG1 3.79Å; F68-V84 HydrophobicContact CB-CG2 4.19Å; F68-V84 HydrophobicContact CD2-CB 3.56Å; F68-V84 HydrophobicContact CD2-CG1 3.34Å; F68-V84 HydrophobicContact CD2-CG2 4.1Å; F68-V84 HydrophobicContact CE2-CB 4.15Å; F68-V84 HydrophobicContact CE2-CG1 3.92Å; F68-V84 HydrophobicContact CG-CB 4.28Å; F68-V84 HydrophobicContact CG-CG1 3.66Å; D80-V84 WeakPolarHBondContact O-CG2 3.35Å; D80-V84 PolarHBondContact O-N 3.22Å; I82-V84 VanDerWaalsContact C-N 3.33Å; I82-V84 PolarHBondContact O-N 2.54Å; V84-Y86 VanDerWaalsContact C-N 3.33Å; V84-Y86 PolarHBondContact O-N 3.49Å; V84-F87 WeakPolarHBondContact O-CB 3.39Å; V84-F87 PolarHBondContact O-N 3.36Å; V84-F87 VanDerWaalsContact O-N 3.14Å; V84-F88 HydrophobicContact CG1-CD2 3.58Å; V84-F88 HydrophobicContact CG1-CE2 3.13Å; V84-F88 HydrophobicContact CG1-CZ 3.74Å; V84-F88 PolarHBondContact O-N 3.5Å
85	Y	62.2	Low	59.2	Low	39 Å²	39	54.4 Å²	54.4	15%	0.153	29%	0.285	C	S	.	.	H	α-helix	trans	-58.6	-45.7	-178.5	169.4	-87	0	0	0	111.2	G81 I82 F88 K89 F155 D158	G81-Y85 WeakPolarHBondContact O-CB 3.29Å; G81-Y85 PolarHBondContact O-N 3.25Å; I82-Y85 PolarHBondContact O-N 3.34Å; Y85-F88 PolarHBondContact O-N 3.4Å; Y85-K89 HydrophobicContact CE1-CD 3.96Å; Y85-K89 WeakPolarHBondContact O-CB 3.38Å; Y85-K89 PolarHBondContact O-N 2.72Å; Y85-K89 PolarHBondContact OH-NZ 2.81Å; Y85-K89 VanDerWaalsContact OH-NZ 3.1Å; Y85-F155 HydrophobicContact CD2-CB 4.44Å; Y85-F155 HydrophobicContact CD2-CD2 4.4Å; Y85-F155 HydrophobicContact CE2-CD2 4.49Å; Y85-D158 PolarHBondContact OH-OD2 2.69Å
86	Y	64.8	Low	59.5	Low	148 Å²	148	50.9 Å²	50.9	58%	0.58	27%	0.265	S	S	*	.	H	α-helix	trans	-69.5	-32.1	177.2	-78.9	-66.4	0	0	0	113.1	I82 I83 V84 K89 A90	I82-Y86 HydrophobicContact CG2-CD2 3.5Å; I82-Y86 HydrophobicContact CG2-CE2 3.5Å; I82-Y86 VanDerWaalsContact O-CD2 3.23Å; I82-Y86 WeakPolarHBondContact O-CD2 3.12Å; I82-Y86 PolarHBondContact O-N 3.13Å; I83-Y86 PolarHBondContact O-N 3.33Å; V84-Y86 VanDerWaalsContact C-N 3.33Å; V84-Y86 PolarHBondContact O-N 3.49Å; Y86-K89 HydrophobicContact CD1-CD 4.49Å; Y86-K89 PolarHBondContact O-N 3.23Å; Y86-A90 VanDerWaalsContact O-CB 3.3Å; Y86-A90 WeakPolarHBondContact O-CB 3.25Å; Y86-A90 PolarHBondContact O-N 2.96Å
87	F	66.9	Low	59.7	Low	10 Å²	10	50.2 Å²	50.2	4%	0.044	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-49.9	172.6	172.2	-98.1	0	0	0	111.1	V22 W26 F57 L60 T64 I83 V84 K89 A90 L91	V22-F87 HydrophobicContact CG1-CB 4.05Å; V22-F87 HydrophobicContact CG1-CD2 3.67Å; V22-F87 HydrophobicContact CG1-CE2 4.34Å; V22-F87 HydrophobicContact CG1-CG 3.9Å; W26-F87 HydrophobicContact CB-CD2 4.45Å; W26-F87 HydrophobicContact CB-CE2 4.29Å; W26-F87 HydrophobicContact CD2-CD2 4.48Å; W26-F87 HydrophobicContact CD2-CE2 4.36Å; W26-F87 HydrophobicContact CE3-CD2 4.2Å; W26-F87 AromaticContact CE3-CE2 3.74Å; W26-F87 HydrophobicContact CE3-CE2 3.74Å; W26-F87 HydrophobicContact CZ3-CE2 4.45Å; F57-F87 HydrophobicContact CE2-CZ 4.16Å; L60-F87 HydrophobicContact CD2-CE1 4.31Å; L60-F87 HydrophobicContact CD2-CE2 3.78Å; L60-F87 HydrophobicContact CD2-CZ 3.38Å; L60-F87 HydrophobicContact CG-CE1 4.49Å; L60-F87 HydrophobicContact CG-CZ 4.01Å; T64-F87 HydrophobicContact CG2-CD1 4.06Å; I83-F87 VanDerWaalsContact O-CB 3.28Å; I83-F87 WeakPolarHBondContact O-CB 3.23Å; I83-F87 PolarHBondContact O-N 3.42Å; V84-F87 WeakPolarHBondContact O-CB 3.39Å; V84-F87 PolarHBondContact O-N 3.36Å; V84-F87 VanDerWaalsContact O-N 3.14Å; F87-K89 VanDerWaalsContact C-N 3.34Å; F87-K89 PolarHBondContact O-N 3.47Å; F87-A90 WeakPolarHBondContact O-CB 3.4Å; F87-A90 PolarHBondContact O-N 3Å; F87-A90 VanDerWaalsContact O-N 3.16Å; F87-L91 HydrophobicContact CD1-CD1 4.07Å; F87-L91 HydrophobicContact CE1-CD1 3.44Å; F87-L91 VanDerWaalsContact CE1-CD1 3.44Å; F87-L91 HydrophobicContact CE1-CG 4.37Å; F87-L91 HydrophobicContact CZ-CD1 3.69Å; F87-L91 HydrophobicContact CZ-CG 4.29Å; F87-L91 PolarHBondContact O-N 3.36Å
88	F	68.6	Low	59.4	Low	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-37	176.7	-62.6	-37.2	0	0	0	112.6	T64 L65 V84 Y85 A90 L91 L92 F122 F155	T64-F88 HydrophobicContact CG2-CE1 3.87Å; T64-F88 HydrophobicContact CG2-CE2 4.28Å; T64-F88 HydrophobicContact CG2-CZ 3.57Å; L65-F88 HydrophobicContact CD2-CE1 4.45Å; L65-F88 HydrophobicContact CD2-CE2 3.68Å; L65-F88 HydrophobicContact CD2-CZ 3.42Å; L65-F88 VanDerWaalsContact CD2-CZ 3.42Å; L65-F88 HydrophobicContact CG-CZ 3.88Å; V84-F88 HydrophobicContact CG1-CD2 3.58Å; V84-F88 HydrophobicContact CG1-CE2 3.13Å; V84-F88 HydrophobicContact CG1-CZ 3.74Å; V84-F88 PolarHBondContact O-N 3.5Å; Y85-F88 PolarHBondContact O-N 3.4Å; F88-A90 VanDerWaalsContact C-N 3.31Å; F88-A90 PolarHBondContact O-N 3.46Å; F88-L91 HydrophobicContact CD1-CD1 4.18Å; F88-L91 WeakPolarHBondContact O-CB 3.48Å; F88-L91 PolarHBondContact O-N 3.49Å; F88-L92 WeakPolarHBondContact O-CG 3.29Å; F88-L92 PolarHBondContact O-N 2.79Å; F88-L92 VanDerWaalsContact O-N 3.12Å; F88-F122 HydrophobicContact CB-CE2 4.46Å; F88-F122 HydrophobicContact CB-CZ 3.98Å; F88-F122 AromaticContact CD1-CD2 4Å; F88-F122 HydrophobicContact CD1-CD2 4Å; F88-F122 AromaticContact CD1-CE2 3.15Å; F88-F122 HydrophobicContact CD1-CE2 3.15Å; F88-F122 AromaticContact CD1-CZ 3.55Å; F88-F122 HydrophobicContact CD1-CZ 3.55Å; F88-F122 HydrophobicContact CD2-CE2 4.32Å; F88-F122 HydrophobicContact CD2-CZ 4.21Å; F88-F122 HydrophobicContact CE1-CD2 4.03Å; F88-F122 AromaticContact CE1-CE2 3.26Å; F88-F122 HydrophobicContact CE1-CE2 3.26Å; F88-F122 HydrophobicContact CE1-CZ 4.06Å; F88-F122 HydrophobicContact CE2-CE2 4.36Å; F88-F122 AromaticContact CG-CE2 3.76Å; F88-F122 HydrophobicContact CG-CE2 3.76Å; F88-F122 AromaticContact CG-CZ 3.67Å; F88-F122 HydrophobicContact CG-CZ 3.67Å; F88-F122 AromaticContact CZ-CE2 3.89Å; F88-F122 HydrophobicContact CZ-CE2 3.89Å; F88-F155 HydrophobicContact CB-CD2 3.99Å; F88-F155 HydrophobicContact CB-CE1 4.42Å; F88-F155 HydrophobicContact CB-CE2 3.29Å; F88-F155 HydrophobicContact CB-CZ 3.54Å; F88-F155 HydrophobicContact CG-CE2 4.39Å; F88-F155 HydrophobicContact CG-CZ 4.41Å
89	K	67.6	Low	58.6	Low	81 Å²	81	52.7 Å²	52.7	35%	0.352	26%	0.262	S	S	.	.	H	α-helix	trans	-63.5	-37	173.4	-167.2	169.6	-167.7	157.9	0	112.3	Y85 Y86 F87 L91 N93	Y85-K89 HydrophobicContact CE1-CD 3.96Å; Y85-K89 WeakPolarHBondContact O-CB 3.38Å; Y85-K89 PolarHBondContact O-N 2.72Å; Y85-K89 PolarHBondContact OH-NZ 2.81Å; Y85-K89 VanDerWaalsContact OH-NZ 3.1Å; Y86-K89 HydrophobicContact CD1-CD 4.49Å; Y86-K89 PolarHBondContact O-N 3.23Å; F87-K89 VanDerWaalsContact C-N 3.34Å; F87-K89 PolarHBondContact O-N 3.47Å; K89-L91 VanDerWaalsContact C-N 3.34Å; K89-N93 PolarHBondContact O-N 3.35Å; K89-N93 VanDerWaalsContact O-N 3.16Å; K89-N93 PolarHBondContact O-ND2 2.84Å
90	A	65.7	Low	57.6	Low	31 Å²	31	52.6 Å²	52.6	26%	0.256	27%	0.272	S	S	.	.	H	α-helix	trans	-68	-35.3	175.5	0	0	0	0	0	111.6	W26 Y86 F87 F88 N93 S94	W26-A90 HydrophobicContact CH2-CB 3.86Å; W26-A90 HydrophobicContact CZ2-CB 3.51Å; Y86-A90 VanDerWaalsContact O-CB 3.3Å; Y86-A90 WeakPolarHBondContact O-CB 3.25Å; Y86-A90 PolarHBondContact O-N 2.96Å; F87-A90 WeakPolarHBondContact O-CB 3.4Å; F87-A90 PolarHBondContact O-N 3Å; F87-A90 VanDerWaalsContact O-N 3.16Å; F88-A90 VanDerWaalsContact C-N 3.31Å; F88-A90 PolarHBondContact O-N 3.46Å; A90-N93 PolarHBondContact O-N 3.08Å; A90-S94 PolarHBondContact O-N 3.18Å
91	L	64.4	Low	56.8	Low	4 Å²	4	57.9 Å²	57.9	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-63	-44.6	173.9	-77.2	169.9	0	0	0	113.1	W26 Y29 F57 F87 F88 K89 N93 S94	W26-L91 HydrophobicContact CE3-CD2 4.49Å; W26-L91 HydrophobicContact CH2-CD2 4.22Å; W26-L91 HydrophobicContact CZ3-CD2 3.54Å; W26-L91 HydrophobicContact CZ3-CG 3.98Å; Y29-L91 HydrophobicContact CE1-CD2 4.21Å; F57-L91 HydrophobicContact CE1-CD2 4.36Å; F57-L91 HydrophobicContact CE2-CD1 4.26Å; F57-L91 HydrophobicContact CE2-CD2 3.76Å; F57-L91 HydrophobicContact CZ-CD1 3.59Å; F57-L91 HydrophobicContact CZ-CD2 3.28Å; F57-L91 HydrophobicContact CZ-CG 4.06Å; F87-L91 HydrophobicContact CD1-CD1 4.07Å; F87-L91 HydrophobicContact CE1-CD1 3.44Å; F87-L91 VanDerWaalsContact CE1-CD1 3.44Å; F87-L91 HydrophobicContact CE1-CG 4.37Å; F87-L91 HydrophobicContact CZ-CD1 3.69Å; F87-L91 HydrophobicContact CZ-CG 4.29Å; F87-L91 PolarHBondContact O-N 3.36Å; F88-L91 HydrophobicContact CD1-CD1 4.18Å; F88-L91 WeakPolarHBondContact O-CB 3.48Å; F88-L91 PolarHBondContact O-N 3.49Å; K89-L91 VanDerWaalsContact C-N 3.34Å; L91-N93 VanDerWaalsContact C-N 3.3Å; L91-N93 PolarHBondContact O-N 3.28Å; L91-S94 WeakPolarHBondContact O-CB 3.27Å; L91-S94 PolarHBondContact O-N 2.97Å; L91-S94 PolarHBondContact O-OG 3.19Å
92	L	64.9	Low	55.8	Low	23 Å²	23	61.1 Å²	61.1	12%	0.12	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-39.9	175.2	-66.9	168.1	0	0	0	112.3	F88 L119 F123 F155 V159	F88-L92 WeakPolarHBondContact O-CG 3.29Å; F88-L92 PolarHBondContact O-N 2.79Å; F88-L92 VanDerWaalsContact O-N 3.12Å; L92-L119 HydrophobicContact CD2-CD2 3.96Å; L92-F123 HydrophobicContact CD2-CE1 4.38Å; L92-F123 HydrophobicContact CD2-CE2 4.26Å; L92-F123 HydrophobicContact CD2-CZ 3.6Å; L92-F155 HydrophobicContact CD1-CE2 3.62Å; L92-F155 HydrophobicContact CD1-CZ 3.51Å; L92-F155 HydrophobicContact CG-CZ 4.19Å; L92-V159 HydrophobicContact CD1-CB 4.22Å; L92-V159 HydrophobicContact CD1-CG1 3.96Å; L92-V159 HydrophobicContact CD1-CG2 3.33Å; L92-V159 HydrophobicContact CD2-CG1 3.96Å; L92-V159 HydrophobicContact CD2-CG2 4.46Å
93	N	63.7	Low	54.6	Low	52 Å²	52	67.4 Å²	67.4	28%	0.278	35%	0.345	S	S	.	.	H	α-helix	trans	-80.8	-13.3	-179	-71.7	-48.2	0	0	0	114.1	K89 A90 L91 H95 K96 D97	K89-N93 PolarHBondContact O-N 3.35Å; K89-N93 VanDerWaalsContact O-N 3.16Å; K89-N93 PolarHBondContact O-ND2 2.84Å; A90-N93 PolarHBondContact O-N 3.08Å; L91-N93 VanDerWaalsContact C-N 3.3Å; L91-N93 PolarHBondContact O-N 3.28Å; N93-H95 PolarHBondContact O-N 3.02Å; N93-K96 WeakPolarHBondContact O-CB 3.38Å; N93-K96 PolarHBondContact O-N 2.9Å; N93-D97 PolarHBondContact O-N 3.3Å
94	S	57.7	Low	53.4	Low	18 Å²	18	74.1 Å²	74.1	13%	0.126	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.1	-179.4	68.8	0	0	0	0	112.8	A90 L91 I98	A90-S94 PolarHBondContact O-N 3.18Å; L91-S94 WeakPolarHBondContact O-CB 3.27Å; L91-S94 PolarHBondContact O-N 2.97Å; L91-S94 PolarHBondContact O-OG 3.19Å; S94-I98 WeakPolarHBondContact O-CG1 3.39Å
95	H	51.7	Low	52.4	Low	38 Å²	38	77.7 Å²	77.7	18%	0.176	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-31.5	174.5	-69.7	-93	0	0	0	114.8	N93 I98 A115 Q116 L119	N93-H95 PolarHBondContact O-N 3.02Å; H95-I98 WeakPolarHBondContact O-CB 3.42Å; H95-I98 PolarHBondContact O-N 3.16Å; H95-A115 WeakPolarHBondContact CE1-CB 3.4Å; H95-A115 PolarHBondContact CE1-O 3.48Å; H95-A115 VanDerWaalsContact CE1-O 3.29Å; H95-A115 WeakPolarHBondContact ND1-CB 3.48Å; H95-A115 VanDerWaalsContact NE2-C 3.34Å; H95-A115 WeakPolarHBondContact NE2-CB 3.43Å; H95-A115 PolarHBondContact NE2-O 3.39Å; H95-A115 VanDerWaalsContact NE2-O 3.1Å; H95-Q116 PolarHBondContact CE1-N 3.24Å; H95-Q116 VanDerWaalsContact CE1-N 3.32Å; H95-L119 WeakPolarHBondContact CD2-CD1 3.36Å; H95-L119 WeakPolarHBondContact NE2-CD1 3.42Å; H95-L119 WeakPolarHBondContact NE2-CG 3.32Å
96	K	54.3	Low	51.4	Low	96 Å²	96	82.9 Å²	82.9	42%	0.417	42%	0.422	S	S	.	.	H	α-helix	trans	-72.1	-37.1	-178.7	-71.4	-178.1	173.6	171.9	0	110.8	N93 I98 K99 D162	N93-K96 WeakPolarHBondContact O-CB 3.38Å; N93-K96 PolarHBondContact O-N 2.9Å; K96-I98 PolarHBondContact O-N 3.33Å; K96-I98 VanDerWaalsContact O-N 3.13Å; K96-K99 PolarHBondContact O-N 3.35Å; K96-D162 WeakPolarHBondContact CE-OD2 3.28Å; K96-D162 IonicContact NZ-OD1 3.23Å; K96-D162 PolarHBondContact NZ-OD1 3.01Å; K96-D162 IonicContact NZ-OD2 3.55Å; K96-D162 PolarHBondContact NZ-OD2 2.73Å
97	D	46	Very low	50.3	Low	110 Å²	110	79.8 Å²	79.8	59%	0.588	42%	0.415	S	S	*	.	H	α-helix	trans	-59.7	-22.3	173.1	-74.1	-13.9	0	0	0	112.2	N93	N93-D97 PolarHBondContact O-N 3.3Å
98	I	42.6	Very low	49.3	Very low	49 Å²	49	81.4 Å²	81.4	25%	0.251	43%	0.426	S	S	.	.	H	α-helix	trans	-74.3	-31	176.6	-54.5	173.6	0	0	0	111.8	S94 H95 K96 A115	S94-I98 WeakPolarHBondContact O-CG1 3.39Å; H95-I98 WeakPolarHBondContact O-CB 3.42Å; H95-I98 PolarHBondContact O-N 3.16Å; K96-I98 PolarHBondContact O-N 3.33Å; K96-I98 VanDerWaalsContact O-N 3.13Å; I98-A115 HydrophobicContact CD1-CB 4.44Å
99	K	37.7	Very low	48.2	Very low	188 Å²	188	88.1 Å²	88.1	82%	0.817	46%	0.462	S	S	*	.	H	α-helix	trans	-79	-24.1	179.5	-77.8	-172	176.3	-177.8	0	113.4	K96	K96-K99 PolarHBondContact O-N 3.35Å
100	G	34.5	Very low	47.2	Very low	67 Å²	67	89 Å²	89	69%	0.691	47%	0.467	S	S	*	.	H	α-helix	trans	-80.7	-20.6	-172.9	0	0	0	0	0	115.3
101	E	38.5	Very low	46.3	Very low	122 Å²	122	91.4 Å²	91.4	57%	0.57	47%	0.47	S	S	*	.	S	Bend	trans	-109	97.9	-175.1	-69.5	-173.8	158.8	0	0	111.4	R37	R37-E101 IonicContact CZ-OE2 3.25Å; R37-E101 IonicContact NH1-OE2 3.2Å; R37-E101 PolarHBondContact NH1-OE2 3.31Å; R37-E101 IonicContact NH2-OE2 2.77Å
102	S	36.8	Very low	45.6	Very low	80 Å²	80	94 Å²	94	56%	0.559	48%	0.483	S	S	*	.			trans	77.5	107.1	164.8	75.2	0	0	0	0	118.2	K104	S102-K104 PolarHBondContact O-N 2.8Å
103	E	35.6	Very low	45.1	Very low	207 Å²	207	95.1 Å²	95.1	97%	0.967	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	16.5	166.5	-81.4	-179.5	147.6	0	0	115.2
104	K	35.7	Very low	44.7	Very low	193 Å²	193	94.1 Å²	94.1	84%	0.839	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.8	-0.1	-170.7	-80	-168.1	177	-179.2	0	117.4	S102	S102-K104 PolarHBondContact O-N 2.8Å
105	V	41.2	Very low	44.6	Very low	75 Å²	75	93.3 Å²	93.3	46%	0.455	48%	0.482	S	S	.	.	S	Bend	trans	-105.9	110.3	175.6	-175.3	0	0	0	0	107.2	I107	V105-I107 VanDerWaalsContact C-N 3.27Å; V105-I107 WeakPolarHBondContact O-CG1 2.88Å; V105-I107 PolarHBondContact O-N 2.77Å
106	I	40	Very low	45.1	Very low	148 Å²	148	97.1 Å²	97.1	76%	0.759	50%	0.5	S	S	*	.			trans	-25.6	94.2	160.4	-61.5	162.1	0	0	0	107.8	T108	I106-T108 HydrophobicContact CG2-CG2 4.33Å; I106-T108 PolarHBondContact O-N 3.3Å
107	I	41.5	Very low	45.6	Very low	84 Å²	84	96.6 Å²	96.6	43%	0.431	50%	0.502	S	S	.	.			trans	-75.9	89.4	-178.2	-57.7	-178.1	0	0	0	102.4	V105 D109	V105-I107 VanDerWaalsContact C-N 3.27Å; V105-I107 WeakPolarHBondContact O-CG1 2.88Å; V105-I107 PolarHBondContact O-N 2.77Å; I107-D109 PolarHBondContact O-N 2.91Å
108	T	46	Very low	46.4	Very low	44 Å²	44	92.1 Å²	92.1	27%	0.27	48%	0.48	S	S	.	.			trans	-52.6	131.4	179.1	43.6	0	0	0	0	107.9	I106 E110 R111	I106-T108 HydrophobicContact CG2-CG2 4.33Å; I106-T108 PolarHBondContact O-N 3.3Å; T108-E110 PolarHBondContact O-N 2.96Å; T108-R111 PolarHBondContact O-N 2.86Å
109	D	46.6	Very low	47.6	Very low	141 Å²	141	90.8 Å²	90.8	75%	0.754	47%	0.473	S	S	*	.	H	α-helix	trans	-47.8	-27.4	172.9	-77.2	-39.8	0	0	0	111.3	I107 N112 S113	I107-D109 PolarHBondContact O-N 2.91Å; D109-N112 PolarHBondContact O-N 3.45Å; D109-S113 WeakPolarHBondContact O-CB 3.39Å; D109-S113 PolarHBondContact O-N 3.28Å
110	E	46.1	Very low	49.2	Very low	98 Å²	98	88.7 Å²	88.7	46%	0.458	46%	0.464	S	S	.	.	H	α-helix	trans	-66.5	-33.2	175.1	-63	-177.9	167	0	0	115.6	T108 S113 L114	T108-E110 PolarHBondContact O-N 2.96Å; E110-S113 WeakPolarHBondContact CA-OG 3.43Å; E110-S113 PolarHBondContact O-N 2.9Å; E110-S113 PolarHBondContact O-OG 3.27Å; E110-L114 PolarHBondContact O-N 2.87Å
111	R	46	Very low	50.9	Low	83 Å²	83	87.2 Å²	87.2	31%	0.313	44%	0.44	S	S	.	.	H	α-helix	trans	-70.1	-42.6	175.1	-79.1	179.6	-178.7	-178.8	2.4	111.1	T108 S113 L114 A115	T108-R111 PolarHBondContact O-N 2.86Å; R111-S113 VanDerWaalsContact C-N 3.28Å; R111-L114 PolarHBondContact O-N 2.9Å; R111-A115 PolarHBondContact O-N 2.9Å
112	N	51.3	Low	52.5	Low	58 Å²	58	81.4 Å²	81.4	31%	0.31	41%	0.413	S	S	.	.	H	α-helix	trans	-64.1	-38.3	173.7	-76.6	-26.9	0	0	0	110.1	D109 Q116	D109-N112 PolarHBondContact O-N 3.45Å; N112-Q116 WeakPolarHBondContact O-CB 3.4Å; N112-Q116 WeakPolarHBondContact O-CG 3.31Å; N112-Q116 PolarHBondContact O-N 2.69Å
113	S	54.7	Low	54.4	Low	47 Å²	47	77.8 Å²	77.8	33%	0.329	39%	0.387	S	S	.	.	H	α-helix	trans	-64.5	-41	177.9	82.8	0	0	0	0	112.4	D109 E110 R111 Q116 N117	D109-S113 WeakPolarHBondContact O-CB 3.39Å; D109-S113 PolarHBondContact O-N 3.28Å; E110-S113 WeakPolarHBondContact CA-OG 3.43Å; E110-S113 PolarHBondContact O-N 2.9Å; E110-S113 PolarHBondContact O-OG 3.27Å; R111-S113 VanDerWaalsContact C-N 3.28Å; S113-Q116 PolarHBondContact O-N 3.47Å; S113-N117 WeakPolarHBondContact O-CB 3.48Å; S113-N117 PolarHBondContact O-N 2.92Å; S113-N117 PolarHBondContact O-ND2 3.37Å; S113-N117 PolarHBondContact O-OD1 2.71Å
114	L	53.5	Low	56.4	Low	30 Å²	30	71 Å²	71	16%	0.157	36%	0.362	C	S	.	.	H	α-helix	trans	-61.3	-55.5	179.5	-173.7	88.7	0	0	0	112.2	L33 V49 E110 R111 Q116 N117 A118	L33-L114 HydrophobicContact CD2-CD2 4.2Å; V49-L114 HydrophobicContact CB-CD1 3.88Å; V49-L114 HydrophobicContact CG1-CD1 3.01Å; V49-L114 HydrophobicContact CG2-CD1 3.65Å; E110-L114 PolarHBondContact O-N 2.87Å; R111-L114 PolarHBondContact O-N 2.9Å; L114-Q116 PolarHBondContact O-N 3.18Å; L114-N117 WeakPolarHBondContact O-CB 3.35Å; L114-N117 PolarHBondContact O-N 3.36Å; L114-N117 VanDerWaalsContact O-N 3.11Å; L114-A118 PolarHBondContact O-N 3.32Å
115	A	56.9	Low	58.3	Low	2 Å²	2	63.8 Å²	63.8	2%	0.017	33%	0.331	C	S	.	.	H	α-helix	trans	-65	-34.2	-177.3	0	0	0	0	0	109.5	H95 I98 R111 A118 L119	H95-A115 WeakPolarHBondContact CE1-CB 3.4Å; H95-A115 PolarHBondContact CE1-O 3.48Å; H95-A115 VanDerWaalsContact CE1-O 3.29Å; H95-A115 WeakPolarHBondContact ND1-CB 3.48Å; H95-A115 VanDerWaalsContact NE2-C 3.34Å; H95-A115 WeakPolarHBondContact NE2-CB 3.43Å; H95-A115 PolarHBondContact NE2-O 3.39Å; H95-A115 VanDerWaalsContact NE2-O 3.1Å; I98-A115 HydrophobicContact CD1-CB 4.44Å; R111-A115 PolarHBondContact O-N 2.9Å; A115-A118 PolarHBondContact O-N 3.05Å; A115-L119 PolarHBondContact O-N 3.03Å
116	Q	62.6	Low	60.2	Low	118 Å²	118	60.2 Å²	60.2	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-66	-38.3	174.4	-77.9	174.8	-2	0	0	111.7	H95 N112 S113 L114 L119 K120	H95-Q116 PolarHBondContact CE1-N 3.24Å; H95-Q116 VanDerWaalsContact CE1-N 3.32Å; N112-Q116 WeakPolarHBondContact O-CB 3.4Å; N112-Q116 WeakPolarHBondContact O-CG 3.31Å; N112-Q116 PolarHBondContact O-N 2.69Å; S113-Q116 PolarHBondContact O-N 3.47Å; L114-Q116 PolarHBondContact O-N 3.18Å; Q116-L119 PolarHBondContact O-N 2.99Å; Q116-K120 VanDerWaalsContact O-CB 3.24Å; Q116-K120 WeakPolarHBondContact O-CB 3.42Å; Q116-K120 PolarHBondContact O-N 2.82Å
117	N	64.1	Low	62.3	Low	85 Å²	85	53.5 Å²	53.5	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-64.4	-44	174.1	-73	-15.1	0	0	0	110.9	S113 L114 L119 K120 M121	S113-N117 WeakPolarHBondContact O-CB 3.48Å; S113-N117 PolarHBondContact O-N 2.92Å; S113-N117 PolarHBondContact O-ND2 3.37Å; S113-N117 PolarHBondContact O-OD1 2.71Å; L114-N117 WeakPolarHBondContact O-CB 3.35Å; L114-N117 PolarHBondContact O-N 3.36Å; L114-N117 VanDerWaalsContact O-N 3.11Å; N117-L119 PolarHBondContact O-N 2.53Å; N117-K120 PolarHBondContact O-N 3.42Å; N117-M121 WeakPolarHBondContact O-CB 3.45Å; N117-M121 PolarHBondContact O-N 2.78Å
118	A	63	Low	64.4	Low	15 Å²	15	56.6 Å²	56.6	12%	0.124	29%	0.286	C	S	.	.	H	α-helix	trans	-61.9	-43.6	176	0	0	0	0	0	111.9	F57 L114 A115 M121 F122	F57-A118 HydrophobicContact CE1-CB 4.33Å; L114-A118 PolarHBondContact O-N 3.32Å; A115-A118 PolarHBondContact O-N 3.05Å; A118-M121 PolarHBondContact O-N 3.34Å; A118-F122 WeakPolarHBondContact O-CB 3.45Å; A118-F122 PolarHBondContact O-N 3.16Å
119	L	67.2	Low	66	Low	22 Å²	22	57.5 Å²	57.5	12%	0.115	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-42.8	173.4	-82	-172.6	0	0	0	112.5	L92 H95 A115 Q116 N117 M121 F122 F123	L92-L119 HydrophobicContact CD2-CD2 3.96Å; H95-L119 WeakPolarHBondContact CD2-CD1 3.36Å; H95-L119 WeakPolarHBondContact NE2-CD1 3.42Å; H95-L119 WeakPolarHBondContact NE2-CG 3.32Å; A115-L119 PolarHBondContact O-N 3.03Å; Q116-L119 PolarHBondContact O-N 2.99Å; N117-L119 PolarHBondContact O-N 2.53Å; L119-M121 VanDerWaalsContact C-N 3.32Å; L119-M121 PolarHBondContact O-N 2.86Å; L119-F122 PolarHBondContact O-N 3.14Å; L119-F123 HydrophobicContact CB-CD2 4.45Å; L119-F123 HydrophobicContact CB-CE2 4.4Å; L119-F123 HydrophobicContact CD2-CE2 4.44Å; L119-F123 WeakPolarHBondContact O-CD2 3.31Å; L119-F123 PolarHBondContact O-N 2.84Å
120	K	71.4	Confident	67.7	Low	143 Å²	143	51 Å²	51	62%	0.622	25%	0.251	S	S	*	.	H	α-helix	trans	-61.7	-42.9	178	-175	-178	178.7	-174.2	0	110.8	Q116 N117 S124	Q116-K120 VanDerWaalsContact O-CB 3.24Å; Q116-K120 WeakPolarHBondContact O-CB 3.42Å; Q116-K120 PolarHBondContact O-N 2.82Å; N117-K120 PolarHBondContact O-N 3.42Å; K120-S124 VanDerWaalsContact O-CB 3.24Å; K120-S124 WeakPolarHBondContact O-CB 3.28Å; K120-S124 PolarHBondContact O-N 3.12Å
121	M	69.6	Low	69.6	Low	37 Å²	37	46.5 Å²	46.5	18%	0.182	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-44.8	175.6	-170	173.7	70.9	0	0	111.2	E54 F57 N117 A118 L119 S124 Q125	E54-M121 HydrophobicContact CB-SD 4.25Å; E54-M121 HydrophobicContact CG-SD 4.38Å; E54-M121 WeakPolarHBondContact O-CE 3.44Å; F57-M121 HydrophobicContact CB-CE 4.18Å; F57-M121 HydrophobicContact CD1-CE 3.59Å; F57-M121 HydrophobicContact CG-CE 4.39Å; N117-M121 WeakPolarHBondContact O-CB 3.45Å; N117-M121 PolarHBondContact O-N 2.78Å; A118-M121 PolarHBondContact O-N 3.34Å; L119-M121 VanDerWaalsContact C-N 3.32Å; L119-M121 PolarHBondContact O-N 2.86Å; M121-S124 PolarHBondContact O-N 3.45Å; M121-Q125 WeakPolarHBondContact O-CG 3.16Å; M121-Q125 PolarHBondContact O-N 3.26Å
122	F	72.7	Confident	71.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.8	-53.7	174.9	167.9	-108.1	0	0	0	112.1	I61 F88 A118 L119 S124 Q125 F126 F155	I61-F122 HydrophobicContact CD1-CB 3.9Å; I61-F122 HydrophobicContact CD1-CD2 4.04Å; I61-F122 HydrophobicContact CD1-CG 4.48Å; I61-F122 HydrophobicContact CG1-CD2 4.08Å; I61-F122 HydrophobicContact CG2-CD2 3.99Å; I61-F122 HydrophobicContact CG2-CE2 4.47Å; F88-F122 HydrophobicContact CB-CE2 4.46Å; F88-F122 HydrophobicContact CB-CZ 3.98Å; F88-F122 AromaticContact CD1-CD2 4Å; F88-F122 HydrophobicContact CD1-CD2 4Å; F88-F122 AromaticContact CD1-CE2 3.15Å; F88-F122 HydrophobicContact CD1-CE2 3.15Å; F88-F122 AromaticContact CD1-CZ 3.55Å; F88-F122 HydrophobicContact CD1-CZ 3.55Å; F88-F122 HydrophobicContact CD2-CE2 4.32Å; F88-F122 HydrophobicContact CD2-CZ 4.21Å; F88-F122 HydrophobicContact CE1-CD2 4.03Å; F88-F122 AromaticContact CE1-CE2 3.26Å; F88-F122 HydrophobicContact CE1-CE2 3.26Å; F88-F122 HydrophobicContact CE1-CZ 4.06Å; F88-F122 HydrophobicContact CE2-CE2 4.36Å; F88-F122 AromaticContact CG-CE2 3.76Å; F88-F122 HydrophobicContact CG-CE2 3.76Å; F88-F122 AromaticContact CG-CZ 3.67Å; F88-F122 HydrophobicContact CG-CZ 3.67Å; F88-F122 AromaticContact CZ-CE2 3.89Å; F88-F122 HydrophobicContact CZ-CE2 3.89Å; A118-F122 WeakPolarHBondContact O-CB 3.45Å; A118-F122 PolarHBondContact O-N 3.16Å; L119-F122 PolarHBondContact O-N 3.14Å; F122-S124 VanDerWaalsContact C-N 3.34Å; F122-S124 PolarHBondContact O-N 2.79Å; F122-Q125 PolarHBondContact O-N 3.04Å; F122-F126 HydrophobicContact CE2-CB 4.17Å; F122-F126 HydrophobicContact CE2-CD2 4.29Å; F122-F126 HydrophobicContact CZ-CB 4.2Å; F122-F126 HydrophobicContact CZ-CD2 4.03Å; F122-F126 HydrophobicContact CZ-CG 4.23Å; F122-F126 WeakPolarHBondContact O-CB 3.31Å; F122-F126 PolarHBondContact O-N 2.81Å; F122-F155 AromaticContact CE1-CE1 3.71Å; F122-F155 HydrophobicContact CE1-CE1 3.71Å; F122-F155 AromaticContact CE1-CZ 3.71Å; F122-F155 HydrophobicContact CE1-CZ 3.71Å; F122-F155 AromaticContact CZ-CE1 3.69Å; F122-F155 HydrophobicContact CZ-CE1 3.69Å; F122-F155 AromaticContact CZ-CZ 3.76Å; F122-F155 HydrophobicContact CZ-CZ 3.76Å
123	F	76.7	Confident	72.9	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-43.7	179.5	-75.3	-57.3	0	0	0	111.5	L92 L119 Q125 F126 F127 V159 V168 I169	L92-F123 HydrophobicContact CD2-CE1 4.38Å; L92-F123 HydrophobicContact CD2-CE2 4.26Å; L92-F123 HydrophobicContact CD2-CZ 3.6Å; L119-F123 HydrophobicContact CB-CD2 4.45Å; L119-F123 HydrophobicContact CB-CE2 4.4Å; L119-F123 HydrophobicContact CD2-CE2 4.44Å; L119-F123 WeakPolarHBondContact O-CD2 3.31Å; L119-F123 PolarHBondContact O-N 2.84Å; F123-Q125 VanDerWaalsContact C-N 3.34Å; F123-Q125 PolarHBondContact O-N 3.02Å; F123-F126 PolarHBondContact O-N 2.7Å; F123-F127 HydrophobicContact CB-CD2 4.27Å; F123-F127 HydrophobicContact CD1-CD2 4.32Å; F123-F127 AromaticContact CD1-CE2 3.86Å; F123-F127 HydrophobicContact CD1-CE2 3.86Å; F123-F127 WeakPolarHBondContact O-CB 3.38Å; F123-F127 VanDerWaalsContact O-CD2 3.24Å; F123-F127 WeakPolarHBondContact O-CD2 3.36Å; F123-F127 PolarHBondContact O-N 2.81Å; F123-V159 HydrophobicContact CZ-CG1 4.39Å; F123-V168 HydrophobicContact CD2-CG1 3.89Å; F123-V168 HydrophobicContact CE2-CG1 4.35Å; F123-V168 HydrophobicContact CG-CG1 4.41Å; F123-I169 HydrophobicContact CD1-CG1 4.37Å; F123-I169 HydrophobicContact CE1-CD1 3.9Å; F123-I169 HydrophobicContact CE1-CG1 3.78Å; F123-I169 HydrophobicContact CZ-CD1 4.05Å; F123-I169 HydrophobicContact CZ-CG1 4.02Å
124	S	78.1	Confident	74.4	Confident	64 Å²	64	40.6 Å²	40.6	45%	0.448	21%	0.205	S	C	.	.	H	α-helix	trans	-54.4	-49.6	176.2	-173.6	0	0	0	0	111.7	K120 M121 F122 F128	K120-S124 VanDerWaalsContact O-CB 3.24Å; K120-S124 WeakPolarHBondContact O-CB 3.28Å; K120-S124 PolarHBondContact O-N 3.12Å; M121-S124 PolarHBondContact O-N 3.45Å; F122-S124 VanDerWaalsContact C-N 3.34Å; F122-S124 PolarHBondContact O-N 2.79Å; S124-F128 WeakPolarHBondContact O-CB 3.29Å; S124-F128 PolarHBondContact O-N 2.92Å
125	Q	76.4	Confident	76	Confident	41 Å²	41	42.2 Å²	42.2	19%	0.192	21%	0.214	C	C	.	.	H	α-helix	trans	-70.5	-40.8	179.7	-69.4	-175.6	7.5	0	0	113.3	S58 I61 L65 M121 F122 F123 F128 K129	S58-Q125 PolarHBondContact O-OE1 2.9Å; S58-Q125 PolarHBondContact OG-NE2 3.3Å; I61-Q125 HydrophobicContact CG2-CB 4.02Å; L65-Q125 HydrophobicContact CD1-CB 4.44Å; M121-Q125 WeakPolarHBondContact O-CG 3.16Å; M121-Q125 PolarHBondContact O-N 3.26Å; F122-Q125 PolarHBondContact O-N 3.04Å; F123-Q125 VanDerWaalsContact C-N 3.34Å; F123-Q125 PolarHBondContact O-N 3.02Å; Q125-F128 PolarHBondContact O-N 3.05Å; Q125-K129 WeakPolarHBondContact O-CB 3.46Å; Q125-K129 PolarHBondContact O-N 3.15Å
126	F	79.7	Confident	77.2	Confident	1 Å²	1	45 Å²	45	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-57.7	-52.3	176.9	177.5	-96.5	0	0	0	111	L65 F122 F123 K129 I130 C152 F155 I156	L65-F126 HydrophobicContact CD1-CB 4.44Å; L65-F126 HydrophobicContact CD2-CB 4.49Å; L65-F126 HydrophobicContact CD2-CD2 3.45Å; L65-F126 VanDerWaalsContact CD2-CD2 3.45Å; L65-F126 HydrophobicContact CD2-CE2 4.11Å; L65-F126 HydrophobicContact CD2-CG 4.4Å; F122-F126 HydrophobicContact CE2-CB 4.17Å; F122-F126 HydrophobicContact CE2-CD2 4.29Å; F122-F126 HydrophobicContact CZ-CB 4.2Å; F122-F126 HydrophobicContact CZ-CD2 4.03Å; F122-F126 HydrophobicContact CZ-CG 4.23Å; F122-F126 WeakPolarHBondContact O-CB 3.31Å; F122-F126 PolarHBondContact O-N 2.81Å; F123-F126 PolarHBondContact O-N 2.7Å; F126-K129 PolarHBondContact O-N 2.89Å; F126-I130 HydrophobicContact CD1-CD1 3.71Å; F126-I130 HydrophobicContact CE1-CD1 3.26Å; F126-I130 HydrophobicContact CE1-CG1 4.5Å; F126-I130 HydrophobicContact CE2-CD1 4.34Å; F126-I130 HydrophobicContact CG-CD1 4.42Å; F126-I130 HydrophobicContact CZ-CD1 3.61Å; F126-I130 WeakPolarHBondContact O-CG1 3.24Å; F126-I130 PolarHBondContact O-N 2.91Å; F126-C152 HydrophobicContact CE2-CB 4.25Å; F126-C152 HydrophobicContact CZ-CB 3.74Å; F126-F155 HydrophobicContact CE1-CD1 4.21Å; F126-F155 AromaticContact CE2-CD1 3.93Å; F126-F155 HydrophobicContact CE2-CD1 3.93Å; F126-F155 HydrophobicContact CE2-CE1 4.4Å; F126-F155 AromaticContact CZ-CD1 3.67Å; F126-F155 HydrophobicContact CZ-CD1 3.67Å; F126-F155 HydrophobicContact CZ-CE1 4.33Å; F126-I156 HydrophobicContact CE1-CD1 3.87Å; F126-I156 HydrophobicContact CE1-CG1 3.65Å; F126-I156 HydrophobicContact CZ-CD1 4.3Å; F126-I156 HydrophobicContact CZ-CG1 4.03Å
127	F	84.4	Confident	78.1	Confident	6 Å²	6	39.3 Å²	39.3	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-72.5	-33.7	-179.8	-77.6	-77.2	0	0	0	112.7	F123 I130 G131 I156 I169 H172 L173 L176	F123-F127 HydrophobicContact CB-CD2 4.27Å; F123-F127 HydrophobicContact CD1-CD2 4.32Å; F123-F127 AromaticContact CD1-CE2 3.86Å; F123-F127 HydrophobicContact CD1-CE2 3.86Å; F123-F127 WeakPolarHBondContact O-CB 3.38Å; F123-F127 VanDerWaalsContact O-CD2 3.24Å; F123-F127 WeakPolarHBondContact O-CD2 3.36Å; F123-F127 PolarHBondContact O-N 2.81Å; F127-I130 HydrophobicContact CD1-CD1 4.37Å; F127-I130 PolarHBondContact O-N 3.29Å; F127-G131 PolarHBondContact O-N 3.17Å; F127-I156 HydrophobicContact CE1-CD1 4.06Å; F127-I156 HydrophobicContact CZ-CD1 4.29Å; F127-I156 HydrophobicContact CZ-CG1 4.25Å; F127-I169 HydrophobicContact CZ-CG2 4.25Å; F127-H172 HydrophobicContact CB-CB 4.04Å; F127-H172 HydrophobicContact CD1-CB 3.86Å; F127-H172 HydrophobicContact CD2-CB 3.31Å; F127-H172 AromaticContact CD2-CD2 3.98Å; F127-H172 AromaticContact CD2-CG 3.65Å; F127-H172 HydrophobicContact CE1-CB 4.13Å; F127-H172 HydrophobicContact CE2-CB 3.61Å; F127-H172 HydrophobicContact CG-CB 3.47Å; F127-H172 VanDerWaalsContact CG-CB 3.47Å; F127-H172 HydrophobicContact CZ-CB 4.02Å; F127-L173 HydrophobicContact CE1-CD2 3.75Å; F127-L173 HydrophobicContact CE1-CG 3.87Å; F127-L173 HydrophobicContact CZ-CD2 4.43Å; F127-L173 HydrophobicContact CZ-CG 4.18Å; F127-L176 HydrophobicContact CD1-CD1 3.64Å; F127-L176 HydrophobicContact CD1-CG 4.44Å; F127-L176 HydrophobicContact CE1-CD1 4.31Å
128	F	84.7	Confident	78.9	Confident	150 Å²	150	36.8 Å²	36.8	66%	0.658	19%	0.19	S	C	*	.	H	α-helix	trans	-58.9	-47.1	170.6	176.3	-100.6	0	0	0	111.3	S124 Q125 G131 C132	S124-F128 WeakPolarHBondContact O-CB 3.29Å; S124-F128 PolarHBondContact O-N 2.92Å; Q125-F128 PolarHBondContact O-N 3.05Å; F128-G131 CarbonylContact O-C 3.6Å; F128-G131 WeakPolarHBondContact O-CA 3.45Å; F128-G131 PolarHBondContact O-N 3.33Å; F128-G131 VanDerWaalsContact O-N 3.09Å; F128-C132 PolarHBondContact O-N 3.28Å; F128-C132 PolarHBondContact O-SG 3.45Å; F128-C132 VanDerWaalsContact O-SG 3.38Å
129	K	79.5	Confident	79.8	Confident	63 Å²	63	44.1 Å²	44.1	27%	0.274	22%	0.222	S	C	.	.	H	α-helix	trans	-65.7	-42.3	-179.9	-172	71.1	-170.1	-167.4	0	112.4	L65 D66 Q125 F126 G131 C132 I133	L65-K129 HydrophobicContact CB-CG 4.38Å; L65-K129 HydrophobicContact CD1-CB 4.3Å; D66-K129 WeakPolarHBondContact OD1-CE 3.49Å; D66-K129 IonicContact OD1-NZ 2.92Å; D66-K129 PolarHBondContact OD1-NZ 3.15Å; Q125-K129 WeakPolarHBondContact O-CB 3.46Å; Q125-K129 PolarHBondContact O-N 3.15Å; F126-K129 PolarHBondContact O-N 2.89Å; K129-G131 VanDerWaalsContact C-N 3.26Å; K129-G131 PolarHBondContact O-N 3.32Å; K129-C132 PolarHBondContact O-N 3.01Å; K129-I133 PolarHBondContact O-N 2.95Å; K129-I133 VanDerWaalsContact O-N 3.15Å
130	I	83.3	Confident	80	Confident	3 Å²	3	46 Å²	46	2%	0.015	23%	0.232	C	C	.	.	H	α-helix	trans	-56.5	-48.1	170.3	-66.9	167.8	0	0	0	109.1	M69 F126 F127 C132 I133 L134 V149 C152 I156 L176	M69-I130 HydrophobicContact CE-CB 4.29Å; M69-I130 HydrophobicContact CE-CG1 3.53Å; F126-I130 HydrophobicContact CD1-CD1 3.71Å; F126-I130 HydrophobicContact CE1-CD1 3.26Å; F126-I130 HydrophobicContact CE1-CG1 4.5Å; F126-I130 HydrophobicContact CE2-CD1 4.34Å; F126-I130 HydrophobicContact CG-CD1 4.42Å; F126-I130 HydrophobicContact CZ-CD1 3.61Å; F126-I130 WeakPolarHBondContact O-CG1 3.24Å; F126-I130 PolarHBondContact O-N 2.91Å; F127-I130 HydrophobicContact CD1-CD1 4.37Å; F127-I130 PolarHBondContact O-N 3.29Å; I130-C132 VanDerWaalsContact C-N 3.32Å; I130-C132 PolarHBondContact O-N 3.04Å; I130-I133 PolarHBondContact O-N 3.37Å; I130-I133 VanDerWaalsContact O-N 3.1Å; I130-L134 HydrophobicContact CG2-CD1 3.89Å; I130-L134 HydrophobicContact CG2-CG 4.06Å; I130-L134 VanDerWaalsContact O-CG 3.31Å; I130-L134 WeakPolarHBondContact O-CG 3.25Å; I130-L134 PolarHBondContact O-N 3.33Å; I130-V149 HydrophobicContact CG2-CG1 3.88Å; I130-V149 HydrophobicContact CG2-CG2 4.23Å; I130-C152 HydrophobicContact CD1-CB 3.9Å; I130-C152 HydrophobicContact CG1-CB 4.27Å; I130-I156 HydrophobicContact CD1-CD1 4.14Å; I130-L176 HydrophobicContact CB-CD1 4.05Å; I130-L176 HydrophobicContact CG2-CD1 3.55Å
131	G	86.2	Confident	79.5	Confident	4 Å²	4	43.2 Å²	43.2	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-52.1	-46.2	177.3	0	0	0	0	0	113.2	F127 F128 K129 L134 D135 K179	F127-G131 PolarHBondContact O-N 3.17Å; F128-G131 CarbonylContact O-C 3.6Å; F128-G131 WeakPolarHBondContact O-CA 3.45Å; F128-G131 PolarHBondContact O-N 3.33Å; F128-G131 VanDerWaalsContact O-N 3.09Å; K129-G131 VanDerWaalsContact C-N 3.26Å; K129-G131 PolarHBondContact O-N 3.32Å; G131-L134 PolarHBondContact O-N 2.92Å; G131-D135 VanDerWaalsContact O-CG 3.26Å; G131-D135 PolarHBondContact O-N 2.89Å; G131-K179 PolarHBondContact O-NZ 2.94Å
132	C	84.5	Confident	79.3	Confident	43 Å²	43	47.1 Å²	47.1	29%	0.291	25%	0.248	S	C	.	.	H	α-helix	trans	-62.2	-42.8	176.8	-64.1	0	0	0	0	112.8	F128 K129 I130 L134 D135 T136	F128-C132 PolarHBondContact O-N 3.28Å; F128-C132 PolarHBondContact O-SG 3.45Å; F128-C132 VanDerWaalsContact O-SG 3.38Å; K129-C132 PolarHBondContact O-N 3.01Å; I130-C132 VanDerWaalsContact C-N 3.32Å; I130-C132 PolarHBondContact O-N 3.04Å; C132-L134 VanDerWaalsContact C-N 3.33Å; C132-D135 WeakPolarHBondContact O-CB 3.49Å; C132-D135 PolarHBondContact O-N 3.01Å; C132-T136 PolarHBondContact O-N 3.43Å; C132-T136 VanDerWaalsContact O-N 3.07Å; C132-T136 PolarHBondContact O-OG1 3.39Å
133	I	81.3	Confident	79	Confident	21 Å²	21	47.1 Å²	47.1	11%	0.108	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-39.9	178.2	-73.5	171.5	0	0	0	111	M69 K129 I130 D135 T136 A137 E145 S148 V149	M69-I133 HydrophobicContact CB-CD1 3.61Å; M69-I133 HydrophobicContact CE-CD1 3.43Å; M69-I133 VanDerWaalsContact CE-CD1 3.43Å; M69-I133 HydrophobicContact CG-CD1 3.53Å; M69-I133 HydrophobicContact SD-CD1 3.61Å; K129-I133 PolarHBondContact O-N 2.95Å; K129-I133 VanDerWaalsContact O-N 3.15Å; I130-I133 PolarHBondContact O-N 3.37Å; I130-I133 VanDerWaalsContact O-N 3.1Å; I133-D135 VanDerWaalsContact C-N 3.28Å; I133-D135 PolarHBondContact O-N 3.13Å; I133-T136 PolarHBondContact O-N 2.85Å; I133-A137 WeakPolarHBondContact O-CB 3.36Å; I133-A137 PolarHBondContact O-N 3.49Å; I133-E145 WeakPolarHBondContact CG2-O 3.27Å; I133-S148 WeakPolarHBondContact CG2-OG 3.48Å; I133-V149 HydrophobicContact CB-CG2 4.46Å; I133-V149 HydrophobicContact CG2-CG2 3.79Å
134	L	86.1	Confident	78.5	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65	-34.2	175.1	-62.3	-179.2	0	0	0	111.7	I130 G131 C132 L138 V149 L176 K179 L180 I183	I130-L134 HydrophobicContact CG2-CD1 3.89Å; I130-L134 HydrophobicContact CG2-CG 4.06Å; I130-L134 VanDerWaalsContact O-CG 3.31Å; I130-L134 WeakPolarHBondContact O-CG 3.25Å; I130-L134 PolarHBondContact O-N 3.33Å; G131-L134 PolarHBondContact O-N 2.92Å; C132-L134 VanDerWaalsContact C-N 3.33Å; L134-L138 WeakPolarHBondContact O-CB 3.44Å; L134-L138 VanDerWaalsContact O-CG 3.27Å; L134-L138 WeakPolarHBondContact O-CG 3.23Å; L134-L138 PolarHBondContact O-N 3.26Å; L134-V149 HydrophobicContact CD2-CG2 3.87Å; L134-L176 HydrophobicContact CD1-CB 4.35Å; L134-L176 HydrophobicContact CD1-CD1 4.37Å; L134-L176 HydrophobicContact CD1-CD2 4.34Å; L134-K179 HydrophobicContact CB-CB 4.17Å; L134-K179 HydrophobicContact CB-CD 4.19Å; L134-K179 HydrophobicContact CD1-CB 4.1Å; L134-L180 HydrophobicContact CD1-CD2 3.59Å; L134-L180 HydrophobicContact CD1-CG 3.96Å; L134-L180 HydrophobicContact CD2-CD2 3.65Å; L134-L180 HydrophobicContact CG-CD2 4.29Å; L134-I183 HydrophobicContact CB-CD1 3.91Å; L134-I183 HydrophobicContact CD2-CD1 3.51Å; L134-I183 HydrophobicContact CG-CD1 4.23Å
135	D	86.8	Confident	78	Confident	65 Å²	65	50.2 Å²	50.2	35%	0.348	26%	0.263	S	S	.	.	H	α-helix	trans	-65.2	-45.7	175	-68.9	-31.6	0	0	0	111.3	G131 C132 I133 L138 E139 K179	G131-D135 VanDerWaalsContact O-CG 3.26Å; G131-D135 PolarHBondContact O-N 2.89Å; C132-D135 WeakPolarHBondContact O-CB 3.49Å; C132-D135 PolarHBondContact O-N 3.01Å; I133-D135 VanDerWaalsContact C-N 3.28Å; I133-D135 PolarHBondContact O-N 3.13Å; D135-L138 WeakPolarHBondContact O-CB 3.38Å; D135-L138 PolarHBondContact O-N 3.49Å; D135-E139 PolarHBondContact O-N 3.09Å; D135-K179 WeakPolarHBondContact OD1-CD 3.2Å; D135-K179 WeakPolarHBondContact OD1-CE 3.18Å; D135-K179 IonicContact OD1-NZ 3.76Å; D135-K179 PolarHBondContact OD1-NZ 2.96Å; D135-K179 IonicContact OD2-NZ 2.73Å; D135-K179 PolarHBondContact OD2-NZ 2.9Å
136	T	82.9	Confident	77.6	Confident	59 Å²	59	48.3 Å²	48.3	36%	0.362	25%	0.254	S	S	.	.	H	α-helix	trans	-66.4	-39.4	176.6	-47.6	0	0	0	0	111.9	C132 I133 L138 E139 D140 E145	C132-T136 PolarHBondContact O-N 3.43Å; C132-T136 VanDerWaalsContact O-N 3.07Å; C132-T136 PolarHBondContact O-OG1 3.39Å; I133-T136 PolarHBondContact O-N 2.85Å; T136-L138 PolarHBondContact O-N 3.28Å; T136-E139 WeakPolarHBondContact O-CB 3.17Å; T136-E139 PolarHBondContact O-N 2.83Å; T136-D140 PolarHBondContact O-N 3.48Å; T136-D140 VanDerWaalsContact O-N 3.15Å; T136-E145 WeakPolarHBondContact CB-OE2 3.46Å; T136-E145 WeakPolarHBondContact CG2-OE2 3.44Å
137	A	82	Confident	77.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-25	174	0	0	0	0	0	113.7	I133 E139 E145 A146 I183	I133-A137 WeakPolarHBondContact O-CB 3.36Å; I133-A137 PolarHBondContact O-N 3.49Å; A137-E139 VanDerWaalsContact C-N 3.34Å; A137-E145 HydrophobicContact CB-CB 4.29Å; A137-A146 HydrophobicContact CB-CB 3.74Å; A137-I183 HydrophobicContact CB-CD1 4.21Å
138	L	81.5	Confident	76.7	Confident	32 Å²	32	49.9 Å²	49.9	17%	0.168	26%	0.263	C	S	.	.	H	α-helix	trans	-75.8	-23.2	172.1	-80.1	169.2	0	0	0	112.4	L134 D135 T136 K179 N182 I183 K186	L134-L138 WeakPolarHBondContact O-CB 3.44Å; L134-L138 VanDerWaalsContact O-CG 3.27Å; L134-L138 WeakPolarHBondContact O-CG 3.23Å; L134-L138 PolarHBondContact O-N 3.26Å; D135-L138 WeakPolarHBondContact O-CB 3.38Å; D135-L138 PolarHBondContact O-N 3.49Å; T136-L138 PolarHBondContact O-N 3.28Å; L138-K179 HydrophobicContact CD1-CB 4.21Å; L138-K179 HydrophobicContact CD1-CG 4.34Å; L138-N182 HydrophobicContact CD2-CB 3.72Å; L138-I183 HydrophobicContact CD2-CG1 3.58Å; L138-I183 HydrophobicContact CG-CD1 4.2Å; L138-I183 HydrophobicContact CG-CG1 3.71Å; L138-K186 HydrophobicContact CD2-CD 4.36Å; L138-K186 PolarHBondContact O-NZ 2.82Å
139	E	80.7	Confident	76.4	Confident	169 Å²	169	42.9 Å²	42.9	79%	0.79	23%	0.233	S	C	*	.	H	α-helix	trans	-81.4	-29.7	175.2	-67	179.1	173	0	0	111.8	D135 T136 A137	D135-E139 PolarHBondContact O-N 3.09Å; T136-E139 WeakPolarHBondContact O-CB 3.17Å; T136-E139 PolarHBondContact O-N 2.83Å; A137-E139 VanDerWaalsContact C-N 3.34Å
140	D	71.4	Confident	76.3	Confident	60 Å²	60	40.5 Å²	40.5	32%	0.321	22%	0.224	S	C	.	.	S	Bend	trans	-83.1	147	177.2	-169.6	12.6	0	0	0	113	T136 E142	T136-D140 PolarHBondContact O-N 3.48Å; T136-D140 VanDerWaalsContact O-N 3.15Å; D140-E142 PolarHBondContact OD1-N 2.96Å
141	S	60.5	Low	75.8	Confident	85 Å²	85	42.8 Å²	42.8	59%	0.594	24%	0.235	S	C	*	.	S	Bend	trans	-79.3	-33.3	177.4	51.8	0	0	0	0	113.2
142	E	65.9	Low	75.3	Confident	119 Å²	119	42.6 Å²	42.6	56%	0.556	23%	0.233	S	C	*	.	S	Bend	trans	-88.1	-7.7	-174.9	-65.9	-174.4	-179.7	0	0	112.8	D140 A144	D140-E142 PolarHBondContact OD1-N 2.96Å; E142-A144 PolarHBondContact O-N 3.14Å
143	T	66.5	Low	75.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.22	C	C	.	.			trans	54.8	17.1	-179.1	63.6	0	0	0	0	114.4	E145 A146 I183 L187	T143-E145 PolarHBondContact O-N 3.28Å; T143-E145 VanDerWaalsContact O-N 3.16Å; T143-A146 VanDerWaalsContact O-CB 3.28Å; T143-A146 WeakPolarHBondContact O-CB 3.43Å; T143-A146 PolarHBondContact O-N 2.89Å; T143-I183 HydrophobicContact CG2-CG2 3.97Å; T143-L187 HydrophobicContact CG2-CB 4.49Å
144	A	65.3	Low	75.1	Confident	44 Å²	44	42.6 Å²	42.6	36%	0.364	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-59.7	-33.6	-170.9	0	0	0	0	0	112.8	E142 A146 F147	E142-A144 PolarHBondContact O-N 3.14Å; A144-A146 VanDerWaalsContact C-N 3.25Å; A144-A146 PolarHBondContact O-N 3.43Å; A144-F147 HydrophobicContact CB-CD2 4.44Å; A144-F147 HydrophobicContact CB-CE2 4.3Å; A144-F147 WeakPolarHBondContact O-CB 3.34Å; A144-F147 VanDerWaalsContact O-CD2 3.32Å; A144-F147 WeakPolarHBondContact O-CD2 3.34Å; A144-F147 WeakPolarHBondContact O-CG 3.44Å; A144-F147 PolarHBondContact O-N 2.94Å; A144-F147 VanDerWaalsContact O-N 3.17Å
145	E	67.9	Low	74.7	Confident	90 Å²	90	42.8 Å²	42.8	42%	0.421	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-65	-28.4	177.4	-64.3	-164	173.7	0	0	113.3	I133 T136 A137 T143 F147 S148	I133-E145 WeakPolarHBondContact CG2-O 3.27Å; T136-E145 WeakPolarHBondContact CB-OE2 3.46Å; T136-E145 WeakPolarHBondContact CG2-OE2 3.44Å; A137-E145 HydrophobicContact CB-CB 4.29Å; T143-E145 PolarHBondContact O-N 3.28Å; T143-E145 VanDerWaalsContact O-N 3.16Å; E145-F147 PolarHBondContact O-N 2.98Å; E145-S148 PolarHBondContact O-N 2.86Å; E145-S148 PolarHBondContact O-OG 3.33Å
146	A	67.7	Low	74.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-64.9	-19.9	177.1	0	0	0	0	0	112.3	A137 T143 A144 S148 V149 I183 F206	A137-A146 HydrophobicContact CB-CB 3.74Å; T143-A146 VanDerWaalsContact O-CB 3.28Å; T143-A146 WeakPolarHBondContact O-CB 3.43Å; T143-A146 PolarHBondContact O-N 2.89Å; A144-A146 VanDerWaalsContact C-N 3.25Å; A144-A146 PolarHBondContact O-N 3.43Å; A146-S148 PolarHBondContact O-N 3.12Å; A146-V149 VanDerWaalsContact O-CB 3.23Å; A146-V149 WeakPolarHBondContact O-CB 3.35Å; A146-V149 PolarHBondContact O-N 2.92Å; A146-I183 HydrophobicContact CB-CD1 4.47Å; A146-I183 HydrophobicContact CB-CG2 4.22Å; A146-F206 HydrophobicContact CB-CD2 4.4Å; A146-F206 HydrophobicContact CB-CE2 3.61Å; A146-F206 HydrophobicContact CB-CZ 3.73Å; A146-F206 WeakPolarHBondContact O-CE2 3.49Å
147	F	74.6	Confident	74.7	Confident	26 Å²	26	37.2 Å²	37.2	11%	0.114	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-66.2	-25.6	179.7	-56.9	-23.6	0	0	0	113	A144 E145 V149 C150 D202 Q203 F206	A144-F147 HydrophobicContact CB-CD2 4.44Å; A144-F147 HydrophobicContact CB-CE2 4.3Å; A144-F147 WeakPolarHBondContact O-CB 3.34Å; A144-F147 VanDerWaalsContact O-CD2 3.32Å; A144-F147 WeakPolarHBondContact O-CD2 3.34Å; A144-F147 WeakPolarHBondContact O-CG 3.44Å; A144-F147 PolarHBondContact O-N 2.94Å; A144-F147 VanDerWaalsContact O-N 3.17Å; E145-F147 PolarHBondContact O-N 2.98Å; F147-V149 PolarHBondContact O-N 3.4Å; F147-C150 VanDerWaalsContact O-CB 3.28Å; F147-C150 WeakPolarHBondContact O-CB 3.43Å; F147-C150 PolarHBondContact O-N 3.49Å; F147-C150 VanDerWaalsContact O-N 3.12Å; F147-C150 PolarHBondContact O-SG 2.89Å; F147-D202 HydrophobicContact CD2-CB 4.04Å; F147-D202 HydrophobicContact CE2-CB 3.69Å; F147-D202 HydrophobicContact CZ-CB 4.12Å; F147-Q203 HydrophobicContact CZ-CG 4.11Å; F147-F206 HydrophobicContact CD1-CB 3.61Å; F147-F206 AromaticContact CD1-CD2 3.78Å; F147-F206 HydrophobicContact CD1-CD2 3.78Å; F147-F206 AromaticContact CD1-CG 3.76Å; F147-F206 HydrophobicContact CD1-CG 3.76Å; F147-F206 HydrophobicContact CE1-CB 3.63Å; F147-F206 HydrophobicContact CE1-CD1 4.4Å; F147-F206 HydrophobicContact CE1-CD2 4.32Å; F147-F206 AromaticContact CE1-CG 3.87Å; F147-F206 HydrophobicContact CE1-CG 3.87Å
148	S	72.4	Confident	74.5	Confident	14 Å²	14	38.9 Å²	38.9	10%	0.098	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-61.4	-27	171.9	63.7	0	0	0	0	112.5	M69 I133 E145 A146 C150	M69-S148 WeakPolarHBondContact O-CB 3.47Å; I133-S148 WeakPolarHBondContact CG2-OG 3.48Å; E145-S148 PolarHBondContact O-N 2.86Å; E145-S148 PolarHBondContact O-OG 3.33Å; A146-S148 PolarHBondContact O-N 3.12Å; S148-C150 VanDerWaalsContact C-N 3.25Å; S148-C150 PolarHBondContact O-N 3.43Å
149	V	77.2	Confident	74.3	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.024	20%	0.2	C	C	.	.	H	α-helix	trans	-69.8	-21.3	177.9	-176.1	0	0	0	0	111.9	M69 I130 I133 L134 A146 F147 I151 C152 I153	M69-V149 HydrophobicContact CE-CG2 4.41Å; I130-V149 HydrophobicContact CG2-CG1 3.88Å; I130-V149 HydrophobicContact CG2-CG2 4.23Å; I133-V149 HydrophobicContact CB-CG2 4.46Å; I133-V149 HydrophobicContact CG2-CG2 3.79Å; L134-V149 HydrophobicContact CD2-CG2 3.87Å; A146-V149 VanDerWaalsContact O-CB 3.23Å; A146-V149 WeakPolarHBondContact O-CB 3.35Å; A146-V149 PolarHBondContact O-N 2.92Å; F147-V149 PolarHBondContact O-N 3.4Å; V149-I151 PolarHBondContact O-N 3.09Å; V149-C152 HydrophobicContact CG1-CB 4.48Å; V149-C152 WeakPolarHBondContact O-CA 3.45Å; V149-C152 VanDerWaalsContact O-CB 3.3Å; V149-C152 WeakPolarHBondContact O-CB 3.44Å; V149-C152 PolarHBondContact O-N 3.12Å; V149-I153 HydrophobicContact CG1-CG1 4.35Å; V149-I153 WeakPolarHBondContact O-CG1 3.49Å; V149-I153 PolarHBondContact O-N 2.97Å
150	C	78.5	Confident	74.3	Confident	13 Å²	13	30 Å²	30	9%	0.088	17%	0.165	C	C	.	.	H	α-helix	trans	-56.4	-37.1	177.7	-68	0	0	0	0	112.8	F147 S148 I153 E209	F147-C150 VanDerWaalsContact O-CB 3.28Å; F147-C150 WeakPolarHBondContact O-CB 3.43Å; F147-C150 PolarHBondContact O-N 3.49Å; F147-C150 VanDerWaalsContact O-N 3.12Å; F147-C150 PolarHBondContact O-SG 2.89Å; S148-C150 VanDerWaalsContact C-N 3.25Å; S148-C150 PolarHBondContact O-N 3.43Å; C150-I153 WeakPolarHBondContact O-CB 3.26Å; C150-I153 PolarHBondContact O-N 3.43Å; C150-E209 HydrophobicContact CB-CG 4.32Å
151	I	71.8	Confident	74.5	Confident	50 Å²	50	34.9 Å²	34.9	26%	0.256	18%	0.179	S	C	.	.	H	α-helix	trans	-72.1	-35.4	179.1	-44.3	-179.2	0	0	0	110.4	F68 S71 V149 I153 E154	F68-I151 HydrophobicContact CD2-CG2 4.36Å; F68-I151 HydrophobicContact CE1-CB 3.94Å; F68-I151 HydrophobicContact CE1-CG2 3.77Å; F68-I151 HydrophobicContact CE2-CB 4.46Å; F68-I151 HydrophobicContact CE2-CG2 3.49Å; F68-I151 VanDerWaalsContact CE2-CG2 3.49Å; F68-I151 HydrophobicContact CZ-CB 3.87Å; F68-I151 HydrophobicContact CZ-CG2 3.16Å; S71-I151 VanDerWaalsContact OG-CD1 3.31Å; S71-I151 WeakPolarHBondContact OG-CD1 3.32Å; V149-I151 PolarHBondContact O-N 3.09Å; I151-I153 VanDerWaalsContact C-N 3.3Å; I151-I153 PolarHBondContact O-N 2.92Å; I151-E154 PolarHBondContact O-N 3.24Å
152	C	76.6	Confident	75	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64.7	-33.7	172.7	-70.2	0	0	0	0	112.6	F68 M69 F126 I130 V149 E154 F155 I156	F68-C152 HydrophobicContact CE1-CB 4.43Å; F68-C152 VanDerWaalsContact CE1-SG 3.53Å; M69-C152 WeakPolarHBondContact CE-SG 3.3Å; M69-C152 PolarHBondContact SD-SG 3.45Å; F126-C152 HydrophobicContact CE2-CB 4.25Å; F126-C152 HydrophobicContact CZ-CB 3.74Å; I130-C152 HydrophobicContact CD1-CB 3.9Å; I130-C152 HydrophobicContact CG1-CB 4.27Å; V149-C152 HydrophobicContact CG1-CB 4.48Å; V149-C152 WeakPolarHBondContact O-CA 3.45Å; V149-C152 VanDerWaalsContact O-CB 3.3Å; V149-C152 WeakPolarHBondContact O-CB 3.44Å; V149-C152 PolarHBondContact O-N 3.12Å; C152-E154 PolarHBondContact O-N 3.41Å; C152-F155 WeakPolarHBondContact O-CB 3.43Å; C152-F155 PolarHBondContact O-N 3.49Å; C152-I156 VanDerWaalsContact O-CG1 3.3Å; C152-I156 WeakPolarHBondContact O-CG1 3.18Å; C152-I156 PolarHBondContact O-N 2.81Å
153	I	83.7	Confident	74.9	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-43.6	178.4	-69.9	169.5	0	0	0	111.2	V149 C150 I151 F155 I156 L157 E209 I210 L213	V149-I153 HydrophobicContact CG1-CG1 4.35Å; V149-I153 WeakPolarHBondContact O-CG1 3.49Å; V149-I153 PolarHBondContact O-N 2.97Å; C150-I153 WeakPolarHBondContact O-CB 3.26Å; C150-I153 PolarHBondContact O-N 3.43Å; I151-I153 VanDerWaalsContact C-N 3.3Å; I151-I153 PolarHBondContact O-N 2.92Å; I153-F155 VanDerWaalsContact C-N 3.29Å; I153-F155 PolarHBondContact O-N 3.42Å; I153-I156 PolarHBondContact O-N 2.93Å; I153-L157 HydrophobicContact CG2-CD1 3.72Å; I153-L157 HydrophobicContact CG2-CG 4.05Å; I153-L157 WeakPolarHBondContact O-CB 3.24Å; I153-L157 VanDerWaalsContact O-CG 3.24Å; I153-L157 WeakPolarHBondContact O-CG 3.46Å; I153-L157 PolarHBondContact O-N 3.36Å; I153-E209 HydrophobicContact CD1-CB 3.92Å; I153-I210 HydrophobicContact CD1-CD1 3.51Å; I153-I210 HydrophobicContact CD1-CG1 4.21Å; I153-L213 HydrophobicContact CG1-CD2 4.09Å; I153-L213 HydrophobicContact CG2-CB 3.85Å
154	E	78.1	Confident	75	Confident	65 Å²	65	37.6 Å²	37.6	30%	0.304	20%	0.197	S	C	.	.	H	α-helix	trans	-58.9	-43	177.7	-175.6	64.9	-165.1	0	0	111.2	I151 C152 L157 D158 R212	I151-E154 PolarHBondContact O-N 3.24Å; C152-E154 PolarHBondContact O-N 3.41Å; E154-L157 PolarHBondContact O-N 2.9Å; E154-D158 PolarHBondContact O-N 2.88Å; E154-D158 VanDerWaalsContact O-N 3.07Å; E154-R212 IonicContact OE2-CZ 2.89Å; E154-R212 IonicContact OE2-NH1 2.62Å; E154-R212 PolarHBondContact OE2-NH1 3.33Å; E154-R212 IonicContact OE2-NH2 2.81Å; E154-R212 PolarHBondContact OE2-NH2 3.27Å
155	F	76.2	Confident	75.4	Confident	3 Å²	3	36.2 Å²	36.2	1%	0.013	19%	0.185	C	C	.	.	H	α-helix	trans	-60.7	-50.8	175.1	176.9	-102.7	0	0	0	111.6	Y85 F88 L92 F122 F126 C152 I153 L157 D158 V159	Y85-F155 HydrophobicContact CD2-CB 4.44Å; Y85-F155 HydrophobicContact CD2-CD2 4.4Å; Y85-F155 HydrophobicContact CE2-CD2 4.49Å; F88-F155 HydrophobicContact CB-CD2 3.99Å; F88-F155 HydrophobicContact CB-CE1 4.42Å; F88-F155 HydrophobicContact CB-CE2 3.29Å; F88-F155 HydrophobicContact CB-CZ 3.54Å; F88-F155 HydrophobicContact CG-CE2 4.39Å; F88-F155 HydrophobicContact CG-CZ 4.41Å; L92-F155 HydrophobicContact CD1-CE2 3.62Å; L92-F155 HydrophobicContact CD1-CZ 3.51Å; L92-F155 HydrophobicContact CG-CZ 4.19Å; F122-F155 AromaticContact CE1-CE1 3.71Å; F122-F155 HydrophobicContact CE1-CE1 3.71Å; F122-F155 AromaticContact CE1-CZ 3.71Å; F122-F155 HydrophobicContact CE1-CZ 3.71Å; F122-F155 AromaticContact CZ-CE1 3.69Å; F122-F155 HydrophobicContact CZ-CE1 3.69Å; F122-F155 AromaticContact CZ-CZ 3.76Å; F122-F155 HydrophobicContact CZ-CZ 3.76Å; F126-F155 HydrophobicContact CE1-CD1 4.21Å; F126-F155 AromaticContact CE2-CD1 3.93Å; F126-F155 HydrophobicContact CE2-CD1 3.93Å; F126-F155 HydrophobicContact CE2-CE1 4.4Å; F126-F155 AromaticContact CZ-CD1 3.67Å; F126-F155 HydrophobicContact CZ-CD1 3.67Å; F126-F155 HydrophobicContact CZ-CE1 4.33Å; C152-F155 WeakPolarHBondContact O-CB 3.43Å; C152-F155 PolarHBondContact O-N 3.49Å; I153-F155 VanDerWaalsContact C-N 3.29Å; I153-F155 PolarHBondContact O-N 3.42Å; F155-L157 VanDerWaalsContact C-N 3.29Å; F155-L157 PolarHBondContact O-N 3.17Å; F155-D158 PolarHBondContact O-N 2.9Å; F155-V159 HydrophobicContact CD1-CG2 4.31Å; F155-V159 HydrophobicContact CE1-CG2 3.97Å; F155-V159 HydrophobicContact CE2-CG2 4.22Å; F155-V159 HydrophobicContact CZ-CG2 3.92Å; F155-V159 WeakPolarHBondContact O-CG2 3.5Å; F155-V159 PolarHBondContact O-N 3.22Å; F155-V159 VanDerWaalsContact O-N 3.13Å
156	I	84.6	Confident	75.8	Confident	5 Å²	5	32.2 Å²	32.2	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-57.1	-43.6	179	-65.3	163.7	0	0	0	111.1	F126 F127 I130 C152 I153 D158 V159 L160 I169 L173 L213	F126-I156 HydrophobicContact CE1-CD1 3.87Å; F126-I156 HydrophobicContact CE1-CG1 3.65Å; F126-I156 HydrophobicContact CZ-CD1 4.3Å; F126-I156 HydrophobicContact CZ-CG1 4.03Å; F127-I156 HydrophobicContact CE1-CD1 4.06Å; F127-I156 HydrophobicContact CZ-CD1 4.29Å; F127-I156 HydrophobicContact CZ-CG1 4.25Å; I130-I156 HydrophobicContact CD1-CD1 4.14Å; C152-I156 VanDerWaalsContact O-CG1 3.3Å; C152-I156 WeakPolarHBondContact O-CG1 3.18Å; C152-I156 PolarHBondContact O-N 2.81Å; I153-I156 PolarHBondContact O-N 2.93Å; I156-D158 VanDerWaalsContact C-N 3.35Å; I156-D158 PolarHBondContact O-N 3.43Å; I156-V159 PolarHBondContact O-N 2.95Å; I156-L160 HydrophobicContact CG2-CD1 4.12Å; I156-L160 HydrophobicContact CG2-CG 4.4Å; I156-L160 WeakPolarHBondContact O-CG 3.26Å; I156-L160 PolarHBondContact O-N 3.33Å; I156-I169 HydrophobicContact CG2-CG2 3.92Å; I156-L173 HydrophobicContact CD1-CD2 4.38Å; I156-L173 HydrophobicContact CG2-CD1 3.99Å; I156-L173 HydrophobicContact CG2-CD2 4.49Å; I156-L213 HydrophobicContact CB-CD1 4.33Å; I156-L213 HydrophobicContact CG2-CD1 3.62Å
157	L	85.1	Confident	76.3	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-61.2	-42.1	179.2	-76.6	174.9	0	0	0	112.3	I153 E154 F155 V159 L160 R161 R212 L213 S216	I153-L157 HydrophobicContact CG2-CD1 3.72Å; I153-L157 HydrophobicContact CG2-CG 4.05Å; I153-L157 WeakPolarHBondContact O-CB 3.24Å; I153-L157 VanDerWaalsContact O-CG 3.24Å; I153-L157 WeakPolarHBondContact O-CG 3.46Å; I153-L157 PolarHBondContact O-N 3.36Å; E154-L157 PolarHBondContact O-N 2.9Å; F155-L157 VanDerWaalsContact C-N 3.29Å; F155-L157 PolarHBondContact O-N 3.17Å; L157-V159 VanDerWaalsContact C-N 3.34Å; L157-L160 PolarHBondContact O-N 2.77Å; L157-R161 WeakPolarHBondContact O-CG 3.48Å; L157-R161 PolarHBondContact O-N 3.33Å; L157-R212 HydrophobicContact CD1-CG 3.92Å; L157-L213 HydrophobicContact CD2-CD1 4.23Å; L157-L213 HydrophobicContact CG-CD1 4.49Å; L157-S216 WeakPolarHBondContact CD2-OG 3.36Å
158	D	79.4	Confident	76.4	Confident	35 Å²	35	36.1 Å²	36.1	19%	0.187	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-37.2	176.8	-83.6	-21.5	0	0	0	112.6	Y85 E154 F155 I156 R161	Y85-D158 PolarHBondContact OH-OD2 2.69Å; E154-D158 PolarHBondContact O-N 2.88Å; E154-D158 VanDerWaalsContact O-N 3.07Å; F155-D158 PolarHBondContact O-N 2.9Å; I156-D158 VanDerWaalsContact C-N 3.35Å; I156-D158 PolarHBondContact O-N 3.43Å; D158-R161 WeakPolarHBondContact O-CB 3.5Å; D158-R161 PolarHBondContact O-N 2.92Å; D158-R161 IonicContact OD1-CZ 3.35Å; D158-R161 IonicContact OD1-NH1 3.62Å; D158-R161 PolarHBondContact OD1-NH1 3.44Å
159	V	75.8	Confident	76.9	Confident	4 Å²	4	35.5 Å²	35.5	2%	0.024	19%	0.188	C	C	.	.	H	α-helix	trans	-70.8	-37.9	176.3	-161	0	0	0	0	111.9	L92 F123 F155 I156 L157 R161 D162 I169	L92-V159 HydrophobicContact CD1-CB 4.22Å; L92-V159 HydrophobicContact CD1-CG1 3.96Å; L92-V159 HydrophobicContact CD1-CG2 3.33Å; L92-V159 HydrophobicContact CD2-CG1 3.96Å; L92-V159 HydrophobicContact CD2-CG2 4.46Å; F123-V159 HydrophobicContact CZ-CG1 4.39Å; F155-V159 HydrophobicContact CD1-CG2 4.31Å; F155-V159 HydrophobicContact CE1-CG2 3.97Å; F155-V159 HydrophobicContact CE2-CG2 4.22Å; F155-V159 HydrophobicContact CZ-CG2 3.92Å; F155-V159 WeakPolarHBondContact O-CG2 3.5Å; F155-V159 PolarHBondContact O-N 3.22Å; F155-V159 VanDerWaalsContact O-N 3.13Å; I156-V159 PolarHBondContact O-N 2.95Å; L157-V159 VanDerWaalsContact C-N 3.34Å; V159-R161 PolarHBondContact O-N 3.28Å; V159-D162 PolarHBondContact O-N 3.16Å; V159-I169 HydrophobicContact CB-CD1 3.29Å; V159-I169 HydrophobicContact CG1-CD1 3.24Å; V159-I169 HydrophobicContact CG2-CD1 4.05Å
160	L	80.4	Confident	77.2	Confident	11 Å²	11	35.4 Å²	35.4	6%	0.058	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-27.9	174.8	-76.6	174.8	0	0	0	112.3	I156 L157 T166 I169 L170 L173 L213 A220	I156-L160 HydrophobicContact CG2-CD1 4.12Å; I156-L160 HydrophobicContact CG2-CG 4.4Å; I156-L160 WeakPolarHBondContact O-CG 3.26Å; I156-L160 PolarHBondContact O-N 3.33Å; L157-L160 PolarHBondContact O-N 2.77Å; L160-T166 HydrophobicContact CD2-CG2 4.2Å; L160-I169 HydrophobicContact CD2-CB 4.25Å; L160-I169 HydrophobicContact CD2-CG2 3.7Å; L160-I169 HydrophobicContact CG-CG2 4.03Å; L160-L170 HydrophobicContact CD2-CD2 4.11Å; L160-L170 HydrophobicContact CD2-CG 4.32Å; L160-L173 HydrophobicContact CD1-CD1 4.49Å; L160-L213 HydrophobicContact CD1-CD1 4.24Å; L160-A220 HydrophobicContact CD2-CB 4.14Å
161	R	76.8	Confident	77.4	Confident	163 Å²	163	37.6 Å²	37.6	62%	0.615	20%	0.202	S	C	*	.	H	α-helix	trans	-73.4	-26	175.4	-70.1	171.2	-177.9	162.3	-2.2	113.6	L157 D158 V159 N163	L157-R161 WeakPolarHBondContact O-CG 3.48Å; L157-R161 PolarHBondContact O-N 3.33Å; D158-R161 WeakPolarHBondContact O-CB 3.5Å; D158-R161 PolarHBondContact O-N 2.92Å; D158-R161 IonicContact OD1-CZ 3.35Å; D158-R161 IonicContact OD1-NH1 3.62Å; D158-R161 PolarHBondContact OD1-NH1 3.44Å; V159-R161 PolarHBondContact O-N 3.28Å; R161-N163 VanDerWaalsContact C-N 3.29Å; R161-N163 PolarHBondContact O-N 3.22Å
162	D	70.6	Confident	78	Confident	58 Å²	58	36.7 Å²	36.7	31%	0.31	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.7	-174.6	-157.6	3.9	0	0	0	113.4	K96 V159 S164	K96-D162 WeakPolarHBondContact CE-OD2 3.28Å; K96-D162 IonicContact NZ-OD1 3.23Å; K96-D162 PolarHBondContact NZ-OD1 3.01Å; K96-D162 IonicContact NZ-OD2 3.55Å; K96-D162 PolarHBondContact NZ-OD2 2.73Å; V159-D162 PolarHBondContact O-N 3.16Å; D162-S164 PolarHBondContact O-N 3.29Å
163	N	64.5	Low	78.4	Confident	117 Å²	117	36.7 Å²	36.7	63%	0.626	20%	0.197	S	C	*	.	S	Bend	trans	60.3	-26.5	179.4	-66.1	-31.3	0	0	0	116.8	R161 S165 T166	R161-N163 VanDerWaalsContact C-N 3.29Å; R161-N163 PolarHBondContact O-N 3.22Å; N163-S165 VanDerWaalsContact C-N 3.28Å; N163-S165 PolarHBondContact O-N 2.88Å; N163-T166 VanDerWaalsContact CA-OG1 3.29Å; N163-T166 WeakPolarHBondContact CA-OG1 3.33Å; N163-T166 PolarHBondContact O-N 2.9Å; N163-T166 PolarHBondContact O-OG1 3.49Å
164	S	67.6	Low	78.5	Confident	86 Å²	86	37.1 Å²	37.1	60%	0.601	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.5	-172.8	58.6	0	0	0	0	113.7	D162	D162-S164 PolarHBondContact O-N 3.29Å
165	S	73.5	Confident	78.7	Confident	15 Å²	15	40.7 Å²	40.7	11%	0.105	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120	11.4	-175.4	-55.4	0	0	0	0	112.8	N163 V167 V168 I169	N163-S165 VanDerWaalsContact C-N 3.28Å; N163-S165 PolarHBondContact O-N 2.88Å; S165-V167 PolarHBondContact O-N 2.9Å; S165-V168 PolarHBondContact O-N 3.29Å; S165-I169 WeakPolarHBondContact O-CG1 3.32Å; S165-I169 PolarHBondContact O-N 3.48Å
166	T	77.2	Confident	79.3	Confident	6 Å²	6	40.9 Å²	40.9	4%	0.037	22%	0.219	C	C	.	.	H	α-helix	trans	-55.7	-47.5	-174.9	-65	0	0	0	0	112.3	L160 N163 V168 I169 L170 A220 V224	L160-T166 HydrophobicContact CD2-CG2 4.2Å; N163-T166 VanDerWaalsContact CA-OG1 3.29Å; N163-T166 WeakPolarHBondContact CA-OG1 3.33Å; N163-T166 PolarHBondContact O-N 2.9Å; N163-T166 PolarHBondContact O-OG1 3.49Å; T166-V168 PolarHBondContact O-N 3.34Å; T166-I169 PolarHBondContact O-N 2.94Å; T166-L170 HydrophobicContact CG2-CD1 3.7Å; T166-L170 HydrophobicContact CG2-CG 4.19Å; T166-L170 WeakPolarHBondContact O-CB 3.48Å; T166-L170 VanDerWaalsContact O-CG 3.24Å; T166-L170 WeakPolarHBondContact O-CG 3.32Å; T166-L170 PolarHBondContact O-N 2.9Å; T166-A220 HydrophobicContact CG2-CB 3.75Å; T166-V224 HydrophobicContact CG2-CG2 4.25Å
167	V	77.5	Confident	79.6	Confident	42 Å²	42	40.7 Å²	40.7	26%	0.255	22%	0.218	S	C	.	.	H	α-helix	trans	-61.1	-47	-179.1	-179.4	0	0	0	0	111.3	S165 I169 L170 C171 V224	S165-V167 PolarHBondContact O-N 2.9Å; V167-I169 VanDerWaalsContact C-N 3.32Å; V167-I169 PolarHBondContact O-N 2.99Å; V167-L170 PolarHBondContact O-N 3.46Å; V167-C171 PolarHBondContact O-N 2.87Å; V167-C171 PolarHBondContact O-SG 3.31Å; V167-V224 HydrophobicContact CG2-CG1 4.02Å; V167-V224 HydrophobicContact CG2-CG2 4.18Å
168	V	76.9	Confident	79.8	Confident	66 Å²	66	43.8 Å²	43.8	40%	0.4	23%	0.234	S	C	.	.	H	α-helix	trans	-61.5	-42.7	-179.1	177.3	0	0	0	0	110.9	F123 S165 T166 C171 H172	F123-V168 HydrophobicContact CD2-CG1 3.89Å; F123-V168 HydrophobicContact CE2-CG1 4.35Å; F123-V168 HydrophobicContact CG-CG1 4.41Å; S165-V168 PolarHBondContact O-N 3.29Å; T166-V168 PolarHBondContact O-N 3.34Å; V168-C171 PolarHBondContact O-N 2.9Å; V168-H172 PolarHBondContact O-CD2 3.1Å; V168-H172 VanDerWaalsContact O-CD2 3.25Å; V168-H172 PolarHBondContact O-N 3.02Å; V168-H172 VanDerWaalsContact O-N 3.17Å
169	I	82.2	Confident	80.3	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-43	178.2	-72.1	177.8	0	0	0	111.7	F123 F127 I156 V159 L160 S165 T166 V167 C171 H172 L173	F123-I169 HydrophobicContact CD1-CG1 4.37Å; F123-I169 HydrophobicContact CE1-CD1 3.9Å; F123-I169 HydrophobicContact CE1-CG1 3.78Å; F123-I169 HydrophobicContact CZ-CD1 4.05Å; F123-I169 HydrophobicContact CZ-CG1 4.02Å; F127-I169 HydrophobicContact CZ-CG2 4.25Å; I156-I169 HydrophobicContact CG2-CG2 3.92Å; V159-I169 HydrophobicContact CB-CD1 3.29Å; V159-I169 HydrophobicContact CG1-CD1 3.24Å; V159-I169 HydrophobicContact CG2-CD1 4.05Å; L160-I169 HydrophobicContact CD2-CB 4.25Å; L160-I169 HydrophobicContact CD2-CG2 3.7Å; L160-I169 HydrophobicContact CG-CG2 4.03Å; S165-I169 WeakPolarHBondContact O-CG1 3.32Å; S165-I169 PolarHBondContact O-N 3.48Å; T166-I169 PolarHBondContact O-N 2.94Å; V167-I169 VanDerWaalsContact C-N 3.32Å; V167-I169 PolarHBondContact O-N 2.99Å; I169-C171 VanDerWaalsContact C-N 3.28Å; I169-C171 PolarHBondContact O-N 3.31Å; I169-H172 PolarHBondContact O-N 2.87Å; I169-L173 HydrophobicContact CG2-CD1 3.66Å; I169-L173 HydrophobicContact CG2-CG 4.15Å; I169-L173 WeakPolarHBondContact O-CB 3.13Å; I169-L173 WeakPolarHBondContact O-CG 3.35Å; I169-L173 PolarHBondContact O-N 3.24Å
170	L	84.2	Confident	81	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-33.5	178.3	-68.1	178	0	0	0	111.8	L160 T166 V167 L173 G174 A217 A220 Y221 V224 M229	L160-L170 HydrophobicContact CD2-CD2 4.11Å; L160-L170 HydrophobicContact CD2-CG 4.32Å; T166-L170 HydrophobicContact CG2-CD1 3.7Å; T166-L170 HydrophobicContact CG2-CG 4.19Å; T166-L170 WeakPolarHBondContact O-CB 3.48Å; T166-L170 VanDerWaalsContact O-CG 3.24Å; T166-L170 WeakPolarHBondContact O-CG 3.32Å; T166-L170 PolarHBondContact O-N 2.9Å; V167-L170 PolarHBondContact O-N 3.46Å; L170-L173 HydrophobicContact CD2-CD1 4.41Å; L170-G174 PolarHBondContact O-N 3.38Å; L170-A217 HydrophobicContact CD2-CB 4.04Å; L170-A220 HydrophobicContact CD1-CB 3.96Å; L170-A220 HydrophobicContact CD2-CB 4.32Å; L170-Y221 HydrophobicContact CB-CE1 4.3Å; L170-Y221 HydrophobicContact CD1-CD1 4.25Å; L170-Y221 HydrophobicContact CD1-CD2 4.49Å; L170-Y221 HydrophobicContact CD1-CE1 4.38Å; L170-Y221 HydrophobicContact CD1-CG 4.24Å; L170-Y221 HydrophobicContact CD2-CD2 4.06Å; L170-Y221 HydrophobicContact CD2-CE2 3.7Å; L170-Y221 PolarHBondContact O-OH 3.17Å; L170-V224 HydrophobicContact CD1-CG2 4.1Å; L170-M229 HydrophobicContact CB-CE 4.14Å; L170-M229 HydrophobicContact CD1-CE 3.43Å; L170-M229 VanDerWaalsContact CD1-CE 3.43Å; L170-M229 HydrophobicContact CG-CE 4.42Å
171	C	82.4	Confident	81.5	Confident	59 Å²	59	44.2 Å²	44.2	40%	0.399	23%	0.234	S	C	.	.	H	α-helix	trans	-62.3	-51	172	-68.3	0	0	0	0	111.8	V167 V168 I169 G174	V167-C171 PolarHBondContact O-N 2.87Å; V167-C171 PolarHBondContact O-SG 3.31Å; V168-C171 PolarHBondContact O-N 2.9Å; I169-C171 VanDerWaalsContact C-N 3.28Å; I169-C171 PolarHBondContact O-N 3.31Å; C171-G174 WeakPolarHBondContact O-CA 3.33Å; C171-G174 PolarHBondContact O-N 2.74Å; C171-G174 VanDerWaalsContact O-N 3.16Å
172	H	83.9	Confident	82.3	Confident	31 Å²	31	40.1 Å²	40.1	14%	0.144	23%	0.225	C	C	.	.	H	α-helix	trans	-67.7	-37.6	179.1	-74	-64.3	0	0	0	113.3	F127 V168 I169 G174 E175	F127-H172 HydrophobicContact CB-CB 4.04Å; F127-H172 HydrophobicContact CD1-CB 3.86Å; F127-H172 HydrophobicContact CD2-CB 3.31Å; F127-H172 AromaticContact CD2-CD2 3.98Å; F127-H172 AromaticContact CD2-CG 3.65Å; F127-H172 HydrophobicContact CE1-CB 4.13Å; F127-H172 HydrophobicContact CE2-CB 3.61Å; F127-H172 HydrophobicContact CG-CB 3.47Å; F127-H172 VanDerWaalsContact CG-CB 3.47Å; F127-H172 HydrophobicContact CZ-CB 4.02Å; V168-H172 PolarHBondContact O-CD2 3.1Å; V168-H172 VanDerWaalsContact O-CD2 3.25Å; V168-H172 PolarHBondContact O-N 3.02Å; V168-H172 VanDerWaalsContact O-N 3.17Å; I169-H172 PolarHBondContact O-N 2.87Å; H172-G174 PolarHBondContact O-N 3.35Å; H172-E175 WeakPolarHBondContact O-CB 3.45Å; H172-E175 PolarHBondContact O-N 3.49Å; H172-E175 VanDerWaalsContact O-N 3.16Å
173	L	86.6	Confident	83.2	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-32.7	172.2	-79.1	173.1	0	0	0	111.9	F127 I156 L160 I169 L170 E175 L176 W177 L213	F127-L173 HydrophobicContact CE1-CD2 3.75Å; F127-L173 HydrophobicContact CE1-CG 3.87Å; F127-L173 HydrophobicContact CZ-CD2 4.43Å; F127-L173 HydrophobicContact CZ-CG 4.18Å; I156-L173 HydrophobicContact CD1-CD2 4.38Å; I156-L173 HydrophobicContact CG2-CD1 3.99Å; I156-L173 HydrophobicContact CG2-CD2 4.49Å; L160-L173 HydrophobicContact CD1-CD1 4.49Å; I169-L173 HydrophobicContact CG2-CD1 3.66Å; I169-L173 HydrophobicContact CG2-CG 4.15Å; I169-L173 WeakPolarHBondContact O-CB 3.13Å; I169-L173 WeakPolarHBondContact O-CG 3.35Å; I169-L173 PolarHBondContact O-N 3.24Å; L170-L173 HydrophobicContact CD2-CD1 4.41Å; L173-E175 PolarHBondContact O-N 2.87Å; L173-L176 PolarHBondContact O-N 3.35Å; L173-W177 HydrophobicContact CB-CH2 4.34Å; L173-W177 HydrophobicContact CB-CZ2 3.6Å; L173-W177 HydrophobicContact CD1-CH2 4.07Å; L173-W177 HydrophobicContact CD1-CZ2 3.8Å; L173-W177 HydrophobicContact CD2-CH2 4.11Å; L173-W177 HydrophobicContact CD2-CZ2 4.21Å; L173-W177 HydrophobicContact CG-CH2 4.43Å; L173-W177 HydrophobicContact CG-CZ2 4.1Å; L173-W177 PolarHBondContact O-N 3.29Å; L173-W177 PolarHBondContact O-NE1 2.9Å; L173-L213 HydrophobicContact CD1-CD1 4.28Å; L173-L213 HydrophobicContact CD2-CD2 4.04Å
174	G	84.3	Confident	84.6	Confident	9 Å²	9	31.9 Å²	31.9	9%	0.093	18%	0.18	C	C	.	.	H	α-helix	trans	-48.7	-39.1	171.9	0	0	0	0	0	113.1	L170 C171 H172 L176	L170-G174 PolarHBondContact O-N 3.38Å; C171-G174 WeakPolarHBondContact O-CA 3.33Å; C171-G174 PolarHBondContact O-N 2.74Å; C171-G174 VanDerWaalsContact O-N 3.16Å; H172-G174 PolarHBondContact O-N 3.35Å; G174-L176 VanDerWaalsContact C-N 3.29Å; G174-L176 PolarHBondContact O-N 3.25Å
175	E	84	Confident	85.7	Confident	139 Å²	139	29 Å²	29	65%	0.65	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-18.3	-179.1	-58.4	175.4	175.2	0	0	113	H172 L173	H172-E175 WeakPolarHBondContact O-CB 3.45Å; H172-E175 PolarHBondContact O-N 3.49Å; H172-E175 VanDerWaalsContact O-N 3.16Å; L173-E175 PolarHBondContact O-N 2.87Å
176	L	88.6	Confident	86.6	Confident	8 Å²	8	32.7 Å²	32.7	4%	0.042	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-18.9	-175.3	-60.9	-170.1	0	0	0	114	F127 I130 L134 L173 G174 N178 K179 L180	F127-L176 HydrophobicContact CD1-CD1 3.64Å; F127-L176 HydrophobicContact CD1-CG 4.44Å; F127-L176 HydrophobicContact CE1-CD1 4.31Å; I130-L176 HydrophobicContact CB-CD1 4.05Å; I130-L176 HydrophobicContact CG2-CD1 3.55Å; L134-L176 HydrophobicContact CD1-CB 4.35Å; L134-L176 HydrophobicContact CD1-CD1 4.37Å; L134-L176 HydrophobicContact CD1-CD2 4.34Å; L173-L176 PolarHBondContact O-N 3.35Å; G174-L176 VanDerWaalsContact C-N 3.29Å; G174-L176 PolarHBondContact O-N 3.25Å; L176-N178 VanDerWaalsContact C-N 3.32Å; L176-N178 PolarHBondContact O-N 2.92Å; L176-K179 WeakPolarHBondContact O-CB 3.3Å; L176-K179 PolarHBondContact O-N 3.5Å; L176-L180 PolarHBondContact O-N 2.8Å
177	W	90.2	Very high	87.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-55.9	-45.6	-173.2	-68.3	132.1	0	0	0	112.9	L173 K179 L180 G181 L213 W214 A217 Y221 A236 V239	L173-W177 HydrophobicContact CB-CH2 4.34Å; L173-W177 HydrophobicContact CB-CZ2 3.6Å; L173-W177 HydrophobicContact CD1-CH2 4.07Å; L173-W177 HydrophobicContact CD1-CZ2 3.8Å; L173-W177 HydrophobicContact CD2-CH2 4.11Å; L173-W177 HydrophobicContact CD2-CZ2 4.21Å; L173-W177 HydrophobicContact CG-CH2 4.43Å; L173-W177 HydrophobicContact CG-CZ2 4.1Å; L173-W177 PolarHBondContact O-N 3.29Å; L173-W177 PolarHBondContact O-NE1 2.9Å; W177-K179 VanDerWaalsContact C-N 3.31Å; W177-K179 PolarHBondContact O-N 3.16Å; W177-L180 HydrophobicContact CE3-CD1 3.82Å; W177-L180 HydrophobicContact CZ3-CD1 3.9Å; W177-L180 PolarHBondContact O-N 2.8Å; W177-G181 PolarHBondContact O-N 2.98Å; W177-L213 HydrophobicContact CH2-CD2 4.13Å; W177-L213 HydrophobicContact CH2-CG 3.93Å; W177-L213 HydrophobicContact CZ3-CD2 4.11Å; W177-L213 HydrophobicContact CZ3-CG 4.24Å; W177-W214 AromaticContact CD2-NE1 3.84Å; W177-W214 AromaticContact CE3-CD1 3.53Å; W177-W214 AromaticContact CE3-NE1 3.12Å; W177-W214 AromaticContact CH2-CD1 3.65Å; W177-W214 AromaticContact CZ3-CD1 3.2Å; W177-W214 HydrophobicContact CZ3-CG 4.12Å; W177-W214 AromaticContact CZ3-NE1 3.32Å; W177-W214 VanDerWaalsContact CZ3-NE1 3.32Å; W177-A217 HydrophobicContact CH2-CB 3.72Å; W177-A217 HydrophobicContact CZ2-CB 3.58Å; W177-Y221 PolarHBondContact NE1-OH 2.84Å; W177-A236 HydrophobicContact CD2-CB 4.13Å; W177-A236 HydrophobicContact CH2-CB 4.4Å; W177-A236 HydrophobicContact CZ2-CB 3.8Å; W177-V239 HydrophobicContact CB-CB 4.24Å; W177-V239 HydrophobicContact CB-CG1 4.46Å; W177-V239 HydrophobicContact CB-CG2 3.84Å; W177-V239 WeakPolarHBondContact O-CG1 3.21Å
178	N	89.5	Confident	87.8	Confident	68 Å²	68	30.4 Å²	30.4	36%	0.364	16%	0.157	S	C	.	.	H	α-helix	trans	-59.8	-40.5	178.4	-76.9	-27.1	0	0	0	112.4	L176 G181 N182 D234 V239	L176-N178 VanDerWaalsContact C-N 3.32Å; L176-N178 PolarHBondContact O-N 2.92Å; N178-G181 PolarHBondContact O-N 2.72Å; N178-N182 WeakPolarHBondContact O-CB 3.4Å; N178-N182 PolarHBondContact O-N 3.27Å; N178-N182 PolarHBondContact O-ND2 3.03Å; N178-D234 PolarHBondContact ND2-OD2 3.13Å; N178-V239 WeakPolarHBondContact OD1-CG2 3.26Å
179	K	89.6	Confident	88.4	Confident	53 Å²	53	29.9 Å²	29.9	23%	0.23	15%	0.15	C	C	.	.	H	α-helix	trans	-65	-47.5	176.7	-60.4	-172.2	-175.6	-168.8	0	110.9	G131 L134 D135 L138 L176 W177 G181 N182 I183	G131-K179 PolarHBondContact O-NZ 2.94Å; L134-K179 HydrophobicContact CB-CB 4.17Å; L134-K179 HydrophobicContact CB-CD 4.19Å; L134-K179 HydrophobicContact CD1-CB 4.1Å; D135-K179 WeakPolarHBondContact OD1-CD 3.2Å; D135-K179 WeakPolarHBondContact OD1-CE 3.18Å; D135-K179 IonicContact OD1-NZ 3.76Å; D135-K179 PolarHBondContact OD1-NZ 2.96Å; D135-K179 IonicContact OD2-NZ 2.73Å; D135-K179 PolarHBondContact OD2-NZ 2.9Å; L138-K179 HydrophobicContact CD1-CB 4.21Å; L138-K179 HydrophobicContact CD1-CG 4.34Å; L176-K179 WeakPolarHBondContact O-CB 3.3Å; L176-K179 PolarHBondContact O-N 3.5Å; W177-K179 VanDerWaalsContact C-N 3.31Å; W177-K179 PolarHBondContact O-N 3.16Å; K179-G181 PolarHBondContact O-N 3.18Å; K179-N182 PolarHBondContact O-N 3.09Å; K179-I183 WeakPolarHBondContact O-CG1 3.48Å; K179-I183 PolarHBondContact O-N 3.32Å
180	L	90.9	Very high	88.7	Confident	5 Å²	5	31.2 Å²	31.2	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-59.8	-44.3	177.2	-68.9	178.7	0	0	0	112.1	L134 L176 W177 N182 I183 I184 I210 L213	L134-L180 HydrophobicContact CD1-CD2 3.59Å; L134-L180 HydrophobicContact CD1-CG 3.96Å; L134-L180 HydrophobicContact CD2-CD2 3.65Å; L134-L180 HydrophobicContact CG-CD2 4.29Å; L176-L180 PolarHBondContact O-N 2.8Å; W177-L180 HydrophobicContact CE3-CD1 3.82Å; W177-L180 HydrophobicContact CZ3-CD1 3.9Å; W177-L180 PolarHBondContact O-N 2.8Å; L180-N182 PolarHBondContact O-N 3.03Å; L180-I183 PolarHBondContact O-N 3.41Å; L180-I184 WeakPolarHBondContact O-CG1 3.45Å; L180-I184 PolarHBondContact O-N 3.49Å; L180-I210 HydrophobicContact CD1-CD1 4.27Å; L180-I210 HydrophobicContact CD2-CD1 3.69Å; L180-I210 HydrophobicContact CG-CD1 4.48Å; L180-L213 HydrophobicContact CD1-CD2 4.48Å
181	G	91.6	Very high	88.8	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-42.6	177.3	0	0	0	0	0	112.5	W177 N178 K179 I184 K185 V243	W177-G181 PolarHBondContact O-N 2.98Å; N178-G181 PolarHBondContact O-N 2.72Å; K179-G181 PolarHBondContact O-N 3.18Å; G181-I184 PolarHBondContact O-N 3.02Å; G181-K185 WeakPolarHBondContact O-CG 3.46Å; G181-K185 PolarHBondContact O-N 2.94Å; G181-V243 VanDerWaalsContact CA-CG2 3.45Å
182	N	91.5	Very high	88.9	Confident	77 Å²	77	28.5 Å²	28.5	41%	0.412	14%	0.138	S	C	.	.	H	α-helix	trans	-65.3	-39.7	177	-72.7	-21.9	0	0	0	112.7	L138 N178 K179 L180 K185 K186	L138-N182 HydrophobicContact CD2-CB 3.72Å; N178-N182 WeakPolarHBondContact O-CB 3.4Å; N178-N182 PolarHBondContact O-N 3.27Å; N178-N182 PolarHBondContact O-ND2 3.03Å; K179-N182 PolarHBondContact O-N 3.09Å; L180-N182 PolarHBondContact O-N 3.03Å; N182-K185 PolarHBondContact O-N 3.33Å; N182-K186 PolarHBondContact O-N 2.85Å
183	I	91.5	Very high	88.9	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-62.2	-46	175	-69.9	165	0	0	0	110.4	L134 A137 L138 T143 A146 K179 L180 K185 K186 L187 F206	L134-I183 HydrophobicContact CB-CD1 3.91Å; L134-I183 HydrophobicContact CD2-CD1 3.51Å; L134-I183 HydrophobicContact CG-CD1 4.23Å; A137-I183 HydrophobicContact CB-CD1 4.21Å; L138-I183 HydrophobicContact CD2-CG1 3.58Å; L138-I183 HydrophobicContact CG-CD1 4.2Å; L138-I183 HydrophobicContact CG-CG1 3.71Å; T143-I183 HydrophobicContact CG2-CG2 3.97Å; A146-I183 HydrophobicContact CB-CD1 4.47Å; A146-I183 HydrophobicContact CB-CG2 4.22Å; K179-I183 WeakPolarHBondContact O-CG1 3.48Å; K179-I183 PolarHBondContact O-N 3.32Å; L180-I183 PolarHBondContact O-N 3.41Å; I183-K185 VanDerWaalsContact C-N 3.33Å; I183-K185 PolarHBondContact O-N 2.91Å; I183-K186 PolarHBondContact O-N 3.02Å; I183-L187 VanDerWaalsContact O-CB 3.29Å; I183-L187 WeakPolarHBondContact O-CB 3.25Å; I183-L187 PolarHBondContact O-N 3.49Å; I183-F206 HydrophobicContact CG2-CE1 3.8Å; I183-F206 HydrophobicContact CG2-CZ 3.83Å
184	I	92.3	Very high	88.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.3	-45.8	177.9	-70.1	166.5	0	0	0	111.2	L180 G181 K186 L187 V188 L207 I210 W214 V243 F271	L180-I184 WeakPolarHBondContact O-CG1 3.45Å; L180-I184 PolarHBondContact O-N 3.49Å; G181-I184 PolarHBondContact O-N 3.02Å; I184-K186 PolarHBondContact O-N 3.34Å; I184-L187 PolarHBondContact O-N 2.95Å; I184-V188 HydrophobicContact CG2-CG2 4.21Å; I184-V188 WeakPolarHBondContact O-CG2 3Å; I184-V188 PolarHBondContact O-N 3.43Å; I184-L207 HydrophobicContact CG1-CD2 4.17Å; I184-L207 HydrophobicContact CG2-CD2 3.94Å; I184-I210 HydrophobicContact CD1-CB 4.19Å; I184-I210 HydrophobicContact CD1-CG2 3.42Å; I184-I210 VanDerWaalsContact CD1-CG2 3.42Å; I184-I210 HydrophobicContact CG1-CG2 4.41Å; I184-W214 HydrophobicContact CD1-CE3 4.27Å; I184-W214 HydrophobicContact CD1-CH2 3.32Å; I184-W214 HydrophobicContact CD1-CZ2 4.34Å; I184-W214 HydrophobicContact CD1-CZ3 3.27Å; I184-V243 HydrophobicContact CB-CG1 4.24Å; I184-V243 HydrophobicContact CG2-CG1 3.69Å; I184-F271 HydrophobicContact CG2-CE1 3.99Å; I184-F271 HydrophobicContact CG2-CZ 3.54Å
185	K	92.4	Very high	89	Confident	27 Å²	27	36 Å²	36	12%	0.117	18%	0.175	C	C	.	.	H	α-helix	trans	-57.9	-50.5	177.7	-73.2	175.7	-177.4	-174.3	0	111.3	G181 N182 I183 L187 V188 E189 D242 V243 V246 Y251	G181-K185 WeakPolarHBondContact O-CG 3.46Å; G181-K185 PolarHBondContact O-N 2.94Å; N182-K185 PolarHBondContact O-N 3.33Å; I183-K185 VanDerWaalsContact C-N 3.33Å; I183-K185 PolarHBondContact O-N 2.91Å; K185-L187 VanDerWaalsContact C-N 3.34Å; K185-L187 PolarHBondContact O-N 3.37Å; K185-V188 PolarHBondContact O-N 3.46Å; K185-E189 WeakPolarHBondContact O-CB 2.94Å; K185-E189 PolarHBondContact O-N 2.93Å; K185-D242 WeakPolarHBondContact CE-OD2 3.43Å; K185-D242 IonicContact NZ-OD1 2.97Å; K185-D242 PolarHBondContact NZ-OD1 2.74Å; K185-D242 IonicContact NZ-OD2 2.77Å; K185-D242 PolarHBondContact NZ-OD2 3.47Å; K185-V243 HydrophobicContact CG-CG2 4.4Å; K185-V246 HydrophobicContact CD-CB 4.33Å; K185-V246 HydrophobicContact CD-CG1 4.15Å; K185-V246 HydrophobicContact CD-CG2 4.39Å; K185-V246 HydrophobicContact CG-CB 4.4Å; K185-V246 HydrophobicContact CG-CG1 4.1Å; K185-Y251 HydrophobicContact CB-CE2 4.48Å; K185-Y251 VanDerWaalsContact O-CE2 3.29Å; K185-Y251 WeakPolarHBondContact O-CE2 3.36Å; K185-Y251 PolarHBondContact O-OH 2.94Å; K185-Y251 VanDerWaalsContact O-OH 3.13Å
186	K	90.7	Very high	88.8	Confident	91 Å²	91	33.1 Å²	33.1	40%	0.396	17%	0.165	S	C	.	.	H	α-helix	trans	-59.4	-43.6	176.6	-75.3	-171.9	174	-163.9	0	112.6	L138 N182 I183 I184 E189 H190	L138-K186 HydrophobicContact CD2-CD 4.36Å; L138-K186 PolarHBondContact O-NZ 2.82Å; N182-K186 PolarHBondContact O-N 2.85Å; I183-K186 PolarHBondContact O-N 3.02Å; I184-K186 PolarHBondContact O-N 3.34Å; K186-E189 WeakPolarHBondContact O-CB 3.32Å; K186-E189 PolarHBondContact O-N 3.39Å; K186-H190 WeakPolarHBondContact O-CB 3.44Å; K186-H190 PolarHBondContact O-N 3.48Å
187	L	90.6	Very high	88.4	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.4	-46.7	179.6	173.9	59.8	0	0	0	111.3	T143 I183 I184 K185 E189 H190 I191 Q203 F206 L207	T143-L187 HydrophobicContact CG2-CB 4.49Å; I183-L187 VanDerWaalsContact O-CB 3.29Å; I183-L187 WeakPolarHBondContact O-CB 3.25Å; I183-L187 PolarHBondContact O-N 3.49Å; I184-L187 PolarHBondContact O-N 2.95Å; K185-L187 VanDerWaalsContact C-N 3.34Å; K185-L187 PolarHBondContact O-N 3.37Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-E189 PolarHBondContact O-N 3.02Å; L187-H190 PolarHBondContact O-N 3.47Å; L187-I191 HydrophobicContact CD1-CD1 4.01Å; L187-I191 HydrophobicContact CD1-CG1 4.27Å; L187-I191 HydrophobicContact CG-CD1 3.89Å; L187-I191 WeakPolarHBondContact O-CD1 3.2Å; L187-I191 VanDerWaalsContact O-CG1 3.26Å; L187-I191 WeakPolarHBondContact O-CG1 3.35Å; L187-I191 PolarHBondContact O-N 2.99Å; L187-Q203 HydrophobicContact CD1-CB 4.17Å; L187-Q203 HydrophobicContact CD1-CG 3.63Å; L187-Q203 HydrophobicContact CD2-CB 4.37Å; L187-F206 HydrophobicContact CD2-CD1 3.69Å; L187-F206 HydrophobicContact CD2-CE1 4.23Å; L187-L207 HydrophobicContact CD2-CD1 4.4Å; L187-L207 HydrophobicContact CD2-CD2 4.02Å; L187-L207 HydrophobicContact CD2-CG 3.98Å
188	V	89.7	Confident	88.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.3	-39.7	176.9	174.2	0	0	0	0	111	I184 K185 I191 I192 C247 Y251 W267 F271	I184-V188 HydrophobicContact CG2-CG2 4.21Å; I184-V188 WeakPolarHBondContact O-CG2 3Å; I184-V188 PolarHBondContact O-N 3.43Å; K185-V188 PolarHBondContact O-N 3.46Å; V188-I191 PolarHBondContact O-N 3.31Å; V188-I192 HydrophobicContact CG1-CD1 3.72Å; V188-I192 HydrophobicContact CG1-CG1 4.3Å; V188-I192 WeakPolarHBondContact O-CB 3.31Å; V188-I192 VanDerWaalsContact O-CG1 3.28Å; V188-I192 WeakPolarHBondContact O-CG1 3.26Å; V188-I192 PolarHBondContact O-N 3.35Å; V188-C247 HydrophobicContact CG1-CB 4.17Å; V188-Y251 HydrophobicContact CB-CD2 4.4Å; V188-Y251 HydrophobicContact CB-CE2 4.31Å; V188-Y251 HydrophobicContact CG1-CD2 3.87Å; V188-Y251 HydrophobicContact CG1-CE2 4.28Å; V188-W267 HydrophobicContact CG1-CH2 3.91Å; V188-W267 HydrophobicContact CG1-CZ3 3.96Å; V188-F271 HydrophobicContact CG2-CE1 4.41Å; V188-F271 HydrophobicContact CG2-CE2 4.03Å; V188-F271 HydrophobicContact CG2-CZ 3.52Å
189	E	89	Confident	88	Confident	55 Å²	55	34.8 Å²	34.8	26%	0.257	17%	0.171	S	C	.	.	H	α-helix	trans	-59	-46.6	174.2	179.8	166.9	-162.3	0	0	111.7	K185 K186 L187 I192 I193 Y251 Y255	K185-E189 WeakPolarHBondContact O-CB 2.94Å; K185-E189 PolarHBondContact O-N 2.93Å; K186-E189 WeakPolarHBondContact O-CB 3.32Å; K186-E189 PolarHBondContact O-N 3.39Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-E189 PolarHBondContact O-N 3.02Å; E189-I192 PolarHBondContact O-N 2.99Å; E189-I193 HydrophobicContact CG-CD1 3.58Å; E189-I193 HydrophobicContact CG-CG1 4.42Å; E189-I193 WeakPolarHBondContact O-CB 3.41Å; E189-I193 WeakPolarHBondContact O-CG1 3.3Å; E189-I193 PolarHBondContact O-N 3.01Å; E189-Y251 HydrophobicContact CB-CE2 4.02Å; E189-Y251 PolarHBondContact OE2-OH 3.39Å; E189-Y255 HydrophobicContact CG-CE2 4.01Å; E189-Y255 PolarHBondContact OE1-OH 3.44Å
190	H	88.4	Confident	87.8	Confident	30 Å²	30	35.7 Å²	35.7	14%	0.139	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-44.8	174.1	175.9	71	0	0	0	112.2	K186 L187 I192 I193 D194 Q195	K186-H190 WeakPolarHBondContact O-CB 3.44Å; K186-H190 PolarHBondContact O-N 3.48Å; L187-H190 PolarHBondContact O-N 3.47Å; H190-I192 VanDerWaalsContact C-N 3.3Å; H190-I192 PolarHBondContact O-N 3.1Å; H190-I193 PolarHBondContact O-N 3.43Å; H190-D194 IonicContact CE1-OD2 2.73Å; H190-D194 PolarHBondContact CE1-OD2 2.83Å; H190-D194 IonicContact CG-OD2 3.07Å; H190-D194 IonicContact ND1-OD2 2.87Å; H190-D194 PolarHBondContact ND1-OD2 3.26Å; H190-D194 WeakPolarHBondContact O-CB 3.3Å; H190-D194 PolarHBondContact O-N 2.95Å; H190-Q195 PolarHBondContact NE2-NE2 2.87Å; H190-Q195 VanDerWaalsContact NE2-NE2 3.17Å; H190-Q195 PolarHBondContact O-N 3.17Å
191	I	87.7	Confident	87.4	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58	-44.4	176.2	-69.7	160.2	0	0	0	110.5	L187 V188 Q195 N196 G197 A199 Q203 L207	L187-I191 HydrophobicContact CD1-CD1 4.01Å; L187-I191 HydrophobicContact CD1-CG1 4.27Å; L187-I191 HydrophobicContact CG-CD1 3.89Å; L187-I191 WeakPolarHBondContact O-CD1 3.2Å; L187-I191 VanDerWaalsContact O-CG1 3.26Å; L187-I191 WeakPolarHBondContact O-CG1 3.35Å; L187-I191 PolarHBondContact O-N 2.99Å; V188-I191 PolarHBondContact O-N 3.31Å; I191-Q195 CarbonylContact O-C 3.57Å; I191-Q195 VanDerWaalsContact O-C 3.24Å; I191-Q195 WeakPolarHBondContact O-CA 3.28Å; I191-Q195 WeakPolarHBondContact O-CB 3.43Å; I191-Q195 PolarHBondContact O-N 3.03Å; I191-N196 PolarHBondContact O-N 3.43Å; I191-G197 WeakPolarHBondContact O-CA 3.45Å; I191-G197 PolarHBondContact O-N 3.29Å; I191-A199 HydrophobicContact CD1-CB 3.8Å; I191-A199 HydrophobicContact CG1-CB 4.12Å; I191-A199 HydrophobicContact CG2-CB 4.18Å; I191-Q203 HydrophobicContact CD1-CB 4.43Å; I191-L207 HydrophobicContact CD1-CD1 4.27Å
192	I	84.5	Confident	87	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-69.4	-47.8	-178.3	-71.4	171.7	0	0	0	111.5	V188 E189 H190 Y251 Y255 V260 W267	V188-I192 HydrophobicContact CG1-CD1 3.72Å; V188-I192 HydrophobicContact CG1-CG1 4.3Å; V188-I192 WeakPolarHBondContact O-CB 3.31Å; V188-I192 VanDerWaalsContact O-CG1 3.28Å; V188-I192 WeakPolarHBondContact O-CG1 3.26Å; V188-I192 PolarHBondContact O-N 3.35Å; E189-I192 PolarHBondContact O-N 2.99Å; H190-I192 VanDerWaalsContact C-N 3.3Å; H190-I192 PolarHBondContact O-N 3.1Å; I192-Y251 HydrophobicContact CD1-CD2 4.31Å; I192-Y251 HydrophobicContact CD1-CG 4.49Å; I192-Y255 HydrophobicContact CG2-CD2 4.23Å; I192-Y255 HydrophobicContact CG2-CG 4.31Å; I192-V260 HydrophobicContact CG2-CG2 3.89Å; I192-W267 HydrophobicContact CD1-CH2 4.46Å
193	I	84.2	Confident	86.8	Confident	45 Å²	45	37.7 Å²	37.7	23%	0.231	20%	0.202	C	C	.	.	H	α-helix	trans	-82	-50.8	-171.1	-62.7	174.4	0	0	0	111.6	E189 H190 Y255 F258	E189-I193 HydrophobicContact CG-CD1 3.58Å; E189-I193 HydrophobicContact CG-CG1 4.42Å; E189-I193 WeakPolarHBondContact O-CB 3.41Å; E189-I193 WeakPolarHBondContact O-CG1 3.3Å; E189-I193 PolarHBondContact O-N 3.01Å; H190-I193 PolarHBondContact O-N 3.43Å; I193-Y255 HydrophobicContact CD1-CD1 4.14Å; I193-Y255 HydrophobicContact CD1-CE1 3.78Å; I193-Y255 HydrophobicContact CD1-CE2 4.18Å; I193-Y255 HydrophobicContact CG1-CD1 4.27Å; I193-Y255 HydrophobicContact CG1-CE1 4.41Å; I193-Y255 HydrophobicContact CG1-CG 4.34Å; I193-F258 HydrophobicContact CG1-CE2 4.44Å; I193-F258 HydrophobicContact CG2-CE1 4.25Å; I193-F258 HydrophobicContact CG2-CZ 4.2Å
194	D	85.3	Confident	86.6	Confident	108 Å²	108	38.6 Å²	38.6	58%	0.578	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-26.2	-169.1	-60.2	-41.4	0	0	0	112.1	H190	H190-D194 IonicContact CE1-OD2 2.73Å; H190-D194 PolarHBondContact CE1-OD2 2.83Å; H190-D194 IonicContact CG-OD2 3.07Å; H190-D194 IonicContact ND1-OD2 2.87Å; H190-D194 PolarHBondContact ND1-OD2 3.26Å; H190-D194 WeakPolarHBondContact O-CB 3.3Å; H190-D194 PolarHBondContact O-N 2.95Å
195	Q	85.9	Confident	86.2	Confident	45 Å²	45	41.7 Å²	41.7	21%	0.21	23%	0.225	C	C	.	.	S	Bend	trans	-112	8.8	-177.3	-50.3	178.6	-23.3	0	0	113.5	H190 I191 G197 K198	H190-Q195 PolarHBondContact NE2-NE2 2.87Å; H190-Q195 VanDerWaalsContact NE2-NE2 3.17Å; H190-Q195 PolarHBondContact O-N 3.17Å; I191-Q195 CarbonylContact O-C 3.57Å; I191-Q195 VanDerWaalsContact O-C 3.24Å; I191-Q195 WeakPolarHBondContact O-CA 3.28Å; I191-Q195 WeakPolarHBondContact O-CB 3.43Å; I191-Q195 PolarHBondContact O-N 3.03Å; Q195-G197 PolarHBondContact O-N 3.42Å; Q195-G197 VanDerWaalsContact O-N 3.16Å; Q195-K198 WeakPolarHBondContact CB-O 3.49Å; Q195-K198 WeakPolarHBondContact O-CB 3.32Å; Q195-K198 PolarHBondContact O-N 3.36Å; Q195-K198 PolarHBondContact OE1-O 3.13Å
196	N	81.3	Confident	86	Confident	80 Å²	80	40.4 Å²	40.4	43%	0.428	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	34.4	178.2	-59.5	-55.8	0	0	0	113.8	I191 L259 D261	I191-N196 PolarHBondContact O-N 3.43Å; N196-L259 WeakPolarHBondContact CB-O 3.19Å; N196-D261 PolarHBondContact O-N 2.9Å
197	G	79.7	Confident	86	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	-4	-179.2	0	0	0	0	0	115.6	I191 Q195 A199 S265 W267	I191-G197 WeakPolarHBondContact O-CA 3.45Å; I191-G197 PolarHBondContact O-N 3.29Å; Q195-G197 PolarHBondContact O-N 3.42Å; Q195-G197 VanDerWaalsContact O-N 3.16Å; G197-A199 PolarHBondContact O-N 3.41Å; G197-S265 PolarHBondContact O-OG 3.35Å; G197-W267 PolarHBondContact O-NE1 2.84Å
198	K	85	Confident	85.9	Confident	92 Å²	92	40.2 Å²	40.2	40%	0.4	22%	0.219	S	C	.	.			trans	-97	93	-175.1	-63.2	-173.5	-178	-178.2	0	111.8	Q195 D261 S265	Q195-K198 WeakPolarHBondContact CB-O 3.49Å; Q195-K198 WeakPolarHBondContact O-CB 3.32Å; Q195-K198 PolarHBondContact O-N 3.36Å; Q195-K198 PolarHBondContact OE1-O 3.13Å; K198-D261 WeakPolarHBondContact CE-OD2 3.39Å; K198-D261 WeakPolarHBondContact CG-O 3.37Å; K198-D261 IonicContact NZ-OD2 3.38Å; K198-D261 PolarHBondContact NZ-OD2 2.89Å; K198-S265 WeakPolarHBondContact CA-OG 3.4Å
199	A	85.9	Confident	85.8	Confident	18 Å²	18	41.5 Å²	41.5	15%	0.149	22%	0.224	C	C	.	.			trans	-67.9	142.3	175	0	0	0	0	0	110.7	I191 G197 Q203 E204 S265	I191-A199 HydrophobicContact CD1-CB 3.8Å; I191-A199 HydrophobicContact CG1-CB 4.12Å; I191-A199 HydrophobicContact CG2-CB 4.18Å; G197-A199 PolarHBondContact O-N 3.41Å; A199-Q203 HydrophobicContact CB-CB 4.32Å; A199-E204 HydrophobicContact CB-CG 3.87Å; A199-S265 PolarHBondContact N-OG 3.04Å
200	N	85.9	Confident	85.9	Confident	72 Å²	72	38.9 Å²	38.9	39%	0.385	21%	0.212	S	C	.	.			trans	-81.1	170	171.4	72.2	43.5	0	0	0	111.3	D202 Q203 E204	N200-D202 VanDerWaalsContact C-N 3.33Å; N200-D202 PolarHBondContact O-N 2.94Å; N200-D202 PolarHBondContact OD1-N 3.29Å; N200-D202 VanDerWaalsContact OD1-N 3.09Å; N200-Q203 PolarHBondContact ND2-OE1 3.04Å; N200-Q203 PolarHBondContact O-N 2.85Å; N200-Q203 VanDerWaalsContact OD1-CG 3.28Å; N200-Q203 WeakPolarHBondContact OD1-CG 3.29Å; N200-Q203 PolarHBondContact OD1-N 3.4Å; N200-E204 WeakPolarHBondContact O-CG 3.35Å; N200-E204 PolarHBondContact O-N 3.39Å
201	G	82.4	Confident	86.1	Confident	54 Å²	54	38 Å²	38	56%	0.557	21%	0.208	S	C	*	.	H	α-helix	trans	-59.6	-38	-175.7	0	0	0	0	0	114.4	E204 V205	G201-E204 PolarHBondContact O-N 3.5Å; G201-V205 VanDerWaalsContact O-CG2 3.26Å; G201-V205 WeakPolarHBondContact O-CG2 3.46Å; G201-V205 PolarHBondContact O-N 3.21Å
202	D	83.5	Confident	86.2	Confident	67 Å²	67	40.8 Å²	40.8	36%	0.358	22%	0.219	S	C	.	.	H	α-helix	trans	-70.7	-38.8	-179.6	-69.3	-38.7	0	0	0	111.6	T74 F147 N200 V205 F206	T74-D202 PolarHBondContact OG1-OD1 3.32Å; F147-D202 HydrophobicContact CD2-CB 4.04Å; F147-D202 HydrophobicContact CE2-CB 3.69Å; F147-D202 HydrophobicContact CZ-CB 4.12Å; N200-D202 VanDerWaalsContact C-N 3.33Å; N200-D202 PolarHBondContact O-N 2.94Å; N200-D202 PolarHBondContact OD1-N 3.29Å; N200-D202 VanDerWaalsContact OD1-N 3.09Å; D202-V205 PolarHBondContact O-N 2.92Å; D202-F206 WeakPolarHBondContact O-CB 3.15Å; D202-F206 PolarHBondContact O-N 3.32Å
203	Q	87.3	Confident	86.5	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.019	22%	0.219	C	C	.	.	H	α-helix	trans	-65.4	-42.2	175.3	-64.5	170.4	-36.1	0	0	111.8	F147 L187 I191 A199 N200 F206 L207	F147-Q203 HydrophobicContact CZ-CG 4.11Å; L187-Q203 HydrophobicContact CD1-CB 4.17Å; L187-Q203 HydrophobicContact CD1-CG 3.63Å; L187-Q203 HydrophobicContact CD2-CB 4.37Å; I191-Q203 HydrophobicContact CD1-CB 4.43Å; A199-Q203 HydrophobicContact CB-CB 4.32Å; N200-Q203 PolarHBondContact ND2-OE1 3.04Å; N200-Q203 PolarHBondContact O-N 2.85Å; N200-Q203 VanDerWaalsContact OD1-CG 3.28Å; N200-Q203 WeakPolarHBondContact OD1-CG 3.29Å; N200-Q203 PolarHBondContact OD1-N 3.4Å; Q203-F206 PolarHBondContact O-N 3.46Å; Q203-L207 WeakPolarHBondContact O-CB 3.45Å; Q203-L207 WeakPolarHBondContact O-CG 3.26Å; Q203-L207 PolarHBondContact O-N 3.49Å
204	E	86.3	Confident	86.8	Confident	21 Å²	21	38.8 Å²	38.8	10%	0.098	21%	0.208	C	C	.	.	H	α-helix	trans	-61.8	-44	175.3	-71.8	-74.5	-171.3	0	0	111.3	A199 N200 G201 L207 F208 I266 W267 Y270	A199-E204 HydrophobicContact CB-CG 3.87Å; N200-E204 WeakPolarHBondContact O-CG 3.35Å; N200-E204 PolarHBondContact O-N 3.39Å; G201-E204 PolarHBondContact O-N 3.5Å; E204-L207 PolarHBondContact O-N 3.35Å; E204-F208 VanDerWaalsContact O-CB 3.29Å; E204-F208 WeakPolarHBondContact O-CB 3.36Å; E204-F208 PolarHBondContact O-N 2.77Å; E204-I266 PolarHBondContact OE1-N 3.05Å; E204-W267 PolarHBondContact OE1-N 3.49Å; E204-W267 VanDerWaalsContact OE1-N 3.09Å; E204-W267 WeakPolarHBondContact OE2-CA 3.26Å; E204-W267 WeakPolarHBondContact OE2-CB 3.24Å; E204-W267 PolarHBondContact OE2-N 3.31Å; E204-Y270 WeakPolarHBondContact OE2-CE2 3.45Å
205	V	84.9	Confident	87	Confident	64 Å²	64	39.9 Å²	39.9	39%	0.388	20%	0.204	S	C	.	.	H	α-helix	trans	-61.8	-46.2	175.2	169.5	0	0	0	0	110.9	G201 D202 F208 E209	G201-V205 VanDerWaalsContact O-CG2 3.26Å; G201-V205 WeakPolarHBondContact O-CG2 3.46Å; G201-V205 PolarHBondContact O-N 3.21Å; D202-V205 PolarHBondContact O-N 2.92Å; V205-F208 WeakPolarHBondContact O-CB 3.45Å; V205-F208 PolarHBondContact O-N 2.85Å; V205-E209 HydrophobicContact CG1-CG 4.32Å; V205-E209 WeakPolarHBondContact O-CB 3.39Å; V205-E209 VanDerWaalsContact O-CG 3.32Å; V205-E209 WeakPolarHBondContact O-CG 3.35Å; V205-E209 PolarHBondContact O-N 2.6Å
206	F	87.9	Confident	87.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.4	-48.4	178.9	178	-101.4	0	0	0	112.2	A146 F147 I183 L187 D202 Q203 F208 E209 I210	A146-F206 HydrophobicContact CB-CD2 4.4Å; A146-F206 HydrophobicContact CB-CE2 3.61Å; A146-F206 HydrophobicContact CB-CZ 3.73Å; A146-F206 WeakPolarHBondContact O-CE2 3.49Å; F147-F206 HydrophobicContact CD1-CB 3.61Å; F147-F206 AromaticContact CD1-CD2 3.78Å; F147-F206 HydrophobicContact CD1-CD2 3.78Å; F147-F206 AromaticContact CD1-CG 3.76Å; F147-F206 HydrophobicContact CD1-CG 3.76Å; F147-F206 HydrophobicContact CE1-CB 3.63Å; F147-F206 HydrophobicContact CE1-CD1 4.4Å; F147-F206 HydrophobicContact CE1-CD2 4.32Å; F147-F206 AromaticContact CE1-CG 3.87Å; F147-F206 HydrophobicContact CE1-CG 3.87Å; I183-F206 HydrophobicContact CG2-CE1 3.8Å; I183-F206 HydrophobicContact CG2-CZ 3.83Å; L187-F206 HydrophobicContact CD2-CD1 3.69Å; L187-F206 HydrophobicContact CD2-CE1 4.23Å; D202-F206 WeakPolarHBondContact O-CB 3.15Å; D202-F206 PolarHBondContact O-N 3.32Å; Q203-F206 PolarHBondContact O-N 3.46Å; F206-F208 VanDerWaalsContact C-N 3.35Å; F206-F208 PolarHBondContact O-N 3.15Å; F206-E209 PolarHBondContact O-N 3.23Å; F206-I210 HydrophobicContact CD1-CG1 4.46Å; F206-I210 HydrophobicContact CD2-CG1 4.39Å; F206-I210 HydrophobicContact CE1-CG1 4.04Å; F206-I210 HydrophobicContact CE2-CD1 4.15Å; F206-I210 HydrophobicContact CE2-CG1 3.96Å; F206-I210 HydrophobicContact CZ-CD1 4.12Å; F206-I210 HydrophobicContact CZ-CG1 3.78Å; F206-I210 WeakPolarHBondContact O-CG1 3.3Å; F206-I210 PolarHBondContact O-N 2.91Å
207	L	90	Very high	87.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.2	-46.4	176.9	-70.7	172.7	0	0	0	111	I184 L187 I191 Q203 E204 E209 I210 F211 W267 Y270 F271	I184-L207 HydrophobicContact CG1-CD2 4.17Å; I184-L207 HydrophobicContact CG2-CD2 3.94Å; L187-L207 HydrophobicContact CD2-CD1 4.4Å; L187-L207 HydrophobicContact CD2-CD2 4.02Å; L187-L207 HydrophobicContact CD2-CG 3.98Å; I191-L207 HydrophobicContact CD1-CD1 4.27Å; Q203-L207 WeakPolarHBondContact O-CB 3.45Å; Q203-L207 WeakPolarHBondContact O-CG 3.26Å; Q203-L207 PolarHBondContact O-N 3.49Å; E204-L207 PolarHBondContact O-N 3.35Å; L207-E209 VanDerWaalsContact C-N 3.32Å; L207-E209 PolarHBondContact O-N 2.93Å; L207-I210 PolarHBondContact O-N 3.28Å; L207-F211 HydrophobicContact CD2-CE2 4.47Å; L207-F211 WeakPolarHBondContact O-CD2 3.26Å; L207-F211 PolarHBondContact O-N 3.47Å; L207-W267 HydrophobicContact CD1-CB 3.58Å; L207-W267 HydrophobicContact CD1-CG 4.29Å; L207-Y270 HydrophobicContact CB-CD2 4.12Å; L207-F271 HydrophobicContact CD1-CE2 4.49Å; L207-F271 HydrophobicContact CD2-CE2 4.3Å; L207-F271 HydrophobicContact CD2-CZ 4.37Å
208	F	89.4	Confident	87.7	Confident	88 Å²	88	35.8 Å²	35.8	39%	0.386	19%	0.187	S	C	.	.	H	α-helix	trans	-55.3	-47.7	176.2	173.1	-100.8	0	0	0	111.9	E204 V205 F206 F211 R212 Y270	E204-F208 VanDerWaalsContact O-CB 3.29Å; E204-F208 WeakPolarHBondContact O-CB 3.36Å; E204-F208 PolarHBondContact O-N 2.77Å; V205-F208 WeakPolarHBondContact O-CB 3.45Å; V205-F208 PolarHBondContact O-N 2.85Å; F206-F208 VanDerWaalsContact C-N 3.35Å; F206-F208 PolarHBondContact O-N 3.15Å; F208-F211 PolarHBondContact O-N 2.9Å; F208-R212 VanDerWaalsContact O-CB 3.27Å; F208-R212 WeakPolarHBondContact O-CB 3.33Å; F208-R212 PolarHBondContact O-N 3.02Å; F208-Y270 HydrophobicContact CB-CE1 4.32Å; F208-Y270 HydrophobicContact CB-CE2 3.97Å; F208-Y270 HydrophobicContact CD2-CD1 4.33Å; F208-Y270 AromaticContact CD2-CE1 3.77Å; F208-Y270 HydrophobicContact CD2-CE1 3.77Å
209	E	87.9	Confident	87.7	Confident	26 Å²	26	36.1 Å²	36.1	12%	0.121	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-42.4	-177.8	-75.2	-56.1	147.2	0	0	112.8	C150 I153 V205 F206 L207 R212 L213	C150-E209 HydrophobicContact CB-CG 4.32Å; I153-E209 HydrophobicContact CD1-CB 3.92Å; V205-E209 HydrophobicContact CG1-CG 4.32Å; V205-E209 WeakPolarHBondContact O-CB 3.39Å; V205-E209 VanDerWaalsContact O-CG 3.32Å; V205-E209 WeakPolarHBondContact O-CG 3.35Å; V205-E209 PolarHBondContact O-N 2.6Å; F206-E209 PolarHBondContact O-N 3.23Å; L207-E209 VanDerWaalsContact C-N 3.32Å; L207-E209 PolarHBondContact O-N 2.93Å; E209-R212 VanDerWaalsContact CD-NH2 3.33Å; E209-R212 WeakPolarHBondContact O-CB 3.29Å; E209-R212 PolarHBondContact O-N 2.95Å; E209-R212 IonicContact OE1-CZ 3.94Å; E209-R212 IonicContact OE1-NE 3.83Å; E209-R212 PolarHBondContact OE1-NE 3Å; E209-R212 IonicContact OE1-NH2 3.8Å; E209-R212 PolarHBondContact OE1-NH2 3Å; E209-R212 IonicContact OE2-CZ 3.44Å; E209-R212 IonicContact OE2-NE 2.7Å; E209-R212 PolarHBondContact OE2-NE 2.9Å; E209-R212 IonicContact OE2-NH2 3.9Å; E209-R212 PolarHBondContact OE2-NH2 3.39Å; E209-L213 PolarHBondContact O-N 3.32Å
210	I	91.1	Very high	87.6	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-65.8	-43.4	176	-62.5	-68.7	0	0	0	111.4	I153 L180 I184 F206 L207 R212 L213 W214	I153-I210 HydrophobicContact CD1-CD1 3.51Å; I153-I210 HydrophobicContact CD1-CG1 4.21Å; L180-I210 HydrophobicContact CD1-CD1 4.27Å; L180-I210 HydrophobicContact CD2-CD1 3.69Å; L180-I210 HydrophobicContact CG-CD1 4.48Å; I184-I210 HydrophobicContact CD1-CB 4.19Å; I184-I210 HydrophobicContact CD1-CG2 3.42Å; I184-I210 VanDerWaalsContact CD1-CG2 3.42Å; I184-I210 HydrophobicContact CG1-CG2 4.41Å; F206-I210 HydrophobicContact CD1-CG1 4.46Å; F206-I210 HydrophobicContact CD2-CG1 4.39Å; F206-I210 HydrophobicContact CE1-CG1 4.04Å; F206-I210 HydrophobicContact CE2-CD1 4.15Å; F206-I210 HydrophobicContact CE2-CG1 3.96Å; F206-I210 HydrophobicContact CZ-CD1 4.12Å; F206-I210 HydrophobicContact CZ-CG1 3.78Å; F206-I210 WeakPolarHBondContact O-CG1 3.3Å; F206-I210 PolarHBondContact O-N 2.91Å; L207-I210 PolarHBondContact O-N 3.28Å; I210-R212 VanDerWaalsContact C-N 3.27Å; I210-R212 PolarHBondContact O-N 3.25Å; I210-L213 WeakPolarHBondContact O-CB 3.48Å; I210-L213 PolarHBondContact O-N 2.92Å; I210-W214 HydrophobicContact CG2-CD2 4.26Å; I210-W214 HydrophobicContact CG2-CE3 3.9Å; I210-W214 HydrophobicContact CG2-CZ3 4.06Å; I210-W214 PolarHBondContact O-N 3.46Å
211	F	91.8	Very high	87.3	Confident	10 Å²	10	32.5 Å²	32.5	4%	0.044	17%	0.168	C	C	.	.	H	α-helix	trans	-66.4	-31.3	176.2	-78	-63.4	0	0	0	112.4	L207 F208 W214 R215 L240 L244 F271 S274	L207-F211 HydrophobicContact CD2-CE2 4.47Å; L207-F211 WeakPolarHBondContact O-CD2 3.26Å; L207-F211 PolarHBondContact O-N 3.47Å; F208-F211 PolarHBondContact O-N 2.9Å; F211-W214 AromaticContact CD1-CE3 3.51Å; F211-W214 HydrophobicContact CD1-CE3 3.51Å; F211-W214 AromaticContact CD1-CZ3 3.88Å; F211-W214 HydrophobicContact CD1-CZ3 3.88Å; F211-W214 AromaticContact CE1-CE3 3.64Å; F211-W214 HydrophobicContact CE1-CE3 3.64Å; F211-W214 AromaticContact CE1-CZ3 3.51Å; F211-W214 HydrophobicContact CE1-CZ3 3.51Å; F211-W214 HydrophobicContact CG-CE3 4.33Å; F211-W214 HydrophobicContact CZ-CZ3 4.04Å; F211-R215 WeakPolarHBondContact O-CB 3.33Å; F211-R215 PolarHBondContact O-N 3.35Å; F211-L240 HydrophobicContact CD1-CD1 4.26Å; F211-L240 HydrophobicContact CE1-CD1 3.73Å; F211-L244 HydrophobicContact CE1-CD2 4.31Å; F211-F271 HydrophobicContact CE2-CD1 4.39Å; F211-F271 AromaticContact CE2-CD2 3.63Å; F211-F271 HydrophobicContact CE2-CD2 3.63Å; F211-F271 HydrophobicContact CE2-CE1 4.22Å; F211-F271 AromaticContact CE2-CE2 3.48Å; F211-F271 HydrophobicContact CE2-CE2 3.48Å; F211-F271 VanDerWaalsContact CE2-CE2 3.48Å; F211-F271 HydrophobicContact CE2-CG 4.09Å; F211-F271 AromaticContact CE2-CZ 3.77Å; F211-F271 HydrophobicContact CE2-CZ 3.77Å; F211-F271 HydrophobicContact CZ-CB 4.49Å; F211-F271 AromaticContact CZ-CD1 3.68Å; F211-F271 HydrophobicContact CZ-CD1 3.68Å; F211-F271 AromaticContact CZ-CD2 3.74Å; F211-F271 HydrophobicContact CZ-CD2 3.74Å; F211-F271 AromaticContact CZ-CE1 3.63Å; F211-F271 HydrophobicContact CZ-CE1 3.63Å; F211-F271 AromaticContact CZ-CE2 3.74Å; F211-F271 HydrophobicContact CZ-CE2 3.74Å; F211-F271 AromaticContact CZ-CG 3.7Å; F211-F271 HydrophobicContact CZ-CG 3.7Å; F211-F271 AromaticContact CZ-CZ 3.66Å; F211-F271 HydrophobicContact CZ-CZ 3.66Å; F211-S274 WeakPolarHBondContact CD1-OG 3.46Å; F211-S274 WeakPolarHBondContact CG-OG 3.32Å
212	R	90.3	Very high	87.1	Confident	60 Å²	60	32 Å²	32	23%	0.226	15%	0.154	C	C	.	.	H	α-helix	trans	-65.9	-43.8	172.4	-171.3	172.7	71.7	127.9	10.3	111.5	E154 L157 F208 E209 I210 S216	E154-R212 IonicContact OE2-CZ 2.89Å; E154-R212 IonicContact OE2-NH1 2.62Å; E154-R212 PolarHBondContact OE2-NH1 3.33Å; E154-R212 IonicContact OE2-NH2 2.81Å; E154-R212 PolarHBondContact OE2-NH2 3.27Å; L157-R212 HydrophobicContact CD1-CG 3.92Å; F208-R212 VanDerWaalsContact O-CB 3.27Å; F208-R212 WeakPolarHBondContact O-CB 3.33Å; F208-R212 PolarHBondContact O-N 3.02Å; E209-R212 VanDerWaalsContact CD-NH2 3.33Å; E209-R212 WeakPolarHBondContact O-CB 3.29Å; E209-R212 PolarHBondContact O-N 2.95Å; E209-R212 IonicContact OE1-CZ 3.94Å; E209-R212 IonicContact OE1-NE 3.83Å; E209-R212 PolarHBondContact OE1-NE 3Å; E209-R212 IonicContact OE1-NH2 3.8Å; E209-R212 PolarHBondContact OE1-NH2 3Å; E209-R212 IonicContact OE2-CZ 3.44Å; E209-R212 IonicContact OE2-NE 2.7Å; E209-R212 PolarHBondContact OE2-NE 2.9Å; E209-R212 IonicContact OE2-NH2 3.9Å; E209-R212 PolarHBondContact OE2-NH2 3.39Å; I210-R212 VanDerWaalsContact C-N 3.27Å; I210-R212 PolarHBondContact O-N 3.25Å; R212-S216 PolarHBondContact O-N 2.89Å; R212-S216 VanDerWaalsContact O-N 3.16Å; R212-S216 PolarHBondContact O-OG 3.39Å
213	L	91.5	Very high	86.9	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.016	17%	0.166	C	C	.	.	H	α-helix	trans	-59.9	-51.7	172.7	177.7	57.8	0	0	0	110.9	I153 I156 L157 L160 L173 W177 L180 E209 I210 R215 S216 A217	I153-L213 HydrophobicContact CG1-CD2 4.09Å; I153-L213 HydrophobicContact CG2-CB 3.85Å; I156-L213 HydrophobicContact CB-CD1 4.33Å; I156-L213 HydrophobicContact CG2-CD1 3.62Å; L157-L213 HydrophobicContact CD2-CD1 4.23Å; L157-L213 HydrophobicContact CG-CD1 4.49Å; L160-L213 HydrophobicContact CD1-CD1 4.24Å; L173-L213 HydrophobicContact CD1-CD1 4.28Å; L173-L213 HydrophobicContact CD2-CD2 4.04Å; W177-L213 HydrophobicContact CH2-CD2 4.13Å; W177-L213 HydrophobicContact CH2-CG 3.93Å; W177-L213 HydrophobicContact CZ3-CD2 4.11Å; W177-L213 HydrophobicContact CZ3-CG 4.24Å; L180-L213 HydrophobicContact CD1-CD2 4.48Å; E209-L213 PolarHBondContact O-N 3.32Å; I210-L213 WeakPolarHBondContact O-CB 3.48Å; I210-L213 PolarHBondContact O-N 2.92Å; L213-R215 PolarHBondContact O-N 3.48Å; L213-S216 PolarHBondContact O-N 3.4Å; L213-S216 VanDerWaalsContact O-N 3.15Å; L213-A217 WeakPolarHBondContact O-CB 3.38Å; L213-A217 PolarHBondContact O-N 2.87Å
214	W	90.3	Very high	86.3	Confident	1 Å²	1	33.9 Å²	33.9	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-56.3	-52.1	178.4	-96.6	-31.5	0	0	0	111.6	W177 I184 I210 F211 S216 A217 L218 V239 L240 V243	W177-W214 AromaticContact CD2-NE1 3.84Å; W177-W214 AromaticContact CE3-CD1 3.53Å; W177-W214 AromaticContact CE3-NE1 3.12Å; W177-W214 AromaticContact CH2-CD1 3.65Å; W177-W214 AromaticContact CZ3-CD1 3.2Å; W177-W214 HydrophobicContact CZ3-CG 4.12Å; W177-W214 AromaticContact CZ3-NE1 3.32Å; W177-W214 VanDerWaalsContact CZ3-NE1 3.32Å; I184-W214 HydrophobicContact CD1-CE3 4.27Å; I184-W214 HydrophobicContact CD1-CH2 3.32Å; I184-W214 HydrophobicContact CD1-CZ2 4.34Å; I184-W214 HydrophobicContact CD1-CZ3 3.27Å; I210-W214 HydrophobicContact CG2-CD2 4.26Å; I210-W214 HydrophobicContact CG2-CE3 3.9Å; I210-W214 HydrophobicContact CG2-CZ3 4.06Å; I210-W214 PolarHBondContact O-N 3.46Å; F211-W214 AromaticContact CD1-CE3 3.51Å; F211-W214 HydrophobicContact CD1-CE3 3.51Å; F211-W214 AromaticContact CD1-CZ3 3.88Å; F211-W214 HydrophobicContact CD1-CZ3 3.88Å; F211-W214 AromaticContact CE1-CE3 3.64Å; F211-W214 HydrophobicContact CE1-CE3 3.64Å; F211-W214 AromaticContact CE1-CZ3 3.51Å; F211-W214 HydrophobicContact CE1-CZ3 3.51Å; F211-W214 HydrophobicContact CG-CE3 4.33Å; F211-W214 HydrophobicContact CZ-CZ3 4.04Å; W214-S216 PolarHBondContact O-N 2.97Å; W214-S216 VanDerWaalsContact O-N 3.16Å; W214-A217 CarbonylContact O-C 3.49Å; W214-A217 PolarHBondContact O-N 2.94Å; W214-A217 VanDerWaalsContact O-N 3.07Å; W214-L218 VanDerWaalsContact O-CG 3.23Å; W214-L218 WeakPolarHBondContact O-CG 3.47Å; W214-L218 PolarHBondContact O-N 2.63Å; W214-V239 HydrophobicContact CZ2-CG1 4.27Å; W214-L240 HydrophobicContact CD2-CB 4.46Å; W214-L240 HydrophobicContact CD2-CD1 3.97Å; W214-L240 HydrophobicContact CE3-CD1 3.55Å; W214-L240 HydrophobicContact CH2-CD1 4.09Å; W214-L240 HydrophobicContact CZ2-CB 4.45Å; W214-L240 HydrophobicContact CZ2-CD1 4.49Å; W214-L240 HydrophobicContact CZ3-CD1 3.59Å; W214-V243 HydrophobicContact CH2-CB 4.12Å; W214-V243 HydrophobicContact CH2-CG1 4.01Å; W214-V243 HydrophobicContact CH2-CG2 4Å; W214-V243 HydrophobicContact CZ3-CG1 4.38Å
215	R	88.7	Confident	85.5	Confident	131 Å²	131	37.5 Å²	37.5	49%	0.494	19%	0.188	S	C	.	.	H	α-helix	trans	-53.1	-41.8	178.8	179	177.6	-173.5	-160.9	0.6	112.2	F211 L213 K219 T277	F211-R215 WeakPolarHBondContact O-CB 3.33Å; F211-R215 PolarHBondContact O-N 3.35Å; L213-R215 PolarHBondContact O-N 3.48Å; R215-K219 WeakPolarHBondContact O-CG 3.29Å; R215-K219 PolarHBondContact O-N 2.87Å; R215-T277 HydrophobicContact CG-CG2 4Å
216	S	88.5	Confident	84.6	Confident	38 Å²	38	36.6 Å²	36.6	27%	0.266	18%	0.181	S	C	.	.	H	α-helix	trans	-72.4	-41	-179.8	-56.2	0	0	0	0	111.5	L157 R212 L213 W214 K219 A220	L157-S216 WeakPolarHBondContact CD2-OG 3.36Å; R212-S216 PolarHBondContact O-N 2.89Å; R212-S216 VanDerWaalsContact O-N 3.16Å; R212-S216 PolarHBondContact O-OG 3.39Å; L213-S216 PolarHBondContact O-N 3.4Å; L213-S216 VanDerWaalsContact O-N 3.15Å; W214-S216 PolarHBondContact O-N 2.97Å; W214-S216 VanDerWaalsContact O-N 3.16Å; S216-K219 PolarHBondContact O-N 3.39Å; S216-A220 WeakPolarHBondContact O-CB 3.3Å; S216-A220 PolarHBondContact O-N 3.13Å
217	A	87.7	Confident	83.5	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-48.7	173.8	0	0	0	0	0	111.5	L170 W177 L213 W214 K219 A220 Y221 A236	L170-A217 HydrophobicContact CD2-CB 4.04Å; W177-A217 HydrophobicContact CH2-CB 3.72Å; W177-A217 HydrophobicContact CZ2-CB 3.58Å; L213-A217 WeakPolarHBondContact O-CB 3.38Å; L213-A217 PolarHBondContact O-N 2.87Å; W214-A217 CarbonylContact O-C 3.49Å; W214-A217 PolarHBondContact O-N 2.94Å; W214-A217 VanDerWaalsContact O-N 3.07Å; A217-K219 VanDerWaalsContact C-N 3.3Å; A217-K219 PolarHBondContact O-N 3.45Å; A217-A220 CarbonylContact O-C 3.5Å; A217-A220 WeakPolarHBondContact O-CA 3.45Å; A217-A220 WeakPolarHBondContact O-CB 3.38Å; A217-A220 PolarHBondContact O-N 3.21Å; A217-Y221 HydrophobicContact CB-CD2 4.43Å; A217-Y221 HydrophobicContact CB-CE2 4.26Å; A217-Y221 WeakPolarHBondContact O-CD2 3.39Å; A217-Y221 PolarHBondContact O-N 3.39Å; A217-A236 HydrophobicContact CB-CB 4.48Å
218	L	84.9	Confident	82.1	Confident	2 Å²	2	53 Å²	53	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-56.6	-43.5	178	-63.1	175.5	0	0	0	111.6	W214 Y221 T222 A236 F237 L240 L281	W214-L218 VanDerWaalsContact O-CG 3.23Å; W214-L218 WeakPolarHBondContact O-CG 3.47Å; W214-L218 PolarHBondContact O-N 2.63Å; L218-Y221 WeakPolarHBondContact O-CB 3.49Å; L218-Y221 PolarHBondContact O-N 2.99Å; L218-T222 PolarHBondContact O-N 3.12Å; L218-A236 HydrophobicContact CD2-CB 3.79Å; L218-F237 HydrophobicContact CB-CE1 4.38Å; L218-F237 HydrophobicContact CB-CE2 4.08Å; L218-F237 HydrophobicContact CB-CZ 3.8Å; L218-F237 HydrophobicContact CD2-CB 4.22Å; L218-F237 HydrophobicContact CD2-CD1 3.66Å; L218-F237 HydrophobicContact CD2-CD2 3.25Å; L218-F237 HydrophobicContact CD2-CE1 3.71Å; L218-F237 HydrophobicContact CD2-CE2 3.29Å; L218-F237 HydrophobicContact CD2-CG 3.42Å; L218-F237 VanDerWaalsContact CD2-CG 3.42Å; L218-F237 HydrophobicContact CD2-CZ 3.52Å; L218-F237 HydrophobicContact CG-CE1 4.49Å; L218-F237 HydrophobicContact CG-CE2 4.26Å; L218-F237 HydrophobicContact CG-CZ 4.21Å; L218-L240 HydrophobicContact CD1-CD2 3.69Å; L218-L281 HydrophobicContact CB-CD1 3.47Å; L218-L281 VanDerWaalsContact CB-CD1 3.47Å; L218-L281 HydrophobicContact CD1-CD1 4.22Å; L218-L281 HydrophobicContact CG-CD1 4.5Å
219	K	85.2	Confident	80.7	Confident	98 Å²	98	49.4 Å²	49.4	43%	0.426	23%	0.233	S	C	.	.	H	α-helix	trans	-63.2	-43.5	173.5	-74.6	177.4	176.5	-174.2	0	111.7	R215 S216 A217 Y221 T222 L281	R215-K219 WeakPolarHBondContact O-CG 3.29Å; R215-K219 PolarHBondContact O-N 2.87Å; S216-K219 PolarHBondContact O-N 3.39Å; A217-K219 VanDerWaalsContact C-N 3.3Å; A217-K219 PolarHBondContact O-N 3.45Å; K219-Y221 VanDerWaalsContact C-N 3.34Å; K219-Y221 PolarHBondContact O-N 3.34Å; K219-T222 PolarHBondContact O-N 3Å; K219-T222 PolarHBondContact O-OG1 3.44Å; K219-L281 HydrophobicContact CG-CD1 4.41Å; K219-L281 HydrophobicContact CG-CD2 4.5Å
220	A	83.3	Confident	79	Confident	11 Å²	11	54.2 Å²	54.2	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-41.3	177.8	0	0	0	0	0	111.6	L160 T166 L170 S216 A217 T222 T223	L160-A220 HydrophobicContact CD2-CB 4.14Å; T166-A220 HydrophobicContact CG2-CB 3.75Å; L170-A220 HydrophobicContact CD1-CB 3.96Å; L170-A220 HydrophobicContact CD2-CB 4.32Å; S216-A220 WeakPolarHBondContact O-CB 3.3Å; S216-A220 PolarHBondContact O-N 3.13Å; A217-A220 CarbonylContact O-C 3.5Å; A217-A220 WeakPolarHBondContact O-CA 3.45Å; A217-A220 WeakPolarHBondContact O-CB 3.38Å; A217-A220 PolarHBondContact O-N 3.21Å; A220-T222 VanDerWaalsContact C-N 3.28Å; A220-T222 PolarHBondContact O-N 3.41Å; A220-T223 PolarHBondContact O-N 2.75Å; A220-T223 PolarHBondContact O-OG1 3.43Å
221	Y	81.2	Confident	77.1	Confident	3 Å²	3	61.6 Å²	61.6	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-54.7	-41.6	173.3	-83.1	-75.3	0	0	0	112	L170 W177 A217 L218 K219 T223 V224 M229 C235 A236 F237	L170-Y221 HydrophobicContact CB-CE1 4.3Å; L170-Y221 HydrophobicContact CD1-CD1 4.25Å; L170-Y221 HydrophobicContact CD1-CD2 4.49Å; L170-Y221 HydrophobicContact CD1-CE1 4.38Å; L170-Y221 HydrophobicContact CD1-CG 4.24Å; L170-Y221 HydrophobicContact CD2-CD2 4.06Å; L170-Y221 HydrophobicContact CD2-CE2 3.7Å; L170-Y221 PolarHBondContact O-OH 3.17Å; W177-Y221 PolarHBondContact NE1-OH 2.84Å; A217-Y221 HydrophobicContact CB-CD2 4.43Å; A217-Y221 HydrophobicContact CB-CE2 4.26Å; A217-Y221 WeakPolarHBondContact O-CD2 3.39Å; A217-Y221 PolarHBondContact O-N 3.39Å; L218-Y221 WeakPolarHBondContact O-CB 3.49Å; L218-Y221 PolarHBondContact O-N 2.99Å; K219-Y221 VanDerWaalsContact C-N 3.34Å; K219-Y221 PolarHBondContact O-N 3.34Å; Y221-T223 PolarHBondContact O-N 2.85Å; Y221-T223 VanDerWaalsContact O-N 3.09Å; Y221-V224 PolarHBondContact O-N 3.27Å; Y221-V224 VanDerWaalsContact O-N 3.15Å; Y221-M229 HydrophobicContact CD1-CE 3.05Å; Y221-M229 HydrophobicContact CD1-SD 3.56Å; Y221-M229 VanDerWaalsContact CD1-SD 3.56Å; Y221-M229 HydrophobicContact CE1-CE 3.35Å; Y221-M229 HydrophobicContact CE1-SD 3.49Å; Y221-M229 WeakPolarHBondContact CE1-SD 3.37Å; Y221-M229 HydrophobicContact CG-CE 3.98Å; Y221-C235 HydrophobicContact CE1-CB 4.17Å; Y221-A236 HydrophobicContact CD2-CB 4.16Å; Y221-A236 HydrophobicContact CE2-CB 3.62Å; Y221-F237 HydrophobicContact CD2-CD2 4.41Å; Y221-F237 HydrophobicContact CD2-CE2 4.03Å; Y221-F237 AromaticContact CG-CE2 3.99Å; Y221-F237 HydrophobicContact CG-CE2 3.99Å
222	T	78.4	Confident	75.2	Confident	45 Å²	45	62.6 Å²	62.6	28%	0.276	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-4.5	177.1	61.1	0	0	0	0	115	L218 K219 A220 F237 L281 H287	L218-T222 PolarHBondContact O-N 3.12Å; K219-T222 PolarHBondContact O-N 3Å; K219-T222 PolarHBondContact O-OG1 3.44Å; A220-T222 VanDerWaalsContact C-N 3.28Å; A220-T222 PolarHBondContact O-N 3.41Å; T222-F237 HydrophobicContact CG2-CZ 4.49Å; T222-L281 HydrophobicContact CG2-CD2 4.29Å; T222-H287 PolarHBondContact O-NE2 2.83Å
223	T	78.4	Confident	73.3	Confident	99 Å²	99	70.7 Å²	70.7	61%	0.607	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-6.8	175.8	67.4	0	0	0	0	113.2	A220 Y221	A220-T223 PolarHBondContact O-N 2.75Å; A220-T223 PolarHBondContact O-OG1 3.43Å; Y221-T223 PolarHBondContact O-N 2.85Å; Y221-T223 VanDerWaalsContact O-N 3.09Å
224	V	75.2	Confident	71.8	Confident	10 Å²	10	74.2 Å²	74.2	6%	0.061	36%	0.355	C	S	.	.	S	Bend	trans	-101.4	132.3	-177.1	-177.6	0	0	0	0	109.7	T166 V167 L170 Y221 R228 M229 H287	T166-V224 HydrophobicContact CG2-CG2 4.25Å; V167-V224 HydrophobicContact CG2-CG1 4.02Å; V167-V224 HydrophobicContact CG2-CG2 4.18Å; L170-V224 HydrophobicContact CD1-CG2 4.1Å; Y221-V224 PolarHBondContact O-N 3.27Å; Y221-V224 VanDerWaalsContact O-N 3.15Å; V224-R228 HydrophobicContact CG1-CB 3.85Å; V224-M229 HydrophobicContact CB-CE 3.58Å; V224-M229 HydrophobicContact CB-CG 4.15Å; V224-M229 HydrophobicContact CG1-CE 3.75Å; V224-M229 HydrophobicContact CG1-CG 3.79Å; V224-M229 HydrophobicContact CG1-SD 4.39Å; V224-M229 HydrophobicContact CG2-CE 3.78Å; V224-H287 PolarHBondContact O-CE1 2.97Å
225	D	68.9	Low	70.9	Confident	97 Å²	97	74.7 Å²	74.7	52%	0.519	36%	0.358	S	S	.	.			trans	-58	138.9	176.7	-173.9	1.4	0	0	0	112	K227 R228	D225-K227 PolarHBondContact O-N 3.45Å; D225-K227 VanDerWaalsContact O-N 3.16Å; D225-R228 WeakPolarHBondContact O-CB 3.36Å; D225-R228 PolarHBondContact O-N 3.33Å
226	D	66	Low	70.3	Confident	46 Å²	46	68.5 Å²	68.5	25%	0.246	34%	0.335	C	S	.	.	H	α-helix	trans	-51.6	-40.9	-178.2	-78.3	-25	0	0	0	112	R228 M229 D230 H287 W289	D226-R228 PolarHBondContact O-N 3.04Å; D226-R228 VanDerWaalsContact O-N 3.1Å; D226-M229 PolarHBondContact O-N 2.89Å; D226-D230 PolarHBondContact O-N 3.02Å; D226-D230 VanDerWaalsContact O-N 3.11Å; D226-H287 WeakPolarHBondContact OD1-CB 3.32Å; D226-H287 IonicContact OD1-CE1 3.87Å; D226-H287 IonicContact OD1-CG 2.6Å; D226-H287 IonicContact OD1-ND1 3.94Å; D226-H287 PolarHBondContact OD1-ND1 2.86Å; D226-H287 IonicContact OD2-ND1 2.8Å; D226-W289 PolarHBondContact OD1-NE1 3.15Å
227	K	65	Low	70	Confident	176 Å²	176	66.7 Å²	66.7	77%	0.765	32%	0.322	S	S	*	.	H	α-helix	trans	-60	-25.9	-180	-69.1	-175.7	-179.5	177.4	0	113.7	D225	D225-K227 PolarHBondContact O-N 3.45Å; D225-K227 VanDerWaalsContact O-N 3.16Å
228	R	60.7	Low	69.6	Low	168 Å²	168	69.2 Å²	69.2	63%	0.634	34%	0.338	S	S	*	.	H	α-helix	trans	-86.3	-15.9	177	-65.4	-173.6	177.2	-170.9	-1.3	112.2	V224 D225 D226	V224-R228 HydrophobicContact CG1-CB 3.85Å; D225-R228 WeakPolarHBondContact O-CB 3.36Å; D225-R228 PolarHBondContact O-N 3.33Å; D226-R228 PolarHBondContact O-N 3.04Å; D226-R228 VanDerWaalsContact O-N 3.1Å
229	M	59.1	Low	69.8	Low	12 Å²	12	69.5 Å²	69.5	6%	0.059	34%	0.34	C	S	.	.	H	α-helix	trans	-105.3	-17.3	-171.4	-77	-64.3	-167.5	0	0	115.1	L170 Y221 V224 D226 N231 T232	L170-M229 HydrophobicContact CB-CE 4.14Å; L170-M229 HydrophobicContact CD1-CE 3.43Å; L170-M229 VanDerWaalsContact CD1-CE 3.43Å; L170-M229 HydrophobicContact CG-CE 4.42Å; Y221-M229 HydrophobicContact CD1-CE 3.05Å; Y221-M229 HydrophobicContact CD1-SD 3.56Å; Y221-M229 VanDerWaalsContact CD1-SD 3.56Å; Y221-M229 HydrophobicContact CE1-CE 3.35Å; Y221-M229 HydrophobicContact CE1-SD 3.49Å; Y221-M229 WeakPolarHBondContact CE1-SD 3.37Å; Y221-M229 HydrophobicContact CG-CE 3.98Å; V224-M229 HydrophobicContact CB-CE 3.58Å; V224-M229 HydrophobicContact CB-CG 4.15Å; V224-M229 HydrophobicContact CG1-CE 3.75Å; V224-M229 HydrophobicContact CG1-CG 3.79Å; V224-M229 HydrophobicContact CG1-SD 4.39Å; V224-M229 HydrophobicContact CG2-CE 3.78Å; D226-M229 PolarHBondContact O-N 2.89Å; M229-N231 PolarHBondContact O-N 3.16Å; M229-T232 PolarHBondContact O-N 2.95Å; M229-T232 PolarHBondContact O-OG1 3.3Å
230	D	53.7	Low	69.9	Low	127 Å²	127	64.9 Å²	64.9	68%	0.679	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-16.6	-178.2	-85	-21.6	0	0	0	114.8	D226	D226-D230 PolarHBondContact O-N 3.02Å; D226-D230 VanDerWaalsContact O-N 3.11Å
231	N	50.6	Low	70.2	Confident	157 Å²	157	64.8 Å²	64.8	84%	0.84	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-9.5	179.5	-70.8	-17.7	0	0	0	115.7	M229 R233	M229-N231 PolarHBondContact O-N 3.16Å; N231-R233 PolarHBondContact O-N 3.35Å
232	T	51.2	Low	70.6	Confident	30 Å²	30	68.1 Å²	68.1	18%	0.184	34%	0.336	C	S	.	.			trans	-101.2	79.7	-179.7	60.6	0	0	0	0	111.1	M229 D234 C235	M229-T232 PolarHBondContact O-N 2.95Å; M229-T232 PolarHBondContact O-OG1 3.3Å; T232-D234 PolarHBondContact O-N 3.37Å; T232-C235 PolarHBondContact O-N 3.49Å
233	R	51.7	Low	71.3	Confident	231 Å²	231	66 Å²	66	87%	0.872	32%	0.323	S	S	*	.	S	Bend	trans	-55.2	-33.6	169.2	-81.5	-174.6	177	-176.3	-0.7	111.9	N231 C235	N231-R233 PolarHBondContact O-N 3.35Å; R233-C235 PolarHBondContact O-N 3.48Å
234	D	59.5	Low	71.9	Confident	76 Å²	76	61.3 Å²	61.3	41%	0.406	29%	0.294	S	S	.	.	S	Bend	trans	-99.6	67.7	176.6	-60.7	-32.5	0	0	0	110.1	N178 T232	N178-D234 PolarHBondContact ND2-OD2 3.13Å; T232-D234 PolarHBondContact O-N 3.37Å
235	C	71.2	Confident	72.5	Confident	12 Å²	12	63.2 Å²	63.2	8%	0.081	30%	0.302	C	S	.	.			trans	-83.8	161.8	174.2	77	0	0	0	0	111.1	Y221 T232 R233 F237 T238 V239	Y221-C235 HydrophobicContact CE1-CB 4.17Å; T232-C235 PolarHBondContact O-N 3.49Å; R233-C235 PolarHBondContact O-N 3.48Å; C235-F237 PolarHBondContact O-N 2.94Å; C235-T238 PolarHBondContact O-N 3.45Å; C235-T238 PolarHBondContact O-OG1 3.4Å; C235-T238 VanDerWaalsContact O-OG1 3.07Å; C235-V239 PolarHBondContact O-N 3.15Å
236	A	75.8	Confident	73.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-52.1	-30.5	178.5	0	0	0	0	0	113.6	W177 A217 L218 Y221 L240	W177-A236 HydrophobicContact CD2-CB 4.13Å; W177-A236 HydrophobicContact CH2-CB 4.4Å; W177-A236 HydrophobicContact CZ2-CB 3.8Å; A217-A236 HydrophobicContact CB-CB 4.48Å; L218-A236 HydrophobicContact CD2-CB 3.79Å; Y221-A236 HydrophobicContact CD2-CB 4.16Å; Y221-A236 HydrophobicContact CE2-CB 3.62Å; A236-L240 WeakPolarHBondContact O-CB 3.41Å; A236-L240 PolarHBondContact O-N 3.01Å
237	F	81.8	Confident	74.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-70.1	-50.3	-177.2	-69.4	-105.7	0	0	0	112.5	L218 Y221 T222 C235 V239 L240 V241 L278 L281 V282 W289 L293	L218-F237 HydrophobicContact CB-CE1 4.38Å; L218-F237 HydrophobicContact CB-CE2 4.08Å; L218-F237 HydrophobicContact CB-CZ 3.8Å; L218-F237 HydrophobicContact CD2-CB 4.22Å; L218-F237 HydrophobicContact CD2-CD1 3.66Å; L218-F237 HydrophobicContact CD2-CD2 3.25Å; L218-F237 HydrophobicContact CD2-CE1 3.71Å; L218-F237 HydrophobicContact CD2-CE2 3.29Å; L218-F237 HydrophobicContact CD2-CG 3.42Å; L218-F237 VanDerWaalsContact CD2-CG 3.42Å; L218-F237 HydrophobicContact CD2-CZ 3.52Å; L218-F237 HydrophobicContact CG-CE1 4.49Å; L218-F237 HydrophobicContact CG-CE2 4.26Å; L218-F237 HydrophobicContact CG-CZ 4.21Å; Y221-F237 HydrophobicContact CD2-CD2 4.41Å; Y221-F237 HydrophobicContact CD2-CE2 4.03Å; Y221-F237 AromaticContact CG-CE2 3.99Å; Y221-F237 HydrophobicContact CG-CE2 3.99Å; T222-F237 HydrophobicContact CG2-CZ 4.49Å; C235-F237 PolarHBondContact O-N 2.94Å; F237-V239 PolarHBondContact O-N 3.31Å; F237-L240 PolarHBondContact O-N 3.26Å; F237-V241 WeakPolarHBondContact O-CG2 3.43Å; F237-V241 PolarHBondContact O-N 2.97Å; F237-L278 HydrophobicContact CB-CD1 4.45Å; F237-L278 HydrophobicContact CD1-CD1 3.53Å; F237-L278 HydrophobicContact CE1-CD1 4.2Å; F237-L278 HydrophobicContact CG-CD1 4.36Å; F237-L281 HydrophobicContact CE1-CB 4.26Å; F237-V282 HydrophobicContact CD1-CG2 4Å; F237-V282 HydrophobicContact CE1-CG2 4.18Å; F237-W289 HydrophobicContact CB-CZ3 4.45Å; F237-W289 AromaticContact CD1-CZ3 3.95Å; F237-W289 HydrophobicContact CD1-CZ3 3.95Å; F237-W289 HydrophobicContact CD2-CE3 4.46Å; F237-W289 AromaticContact CD2-CH2 3.75Å; F237-W289 HydrophobicContact CD2-CH2 3.75Å; F237-W289 AromaticContact CD2-CZ3 3.37Å; F237-W289 HydrophobicContact CD2-CZ3 3.37Å; F237-W289 HydrophobicContact CE1-CH2 4.22Å; F237-W289 AromaticContact CE1-CZ3 4Å; F237-W289 HydrophobicContact CE1-CZ3 4Å; F237-W289 AromaticContact CE2-CH2 3.29Å; F237-W289 HydrophobicContact CE2-CH2 3.29Å; F237-W289 AromaticContact CE2-CZ3 3.43Å; F237-W289 HydrophobicContact CE2-CZ3 3.43Å; F237-W289 VanDerWaalsContact CE2-CZ3 3.43Å; F237-W289 HydrophobicContact CG-CH2 4.4Å; F237-W289 AromaticContact CG-CZ3 3.67Å; F237-W289 HydrophobicContact CG-CZ3 3.67Å; F237-W289 AromaticContact CZ-CH2 3.57Å; F237-W289 HydrophobicContact CZ-CH2 3.57Å; F237-W289 AromaticContact CZ-CZ3 3.76Å; F237-W289 HydrophobicContact CZ-CZ3 3.76Å; F237-L293 HydrophobicContact CB-CD1 3.43Å; F237-L293 VanDerWaalsContact CB-CD1 3.43Å; F237-L293 HydrophobicContact CD1-CD1 4Å; F237-L293 HydrophobicContact CG-CD1 4.05Å
238	T	80.6	Confident	75.6	Confident	53 Å²	53	48.6 Å²	48.6	33%	0.325	23%	0.233	S	C	.	.	H	α-helix	trans	-64.1	-44.4	-175.4	49.2	0	0	0	0	110.8	C235 V241 D242 L293	C235-T238 PolarHBondContact O-N 3.45Å; C235-T238 PolarHBondContact O-OG1 3.4Å; C235-T238 VanDerWaalsContact O-OG1 3.07Å; T238-V241 PolarHBondContact O-N 3.17Å; T238-D242 PolarHBondContact O-N 3.27Å; T238-L293 HydrophobicContact CG2-CD2 4.23Å
239	V	87.4	Confident	76.6	Confident	8 Å²	8	41.4 Å²	41.4	5%	0.048	21%	0.208	C	C	.	.	H	α-helix	trans	-65.5	-43	176.7	-175.7	0	0	0	0	111.4	W177 N178 W214 C235 F237 V241 D242 V243	W177-V239 HydrophobicContact CB-CB 4.24Å; W177-V239 HydrophobicContact CB-CG1 4.46Å; W177-V239 HydrophobicContact CB-CG2 3.84Å; W177-V239 WeakPolarHBondContact O-CG1 3.21Å; N178-V239 WeakPolarHBondContact OD1-CG2 3.26Å; W214-V239 HydrophobicContact CZ2-CG1 4.27Å; C235-V239 PolarHBondContact O-N 3.15Å; F237-V239 PolarHBondContact O-N 3.31Å; V239-V241 PolarHBondContact O-N 2.99Å; V239-D242 PolarHBondContact O-N 3.01Å; V239-V243 HydrophobicContact CG1-CG2 4.24Å; V239-V243 WeakPolarHBondContact O-CB 3.5Å; V239-V243 VanDerWaalsContact O-CG2 3.26Å; V239-V243 WeakPolarHBondContact O-CG2 3.29Å; V239-V243 PolarHBondContact O-N 2.92Å
240	L	89.3	Confident	77.8	Confident	1 Å²	1	45 Å²	45	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-43.8	178.3	176.2	63.3	0	0	0	111.7	F211 W214 L218 A236 F237 D242 V243 L244 L278	F211-L240 HydrophobicContact CD1-CD1 4.26Å; F211-L240 HydrophobicContact CE1-CD1 3.73Å; W214-L240 HydrophobicContact CD2-CB 4.46Å; W214-L240 HydrophobicContact CD2-CD1 3.97Å; W214-L240 HydrophobicContact CE3-CD1 3.55Å; W214-L240 HydrophobicContact CH2-CD1 4.09Å; W214-L240 HydrophobicContact CZ2-CB 4.45Å; W214-L240 HydrophobicContact CZ2-CD1 4.49Å; W214-L240 HydrophobicContact CZ3-CD1 3.59Å; L218-L240 HydrophobicContact CD1-CD2 3.69Å; A236-L240 WeakPolarHBondContact O-CB 3.41Å; A236-L240 PolarHBondContact O-N 3.01Å; F237-L240 PolarHBondContact O-N 3.26Å; L240-D242 VanDerWaalsContact C-N 3.3Å; L240-D242 PolarHBondContact O-N 3.28Å; L240-V243 PolarHBondContact O-N 2.64Å; L240-L244 HydrophobicContact CD1-CD1 4Å; L240-L244 HydrophobicContact CD1-CD2 4.16Å; L240-L244 HydrophobicContact CD1-CG 3.78Å; L240-L244 HydrophobicContact CD2-CD1 4.46Å; L240-L244 HydrophobicContact CG-CD1 3.87Å; L240-L244 HydrophobicContact CG-CG 4.1Å; L240-L244 WeakPolarHBondContact O-CB 3.32Å; L240-L244 WeakPolarHBondContact O-CG 3.42Å; L240-L244 PolarHBondContact O-N 3.23Å; L240-L278 HydrophobicContact CD2-CB 4.36Å
241	V	87.9	Confident	79.3	Confident	10 Å²	10	39.8 Å²	39.8	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-55.7	-48.3	177.5	172.5	0	0	0	0	110.7	F237 T238 V239 L244 H245 L278 I296 V297	F237-V241 WeakPolarHBondContact O-CG2 3.43Å; F237-V241 PolarHBondContact O-N 2.97Å; T238-V241 PolarHBondContact O-N 3.17Å; V239-V241 PolarHBondContact O-N 2.99Å; V241-L244 PolarHBondContact O-N 2.98Å; V241-H245 WeakPolarHBondContact O-CB 3.27Å; V241-H245 PolarHBondContact O-N 3.13Å; V241-L278 HydrophobicContact CB-CD2 4.49Å; V241-L278 HydrophobicContact CG2-CD1 4.33Å; V241-L278 HydrophobicContact CG2-CD2 3.55Å; V241-L278 HydrophobicContact CG2-CG 4.46Å; V241-I296 HydrophobicContact CG1-CB 4.31Å; V241-I296 HydrophobicContact CG1-CG2 3.42Å; V241-I296 VanDerWaalsContact CG1-CG2 3.42Å; V241-V297 HydrophobicContact CG2-CG2 4.23Å
242	D	89.8	Confident	80.5	Confident	73 Å²	73	32.7 Å²	32.7	39%	0.39	16%	0.157	S	C	.	.	H	α-helix	trans	-64.1	-45.1	179.6	170.3	47.1	0	0	0	111.8	K185 T238 V239 L240 L244 H245 V246	K185-D242 WeakPolarHBondContact CE-OD2 3.43Å; K185-D242 IonicContact NZ-OD1 2.97Å; K185-D242 PolarHBondContact NZ-OD1 2.74Å; K185-D242 IonicContact NZ-OD2 2.77Å; K185-D242 PolarHBondContact NZ-OD2 3.47Å; T238-D242 PolarHBondContact O-N 3.27Å; V239-D242 PolarHBondContact O-N 3.01Å; L240-D242 VanDerWaalsContact C-N 3.3Å; L240-D242 PolarHBondContact O-N 3.28Å; D242-L244 PolarHBondContact O-N 3.31Å; D242-H245 PolarHBondContact O-N 3.23Å; D242-V246 WeakPolarHBondContact O-CG2 3.11Å; D242-V246 PolarHBondContact O-N 3.36Å
243	V	92.6	Very high	81.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.4	-45.3	174.8	170.6	0	0	0	0	111.7	G181 I184 K185 W214 V239 L240 V246 C247 F271	G181-V243 VanDerWaalsContact CA-CG2 3.45Å; I184-V243 HydrophobicContact CB-CG1 4.24Å; I184-V243 HydrophobicContact CG2-CG1 3.69Å; K185-V243 HydrophobicContact CG-CG2 4.4Å; W214-V243 HydrophobicContact CH2-CB 4.12Å; W214-V243 HydrophobicContact CH2-CG1 4.01Å; W214-V243 HydrophobicContact CH2-CG2 4Å; W214-V243 HydrophobicContact CZ3-CG1 4.38Å; V239-V243 HydrophobicContact CG1-CG2 4.24Å; V239-V243 WeakPolarHBondContact O-CB 3.5Å; V239-V243 VanDerWaalsContact O-CG2 3.26Å; V239-V243 WeakPolarHBondContact O-CG2 3.29Å; V239-V243 PolarHBondContact O-N 2.92Å; L240-V243 PolarHBondContact O-N 2.64Å; V243-V246 PolarHBondContact O-N 3.35Å; V243-C247 VanDerWaalsContact O-CB 3.3Å; V243-C247 WeakPolarHBondContact O-CB 3.47Å; V243-C247 PolarHBondContact O-N 3.38Å; V243-C247 PolarHBondContact O-SG 2.99Å; V243-F271 HydrophobicContact CG1-CE1 3.98Å
244	L	91.6	Very high	83	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63	-43.6	178.2	-70	176.5	0	0	0	111.2	F211 L240 V241 D242 L248 F271 L275 L278 L300	F211-L244 HydrophobicContact CE1-CD2 4.31Å; L240-L244 HydrophobicContact CD1-CD1 4Å; L240-L244 HydrophobicContact CD1-CD2 4.16Å; L240-L244 HydrophobicContact CD1-CG 3.78Å; L240-L244 HydrophobicContact CD2-CD1 4.46Å; L240-L244 HydrophobicContact CG-CD1 3.87Å; L240-L244 HydrophobicContact CG-CG 4.1Å; L240-L244 WeakPolarHBondContact O-CB 3.32Å; L240-L244 WeakPolarHBondContact O-CG 3.42Å; L240-L244 PolarHBondContact O-N 3.23Å; V241-L244 PolarHBondContact O-N 2.98Å; D242-L244 PolarHBondContact O-N 3.31Å; L244-L248 HydrophobicContact CB-CD1 4.31Å; L244-L248 HydrophobicContact CD2-CD1 4.17Å; L244-L248 WeakPolarHBondContact O-CB 3.46Å; L244-L248 VanDerWaalsContact O-CG 3.32Å; L244-L248 WeakPolarHBondContact O-CG 3.33Å; L244-L248 PolarHBondContact O-N 2.79Å; L244-F271 HydrophobicContact CD2-CB 3.88Å; L244-F271 HydrophobicContact CD2-CD1 3.74Å; L244-F271 HydrophobicContact CD2-CG 4.2Å; L244-F271 VanDerWaalsContact CD2-O 3.3Å; L244-F271 WeakPolarHBondContact CD2-O 3.43Å; L244-L275 HydrophobicContact CD1-CB 4.03Å; L244-L275 HydrophobicContact CD1-CD1 4.27Å; L244-L278 HydrophobicContact CD1-CD2 3.88Å; L244-L300 HydrophobicContact CB-CD2 3.82Å
245	H	89	Confident	83.7	Confident	50 Å²	50	28.4 Å²	28.4	23%	0.231	15%	0.146	C	C	.	.	H	α-helix	trans	-59.5	-56.2	175.8	180	-106.7	0	0	0	110.7	V241 D242 C247 L248 T249 E250 L300 E303	V241-H245 WeakPolarHBondContact O-CB 3.27Å; V241-H245 PolarHBondContact O-N 3.13Å; D242-H245 PolarHBondContact O-N 3.23Å; H245-C247 VanDerWaalsContact C-N 3.33Å; H245-C247 PolarHBondContact O-N 2.86Å; H245-L248 PolarHBondContact O-N 3.49Å; H245-T249 PolarHBondContact CD2-OG1 3.26Å; H245-T249 VanDerWaalsContact CD2-OG1 3.25Å; H245-T249 PolarHBondContact NE2-OG1 2.89Å; H245-T249 PolarHBondContact O-N 3.12Å; H245-T249 PolarHBondContact O-OG1 3.22Å; H245-E250 IonicContact CE1-OE1 3.56Å; H245-E250 PolarHBondContact CE1-OE1 2.96Å; H245-E250 IonicContact ND1-OE1 3.81Å; H245-E250 PolarHBondContact ND1-OE1 3.15Å; H245-E250 PolarHBondContact O-N 3.24Å; H245-L300 HydrophobicContact CB-CD1 4.16Å; H245-E303 IonicContact CD2-OE2 2.72Å; H245-E303 IonicContact NE2-OE2 2.77Å; H245-E303 PolarHBondContact NE2-OE2 3.43Å
246	V	90	Very high	83.5	Confident	11 Å²	11	29.3 Å²	29.3	7%	0.067	15%	0.152	C	C	.	.	I	π-helix	trans	-56.8	-47.3	-178.7	173.1	0	0	0	0	111.7	K185 D242 V243 E250 Y251	K185-V246 HydrophobicContact CD-CB 4.33Å; K185-V246 HydrophobicContact CD-CG1 4.15Å; K185-V246 HydrophobicContact CD-CG2 4.39Å; K185-V246 HydrophobicContact CG-CB 4.4Å; K185-V246 HydrophobicContact CG-CG1 4.1Å; D242-V246 WeakPolarHBondContact O-CG2 3.11Å; D242-V246 PolarHBondContact O-N 3.36Å; V243-V246 PolarHBondContact O-N 3.35Å; V246-E250 PolarHBondContact O-N 2.94Å; V246-Y251 HydrophobicContact CG1-CD1 3.89Å; V246-Y251 HydrophobicContact CG1-CD2 4.16Å; V246-Y251 HydrophobicContact CG1-CE1 3.53Å; V246-Y251 HydrophobicContact CG1-CE2 3.77Å; V246-Y251 HydrophobicContact CG1-CG 4.22Å; V246-Y251 VanDerWaalsContact CG1-CZ 3.47Å; V246-Y251 WeakPolarHBondContact O-CB 3.49Å; V246-Y251 PolarHBondContact O-N 3.16Å
247	C	89.1	Confident	83.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.185	C	C	.	.	I	π-helix	trans	-79	-34	-172.9	-61	0	0	0	0	113.8	V188 V243 H245 Y251 F252 F271	V188-C247 HydrophobicContact CG1-CB 4.17Å; V243-C247 VanDerWaalsContact O-CB 3.3Å; V243-C247 WeakPolarHBondContact O-CB 3.47Å; V243-C247 PolarHBondContact O-N 3.38Å; V243-C247 PolarHBondContact O-SG 2.99Å; H245-C247 VanDerWaalsContact C-N 3.33Å; H245-C247 PolarHBondContact O-N 2.86Å; C247-Y251 HydrophobicContact CB-CD2 4.47Å; C247-F252 WeakPolarHBondContact O-CD2 3.33Å; C247-F252 WeakPolarHBondContact O-CE2 3.34Å; C247-F271 HydrophobicContact CB-CD1 3.7Å; C247-F271 HydrophobicContact CB-CE1 3.29Å; C247-F271 HydrophobicContact CB-CZ 4.04Å; C247-F271 VanDerWaalsContact SG-CE1 3.59Å
248	L	84.6	Confident	82.2	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	20%	0.198	C	C	.	.	I	π-helix	trans	-90.4	-29.8	-177	-63.8	174.2	0	0	0	113.3	L244 H245 F271 V272 L275 L304 L328	L244-L248 HydrophobicContact CB-CD1 4.31Å; L244-L248 HydrophobicContact CD2-CD1 4.17Å; L244-L248 WeakPolarHBondContact O-CB 3.46Å; L244-L248 VanDerWaalsContact O-CG 3.32Å; L244-L248 WeakPolarHBondContact O-CG 3.33Å; L244-L248 PolarHBondContact O-N 2.79Å; H245-L248 PolarHBondContact O-N 3.49Å; L248-F271 HydrophobicContact CD1-CB 4.06Å; L248-F271 HydrophobicContact CD2-CB 3.54Å; L248-F271 HydrophobicContact CD2-CG 4.28Å; L248-F271 HydrophobicContact CG-CB 3.92Å; L248-F271 HydrophobicContact CG-CD1 4.37Å; L248-V272 HydrophobicContact CD2-CG2 4.28Å; L248-L275 HydrophobicContact CD1-CD2 4.48Å; L248-L304 HydrophobicContact CB-CD1 4.4Å; L248-L304 HydrophobicContact CB-CD2 3.77Å; L248-L304 HydrophobicContact CD1-CD1 4.05Å; L248-L328 HydrophobicContact CD2-CD2 3.44Å; L248-L328 VanDerWaalsContact CD2-CD2 3.44Å
249	T	82.2	Confident	81.5	Confident	17 Å²	17	42.5 Å²	42.5	10%	0.104	21%	0.21	C	C	.	.	I	π-helix	trans	-114.5	-58.7	-176.4	63.7	0	0	0	0	112.3	H245 T253 L300 E303 L304	H245-T249 PolarHBondContact CD2-OG1 3.26Å; H245-T249 VanDerWaalsContact CD2-OG1 3.25Å; H245-T249 PolarHBondContact NE2-OG1 2.89Å; H245-T249 PolarHBondContact O-N 3.12Å; H245-T249 PolarHBondContact O-OG1 3.22Å; T249-T253 PolarHBondContact O-N 2.73Å; T249-T253 VanDerWaalsContact O-N 3.14Å; T249-T253 PolarHBondContact O-OG1 3.29Å; T249-L300 HydrophobicContact CG2-CD1 3.73Å; T249-E303 HydrophobicContact CG2-CB 4.36Å; T249-L304 HydrophobicContact CG2-CD2 3.64Å; T249-L304 HydrophobicContact CG2-CG 3.87Å
250	E	84.5	Confident	80.5	Confident	88 Å²	88	42.8 Å²	42.8	41%	0.411	21%	0.211	S	C	.	.	I	π-helix	trans	-65.8	-46.3	-170.4	-62.4	-172.1	-175.5	0	0	112.4	H245 V246 T253 K254	H245-E250 IonicContact CE1-OE1 3.56Å; H245-E250 PolarHBondContact CE1-OE1 2.96Å; H245-E250 IonicContact ND1-OE1 3.81Å; H245-E250 PolarHBondContact ND1-OE1 3.15Å; H245-E250 PolarHBondContact O-N 3.24Å; V246-E250 PolarHBondContact O-N 2.94Å; E250-T253 WeakPolarHBondContact O-CB 3.38Å; E250-T253 PolarHBondContact O-N 3.28Å; E250-T253 VanDerWaalsContact O-N 3.16Å; E250-K254 VanDerWaalsContact O-CB 3.25Å; E250-K254 WeakPolarHBondContact O-CB 3.46Å; E250-K254 PolarHBondContact O-N 3.18Å
251	Y	85.2	Confident	79.6	Confident	17 Å²	17	45.2 Å²	45.2	7%	0.067	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-42.3	-178.5	-76	-14.3	0	0	0	112.8	K185 V188 E189 I192 V246 C247 T253 K254 Y255	K185-Y251 HydrophobicContact CB-CE2 4.48Å; K185-Y251 VanDerWaalsContact O-CE2 3.29Å; K185-Y251 WeakPolarHBondContact O-CE2 3.36Å; K185-Y251 PolarHBondContact O-OH 2.94Å; K185-Y251 VanDerWaalsContact O-OH 3.13Å; V188-Y251 HydrophobicContact CB-CD2 4.4Å; V188-Y251 HydrophobicContact CB-CE2 4.31Å; V188-Y251 HydrophobicContact CG1-CD2 3.87Å; V188-Y251 HydrophobicContact CG1-CE2 4.28Å; E189-Y251 HydrophobicContact CB-CE2 4.02Å; E189-Y251 PolarHBondContact OE2-OH 3.39Å; I192-Y251 HydrophobicContact CD1-CD2 4.31Å; I192-Y251 HydrophobicContact CD1-CG 4.49Å; V246-Y251 HydrophobicContact CG1-CD1 3.89Å; V246-Y251 HydrophobicContact CG1-CD2 4.16Å; V246-Y251 HydrophobicContact CG1-CE1 3.53Å; V246-Y251 HydrophobicContact CG1-CE2 3.77Å; V246-Y251 HydrophobicContact CG1-CG 4.22Å; V246-Y251 VanDerWaalsContact CG1-CZ 3.47Å; V246-Y251 WeakPolarHBondContact O-CB 3.49Å; V246-Y251 PolarHBondContact O-N 3.16Å; C247-Y251 HydrophobicContact CB-CD2 4.47Å; Y251-T253 PolarHBondContact O-N 3.27Å; Y251-K254 PolarHBondContact O-N 3.34Å; Y251-Y255 HydrophobicContact CD1-CD2 4.02Å; Y251-Y255 AromaticContact CD1-CE2 3.51Å; Y251-Y255 HydrophobicContact CD1-CE2 3.51Å; Y251-Y255 AromaticContact CE1-CE2 3.88Å; Y251-Y255 HydrophobicContact CE1-CE2 3.88Å; Y251-Y255 HydrophobicContact CG-CD2 4.16Å; Y251-Y255 HydrophobicContact CG-CE2 4.04Å; Y251-Y255 WeakPolarHBondContact O-CA 2.88Å; Y251-Y255 VanDerWaalsContact O-CB 3.24Å; Y251-Y255 WeakPolarHBondContact O-CB 3.24Å; Y251-Y255 WeakPolarHBondContact O-CD2 3.27Å; Y251-Y255 PolarHBondContact O-N 3Å
252	F	75.9	Confident	78.7	Confident	7 Å²	7	45 Å²	45	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-64.1	-32.4	174.8	-77.2	-88.1	0	0	0	112.3	C247 S256 V260 V262 W267 L328	C247-F252 WeakPolarHBondContact O-CD2 3.33Å; C247-F252 WeakPolarHBondContact O-CE2 3.34Å; F252-S256 VanDerWaalsContact O-CA 3.3Å; F252-S256 WeakPolarHBondContact O-CA 3.19Å; F252-S256 VanDerWaalsContact O-CB 3.25Å; F252-S256 WeakPolarHBondContact O-CB 3.32Å; F252-S256 PolarHBondContact O-N 2.9Å; F252-S256 VanDerWaalsContact O-N 3.14Å; F252-V260 HydrophobicContact CE1-CG1 4.3Å; F252-V262 HydrophobicContact CE1-CG2 4.45Å; F252-V262 HydrophobicContact CZ-CG2 4.49Å; F252-W267 AromaticContact CE2-CH2 3.95Å; F252-W267 HydrophobicContact CE2-CH2 3.95Å; F252-W267 AromaticContact CZ-CH2 3.93Å; F252-W267 HydrophobicContact CZ-CH2 3.93Å; F252-W267 HydrophobicContact CZ-CZ2 4.4Å; F252-L328 HydrophobicContact CD1-CB 4.27Å; F252-L328 HydrophobicContact CD2-CB 3.99Å; F252-L328 HydrophobicContact CE1-CB 4.23Å; F252-L328 HydrophobicContact CE1-CD1 4.14Å; F252-L328 HydrophobicContact CE2-CB 3.95Å; F252-L328 HydrophobicContact CE2-CD1 4.12Å; F252-L328 HydrophobicContact CE2-CG 4.43Å; F252-L328 HydrophobicContact CG-CB 4.16Å; F252-L328 HydrophobicContact CZ-CB 4.08Å; F252-L328 HydrophobicContact CZ-CD1 3.67Å; F252-L328 HydrophobicContact CZ-CG 4.39Å
253	T	75.1	Confident	77.7	Confident	91 Å²	91	43 Å²	43	56%	0.558	22%	0.215	S	C	*	.	H	α-helix	trans	-72.6	-51.2	175.9	-53.7	0	0	0	0	111.2	T249 E250 Y251 S256	T249-T253 PolarHBondContact O-N 2.73Å; T249-T253 VanDerWaalsContact O-N 3.14Å; T249-T253 PolarHBondContact O-OG1 3.29Å; E250-T253 WeakPolarHBondContact O-CB 3.38Å; E250-T253 PolarHBondContact O-N 3.28Å; E250-T253 VanDerWaalsContact O-N 3.16Å; Y251-T253 PolarHBondContact O-N 3.27Å; T253-S256 WeakPolarHBondContact O-CB 3.28Å; T253-S256 PolarHBondContact O-N 2.86Å; T253-S256 PolarHBondContact O-OG 2.98Å
254	K	79.1	Confident	76.5	Confident	138 Å²	138	49.2 Å²	49.2	60%	0.6	25%	0.247	S	C	*	.	H	α-helix	trans	-67.9	-38.8	-175.5	-174.2	-177.1	178.7	-164.7	0	112.5	E250 Y251	E250-K254 VanDerWaalsContact O-CB 3.25Å; E250-K254 WeakPolarHBondContact O-CB 3.46Å; E250-K254 PolarHBondContact O-N 3.18Å; Y251-K254 PolarHBondContact O-N 3.34Å
255	Y	74.2	Confident	75.7	Confident	19 Å²	19	49.9 Å²	49.9	8%	0.075	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	15.6	-177.5	-55.7	-50.9	0	0	0	112.6	E189 I192 I193 Y251 K257 F258	E189-Y255 HydrophobicContact CG-CE2 4.01Å; E189-Y255 PolarHBondContact OE1-OH 3.44Å; I192-Y255 HydrophobicContact CG2-CD2 4.23Å; I192-Y255 HydrophobicContact CG2-CG 4.31Å; I193-Y255 HydrophobicContact CD1-CD1 4.14Å; I193-Y255 HydrophobicContact CD1-CE1 3.78Å; I193-Y255 HydrophobicContact CD1-CE2 4.18Å; I193-Y255 HydrophobicContact CG1-CD1 4.27Å; I193-Y255 HydrophobicContact CG1-CE1 4.41Å; I193-Y255 HydrophobicContact CG1-CG 4.34Å; Y251-Y255 HydrophobicContact CD1-CD2 4.02Å; Y251-Y255 AromaticContact CD1-CE2 3.51Å; Y251-Y255 HydrophobicContact CD1-CE2 3.51Å; Y251-Y255 AromaticContact CE1-CE2 3.88Å; Y251-Y255 HydrophobicContact CE1-CE2 3.88Å; Y251-Y255 HydrophobicContact CG-CD2 4.16Å; Y251-Y255 HydrophobicContact CG-CE2 4.04Å; Y251-Y255 WeakPolarHBondContact O-CA 2.88Å; Y251-Y255 VanDerWaalsContact O-CB 3.24Å; Y251-Y255 WeakPolarHBondContact O-CB 3.24Å; Y251-Y255 WeakPolarHBondContact O-CD2 3.27Å; Y251-Y255 PolarHBondContact O-N 3Å; Y255-K257 PolarHBondContact O-N 2.84Å; Y255-F258 HydrophobicContact CD1-CD2 4.14Å; Y255-F258 AromaticContact CD1-CE2 3.83Å; Y255-F258 HydrophobicContact CD1-CE2 3.83Å; Y255-F258 HydrophobicContact CG-CD2 4.38Å; Y255-F258 HydrophobicContact CG-CE2 4.49Å; Y255-F258 WeakPolarHBondContact O-CB 3.34Å; Y255-F258 WeakPolarHBondContact O-CD2 3.3Å; Y255-F258 PolarHBondContact O-N 3.23Å
256	S	67.7	Low	75.4	Confident	30 Å²	30	50.5 Å²	50.5	21%	0.21	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-29.4	176.4	52.6	0	0	0	0	114.1	F252 T253 F258 F324	F252-S256 VanDerWaalsContact O-CA 3.3Å; F252-S256 WeakPolarHBondContact O-CA 3.19Å; F252-S256 VanDerWaalsContact O-CB 3.25Å; F252-S256 WeakPolarHBondContact O-CB 3.32Å; F252-S256 PolarHBondContact O-N 2.9Å; F252-S256 VanDerWaalsContact O-N 3.14Å; T253-S256 WeakPolarHBondContact O-CB 3.28Å; T253-S256 PolarHBondContact O-N 2.86Å; T253-S256 PolarHBondContact O-OG 2.98Å; S256-F258 PolarHBondContact O-N 3.37Å; S256-F324 WeakPolarHBondContact O-CD2 3.27Å; S256-F324 WeakPolarHBondContact O-CE2 3.49Å
257	K	66.7	Low	75.1	Confident	158 Å²	158	50 Å²	50	69%	0.687	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.8	176.4	69.1	179.6	-178	178.8	0	114.6	Y255	Y255-K257 PolarHBondContact O-N 2.84Å
258	F	64.5	Low	74.8	Confident	62 Å²	62	50.4 Å²	50.4	27%	0.272	26%	0.256	S	S	.	.	S	Bend	trans	-86.3	148.8	179.7	-66.4	-84.9	0	0	0	110.3	I193 Y255 S256 V260	I193-F258 HydrophobicContact CG1-CE2 4.44Å; I193-F258 HydrophobicContact CG2-CE1 4.25Å; I193-F258 HydrophobicContact CG2-CZ 4.2Å; Y255-F258 HydrophobicContact CD1-CD2 4.14Å; Y255-F258 AromaticContact CD1-CE2 3.83Å; Y255-F258 HydrophobicContact CD1-CE2 3.83Å; Y255-F258 HydrophobicContact CG-CD2 4.38Å; Y255-F258 HydrophobicContact CG-CE2 4.49Å; Y255-F258 WeakPolarHBondContact O-CB 3.34Å; Y255-F258 WeakPolarHBondContact O-CD2 3.3Å; Y255-F258 PolarHBondContact O-N 3.23Å; S256-F258 PolarHBondContact O-N 3.37Å; F258-V260 HydrophobicContact CB-CG2 4.35Å; F258-V260 PolarHBondContact O-N 3.23Å
259	L	64.8	Low	74.8	Confident	110 Å²	110	51.1 Å²	51.1	58%	0.576	26%	0.26	S	S	*	.			trans	-79	90.1	178.1	-121.2	139.8	0	0	0	108.8	N196 A323	N196-L259 WeakPolarHBondContact CB-O 3.19Å; L259-A323 HydrophobicContact CD1-CB 3.59Å; L259-A323 HydrophobicContact CD2-CB 3.48Å; L259-A323 VanDerWaalsContact CD2-CB 3.48Å; L259-A323 HydrophobicContact CG-CB 3.35Å
260	V	66.4	Low	75	Confident	14 Å²	14	51.8 Å²	51.8	9%	0.085	26%	0.261	C	S	.	.			trans	-94.2	113.6	-177.8	-173	0	0	0	0	109.9	I192 F252 F258 V262	I192-V260 HydrophobicContact CG2-CG2 3.89Å; F252-V260 HydrophobicContact CE1-CG1 4.3Å; F258-V260 HydrophobicContact CB-CG2 4.35Å; F258-V260 PolarHBondContact O-N 3.23Å; V260-V262 HydrophobicContact CG1-CG2 3.56Å
261	D	71.3	Confident	75.3	Confident	52 Å²	52	47.6 Å²	47.6	28%	0.278	24%	0.242	S	C	.	.			trans	-113.7	98.3	174.5	178	17.5	0	0	0	110.1	N196 K198 S263	N196-D261 PolarHBondContact O-N 2.9Å; K198-D261 WeakPolarHBondContact CE-OD2 3.39Å; K198-D261 WeakPolarHBondContact CG-O 3.37Å; K198-D261 IonicContact NZ-OD2 3.38Å; K198-D261 PolarHBondContact NZ-OD2 2.89Å; D261-S263 VanDerWaalsContact OD1-CB 3.27Å; D261-S263 WeakPolarHBondContact OD1-CB 3.5Å; D261-S263 PolarHBondContact OD1-N 3.09Å; D261-S263 PolarHBondContact OD1-OG 3.37Å
262	V	69.6	Low	75.4	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.042	24%	0.239	C	C	.	.			trans	-98.2	6.4	-179.3	-145.7	0	0	0	0	112.1	F252 V260 L264 S265 W267 P268 H331	F252-V262 HydrophobicContact CE1-CG2 4.45Å; F252-V262 HydrophobicContact CZ-CG2 4.49Å; V260-V262 HydrophobicContact CG1-CG2 3.56Å; V262-L264 PolarHBondContact O-N 3.45Å; V262-L264 VanDerWaalsContact O-N 3.08Å; V262-S265 PolarHBondContact O-N 2.92Å; V262-W267 HydrophobicContact CG1-CZ2 3.97Å; V262-P268 HydrophobicContact CB-CG 4.3Å; V262-P268 HydrophobicContact CG1-CG 3.23Å; V262-H331 WeakPolarHBondContact CA-NE2 3.42Å; V262-H331 VanDerWaalsContact CB-NE2 3.35Å; V262-H331 WeakPolarHBondContact CB-NE2 3.15Å; V262-H331 PolarHBondContact N-CE1 2.62Å; V262-H331 VanDerWaalsContact N-CE1 3.35Å; V262-H331 PolarHBondContact N-NE2 3.47Å
263	S	67.1	Low	76.1	Confident	31 Å²	31	52.2 Å²	52.2	22%	0.217	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.1	-171.6	59.7	0	0	0	0	114.4	D261	D261-S263 VanDerWaalsContact OD1-CB 3.27Å; D261-S263 WeakPolarHBondContact OD1-CB 3.5Å; D261-S263 PolarHBondContact OD1-N 3.09Å; D261-S263 PolarHBondContact OD1-OG 3.37Å
264	L	68.1	Low	76.8	Confident	129 Å²	129	48.4 Å²	48.4	68%	0.675	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-2.7	-180	-61	176.3	0	0	0	113.4	V262	V262-L264 PolarHBondContact O-N 3.45Å; V262-L264 VanDerWaalsContact O-N 3.08Å
265	S	75.5	Confident	77.3	Confident	14 Å²	14	42 Å²	42	10%	0.098	21%	0.208	C	C	.	.			trans	-100.4	142.3	-174.4	-53	0	0	0	0	111.1	G197 K198 A199 V262	G197-S265 PolarHBondContact O-OG 3.35Å; K198-S265 WeakPolarHBondContact CA-OG 3.4Å; A199-S265 PolarHBondContact N-OG 3.04Å; V262-S265 PolarHBondContact O-N 2.92Å
266	I	81.1	Confident	78.1	Confident	64 Å²	64	42.5 Å²	42.5	33%	0.328	21%	0.21	S	C	.	.			trans	-94.8	-21.7	-177.8	-56.5	174.9	0	0	0	110.2	E204 P268 V269 Y270 P351	E204-I266 PolarHBondContact OE1-N 3.05Å; I266-P268 VanDerWaalsContact C-N 3.35Å; I266-P268 WeakPolarHBondContact O-CD 3.23Å; I266-P268 VanDerWaalsContact O-N 3.11Å; I266-V269 HydrophobicContact CG2-CB 4.36Å; I266-V269 WeakPolarHBondContact O-CA 3.19Å; I266-V269 WeakPolarHBondContact O-CB 3.42Å; I266-V269 WeakPolarHBondContact O-CG2 3.47Å; I266-V269 PolarHBondContact O-N 3.49Å; I266-Y270 HydrophobicContact CB-CE2 4.49Å; I266-Y270 HydrophobicContact CG2-CD1 4.42Å; I266-Y270 HydrophobicContact CG2-CE1 3.68Å; I266-Y270 HydrophobicContact CG2-CE2 4.22Å; I266-P351 HydrophobicContact CG1-CB 4.29Å
267	W	84.7	Confident	79	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-51.1	-40.8	-173	72.7	-96.9	0	0	0	115.2	V188 I192 G197 E204 L207 F252 V262 V269 Y270 F271	V188-W267 HydrophobicContact CG1-CH2 3.91Å; V188-W267 HydrophobicContact CG1-CZ3 3.96Å; I192-W267 HydrophobicContact CD1-CH2 4.46Å; G197-W267 PolarHBondContact O-NE1 2.84Å; E204-W267 PolarHBondContact OE1-N 3.49Å; E204-W267 VanDerWaalsContact OE1-N 3.09Å; E204-W267 WeakPolarHBondContact OE2-CA 3.26Å; E204-W267 WeakPolarHBondContact OE2-CB 3.24Å; E204-W267 PolarHBondContact OE2-N 3.31Å; L207-W267 HydrophobicContact CD1-CB 3.58Å; L207-W267 HydrophobicContact CD1-CG 4.29Å; F252-W267 AromaticContact CE2-CH2 3.95Å; F252-W267 HydrophobicContact CE2-CH2 3.95Å; F252-W267 AromaticContact CZ-CH2 3.93Å; F252-W267 HydrophobicContact CZ-CH2 3.93Å; F252-W267 HydrophobicContact CZ-CZ2 4.4Å; V262-W267 HydrophobicContact CG1-CZ2 3.97Å; W267-V269 PolarHBondContact O-N 3.23Å; W267-V269 VanDerWaalsContact O-N 3.14Å; W267-Y270 HydrophobicContact CB-CD2 4.31Å; W267-Y270 WeakPolarHBondContact O-CB 3.27Å; W267-Y270 PolarHBondContact O-N 3.01Å; W267-F271 AromaticContact CE3-CD2 3.66Å; W267-F271 HydrophobicContact CE3-CD2 3.66Å; W267-F271 AromaticContact CE3-CE2 3.58Å; W267-F271 HydrophobicContact CE3-CE2 3.58Å; W267-F271 HydrophobicContact CE3-CZ 4.47Å; W267-F271 HydrophobicContact CZ3-CD2 4.15Å; W267-F271 HydrophobicContact CZ3-CE2 4.14Å; W267-F271 VanDerWaalsContact O-CD2 3.29Å; W267-F271 WeakPolarHBondContact O-CD2 3.47Å; W267-F271 PolarHBondContact O-N 3.49Å
268	P	83	Confident	80	Confident	9 Å²	9	34.9 Å²	34.9	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-60.8	-31.7	179.5	-20.5	33.2	0	0	0	112.4	V262 I266 Y270 F271 V272 L328	V262-P268 HydrophobicContact CB-CG 4.3Å; V262-P268 HydrophobicContact CG1-CG 3.23Å; I266-P268 VanDerWaalsContact C-N 3.35Å; I266-P268 WeakPolarHBondContact O-CD 3.23Å; I266-P268 VanDerWaalsContact O-N 3.11Å; P268-Y270 VanDerWaalsContact C-N 3.29Å; P268-Y270 PolarHBondContact O-N 2.84Å; P268-F271 PolarHBondContact O-N 3.1Å; P268-V272 WeakPolarHBondContact O-CG2 3.14Å; P268-V272 PolarHBondContact O-N 3.03Å; P268-L328 HydrophobicContact CB-CD1 4.13Å
269	V	84.1	Confident	81.1	Confident	16 Å²	16	32.1 Å²	32.1	10%	0.097	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-38.7	175.6	-174	0	0	0	0	110.3	I266 W267 V272 R273 L355	I266-V269 HydrophobicContact CG2-CB 4.36Å; I266-V269 WeakPolarHBondContact O-CA 3.19Å; I266-V269 WeakPolarHBondContact O-CB 3.42Å; I266-V269 WeakPolarHBondContact O-CG2 3.47Å; I266-V269 PolarHBondContact O-N 3.49Å; W267-V269 PolarHBondContact O-N 3.23Å; W267-V269 VanDerWaalsContact O-N 3.14Å; V269-V272 PolarHBondContact O-N 3.07Å; V269-R273 HydrophobicContact CG1-CG 4.19Å; V269-R273 VanDerWaalsContact O-CB 3.24Å; V269-R273 WeakPolarHBondContact O-CB 3.33Å; V269-R273 VanDerWaalsContact O-CG 3.26Å; V269-R273 WeakPolarHBondContact O-CG 3.49Å; V269-R273 PolarHBondContact O-N 2.98Å; V269-L355 HydrophobicContact CG1-CD2 3.93Å
270	Y	87.5	Confident	82.2	Confident	32 Å²	32	31.5 Å²	31.5	13%	0.125	16%	0.156	C	C	.	.	H	α-helix	trans	-63.5	-43.2	176.9	-56	-38.2	0	0	0	111.9	E204 L207 F208 I266 W267 P268 S274	E204-Y270 WeakPolarHBondContact OE2-CE2 3.45Å; L207-Y270 HydrophobicContact CB-CD2 4.12Å; F208-Y270 HydrophobicContact CB-CE1 4.32Å; F208-Y270 HydrophobicContact CB-CE2 3.97Å; F208-Y270 HydrophobicContact CD2-CD1 4.33Å; F208-Y270 AromaticContact CD2-CE1 3.77Å; F208-Y270 HydrophobicContact CD2-CE1 3.77Å; I266-Y270 HydrophobicContact CB-CE2 4.49Å; I266-Y270 HydrophobicContact CG2-CD1 4.42Å; I266-Y270 HydrophobicContact CG2-CE1 3.68Å; I266-Y270 HydrophobicContact CG2-CE2 4.22Å; W267-Y270 HydrophobicContact CB-CD2 4.31Å; W267-Y270 WeakPolarHBondContact O-CB 3.27Å; W267-Y270 PolarHBondContact O-N 3.01Å; P268-Y270 VanDerWaalsContact C-N 3.29Å; P268-Y270 PolarHBondContact O-N 2.84Å; Y270-S274 VanDerWaalsContact O-CB 3.26Å; Y270-S274 WeakPolarHBondContact O-CB 3.45Å; Y270-S274 PolarHBondContact O-N 3.2Å; Y270-S274 PolarHBondContact O-OG 2.97Å
271	F	90.2	Very high	83	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65.6	-46.5	177.1	-74.7	-106.5	0	0	0	111.1	I184 V188 L207 F211 V243 L244 C247 L248 W267 P268 R273 S274 L275	I184-F271 HydrophobicContact CG2-CE1 3.99Å; I184-F271 HydrophobicContact CG2-CZ 3.54Å; V188-F271 HydrophobicContact CG2-CE1 4.41Å; V188-F271 HydrophobicContact CG2-CE2 4.03Å; V188-F271 HydrophobicContact CG2-CZ 3.52Å; L207-F271 HydrophobicContact CD1-CE2 4.49Å; L207-F271 HydrophobicContact CD2-CE2 4.3Å; L207-F271 HydrophobicContact CD2-CZ 4.37Å; F211-F271 HydrophobicContact CE2-CD1 4.39Å; F211-F271 AromaticContact CE2-CD2 3.63Å; F211-F271 HydrophobicContact CE2-CD2 3.63Å; F211-F271 HydrophobicContact CE2-CE1 4.22Å; F211-F271 AromaticContact CE2-CE2 3.48Å; F211-F271 HydrophobicContact CE2-CE2 3.48Å; F211-F271 VanDerWaalsContact CE2-CE2 3.48Å; F211-F271 HydrophobicContact CE2-CG 4.09Å; F211-F271 AromaticContact CE2-CZ 3.77Å; F211-F271 HydrophobicContact CE2-CZ 3.77Å; F211-F271 HydrophobicContact CZ-CB 4.49Å; F211-F271 AromaticContact CZ-CD1 3.68Å; F211-F271 HydrophobicContact CZ-CD1 3.68Å; F211-F271 AromaticContact CZ-CD2 3.74Å; F211-F271 HydrophobicContact CZ-CD2 3.74Å; F211-F271 AromaticContact CZ-CE1 3.63Å; F211-F271 HydrophobicContact CZ-CE1 3.63Å; F211-F271 AromaticContact CZ-CE2 3.74Å; F211-F271 HydrophobicContact CZ-CE2 3.74Å; F211-F271 AromaticContact CZ-CG 3.7Å; F211-F271 HydrophobicContact CZ-CG 3.7Å; F211-F271 AromaticContact CZ-CZ 3.66Å; F211-F271 HydrophobicContact CZ-CZ 3.66Å; V243-F271 HydrophobicContact CG1-CE1 3.98Å; L244-F271 HydrophobicContact CD2-CB 3.88Å; L244-F271 HydrophobicContact CD2-CD1 3.74Å; L244-F271 HydrophobicContact CD2-CG 4.2Å; L244-F271 VanDerWaalsContact CD2-O 3.3Å; L244-F271 WeakPolarHBondContact CD2-O 3.43Å; C247-F271 HydrophobicContact CB-CD1 3.7Å; C247-F271 HydrophobicContact CB-CE1 3.29Å; C247-F271 HydrophobicContact CB-CZ 4.04Å; C247-F271 VanDerWaalsContact SG-CE1 3.59Å; L248-F271 HydrophobicContact CD1-CB 4.06Å; L248-F271 HydrophobicContact CD2-CB 3.54Å; L248-F271 HydrophobicContact CD2-CG 4.28Å; L248-F271 HydrophobicContact CG-CB 3.92Å; L248-F271 HydrophobicContact CG-CD1 4.37Å; W267-F271 AromaticContact CE3-CD2 3.66Å; W267-F271 HydrophobicContact CE3-CD2 3.66Å; W267-F271 AromaticContact CE3-CE2 3.58Å; W267-F271 HydrophobicContact CE3-CE2 3.58Å; W267-F271 HydrophobicContact CE3-CZ 4.47Å; W267-F271 HydrophobicContact CZ3-CD2 4.15Å; W267-F271 HydrophobicContact CZ3-CE2 4.14Å; W267-F271 VanDerWaalsContact O-CD2 3.29Å; W267-F271 WeakPolarHBondContact O-CD2 3.47Å; W267-F271 PolarHBondContact O-N 3.49Å; P268-F271 PolarHBondContact O-N 3.1Å; F271-R273 PolarHBondContact O-N 3.25Å; F271-S274 CarbonylContact O-C 3.24Å; F271-S274 WeakPolarHBondContact O-CB 3.42Å; F271-S274 PolarHBondContact O-N 3.27Å; F271-S274 VanDerWaalsContact O-N 3.13Å; F271-L275 PolarHBondContact O-N 3.23Å
272	V	87.8	Confident	83.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.8	-40	179.6	172.7	0	0	0	0	111.9	L248 P268 V269 S274 L275 R276 L328 S356 I359 I360	L248-V272 HydrophobicContact CD2-CG2 4.28Å; P268-V272 WeakPolarHBondContact O-CG2 3.14Å; P268-V272 PolarHBondContact O-N 3.03Å; V269-V272 PolarHBondContact O-N 3.07Å; V272-S274 VanDerWaalsContact C-N 3.28Å; V272-S274 PolarHBondContact O-N 3.45Å; V272-L275 WeakPolarHBondContact O-CB 3.26Å; V272-L275 PolarHBondContact O-N 3.05Å; V272-R276 PolarHBondContact O-N 3.36Å; V272-L328 HydrophobicContact CG2-CD2 4.41Å; V272-S356 WeakPolarHBondContact CG1-O 3.46Å; V272-I359 HydrophobicContact CG1-CB 3.62Å; V272-I359 HydrophobicContact CG1-CD1 4.21Å; V272-I359 HydrophobicContact CG1-CG2 3.39Å; V272-I360 HydrophobicContact CG1-CD1 4.49Å; V272-I360 HydrophobicContact CG1-CG1 4.05Å; V272-I360 HydrophobicContact CG2-CD1 4.21Å; V272-I360 HydrophobicContact CG2-CG1 4.46Å
273	R	89	Confident	84.1	Confident	120 Å²	120	32.6 Å²	32.6	45%	0.453	16%	0.156	S	C	.	.	H	α-helix	trans	-64.1	-34.4	172	-77.4	179.1	172.1	170.9	-2.6	112.3	V269 F271 R276 T277 I359	V269-R273 HydrophobicContact CG1-CG 4.19Å; V269-R273 VanDerWaalsContact O-CB 3.24Å; V269-R273 WeakPolarHBondContact O-CB 3.33Å; V269-R273 VanDerWaalsContact O-CG 3.26Å; V269-R273 WeakPolarHBondContact O-CG 3.49Å; V269-R273 PolarHBondContact O-N 2.98Å; F271-R273 PolarHBondContact O-N 3.25Å; R273-R276 WeakPolarHBondContact O-CB 3.43Å; R273-R276 PolarHBondContact O-N 3.49Å; R273-T277 PolarHBondContact O-N 2.98Å; R273-T277 PolarHBondContact O-OG1 3.22Å; R273-I359 HydrophobicContact CG-CD1 3.7Å
274	S	90	Very high	84.8	Confident	12 Å²	12	39 Å²	39	8%	0.084	18%	0.181	C	C	.	.	H	α-helix	trans	-72.5	-39.4	177.4	-61.9	0	0	0	0	111.4	F211 Y270 F271 V272 R276 T277 L278	F211-S274 WeakPolarHBondContact CD1-OG 3.46Å; F211-S274 WeakPolarHBondContact CG-OG 3.32Å; Y270-S274 VanDerWaalsContact O-CB 3.26Å; Y270-S274 WeakPolarHBondContact O-CB 3.45Å; Y270-S274 PolarHBondContact O-N 3.2Å; Y270-S274 PolarHBondContact O-OG 2.97Å; F271-S274 CarbonylContact O-C 3.24Å; F271-S274 WeakPolarHBondContact O-CB 3.42Å; F271-S274 PolarHBondContact O-N 3.27Å; F271-S274 VanDerWaalsContact O-N 3.13Å; V272-S274 VanDerWaalsContact C-N 3.28Å; V272-S274 PolarHBondContact O-N 3.45Å; S274-R276 VanDerWaalsContact C-N 3.32Å; S274-R276 PolarHBondContact O-N 3.49Å; S274-T277 PolarHBondContact O-N 3.2Å; S274-L278 VanDerWaalsContact O-CB 3.24Å; S274-L278 WeakPolarHBondContact O-CB 3.45Å; S274-L278 PolarHBondContact O-N 3.42Å
275	L	89.7	Confident	85.1	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-56.3	-45.6	167.8	178.9	60.7	0	0	0	111.3	L244 L248 F271 V272 T277 L278 Y279 V297 L300 I301 L304	L244-L275 HydrophobicContact CD1-CB 4.03Å; L244-L275 HydrophobicContact CD1-CD1 4.27Å; L248-L275 HydrophobicContact CD1-CD2 4.48Å; F271-L275 PolarHBondContact O-N 3.23Å; V272-L275 WeakPolarHBondContact O-CB 3.26Å; V272-L275 PolarHBondContact O-N 3.05Å; L275-T277 VanDerWaalsContact C-N 3.35Å; L275-T277 PolarHBondContact O-N 3.28Å; L275-L278 PolarHBondContact O-N 3Å; L275-Y279 VanDerWaalsContact O-CB 3.3Å; L275-Y279 WeakPolarHBondContact O-CB 3.28Å; L275-Y279 PolarHBondContact O-N 2.82Å; L275-V297 HydrophobicContact CD1-CG1 4.19Å; L275-L300 HydrophobicContact CD1-CD2 3.63Å; L275-L300 HydrophobicContact CD1-CG 4.16Å; L275-I301 HydrophobicContact CD1-CG1 4.25Å; L275-I301 HydrophobicContact CD2-CG1 4.09Å; L275-I301 HydrophobicContact CG-CG1 4.33Å; L275-L304 HydrophobicContact CD2-CD1 3.48Å; L275-L304 VanDerWaalsContact CD2-CD1 3.48Å
276	R	90.5	Very high	85	Confident	29 Å²	29	40.2 Å²	40.2	11%	0.109	19%	0.188	C	C	.	.	H	α-helix	trans	-61	-43.2	176.3	-176	59.5	175.6	148.4	-1.1	112.7	V272 R273 S274 K280 I359 C363 E366	V272-R276 PolarHBondContact O-N 3.36Å; R273-R276 WeakPolarHBondContact O-CB 3.43Å; R273-R276 PolarHBondContact O-N 3.49Å; S274-R276 VanDerWaalsContact C-N 3.32Å; S274-R276 PolarHBondContact O-N 3.49Å; R276-K280 WeakPolarHBondContact O-CB 3.32Å; R276-K280 WeakPolarHBondContact O-CG 3.46Å; R276-K280 PolarHBondContact O-N 3.07Å; R276-I359 HydrophobicContact CB-CG2 3.64Å; R276-I359 HydrophobicContact CG-CG2 4.08Å; R276-C363 WeakPolarHBondContact CD-SG 3.21Å; R276-E366 IonicContact CZ-OE1 3.97Å; R276-E366 IonicContact CZ-OE2 2.81Å; R276-E366 VanDerWaalsContact CZ-OE2 3.31Å; R276-E366 IonicContact NH1-OE1 3.81Å; R276-E366 IonicContact NH1-OE2 3.38Å; R276-E366 PolarHBondContact NH1-OE2 3.29Å; R276-E366 VanDerWaalsContact NH2-CD 3.27Å; R276-E366 IonicContact NH2-OE1 2.65Å; R276-E366 PolarHBondContact NH2-OE1 3.38Å; R276-E366 IonicContact NH2-OE2 3.64Å; R276-E366 PolarHBondContact NH2-OE2 2.85Å; R276-E366 VanDerWaalsContact NH2-OE2 3.12Å
277	T	87.8	Confident	84.5	Confident	29 Å²	29	38.5 Å²	38.5	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-65.2	-48.5	179.3	-59.2	0	0	0	0	110.1	R215 R273 S274 L275 K280 L281	R215-T277 HydrophobicContact CG-CG2 4Å; R273-T277 PolarHBondContact O-N 2.98Å; R273-T277 PolarHBondContact O-OG1 3.22Å; S274-T277 PolarHBondContact O-N 3.2Å; L275-T277 VanDerWaalsContact C-N 3.35Å; L275-T277 PolarHBondContact O-N 3.28Å; T277-K280 PolarHBondContact O-N 2.62Å; T277-L281 HydrophobicContact CG2-CD1 3.87Å; T277-L281 HydrophobicContact CG2-CG 4.39Å; T277-L281 WeakPolarHBondContact O-CB 3.23Å; T277-L281 WeakPolarHBondContact O-CG 3.09Å; T277-L281 PolarHBondContact O-N 3.37Å
278	L	86.7	Confident	83.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-56.8	-50.9	176.8	176.6	66.1	0	0	0	110.8	F237 L240 V241 L244 S274 L275 K280 L281 V282 V297	F237-L278 HydrophobicContact CB-CD1 4.45Å; F237-L278 HydrophobicContact CD1-CD1 3.53Å; F237-L278 HydrophobicContact CE1-CD1 4.2Å; F237-L278 HydrophobicContact CG-CD1 4.36Å; L240-L278 HydrophobicContact CD2-CB 4.36Å; V241-L278 HydrophobicContact CB-CD2 4.49Å; V241-L278 HydrophobicContact CG2-CD1 4.33Å; V241-L278 HydrophobicContact CG2-CD2 3.55Å; V241-L278 HydrophobicContact CG2-CG 4.46Å; L244-L278 HydrophobicContact CD1-CD2 3.88Å; S274-L278 VanDerWaalsContact O-CB 3.24Å; S274-L278 WeakPolarHBondContact O-CB 3.45Å; S274-L278 PolarHBondContact O-N 3.42Å; L275-L278 PolarHBondContact O-N 3Å; L278-K280 PolarHBondContact O-N 2.6Å; L278-L281 PolarHBondContact O-N 3.29Å; L278-V282 HydrophobicContact CD1-CG2 3.88Å; L278-V282 HydrophobicContact CG-CG2 4.39Å; L278-V282 VanDerWaalsContact O-CB 3.29Å; L278-V282 WeakPolarHBondContact O-CB 3.34Å; L278-V282 VanDerWaalsContact O-CG2 3.3Å; L278-V282 WeakPolarHBondContact O-CG2 3.34Å; L278-V282 PolarHBondContact O-N 3.45Å; L278-V297 HydrophobicContact CD2-CG2 3.89Å; L278-V297 HydrophobicContact CG-CG2 4Å
279	Y	88	Confident	83.3	Confident	3 Å²	3	46.4 Å²	46.4	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-53.5	-53.2	175	-179.7	-89.8	0	0	0	111.4	L275 L281 V282 Y283 V297 I301 E366 N367 K370	L275-Y279 VanDerWaalsContact O-CB 3.3Å; L275-Y279 WeakPolarHBondContact O-CB 3.28Å; L275-Y279 PolarHBondContact O-N 2.82Å; Y279-L281 VanDerWaalsContact C-N 3.32Å; Y279-L281 PolarHBondContact O-N 3.15Å; Y279-V282 PolarHBondContact O-N 3.37Å; Y279-Y283 HydrophobicContact CD1-CD2 4.14Å; Y279-Y283 AromaticContact CD2-CD2 3.7Å; Y279-Y283 HydrophobicContact CD2-CD2 3.7Å; Y279-Y283 AromaticContact CD2-CE2 3.5Å; Y279-Y283 HydrophobicContact CD2-CE2 3.5Å; Y279-Y283 AromaticContact CE1-CD2 3.95Å; Y279-Y283 HydrophobicContact CE1-CD2 3.95Å; Y279-Y283 HydrophobicContact CE1-CE2 4.36Å; Y279-Y283 AromaticContact CE2-CD2 3.56Å; Y279-Y283 HydrophobicContact CE2-CD2 3.56Å; Y279-Y283 AromaticContact CE2-CE2 3.15Å; Y279-Y283 HydrophobicContact CE2-CE2 3.15Å; Y279-Y283 HydrophobicContact CG-CD2 4.02Å; Y279-Y283 HydrophobicContact CG-CE2 4.29Å; Y279-Y283 AromaticContact CZ-CD2 3.67Å; Y279-Y283 AromaticContact CZ-CE2 3.63Å; Y279-Y283 VanDerWaalsContact O-CD2 3.27Å; Y279-Y283 WeakPolarHBondContact O-CD2 3.38Å; Y279-Y283 PolarHBondContact O-N 2.75Å; Y279-V297 HydrophobicContact CD2-CG1 3.96Å; Y279-I301 HydrophobicContact CD2-CD1 3.24Å; Y279-I301 HydrophobicContact CE2-CD1 3.67Å; Y279-I301 HydrophobicContact CG-CD1 4.06Å; Y279-E366 HydrophobicContact CE1-CB 4.02Å; Y279-E366 WeakPolarHBondContact CE1-OE2 3.24Å; Y279-E366 WeakPolarHBondContact OH-CB 3.19Å; Y279-E366 PolarHBondContact OH-O 2.98Å; Y279-N367 HydrophobicContact CE2-CB 4.42Å; Y279-N367 PolarHBondContact OH-N 3.44Å; Y279-K370 PolarHBondContact OH-NZ 3.02Å
280	K	87.3	Confident	82.7	Confident	97 Å²	97	45.7 Å²	45.7	42%	0.422	21%	0.211	S	C	.	.	H	α-helix	trans	-60.4	-40.2	-179.8	-79.2	-173.4	174	-179.4	0	113	R276 T277 L278 K284	R276-K280 WeakPolarHBondContact O-CB 3.32Å; R276-K280 WeakPolarHBondContact O-CG 3.46Å; R276-K280 PolarHBondContact O-N 3.07Å; T277-K280 PolarHBondContact O-N 2.62Å; L278-K280 PolarHBondContact O-N 2.6Å; K280-K284 VanDerWaalsContact O-CB 3.25Å; K280-K284 WeakPolarHBondContact O-CB 3.23Å; K280-K284 WeakPolarHBondContact O-CG 3.05Å; K280-K284 PolarHBondContact O-N 2.87Å; K280-K284 VanDerWaalsContact O-N 3.09Å
281	L	83.9	Confident	82.1	Confident	28 Å²	28	47 Å²	47	15%	0.147	22%	0.22	C	C	.	.	H	α-helix	trans	-73.3	-44.5	-177.7	-71.5	176.4	0	0	0	111.3	L218 K219 T222 F237 T277 L278 Y279 Y283 K284 S285	L218-L281 HydrophobicContact CB-CD1 3.47Å; L218-L281 VanDerWaalsContact CB-CD1 3.47Å; L218-L281 HydrophobicContact CD1-CD1 4.22Å; L218-L281 HydrophobicContact CG-CD1 4.5Å; K219-L281 HydrophobicContact CG-CD1 4.41Å; K219-L281 HydrophobicContact CG-CD2 4.5Å; T222-L281 HydrophobicContact CG2-CD2 4.29Å; F237-L281 HydrophobicContact CE1-CB 4.26Å; T277-L281 HydrophobicContact CG2-CD1 3.87Å; T277-L281 HydrophobicContact CG2-CG 4.39Å; T277-L281 WeakPolarHBondContact O-CB 3.23Å; T277-L281 WeakPolarHBondContact O-CG 3.09Å; T277-L281 PolarHBondContact O-N 3.37Å; L278-L281 PolarHBondContact O-N 3.29Å; Y279-L281 VanDerWaalsContact C-N 3.32Å; Y279-L281 PolarHBondContact O-N 3.15Å; L281-Y283 VanDerWaalsContact C-N 3.29Å; L281-Y283 PolarHBondContact O-N 3.36Å; L281-K284 PolarHBondContact O-N 2.7Å; L281-S285 WeakPolarHBondContact O-CB 3.35Å; L281-S285 PolarHBondContact O-N 3.01Å
282	V	82.3	Confident	81.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58	-43.5	176.8	163.9	0	0	0	0	110.2	F237 L278 Y279 A290 L293 H294	F237-V282 HydrophobicContact CD1-CG2 4Å; F237-V282 HydrophobicContact CE1-CG2 4.18Å; L278-V282 HydrophobicContact CD1-CG2 3.88Å; L278-V282 HydrophobicContact CG-CG2 4.39Å; L278-V282 VanDerWaalsContact O-CB 3.29Å; L278-V282 WeakPolarHBondContact O-CB 3.34Å; L278-V282 VanDerWaalsContact O-CG2 3.3Å; L278-V282 WeakPolarHBondContact O-CG2 3.34Å; L278-V282 PolarHBondContact O-N 3.45Å; Y279-V282 PolarHBondContact O-N 3.37Å; V282-A290 WeakPolarHBondContact CG1-O 3.47Å; V282-L293 HydrophobicContact CG1-CB 4.22Å; V282-L293 HydrophobicContact CG2-CB 4.12Å; V282-L293 HydrophobicContact CG2-CD1 4.27Å; V282-H294 WeakPolarHBondContact CG1-CE1 3.3Å; V282-H294 WeakPolarHBondContact CG1-ND1 3.25Å; V282-H294 PolarHBondContact O-CE1 3.42Å
283	Y	81	Confident	81.2	Confident	68 Å²	68	52.8 Å²	52.8	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-80.5	-12.5	178.7	-78.2	-76.6	0	0	0	117	Y279 L281 H294 S298 K370	Y279-Y283 HydrophobicContact CD1-CD2 4.14Å; Y279-Y283 AromaticContact CD2-CD2 3.7Å; Y279-Y283 HydrophobicContact CD2-CD2 3.7Å; Y279-Y283 AromaticContact CD2-CE2 3.5Å; Y279-Y283 HydrophobicContact CD2-CE2 3.5Å; Y279-Y283 AromaticContact CE1-CD2 3.95Å; Y279-Y283 HydrophobicContact CE1-CD2 3.95Å; Y279-Y283 HydrophobicContact CE1-CE2 4.36Å; Y279-Y283 AromaticContact CE2-CD2 3.56Å; Y279-Y283 HydrophobicContact CE2-CD2 3.56Å; Y279-Y283 AromaticContact CE2-CE2 3.15Å; Y279-Y283 HydrophobicContact CE2-CE2 3.15Å; Y279-Y283 HydrophobicContact CG-CD2 4.02Å; Y279-Y283 HydrophobicContact CG-CE2 4.29Å; Y279-Y283 AromaticContact CZ-CD2 3.67Å; Y279-Y283 AromaticContact CZ-CE2 3.63Å; Y279-Y283 VanDerWaalsContact O-CD2 3.27Å; Y279-Y283 WeakPolarHBondContact O-CD2 3.38Å; Y279-Y283 PolarHBondContact O-N 2.75Å; L281-Y283 VanDerWaalsContact C-N 3.29Å; L281-Y283 PolarHBondContact O-N 3.36Å; Y283-H294 AromaticContact CD1-CE1 3.23Å; Y283-H294 WeakPolarHBondContact CD1-CE1 2.89Å; Y283-H294 AromaticContact CD1-ND1 3.33Å; Y283-H294 VanDerWaalsContact CD1-ND1 3.33Å; Y283-H294 WeakPolarHBondContact CD1-ND1 3.29Å; Y283-H294 AromaticContact CD2-CE1 3.98Å; Y283-H294 AromaticContact CD2-ND1 3.69Å; Y283-H294 AromaticContact CE1-CE1 3.54Å; Y283-H294 AromaticContact CE1-CG 3.89Å; Y283-H294 AromaticContact CE1-ND1 3.14Å; Y283-H294 WeakPolarHBondContact CE1-ND1 3.07Å; Y283-H294 AromaticContact CE2-ND1 3.47Å; Y283-H294 WeakPolarHBondContact CE2-ND1 3.31Å; Y283-H294 AromaticContact CG-CE1 3.5Å; Y283-H294 AromaticContact CG-ND1 3.63Å; Y283-H294 AromaticContact CZ-ND1 3.21Å; Y283-S298 PolarHBondContact OH-OG 3.31Å; Y283-K370 HydrophobicContact CD1-CD 4.19Å; Y283-K370 HydrophobicContact CE1-CD 3.65Å
284	K	82	Confident	80.9	Confident	166 Å²	166	48.8 Å²	48.8	72%	0.722	24%	0.237	S	C	*	.	H	α-helix	trans	-102.7	-7.6	174.5	-72.5	-175.7	175.3	-160.5	0	113.2	K280 L281	K280-K284 VanDerWaalsContact O-CB 3.25Å; K280-K284 WeakPolarHBondContact O-CB 3.23Å; K280-K284 WeakPolarHBondContact O-CG 3.05Å; K280-K284 PolarHBondContact O-N 2.87Å; K280-K284 VanDerWaalsContact O-N 3.09Å; L281-K284 PolarHBondContact O-N 2.7Å
285	S	76.2	Confident	80.6	Confident	10 Å²	10	52.4 Å²	52.4	7%	0.07	26%	0.261	C	S	.	.			trans	-86.2	130	-174.9	172.4	0	0	0	0	110.4	L281 H287 A290 N291	L281-S285 WeakPolarHBondContact O-CB 3.35Å; L281-S285 PolarHBondContact O-N 3.01Å; S285-H287 PolarHBondContact O-N 3.46Å; S285-H287 VanDerWaalsContact OG-CB 3.28Å; S285-H287 WeakPolarHBondContact OG-CB 3.14Å; S285-H287 PolarHBondContact OG-CD2 3.3Å; S285-H287 PolarHBondContact OG-N 3.21Å; S285-H287 VanDerWaalsContact OG-N 3.14Å; S285-A290 VanDerWaalsContact OG-CB 3.27Å; S285-A290 WeakPolarHBondContact OG-CB 3.32Å; S285-N291 PolarHBondContact O-OD1 2.77Å
286	D	71.6	Confident	80.4	Confident	159 Å²	159	56.3 Å²	56.3	85%	0.85	28%	0.281	S	S	*	.			trans	-78.6	-10.9	171.2	-63.4	-38.9	0	0	0	112.2
287	H	72.4	Confident	80.2	Confident	28 Å²	28	55 Å²	55	13%	0.13	28%	0.275	C	S	.	.			trans	-65.9	131.8	-178.7	-61	-73.7	0	0	0	112.9	T222 V224 D226 S285 W289 A290 N291	T222-H287 PolarHBondContact O-NE2 2.83Å; V224-H287 PolarHBondContact O-CE1 2.97Å; D226-H287 WeakPolarHBondContact OD1-CB 3.32Å; D226-H287 IonicContact OD1-CE1 3.87Å; D226-H287 IonicContact OD1-CG 2.6Å; D226-H287 IonicContact OD1-ND1 3.94Å; D226-H287 PolarHBondContact OD1-ND1 2.86Å; D226-H287 IonicContact OD2-ND1 2.8Å; S285-H287 PolarHBondContact O-N 3.46Å; S285-H287 VanDerWaalsContact OG-CB 3.28Å; S285-H287 WeakPolarHBondContact OG-CB 3.14Å; S285-H287 PolarHBondContact OG-CD2 3.3Å; S285-H287 PolarHBondContact OG-N 3.21Å; S285-H287 VanDerWaalsContact OG-N 3.14Å; H287-W289 VanDerWaalsContact C-N 3.32Å; H287-W289 HydrophobicContact CB-CD2 4.3Å; H287-W289 HydrophobicContact CB-CG 4.41Å; H287-W289 HydrophobicContact CB-CZ2 3.97Å; H287-W289 AromaticContact CG-NE1 3.72Å; H287-W289 AromaticContact ND1-NE1 3.93Å; H287-W289 PolarHBondContact O-N 3.48Å; H287-A290 HydrophobicContact CB-CB 4.27Å; H287-A290 WeakPolarHBondContact O-CB 3.19Å; H287-A290 PolarHBondContact O-N 3.2Å; H287-A290 VanDerWaalsContact O-N 3.15Å; H287-N291 PolarHBondContact O-N 3.36Å; H287-N291 VanDerWaalsContact O-N 3.17Å; H287-N291 PolarHBondContact O-ND2 2.85Å
288	L	69.7	Low	80.2	Confident	123 Å²	123	54.2 Å²	54.2	64%	0.644	27%	0.272	S	S	*	.	H	α-helix	trans	-60.6	-39.7	-177.5	-173.9	69.2	0	0	0	112.5	A290 N291 N292	L288-A290 VanDerWaalsContact C-N 3.32Å; L288-A290 PolarHBondContact O-N 3.2Å; L288-N291 PolarHBondContact O-N 3.45Å; L288-N292 PolarHBondContact O-N 2.78Å; L288-N292 PolarHBondContact O-ND2 3.16Å
289	W	71.3	Confident	80.3	Confident	52 Å²	52	60 Å²	60	20%	0.197	30%	0.297	C	S	.	.	H	α-helix	trans	-66.9	-33.5	179.4	58.6	-96.8	0	0	0	112.4	D226 F237 H287 N291 N292	D226-W289 PolarHBondContact OD1-NE1 3.15Å; F237-W289 HydrophobicContact CB-CZ3 4.45Å; F237-W289 AromaticContact CD1-CZ3 3.95Å; F237-W289 HydrophobicContact CD1-CZ3 3.95Å; F237-W289 HydrophobicContact CD2-CE3 4.46Å; F237-W289 AromaticContact CD2-CH2 3.75Å; F237-W289 HydrophobicContact CD2-CH2 3.75Å; F237-W289 AromaticContact CD2-CZ3 3.37Å; F237-W289 HydrophobicContact CD2-CZ3 3.37Å; F237-W289 HydrophobicContact CE1-CH2 4.22Å; F237-W289 AromaticContact CE1-CZ3 4Å; F237-W289 HydrophobicContact CE1-CZ3 4Å; F237-W289 AromaticContact CE2-CH2 3.29Å; F237-W289 HydrophobicContact CE2-CH2 3.29Å; F237-W289 AromaticContact CE2-CZ3 3.43Å; F237-W289 HydrophobicContact CE2-CZ3 3.43Å; F237-W289 VanDerWaalsContact CE2-CZ3 3.43Å; F237-W289 HydrophobicContact CG-CH2 4.4Å; F237-W289 AromaticContact CG-CZ3 3.67Å; F237-W289 HydrophobicContact CG-CZ3 3.67Å; F237-W289 AromaticContact CZ-CH2 3.57Å; F237-W289 HydrophobicContact CZ-CH2 3.57Å; F237-W289 AromaticContact CZ-CZ3 3.76Å; F237-W289 HydrophobicContact CZ-CZ3 3.76Å; H287-W289 VanDerWaalsContact C-N 3.32Å; H287-W289 HydrophobicContact CB-CD2 4.3Å; H287-W289 HydrophobicContact CB-CG 4.41Å; H287-W289 HydrophobicContact CB-CZ2 3.97Å; H287-W289 AromaticContact CG-NE1 3.72Å; H287-W289 AromaticContact ND1-NE1 3.93Å; H287-W289 PolarHBondContact O-N 3.48Å; W289-N291 VanDerWaalsContact C-N 3.34Å; W289-N292 PolarHBondContact O-N 3.01Å
290	A	72.3	Confident	80.3	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.5	-39.5	175.3	0	0	0	0	0	110.3	V282 S285 H287 L288 N292 L293	V282-A290 WeakPolarHBondContact CG1-O 3.47Å; S285-A290 VanDerWaalsContact OG-CB 3.27Å; S285-A290 WeakPolarHBondContact OG-CB 3.32Å; H287-A290 HydrophobicContact CB-CB 4.27Å; H287-A290 WeakPolarHBondContact O-CB 3.19Å; H287-A290 PolarHBondContact O-N 3.2Å; H287-A290 VanDerWaalsContact O-N 3.15Å; L288-A290 VanDerWaalsContact C-N 3.32Å; L288-A290 PolarHBondContact O-N 3.2Å; A290-N292 PolarHBondContact O-N 2.84Å; A290-L293 WeakPolarHBondContact O-CB 3.38Å; A290-L293 PolarHBondContact O-N 3.33Å
291	N	73.8	Confident	80.4	Confident	60 Å²	60	55.6 Å²	55.6	32%	0.321	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-31.1	177.7	-71.3	-31.9	0	0	0	113.2	S285 H287 L288 W289 L293 H294	S285-N291 PolarHBondContact O-OD1 2.77Å; H287-N291 PolarHBondContact O-N 3.36Å; H287-N291 VanDerWaalsContact O-N 3.17Å; H287-N291 PolarHBondContact O-ND2 2.85Å; L288-N291 PolarHBondContact O-N 3.45Å; W289-N291 VanDerWaalsContact C-N 3.34Å; N291-L293 PolarHBondContact O-N 3.07Å; N291-H294 WeakPolarHBondContact CA-CD2 3.5Å; N291-H294 WeakPolarHBondContact O-CB 3.48Å; N291-H294 PolarHBondContact O-CD2 2.93Å; N291-H294 PolarHBondContact O-N 2.82Å; N291-H294 PolarHBondContact OD1-NE2 3.26Å
292	N	78.4	Confident	80.7	Confident	109 Å²	109	56.4 Å²	56.4	58%	0.583	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-16.7	175	-66.1	-25.7	0	0	0	113.4	L288 W289 A290 P295	L288-N292 PolarHBondContact O-N 2.78Å; L288-N292 PolarHBondContact O-ND2 3.16Å; W289-N292 PolarHBondContact O-N 3.01Å; A290-N292 PolarHBondContact O-N 2.84Å; N292-P295 WeakPolarHBondContact O-CD 3.46Å
293	L	80.6	Confident	80.9	Confident	13 Å²	13	58.2 Å²	58.2	7%	0.068	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-12.9	178.5	-60.1	174.5	0	0	0	113.2	F237 T238 V282 A290 N291 P295 I296 V297	F237-L293 HydrophobicContact CB-CD1 3.43Å; F237-L293 VanDerWaalsContact CB-CD1 3.43Å; F237-L293 HydrophobicContact CD1-CD1 4Å; F237-L293 HydrophobicContact CG-CD1 4.05Å; T238-L293 HydrophobicContact CG2-CD2 4.23Å; V282-L293 HydrophobicContact CG1-CB 4.22Å; V282-L293 HydrophobicContact CG2-CB 4.12Å; V282-L293 HydrophobicContact CG2-CD1 4.27Å; A290-L293 WeakPolarHBondContact O-CB 3.38Å; A290-L293 PolarHBondContact O-N 3.33Å; N291-L293 PolarHBondContact O-N 3.07Å; L293-P295 VanDerWaalsContact C-CD 3.5Å; L293-I296 HydrophobicContact CD2-CD1 4.16Å; L293-I296 PolarHBondContact O-N 3.42Å; L293-I296 VanDerWaalsContact O-N 3.13Å; L293-V297 WeakPolarHBondContact O-CG2 3.21Å; L293-V297 PolarHBondContact O-N 3.15Å
294	H	84.3	Confident	81.1	Confident	36 Å²	36	55.1 Å²	55.1	17%	0.167	28%	0.276	C	S	.	.	H	α-helix	trans	-46.9	-55.1	178.2	-74.1	-49.2	0	0	0	112.7	V282 Y283 N291 I296 V297 S298	V282-H294 WeakPolarHBondContact CG1-CE1 3.3Å; V282-H294 WeakPolarHBondContact CG1-ND1 3.25Å; V282-H294 PolarHBondContact O-CE1 3.42Å; Y283-H294 AromaticContact CD1-CE1 3.23Å; Y283-H294 WeakPolarHBondContact CD1-CE1 2.89Å; Y283-H294 AromaticContact CD1-ND1 3.33Å; Y283-H294 VanDerWaalsContact CD1-ND1 3.33Å; Y283-H294 WeakPolarHBondContact CD1-ND1 3.29Å; Y283-H294 AromaticContact CD2-CE1 3.98Å; Y283-H294 AromaticContact CD2-ND1 3.69Å; Y283-H294 AromaticContact CE1-CE1 3.54Å; Y283-H294 AromaticContact CE1-CG 3.89Å; Y283-H294 AromaticContact CE1-ND1 3.14Å; Y283-H294 WeakPolarHBondContact CE1-ND1 3.07Å; Y283-H294 AromaticContact CE2-ND1 3.47Å; Y283-H294 WeakPolarHBondContact CE2-ND1 3.31Å; Y283-H294 AromaticContact CG-CE1 3.5Å; Y283-H294 AromaticContact CG-ND1 3.63Å; Y283-H294 AromaticContact CZ-ND1 3.21Å; N291-H294 WeakPolarHBondContact CA-CD2 3.5Å; N291-H294 WeakPolarHBondContact O-CB 3.48Å; N291-H294 PolarHBondContact O-CD2 2.93Å; N291-H294 PolarHBondContact O-N 2.82Å; N291-H294 PolarHBondContact OD1-NE2 3.26Å; H294-I296 PolarHBondContact O-N 2.66Å; H294-V297 PolarHBondContact O-N 3.1Å; H294-S298 WeakPolarHBondContact O-CB 3.36Å; H294-S298 PolarHBondContact O-N 2.84Å; H294-S298 PolarHBondContact O-OG 3.37Å
295	P	83.9	Confident	81.3	Confident	88 Å²	88	47.2 Å²	47.2	57%	0.571	24%	0.241	S	C	*	.	H	α-helix	trans	-65	-33	-173.5	-19.1	34.3	0	0	0	112	N292 L293 K299	N292-P295 WeakPolarHBondContact O-CD 3.46Å; L293-P295 VanDerWaalsContact C-CD 3.5Å; P295-K299 WeakPolarHBondContact O-CB 3.31Å; P295-K299 PolarHBondContact O-N 3.29Å
296	I	85.1	Confident	81.7	Confident	85 Å²	85	47 Å²	47	44%	0.436	24%	0.239	S	C	.	.	H	α-helix	trans	-73	-45.3	-177.8	-47.8	177.1	0	0	0	110.1	V241 L293 H294 K299 L300	V241-I296 HydrophobicContact CG1-CB 4.31Å; V241-I296 HydrophobicContact CG1-CG2 3.42Å; V241-I296 VanDerWaalsContact CG1-CG2 3.42Å; L293-I296 HydrophobicContact CD2-CD1 4.16Å; L293-I296 PolarHBondContact O-N 3.42Å; L293-I296 VanDerWaalsContact O-N 3.13Å; H294-I296 PolarHBondContact O-N 2.66Å; I296-K299 PolarHBondContact O-N 3.19Å; I296-L300 PolarHBondContact O-N 3.07Å
297	V	86.5	Confident	82.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.3	-42.8	177.5	-179.9	0	0	0	0	110.9	V241 L275 L278 Y279 L293 H294 K299 L300 I301	V241-V297 HydrophobicContact CG2-CG2 4.23Å; L275-V297 HydrophobicContact CD1-CG1 4.19Å; L278-V297 HydrophobicContact CD2-CG2 3.89Å; L278-V297 HydrophobicContact CG-CG2 4Å; Y279-V297 HydrophobicContact CD2-CG1 3.96Å; L293-V297 WeakPolarHBondContact O-CG2 3.21Å; L293-V297 PolarHBondContact O-N 3.15Å; H294-V297 PolarHBondContact O-N 3.1Å; V297-K299 VanDerWaalsContact C-N 3.33Å; V297-K299 PolarHBondContact O-N 3.3Å; V297-L300 PolarHBondContact O-N 3.46Å; V297-I301 HydrophobicContact CG1-CD1 4.06Å; V297-I301 WeakPolarHBondContact O-CG1 3.45Å; V297-I301 PolarHBondContact O-N 2.93Å
298	S	88	Confident	82.4	Confident	14 Å²	14	39.2 Å²	39.2	10%	0.098	20%	0.201	C	C	.	.	H	α-helix	trans	-59.7	-43.3	174.4	-68.8	0	0	0	0	112	Y283 H294 L300 I301 Y302 N367	Y283-S298 PolarHBondContact OH-OG 3.31Å; H294-S298 WeakPolarHBondContact O-CB 3.36Å; H294-S298 PolarHBondContact O-N 2.84Å; H294-S298 PolarHBondContact O-OG 3.37Å; S298-L300 PolarHBondContact O-N 3.09Å; S298-I301 PolarHBondContact O-N 3.2Å; S298-Y302 WeakPolarHBondContact O-CB 3.44Å; S298-Y302 PolarHBondContact O-N 3.14Å; S298-N367 WeakPolarHBondContact CB-OD1 3.45Å; S298-N367 PolarHBondContact OG-OD1 3.37Å
299	K	88.3	Confident	82.7	Confident	122 Å²	122	33.7 Å²	33.7	53%	0.53	17%	0.172	S	C	.	.	H	α-helix	trans	-61.5	-43.3	176.5	-178.2	179.6	171.9	-172.8	0	111.8	P295 I296 V297 Y302 E303	P295-K299 WeakPolarHBondContact O-CB 3.31Å; P295-K299 PolarHBondContact O-N 3.29Å; I296-K299 PolarHBondContact O-N 3.19Å; V297-K299 VanDerWaalsContact C-N 3.33Å; V297-K299 PolarHBondContact O-N 3.3Å; K299-Y302 WeakPolarHBondContact O-CB 3.24Å; K299-Y302 PolarHBondContact O-N 3.47Å; K299-E303 WeakPolarHBondContact CE-OE1 3.37Å; K299-E303 HydrophobicContact CG-CG 4.48Å; K299-E303 IonicContact NZ-OE1 3.29Å; K299-E303 WeakPolarHBondContact O-CB 3.38Å; K299-E303 WeakPolarHBondContact O-CG 3.17Å; K299-E303 PolarHBondContact O-N 3.15Å
300	L	88.6	Confident	82.7	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-44.7	177	176.6	58.8	0	0	0	112	L244 H245 T249 L275 I296 V297 S298 E303 L304	L244-L300 HydrophobicContact CB-CD2 3.82Å; H245-L300 HydrophobicContact CB-CD1 4.16Å; T249-L300 HydrophobicContact CG2-CD1 3.73Å; L275-L300 HydrophobicContact CD1-CD2 3.63Å; L275-L300 HydrophobicContact CD1-CG 4.16Å; I296-L300 PolarHBondContact O-N 3.07Å; V297-L300 PolarHBondContact O-N 3.46Å; S298-L300 PolarHBondContact O-N 3.09Å; L300-E303 PolarHBondContact O-N 3.33Å; L300-L304 HydrophobicContact CD1-CD1 4.19Å; L300-L304 HydrophobicContact CD1-CG 4.38Å; L300-L304 HydrophobicContact CG-CD1 4.23Å; L300-L304 WeakPolarHBondContact O-CG 3.13Å; L300-L304 PolarHBondContact O-N 2.77Å
301	I	89.1	Confident	82.5	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-45.7	176.1	-69	161.5	0	0	0	110.7	L275 Y279 V297 S298 E303 L304 L305 C363	L275-I301 HydrophobicContact CD1-CG1 4.25Å; L275-I301 HydrophobicContact CD2-CG1 4.09Å; L275-I301 HydrophobicContact CG-CG1 4.33Å; Y279-I301 HydrophobicContact CD2-CD1 3.24Å; Y279-I301 HydrophobicContact CE2-CD1 3.67Å; Y279-I301 HydrophobicContact CG-CD1 4.06Å; V297-I301 HydrophobicContact CG1-CD1 4.06Å; V297-I301 WeakPolarHBondContact O-CG1 3.45Å; V297-I301 PolarHBondContact O-N 2.93Å; S298-I301 PolarHBondContact O-N 3.2Å; I301-E303 VanDerWaalsContact C-N 3.35Å; I301-E303 PolarHBondContact O-N 3.49Å; I301-L304 PolarHBondContact O-N 2.72Å; I301-L305 HydrophobicContact CG2-CD1 3.85Å; I301-L305 PolarHBondContact O-N 2.92Å; I301-C363 HydrophobicContact CD1-CB 3.89Å; I301-C363 HydrophobicContact CG1-CB 4.16Å; I301-C363 HydrophobicContact CG2-CB 4.08Å
302	Y	89.5	Confident	82	Confident	45 Å²	45	39.1 Å²	39.1	18%	0.176	19%	0.194	C	C	.	.	H	α-helix	trans	-57.3	-47.1	176.7	171.2	-95.7	0	0	0	111.7	S298 K299 L305 C306 Q377 I381	S298-Y302 WeakPolarHBondContact O-CB 3.44Å; S298-Y302 PolarHBondContact O-N 3.14Å; K299-Y302 WeakPolarHBondContact O-CB 3.24Å; K299-Y302 PolarHBondContact O-N 3.47Å; Y302-L305 PolarHBondContact O-N 3.44Å; Y302-C306 WeakPolarHBondContact CE2-SG 3.31Å; Y302-C306 VanDerWaalsContact O-CB 3.31Å; Y302-C306 WeakPolarHBondContact O-CB 3.41Å; Y302-C306 PolarHBondContact O-N 3.47Å; Y302-C306 PolarHBondContact O-SG 3.17Å; Y302-Q377 HydrophobicContact CD2-CB 4.49Å; Y302-Q377 HydrophobicContact CE2-CB 4.3Å; Y302-Q377 HydrophobicContact CE2-CG 4.26Å; Y302-I381 HydrophobicContact CD2-CD1 4.22Å; Y302-I381 HydrophobicContact CD2-CG1 3.83Å; Y302-I381 HydrophobicContact CE2-CG1 4.45Å
303	E	86.2	Confident	81	Confident	39 Å²	39	42.4 Å²	42.4	18%	0.182	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-41.4	178.7	-75.9	177.3	176.5	0	0	112.1	H245 T249 K299 L300 I301 L305 S307	H245-E303 IonicContact CD2-OE2 2.72Å; H245-E303 IonicContact NE2-OE2 2.77Å; H245-E303 PolarHBondContact NE2-OE2 3.43Å; T249-E303 HydrophobicContact CG2-CB 4.36Å; K299-E303 WeakPolarHBondContact CE-OE1 3.37Å; K299-E303 HydrophobicContact CG-CG 4.48Å; K299-E303 IonicContact NZ-OE1 3.29Å; K299-E303 WeakPolarHBondContact O-CB 3.38Å; K299-E303 WeakPolarHBondContact O-CG 3.17Å; K299-E303 PolarHBondContact O-N 3.15Å; L300-E303 PolarHBondContact O-N 3.33Å; I301-E303 VanDerWaalsContact C-N 3.35Å; I301-E303 PolarHBondContact O-N 3.49Å; E303-L305 PolarHBondContact O-N 3.49Å; E303-S307 WeakPolarHBondContact O-CB 3.3Å; E303-S307 PolarHBondContact O-N 3.29Å
304	L	86.1	Confident	79.6	Confident	2 Å²	2	46 Å²	46	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-43.5	176.8	-74.9	167.5	0	0	0	112.3	L248 T249 L275 L300 I301 S307 T329	L248-L304 HydrophobicContact CB-CD1 4.4Å; L248-L304 HydrophobicContact CB-CD2 3.77Å; L248-L304 HydrophobicContact CD1-CD1 4.05Å; T249-L304 HydrophobicContact CG2-CD2 3.64Å; T249-L304 HydrophobicContact CG2-CG 3.87Å; L275-L304 HydrophobicContact CD2-CD1 3.48Å; L275-L304 VanDerWaalsContact CD2-CD1 3.48Å; L300-L304 HydrophobicContact CD1-CD1 4.19Å; L300-L304 HydrophobicContact CD1-CG 4.38Å; L300-L304 HydrophobicContact CG-CD1 4.23Å; L300-L304 WeakPolarHBondContact O-CG 3.13Å; L300-L304 PolarHBondContact O-N 2.77Å; I301-L304 PolarHBondContact O-N 2.72Å; L304-S307 PolarHBondContact O-OG 3.25Å; L304-T329 PolarHBondContact O-OG1 3.3Å
305	L	86.5	Confident	78	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-51.9	177.7	-74.9	162.4	0	0	0	111.7	I301 Y302 E303 S307 H308 I360 I381 I385 L388	I301-L305 HydrophobicContact CG2-CD1 3.85Å; I301-L305 PolarHBondContact O-N 2.92Å; Y302-L305 PolarHBondContact O-N 3.44Å; E303-L305 PolarHBondContact O-N 3.49Å; L305-S307 PolarHBondContact O-N 3.46Å; L305-H308 PolarHBondContact O-N 3.48Å; L305-I360 HydrophobicContact CD2-CG2 3.46Å; L305-I360 VanDerWaalsContact CD2-CG2 3.46Å; L305-I360 HydrophobicContact CG-CG2 3.85Å; L305-I381 HydrophobicContact CD1-CG2 4.13Å; L305-I385 HydrophobicContact CD2-CG1 3.88Å; L305-L388 HydrophobicContact CD2-CD1 3.95Å
306	C	83.3	Confident	76.1	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.034	24%	0.242	C	C	.	.	H	α-helix	trans	-73.2	-15.4	-175.5	-61.6	0	0	0	0	113.1	Y302 H308 S309 R310 S384	Y302-C306 WeakPolarHBondContact CE2-SG 3.31Å; Y302-C306 VanDerWaalsContact O-CB 3.31Å; Y302-C306 WeakPolarHBondContact O-CB 3.41Å; Y302-C306 PolarHBondContact O-N 3.47Å; Y302-C306 PolarHBondContact O-SG 3.17Å; C306-H308 PolarHBondContact O-N 3.46Å; C306-S309 PolarHBondContact O-N 2.71Å; C306-R310 VanDerWaalsContact O-CG 3.29Å; C306-R310 WeakPolarHBondContact O-CG 3.2Å; C306-R310 PolarHBondContact O-N 2.9Å; C306-R310 VanDerWaalsContact O-N 3.13Å; C306-S384 PolarHBondContact SG-OG 3.26Å
307	S	81.2	Confident	73.8	Confident	24 Å²	24	54.3 Å²	54.3	17%	0.168	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-34.3	176.1	69.5	0	0	0	0	112	E303 L304 L305 S311 C327	E303-S307 WeakPolarHBondContact O-CB 3.3Å; E303-S307 PolarHBondContact O-N 3.29Å; L304-S307 PolarHBondContact O-OG 3.25Å; L305-S307 PolarHBondContact O-N 3.46Å; S307-S311 WeakPolarHBondContact O-CB 3.44Å; S307-S311 PolarHBondContact O-N 3.19Å; S307-C327 VanDerWaalsContact C-SG 3.55Å; S307-C327 VanDerWaalsContact OG-CB 3.31Å; S307-C327 WeakPolarHBondContact OG-CB 3.28Å; S307-C327 PolarHBondContact OG-SG 3.08Å
308	H	78.7	Confident	71.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-55.7	178.8	177.9	70.6	0	0	0	111.6	L305 C306 R310 S311 Q312 T329 T330 L388 D391	L305-H308 PolarHBondContact O-N 3.48Å; C306-H308 PolarHBondContact O-N 3.46Å; H308-R310 PolarHBondContact O-N 2.88Å; H308-S311 WeakPolarHBondContact O-CA 3.07Å; H308-S311 WeakPolarHBondContact O-CB 3.43Å; H308-S311 PolarHBondContact O-N 3.41Å; H308-S311 PolarHBondContact O-OG 3.24Å; H308-Q312 PolarHBondContact CE1-NE2 3.1Å; H308-Q312 PolarHBondContact NE2-NE2 2.89Å; H308-Q312 PolarHBondContact O-N 2.95Å; H308-T329 HydrophobicContact CB-CG2 4.33Å; H308-T330 PolarHBondContact ND1-OG1 2.67Å; H308-L388 HydrophobicContact CB-CD2 3.6Å; H308-L388 HydrophobicContact CB-CG 4.12Å; H308-L388 WeakPolarHBondContact CD2-CD2 2.96Å; H308-D391 IonicContact CE1-OD2 2.75Å; H308-D391 PolarHBondContact CE1-OD2 3.48Å; H308-D391 VanDerWaalsContact CE1-OD2 3.26Å; H308-D391 IonicContact NE2-OD2 3.36Å
309	S	74.9	Confident	69.2	Low	7 Å²	7	62.7 Å²	62.7	5%	0.049	31%	0.311	C	S	.	.	H	α-helix	trans	-54.4	-41.3	176.9	-56	0	0	0	0	112.5	C306 R313 S384 E387	C306-S309 PolarHBondContact O-N 2.71Å; S309-R313 VanDerWaalsContact O-CG 3.28Å; S309-R313 WeakPolarHBondContact O-CG 3.38Å; S309-R313 PolarHBondContact O-N 3.21Å; S309-R313 VanDerWaalsContact O-N 3.15Å; S309-S384 PolarHBondContact OG-OG 2.95Å; S309-E387 WeakPolarHBondContact CA-OE2 3.41Å; S309-E387 WeakPolarHBondContact CB-OE2 3.38Å; S309-E387 PolarHBondContact OG-OE2 2.65Å
310	R	71	Confident	66.9	Low	137 Å²	137	65.1 Å²	65.1	52%	0.517	33%	0.329	S	S	.	.	H	α-helix	trans	-66	-41.9	175.5	-69.5	173.4	-172	173.5	4.8	111.9	C306 H308 R313 S314	C306-R310 VanDerWaalsContact O-CG 3.29Å; C306-R310 WeakPolarHBondContact O-CG 3.2Å; C306-R310 PolarHBondContact O-N 2.9Å; C306-R310 VanDerWaalsContact O-N 3.13Å; H308-R310 PolarHBondContact O-N 2.88Å; R310-R313 PolarHBondContact O-N 2.95Å; R310-S314 PolarHBondContact O-N 2.99Å; R310-S314 VanDerWaalsContact O-N 3.07Å; R310-S314 PolarHBondContact O-OG 3.13Å
311	S	68.2	Low	64.7	Low	15 Å²	15	67.9 Å²	67.9	11%	0.105	35%	0.349	C	S	.	.	H	α-helix	trans	-62.7	-46.3	178.6	76.2	0	0	0	0	111.1	S307 H308 R313 S314 T315 T330	S307-S311 WeakPolarHBondContact O-CB 3.44Å; S307-S311 PolarHBondContact O-N 3.19Å; H308-S311 WeakPolarHBondContact O-CA 3.07Å; H308-S311 WeakPolarHBondContact O-CB 3.43Å; H308-S311 PolarHBondContact O-N 3.41Å; H308-S311 PolarHBondContact O-OG 3.24Å; S311-R313 PolarHBondContact O-N 3.07Å; S311-S314 PolarHBondContact O-N 3Å; S311-S314 VanDerWaalsContact O-N 3.16Å; S311-S314 PolarHBondContact O-OG 3.37Å; S311-T315 PolarHBondContact O-N 3.19Å; S311-T315 PolarHBondContact O-OG1 3.26Å; S311-T330 PolarHBondContact OG-OG1 3.3Å
312	Q	64.6	Low	62.6	Low	74 Å²	74	74.1 Å²	74.1	35%	0.346	38%	0.383	S	S	.	.	H	α-helix	trans	-59.6	-44.1	177.4	-74.8	-169.2	-14.1	0	0	112	H308 S314 T315 D391	H308-Q312 PolarHBondContact CE1-NE2 3.1Å; H308-Q312 PolarHBondContact NE2-NE2 2.89Å; H308-Q312 PolarHBondContact O-N 2.95Å; Q312-S314 VanDerWaalsContact C-N 3.3Å; Q312-S314 PolarHBondContact O-N 2.48Å; Q312-T315 WeakPolarHBondContact CA-OG1 3.5Å; Q312-T315 PolarHBondContact O-N 3.33Å; Q312-T315 PolarHBondContact O-OG1 3.07Å; Q312-D391 PolarHBondContact NE2-OD2 3.07Å
313	R	55.9	Low	60.5	Low	179 Å²	179	72.6 Å²	72.6	68%	0.675	38%	0.379	S	S	*	.	H	α-helix	trans	-66.1	-29.9	178.2	-69.5	174.6	-167	-175.7	5.1	113.5	S309 R310 S311 E387	S309-R313 VanDerWaalsContact O-CG 3.28Å; S309-R313 WeakPolarHBondContact O-CG 3.38Å; S309-R313 PolarHBondContact O-N 3.21Å; S309-R313 VanDerWaalsContact O-N 3.15Å; R310-R313 PolarHBondContact O-N 2.95Å; S311-R313 PolarHBondContact O-N 3.07Å; R313-E387 IonicContact NH2-OE1 3.44Å
314	S	52.1	Low	58.6	Low	89 Å²	89	73.5 Å²	73.5	62%	0.622	38%	0.382	S	S	*	.	H	α-helix	trans	-78.1	-24.9	179.1	70.3	0	0	0	0	113.3	R310 S311 Q312 I316	R310-S314 PolarHBondContact O-N 2.99Å; R310-S314 VanDerWaalsContact O-N 3.07Å; R310-S314 PolarHBondContact O-OG 3.13Å; S311-S314 PolarHBondContact O-N 3Å; S311-S314 VanDerWaalsContact O-N 3.16Å; S311-S314 PolarHBondContact O-OG 3.37Å; Q312-S314 VanDerWaalsContact C-N 3.3Å; Q312-S314 PolarHBondContact O-N 2.48Å; S314-I316 VanDerWaalsContact C-N 3.32Å; S314-I316 PolarHBondContact O-N 3.4Å
315	T	50.3	Low	57	Low	56 Å²	56	73.9 Å²	73.9	34%	0.344	39%	0.385	S	S	.	.			trans	-76.1	77.1	176.4	16.3	0	0	0	0	111.3	S311 Q312	S311-T315 PolarHBondContact O-N 3.19Å; S311-T315 PolarHBondContact O-OG1 3.26Å; Q312-T315 WeakPolarHBondContact CA-OG1 3.5Å; Q312-T315 PolarHBondContact O-N 3.33Å; Q312-T315 PolarHBondContact O-OG1 3.07Å
316	I	43	Very low	55.9	Low	147 Å²	147	74.7 Å²	74.7	75%	0.754	39%	0.394	S	S	*	.	S	Bend	trans	-87.4	-21.8	164.3	-66.8	179.4	0	0	0	111.5	S314	S314-I316 VanDerWaalsContact C-N 3.32Å; S314-I316 PolarHBondContact O-N 3.4Å
317	E	37.9	Very low	55.5	Low	180 Å²	180	74.8 Å²	74.8	84%	0.841	39%	0.394	S	S	*	.	S	Bend	trans	-146.4	11.8	-169	-89.8	179.9	179.7	0	0	119.4
318	I	41	Very low	55.4	Low	100 Å²	100	73.7 Å²	73.7	51%	0.513	39%	0.386	S	S	.	.			trans	-99.9	109.5	-175.6	-51.8	177.4	0	0	0	111.5
319	S	37.2	Very low	55.5	Low	89 Å²	89	73.7 Å²	73.7	62%	0.622	39%	0.386	S	S	*	.			trans	-36.2	153.5	177.4	53.6	0	0	0	0	117.3	S321	S319-S321 PolarHBondContact O-N 2.95Å; S319-S321 PolarHBondContact O-OG 3.24Å
320	N	40.6	Very low	55.6	Low	173 Å²	173	73.6 Å²	73.6	93%	0.925	39%	0.386	S	S	*	.	S	Bend	trans	-41.5	10.7	172.7	-74.1	-8.1	0	0	0	119.3	N322	N320-N322 PolarHBondContact O-N 3.4Å
321	S	40.9	Very low	55.8	Low	61 Å²	61	67.7 Å²	67.7	43%	0.427	36%	0.364	S	S	.	.			trans	-66.7	124.4	164.3	58.7	0	0	0	0	108.7	S319 A323	S319-S321 PolarHBondContact O-N 2.95Å; S319-S321 PolarHBondContact O-OG 3.24Å; S321-A323 PolarHBondContact O-N 3.47Å; S321-A323 WeakPolarHBondContact OG-CB 3.37Å
322	N	45.5	Very low	56.3	Low	135 Å²	135	67.4 Å²	67.4	72%	0.722	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	14	167.9	-74.6	-15.2	0	0	0	114.1	N320	N320-N322 PolarHBondContact O-N 3.4Å
323	A	45.8	Very low	57	Low	13 Å²	13	63.9 Å²	63.9	11%	0.107	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-25.3	-158	0	0	0	0	0	114.7	L259 S321	L259-A323 HydrophobicContact CD1-CB 3.59Å; L259-A323 HydrophobicContact CD2-CB 3.48Å; L259-A323 VanDerWaalsContact CD2-CB 3.48Å; L259-A323 HydrophobicContact CG-CB 3.35Å; S321-A323 PolarHBondContact O-N 3.47Å; S321-A323 WeakPolarHBondContact OG-CB 3.37Å
324	F	45.7	Very low	58	Low	57 Å²	57	59.2 Å²	59.2	25%	0.25	33%	0.327	C	S	.	.			trans	-114	92	-169.6	-167.1	-91.5	0	0	0	112	S256 R334	S256-F324 WeakPolarHBondContact O-CD2 3.27Å; S256-F324 WeakPolarHBondContact O-CE2 3.49Å; F324-R334 VanDerWaalsContact C-NH1 3.32Å; F324-R334 PolarHBondContact O-NH1 3.4Å; F324-R334 PolarHBondContact O-NH2 3.28Å
325	C	52.5	Low	59	Low	11 Å²	11	55.3 Å²	55.3	7%	0.074	30%	0.3	C	S	.	.			trans	-101.6	93.9	170.1	-58.8	0	0	0	0	108.1	C327 H331 R334	C325-C327 PolarHBondContact O-N 3.25Å; C325-H331 HydrophobicContact CB-CB 3.67Å; C325-H331 VanDerWaalsContact SG-CA 3.58Å; C325-R334 PolarHBondContact SG-NH1 2.98Å
326	G	63.2	Low	60.2	Low	17 Å²	17	52.9 Å²	52.9	18%	0.175	29%	0.285	C	S	.	.	S	Bend	trans	-58.1	-14.3	179.3	0	0	0	0	0	114.4
327	C	75.4	Confident	61.7	Low	6 Å²	6	47.3 Å²	47.3	4%	0.041	26%	0.255	C	S	.	.	S	Bend	trans	-148.4	162.3	171	68.3	0	0	0	0	112.2	S307 C325 T329 T330 H331	S307-C327 VanDerWaalsContact C-SG 3.55Å; S307-C327 VanDerWaalsContact OG-CB 3.31Å; S307-C327 WeakPolarHBondContact OG-CB 3.28Å; S307-C327 PolarHBondContact OG-SG 3.08Å; C325-C327 PolarHBondContact O-N 3.25Å; C327-T329 VanDerWaalsContact C-N 3.34Å; C327-T329 PolarHBondContact O-N 3.22Å; C327-T330 PolarHBondContact O-N 3.32Å; C327-T330 PolarHBondContact SG-OG1 3.21Å; C327-H331 PolarHBondContact O-N 3.49Å
328	L	79.9	Confident	63.2	Low	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-57.9	-42.6	177.1	175.5	64.4	0	0	0	112.7	L248 F252 P268 V272 T330 H331 I332	L248-L328 HydrophobicContact CD2-CD2 3.44Å; L248-L328 VanDerWaalsContact CD2-CD2 3.44Å; F252-L328 HydrophobicContact CD1-CB 4.27Å; F252-L328 HydrophobicContact CD2-CB 3.99Å; F252-L328 HydrophobicContact CE1-CB 4.23Å; F252-L328 HydrophobicContact CE1-CD1 4.14Å; F252-L328 HydrophobicContact CE2-CB 3.95Å; F252-L328 HydrophobicContact CE2-CD1 4.12Å; F252-L328 HydrophobicContact CE2-CG 4.43Å; F252-L328 HydrophobicContact CG-CB 4.16Å; F252-L328 HydrophobicContact CZ-CB 4.08Å; F252-L328 HydrophobicContact CZ-CD1 3.67Å; F252-L328 HydrophobicContact CZ-CG 4.39Å; P268-L328 HydrophobicContact CB-CD1 4.13Å; V272-L328 HydrophobicContact CG2-CD2 4.41Å; L328-T330 VanDerWaalsContact C-N 3.33Å; L328-T330 PolarHBondContact O-N 2.81Å; L328-H331 WeakPolarHBondContact O-CA 3.16Å; L328-H331 VanDerWaalsContact O-CB 3.28Å; L328-H331 WeakPolarHBondContact O-CB 3.37Å; L328-H331 PolarHBondContact O-N 2.96Å; L328-I332 HydrophobicContact CD1-CD1 4.1Å; L328-I332 HydrophobicContact CD1-CG1 4.14Å; L328-I332 HydrophobicContact CD2-CD1 4.35Å; L328-I332 HydrophobicContact CG-CD1 3.83Å; L328-I332 HydrophobicContact CG-CG1 4.31Å; L328-I332 WeakPolarHBondContact O-CG1 3.5Å; L328-I332 PolarHBondContact O-N 3.37Å
329	T	79.5	Confident	64.3	Low	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.2	-40.4	-175	-42.4	0	0	0	0	111.4	L304 H308 C327 H331 I332 V333 L357 L388	L304-T329 PolarHBondContact O-OG1 3.3Å; H308-T329 HydrophobicContact CB-CG2 4.33Å; C327-T329 VanDerWaalsContact C-N 3.34Å; C327-T329 PolarHBondContact O-N 3.22Å; T329-H331 VanDerWaalsContact C-N 3.31Å; T329-H331 PolarHBondContact O-N 3.09Å; T329-I332 PolarHBondContact O-N 2.9Å; T329-V333 WeakPolarHBondContact O-CG2 3.24Å; T329-V333 PolarHBondContact O-N 2.89Å; T329-L357 HydrophobicContact CG2-CD1 4.1Å; T329-L388 HydrophobicContact CG2-CD1 3.88Å; T329-L388 HydrophobicContact CG2-CD2 3.41Å; T329-L388 VanDerWaalsContact CG2-CD2 3.41Å; T329-L388 HydrophobicContact CG2-CG 4.32Å
330	T	76.8	Confident	65.5	Low	5 Å²	5	39.2 Å²	39.2	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-36.2	172.4	-61.8	0	0	0	0	112	H308 S311 C327 L328 R334	H308-T330 PolarHBondContact ND1-OG1 2.67Å; S311-T330 PolarHBondContact OG-OG1 3.3Å; C327-T330 PolarHBondContact O-N 3.32Å; C327-T330 PolarHBondContact SG-OG1 3.21Å; L328-T330 VanDerWaalsContact C-N 3.33Å; L328-T330 PolarHBondContact O-N 2.81Å; T330-R334 WeakPolarHBondContact O-CG 3.42Å; T330-R334 PolarHBondContact O-N 2.83Å; T330-R334 VanDerWaalsContact O-N 3.09Å
331	H	76.3	Confident	65.9	Low	14 Å²	14	36.4 Å²	36.4	7%	0.065	19%	0.191	C	C	.	.	H	α-helix	trans	-61.9	-49.9	172.9	-174.5	72.5	0	0	0	111.3	V262 C325 C327 L328 T329 V333 R334 T335	V262-H331 WeakPolarHBondContact CA-NE2 3.42Å; V262-H331 VanDerWaalsContact CB-NE2 3.35Å; V262-H331 WeakPolarHBondContact CB-NE2 3.15Å; V262-H331 PolarHBondContact N-CE1 2.62Å; V262-H331 VanDerWaalsContact N-CE1 3.35Å; V262-H331 PolarHBondContact N-NE2 3.47Å; C325-H331 HydrophobicContact CB-CB 3.67Å; C325-H331 VanDerWaalsContact SG-CA 3.58Å; C327-H331 PolarHBondContact O-N 3.49Å; L328-H331 WeakPolarHBondContact O-CA 3.16Å; L328-H331 VanDerWaalsContact O-CB 3.28Å; L328-H331 WeakPolarHBondContact O-CB 3.37Å; L328-H331 PolarHBondContact O-N 2.96Å; T329-H331 VanDerWaalsContact C-N 3.31Å; T329-H331 PolarHBondContact O-N 3.09Å; H331-V333 VanDerWaalsContact C-N 3.35Å; H331-V333 PolarHBondContact O-N 3.39Å; H331-R334 PolarHBondContact O-N 3.3Å; H331-T335 PolarHBondContact NE2-OG1 3.05Å; H331-T335 PolarHBondContact O-N 3.41Å; H331-T335 PolarHBondContact O-OG1 2.69Å
332	I	79.2	Confident	66.3	Low	9 Å²	9	41.7 Å²	41.7	5%	0.046	21%	0.207	C	C	.	.	H	α-helix	trans	-58.4	-46.8	179.7	-63	163.6	0	0	0	110.8	L328 T329 R334 T335 I336 L357 I360	L328-I332 HydrophobicContact CD1-CD1 4.1Å; L328-I332 HydrophobicContact CD1-CG1 4.14Å; L328-I332 HydrophobicContact CD2-CD1 4.35Å; L328-I332 HydrophobicContact CG-CD1 3.83Å; L328-I332 HydrophobicContact CG-CG1 4.31Å; L328-I332 WeakPolarHBondContact O-CG1 3.5Å; L328-I332 PolarHBondContact O-N 3.37Å; T329-I332 PolarHBondContact O-N 2.9Å; I332-R334 VanDerWaalsContact C-N 3.35Å; I332-R334 PolarHBondContact O-N 3.17Å; I332-T335 PolarHBondContact O-N 2.97Å; I332-I336 HydrophobicContact CG2-CD1 3.76Å; I332-I336 HydrophobicContact CG2-CG1 4.33Å; I332-I336 VanDerWaalsContact O-CG1 3.27Å; I332-I336 WeakPolarHBondContact O-CG1 3.49Å; I332-I336 PolarHBondContact O-N 3.38Å; I332-L357 HydrophobicContact CG2-CB 3.81Å; I332-I360 HydrophobicContact CD1-CD1 4.01Å
333	V	79.3	Confident	66.2	Low	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58	-45.8	178	169.3	0	0	0	0	111.5	T329 H331 I336 K337 L357 L388 D391 I392	T329-V333 WeakPolarHBondContact O-CG2 3.24Å; T329-V333 PolarHBondContact O-N 2.89Å; H331-V333 VanDerWaalsContact C-N 3.35Å; H331-V333 PolarHBondContact O-N 3.39Å; V333-I336 PolarHBondContact O-N 2.9Å; V333-K337 HydrophobicContact CG1-CD 4.49Å; V333-K337 WeakPolarHBondContact O-CG 3.34Å; V333-K337 PolarHBondContact O-N 3.16Å; V333-L357 HydrophobicContact CG2-CD2 4.47Å; V333-L388 HydrophobicContact CG2-CD2 3.62Å; V333-D391 HydrophobicContact CG1-CB 4.02Å; V333-I392 HydrophobicContact CB-CG1 4.45Å; V333-I392 HydrophobicContact CG1-CG1 3.89Å; V333-I392 HydrophobicContact CG2-CD1 4.28Å; V333-I392 HydrophobicContact CG2-CG1 4.14Å
334	R	75.7	Confident	66.1	Low	80 Å²	80	46 Å²	46	30%	0.302	23%	0.232	S	C	.	.	H	α-helix	trans	-65.8	-39.5	177.6	-73.4	179.6	-176.6	161.3	0.6	112.7	F324 C325 T330 H331 I332 I336 K337 T338	F324-R334 VanDerWaalsContact C-NH1 3.32Å; F324-R334 PolarHBondContact O-NH1 3.4Å; F324-R334 PolarHBondContact O-NH2 3.28Å; C325-R334 PolarHBondContact SG-NH1 2.98Å; T330-R334 WeakPolarHBondContact O-CG 3.42Å; T330-R334 PolarHBondContact O-N 2.83Å; T330-R334 VanDerWaalsContact O-N 3.09Å; H331-R334 PolarHBondContact O-N 3.3Å; I332-R334 VanDerWaalsContact C-N 3.35Å; I332-R334 PolarHBondContact O-N 3.17Å; R334-I336 VanDerWaalsContact C-N 3.33Å; R334-K337 WeakPolarHBondContact O-CB 3.33Å; R334-K337 PolarHBondContact O-N 3.42Å; R334-T338 WeakPolarHBondContact O-CG2 3.2Å; R334-T338 PolarHBondContact O-N 3.11Å; R334-T338 PolarHBondContact O-OG1 2.99Å; R334-T338 VanDerWaalsContact O-OG1 3.08Å
335	T	74.4	Confident	66	Low	8 Å²	8	51.4 Å²	51.4	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-43.8	176	-55.1	0	0	0	0	110.5	H331 I332 K337 T338 Q339 I353	H331-T335 PolarHBondContact NE2-OG1 3.05Å; H331-T335 PolarHBondContact O-N 3.41Å; H331-T335 PolarHBondContact O-OG1 2.69Å; I332-T335 PolarHBondContact O-N 2.97Å; T335-K337 PolarHBondContact O-N 3.14Å; T335-T338 WeakPolarHBondContact CA-OG1 3.49Å; T335-T338 PolarHBondContact O-N 2.79Å; T335-T338 PolarHBondContact O-OG1 2.94Å; T335-Q339 PolarHBondContact O-N 3.13Å; T335-I353 HydrophobicContact CG2-CD1 3.69Å; T335-I353 HydrophobicContact CG2-CG2 3.76Å
336	I	75.1	Confident	65.6	Low	5 Å²	5	57.2 Å²	57.2	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-58.4	-46.7	174.3	-67.2	167.3	0	0	0	110.8	I332 V333 R334 Q339 K340 I353 L357 I392	I332-I336 HydrophobicContact CG2-CD1 3.76Å; I332-I336 HydrophobicContact CG2-CG1 4.33Å; I332-I336 VanDerWaalsContact O-CG1 3.27Å; I332-I336 WeakPolarHBondContact O-CG1 3.49Å; I332-I336 PolarHBondContact O-N 3.38Å; V333-I336 PolarHBondContact O-N 2.9Å; R334-I336 VanDerWaalsContact C-N 3.33Å; I336-Q339 PolarHBondContact O-N 3.18Å; I336-K340 HydrophobicContact CG2-CD 4.38Å; I336-K340 HydrophobicContact CG2-CG 4.43Å; I336-K340 WeakPolarHBondContact O-CG 3.3Å; I336-K340 PolarHBondContact O-N 3.36Å; I336-I353 HydrophobicContact CG1-CG2 4.35Å; I336-L357 HydrophobicContact CD1-CB 4.2Å; I336-L357 HydrophobicContact CD1-CD2 3.73Å; I336-I392 HydrophobicContact CG2-CG2 4.12Å
337	K	73.8	Confident	64.8	Low	29 Å²	29	58.9 Å²	58.9	13%	0.126	30%	0.302	C	S	.	.	H	α-helix	trans	-58.5	-52.2	176.9	-75.4	-178.7	163	-148.6	0	112.6	V333 R334 T335 Q339 K340 I341 D391 S394 D395	V333-K337 HydrophobicContact CG1-CD 4.49Å; V333-K337 WeakPolarHBondContact O-CG 3.34Å; V333-K337 PolarHBondContact O-N 3.16Å; R334-K337 WeakPolarHBondContact O-CB 3.33Å; R334-K337 PolarHBondContact O-N 3.42Å; T335-K337 PolarHBondContact O-N 3.14Å; K337-Q339 PolarHBondContact O-N 3.37Å; K337-K340 PolarHBondContact O-N 3.01Å; K337-I341 WeakPolarHBondContact O-CG1 3.43Å; K337-I341 PolarHBondContact O-N 3.02Å; K337-D391 WeakPolarHBondContact CE-O 3.48Å; K337-D391 WeakPolarHBondContact CE-OD1 3.3Å; K337-D391 PolarHBondContact NZ-O 3.16Å; K337-D391 IonicContact NZ-OD1 2.95Å; K337-D391 PolarHBondContact NZ-OD1 3.28Å; K337-S394 PolarHBondContact NZ-OG 2.68Å; K337-D395 VanDerWaalsContact CD-OD2 3.32Å; K337-D395 WeakPolarHBondContact CD-OD2 3.5Å; K337-D395 WeakPolarHBondContact CE-OD2 2.99Å; K337-D395 IonicContact NZ-OD2 3.68Å; K337-D395 PolarHBondContact NZ-OD2 3.41Å
338	T	69	Low	63.4	Low	57 Å²	57	66.8 Å²	66.8	35%	0.35	34%	0.343	S	S	.	.	H	α-helix	trans	-63.7	-27.3	-177	55.3	0	0	0	0	113.2	R334 T335	R334-T338 WeakPolarHBondContact O-CG2 3.2Å; R334-T338 PolarHBondContact O-N 3.11Å; R334-T338 PolarHBondContact O-OG1 2.99Å; R334-T338 VanDerWaalsContact O-OG1 3.08Å; T335-T338 WeakPolarHBondContact CA-OG1 3.49Å; T335-T338 PolarHBondContact O-N 2.79Å; T335-T338 PolarHBondContact O-OG1 2.94Å
339	Q	65.1	Low	61.8	Low	52 Å²	52	74.6 Å²	74.6	24%	0.243	38%	0.384	C	S	.	.	H	α-helix	trans	-88.2	-32.8	175.7	-74.5	-165.5	-19.4	0	0	114.3	T335 I336 K337 I341 K342 C343	T335-Q339 PolarHBondContact O-N 3.13Å; I336-Q339 PolarHBondContact O-N 3.18Å; K337-Q339 PolarHBondContact O-N 3.37Å; Q339-I341 PolarHBondContact O-N 3.15Å; Q339-K342 CarbonylContact O-C 3.57Å; Q339-K342 WeakPolarHBondContact O-CA 3.41Å; Q339-K342 PolarHBondContact O-N 3.2Å; Q339-C343 PolarHBondContact O-N 2.86Å
340	K	61.6	Low	60.7	Low	91 Å²	91	79.7 Å²	79.7	40%	0.396	41%	0.408	S	S	.	.	H	α-helix	trans	-54.3	-35.4	170.5	-83.1	-174.6	177.7	-176.1	0	111.8	I336 K337 K342 I392	I336-K340 HydrophobicContact CG2-CD 4.38Å; I336-K340 HydrophobicContact CG2-CG 4.43Å; I336-K340 WeakPolarHBondContact O-CG 3.3Å; I336-K340 PolarHBondContact O-N 3.36Å; K337-K340 PolarHBondContact O-N 3.01Å; K340-K342 PolarHBondContact O-N 2.99Å; K340-I392 PolarHBondContact NZ-O 2.87Å
341	I	49.5	Very low	60	Low	113 Å²	113	82.3 Å²	82.3	58%	0.579	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-19.3	175.6	-61.4	164.9	0	0	0	112.2	K337 Q339	K337-I341 WeakPolarHBondContact O-CG1 3.43Å; K337-I341 PolarHBondContact O-N 3.02Å; Q339-I341 PolarHBondContact O-N 3.15Å
342	K	48.8	Very low	59.7	Low	173 Å²	173	84.4 Å²	84.4	75%	0.752	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-27.1	-176.4	-68.6	-177.2	178.9	179.3	0	114.6	Q339 K340 D344	Q339-K342 CarbonylContact O-C 3.57Å; Q339-K342 WeakPolarHBondContact O-CA 3.41Å; Q339-K342 PolarHBondContact O-N 3.2Å; K340-K342 PolarHBondContact O-N 2.99Å; K342-D344 PolarHBondContact O-N 3.14Å
343	C	43	Very low	59.2	Low	66 Å²	66	85.3 Å²	85.3	45%	0.446	44%	0.441	S	S	.	.			trans	-89.6	87.2	-169	-73.2	0	0	0	0	113.2	Q339	Q339-C343 PolarHBondContact O-N 2.86Å
344	D	44.4	Very low	59	Low	172 Å²	172	86.7 Å²	86.7	92%	0.92	45%	0.451	S	S	*	.	S	Bend	trans	-94.2	-4.6	152.8	-84	-29.2	0	0	0	112.2	K342	K342-D344 PolarHBondContact O-N 3.14Å
345	E	43.6	Very low	59.2	Low	171 Å²	171	83.8 Å²	83.8	80%	0.799	44%	0.441	S	S	*	.	S	Bend	trans	-125.9	118.1	175.3	-70.1	-174.5	166	0	0	110.5	S347	E345-S347 PolarHBondContact O-N 3.49Å; E345-S347 VanDerWaalsContact O-N 3.09Å
346	V	44.6	Very low	59.7	Low	133 Å²	133	83.6 Å²	83.6	81%	0.806	44%	0.44	S	S	*	.			trans	-71.6	101.6	175.2	-179.9	0	0	0	0	108.9	L348	V346-L348 PolarHBondContact O-N 2.88Å
347	S	46.5	Very low	60.2	Low	51 Å²	51	83.3 Å²	83.3	36%	0.357	44%	0.438	S	S	.	.			trans	-72.6	107.4	169.1	173.1	0	0	0	0	109.6	E345 L349 E350	E345-S347 PolarHBondContact O-N 3.49Å; E345-S347 VanDerWaalsContact O-N 3.09Å; S347-L349 PolarHBondContact O-N 3.14Å; S347-E350 PolarHBondContact O-N 3.29Å; S347-E350 WeakPolarHBondContact OG-CG 3.38Å; S347-E350 PolarHBondContact OG-N 2.88Å
348	L	44.8	Very low	60.8	Low	172 Å²	172	82.2 Å²	82.2	90%	0.901	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-12.4	178.4	-138.2	116.7	0	0	0	113.8	V346	V346-L348 PolarHBondContact O-N 2.88Å
349	L	46.9	Very low	61.7	Low	166 Å²	166	80.2 Å²	80.2	87%	0.869	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-9.6	-175.2	-70.6	167.5	0	0	0	113.1	S347	S347-L349 PolarHBondContact O-N 3.14Å
350	E	57	Low	62.8	Low	107 Å²	107	77.9 Å²	77.9	50%	0.5	41%	0.41	S	S	.	.	S	Bend	trans	-77.2	141.7	179.8	-84.5	176.7	-159	0	0	111.4	S347 D352	S347-E350 PolarHBondContact O-N 3.29Å; S347-E350 WeakPolarHBondContact OG-CG 3.38Å; S347-E350 PolarHBondContact OG-N 2.88Å; E350-D352 PolarHBondContact O-N 3.45Å
351	P	60.8	Low	64.1	Low	60 Å²	60	73.6 Å²	73.6	39%	0.39	39%	0.391	S	S	.	.			trans	-62	128.3	175	25.6	-31.7	0	0	0	109.4	I266 I353	I266-P351 HydrophobicContact CG1-CB 4.29Å; P351-I353 WeakPolarHBondContact O-CG1 3.06Å; P351-I353 PolarHBondContact O-N 3.46Å
352	D	70.2	Confident	66	Low	57 Å²	57	68.7 Å²	68.7	31%	0.305	37%	0.366	S	S	.	.			trans	-60.9	99.4	173.3	169.7	9.1	0	0	0	110.3	E350 C354 L355 R358	E350-D352 PolarHBondContact O-N 3.45Å; D352-C354 VanDerWaalsContact C-N 3.33Å; D352-C354 WeakPolarHBondContact OD1-CB 3.24Å; D352-C354 PolarHBondContact OD1-N 3.39Å; D352-C354 VanDerWaalsContact OD1-N 3.15Å; D352-L355 HydrophobicContact CB-CB 4.24Å; D352-L355 VanDerWaalsContact O-CB 3.23Å; D352-L355 WeakPolarHBondContact O-CB 3.4Å; D352-L355 PolarHBondContact O-N 2.96Å; D352-L355 PolarHBondContact OD1-N 2.94Å; D352-L355 WeakPolarHBondContact OD2-CB 3.41Å; D352-R358 IonicContact OD1-CZ 3.73Å; D352-R358 IonicContact OD1-NH2 3.59Å; D352-R358 PolarHBondContact OD1-NH2 2.88Å; D352-R358 IonicContact OD2-CZ 2.84Å; D352-R358 IonicContact OD2-NE 3.2Å; D352-R358 IonicContact OD2-NH2 3.26Å; D352-R358 PolarHBondContact OD2-NH2 3.48Å
353	I	68	Low	68	Low	28 Å²	28	60.5 Å²	60.5	14%	0.144	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-30.3	-176.5	-51.5	-157.7	0	0	0	111	T335 I336 P351 L355	T335-I353 HydrophobicContact CG2-CD1 3.69Å; T335-I353 HydrophobicContact CG2-CG2 3.76Å; I336-I353 HydrophobicContact CG1-CG2 4.35Å; P351-I353 WeakPolarHBondContact O-CG1 3.06Å; P351-I353 PolarHBondContact O-N 3.46Å; I353-L355 PolarHBondContact O-N 3.43Å
354	C	76.2	Confident	70.2	Confident	30 Å²	30	57.3 Å²	57.3	20%	0.203	31%	0.309	C	S	.	.	H	α-helix	trans	-65.7	-23.1	175.9	-69.6	0	0	0	0	111.7	D352 S356 L357 R358 L410	D352-C354 VanDerWaalsContact C-N 3.33Å; D352-C354 WeakPolarHBondContact OD1-CB 3.24Å; D352-C354 PolarHBondContact OD1-N 3.39Å; D352-C354 VanDerWaalsContact OD1-N 3.15Å; C354-S356 VanDerWaalsContact C-N 3.33Å; C354-S356 PolarHBondContact O-N 3.35Å; C354-L357 PolarHBondContact O-N 3.45Å; C354-L357 VanDerWaalsContact O-N 3.13Å; C354-R358 WeakPolarHBondContact O-CG 3.37Å; C354-R358 PolarHBondContact O-N 2.65Å; C354-L410 HydrophobicContact CB-CD1 4.08Å
355	L	80.3	Confident	72.5	Confident	18 Å²	18	49.1 Å²	49.1	9%	0.094	27%	0.265	C	S	.	.	H	α-helix	trans	-54.3	-46.2	-176.1	-171	56.1	0	0	0	113.6	V269 D352 I353 L357 R358 I359	V269-L355 HydrophobicContact CG1-CD2 3.93Å; D352-L355 HydrophobicContact CB-CB 4.24Å; D352-L355 VanDerWaalsContact O-CB 3.23Å; D352-L355 WeakPolarHBondContact O-CB 3.4Å; D352-L355 PolarHBondContact O-N 2.96Å; D352-L355 PolarHBondContact OD1-N 2.94Å; D352-L355 WeakPolarHBondContact OD2-CB 3.41Å; I353-L355 PolarHBondContact O-N 3.43Å; L355-L357 VanDerWaalsContact C-N 3.31Å; L355-L357 PolarHBondContact O-N 2.95Å; L355-R358 PolarHBondContact O-N 3.43Å; L355-I359 HydrophobicContact CD1-CD1 4.03Å; L355-I359 HydrophobicContact CD1-CG1 4.24Å; L355-I359 HydrophobicContact CG-CD1 3.86Å; L355-I359 HydrophobicContact CG-CG1 4.46Å; L355-I359 WeakPolarHBondContact O-CB 3.33Å; L355-I359 VanDerWaalsContact O-CG1 3.27Å; L355-I359 WeakPolarHBondContact O-CG1 3.49Å; L355-I359 PolarHBondContact O-N 3.05Å
356	S	83.5	Confident	74.7	Confident	4 Å²	4	42.3 Å²	42.3	3%	0.028	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-45	-179	-69.5	0	0	0	0	110.6	V272 C354 I359 I360	V272-S356 WeakPolarHBondContact CG1-O 3.46Å; C354-S356 VanDerWaalsContact C-N 3.33Å; C354-S356 PolarHBondContact O-N 3.35Å; S356-I359 PolarHBondContact O-N 2.92Å; S356-I360 WeakPolarHBondContact O-CD1 3.47Å; S356-I360 VanDerWaalsContact O-CG1 3.26Å; S356-I360 WeakPolarHBondContact O-CG1 3.11Å; S356-I360 PolarHBondContact O-N 3.27Å
357	L	85.9	Confident	76.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.3	-43.9	178.4	-175.4	65.1	0	0	0	112	T329 I332 V333 I336 C354 L355 I359 I360 V361 I392 L410	T329-L357 HydrophobicContact CG2-CD1 4.1Å; I332-L357 HydrophobicContact CG2-CB 3.81Å; V333-L357 HydrophobicContact CG2-CD2 4.47Å; I336-L357 HydrophobicContact CD1-CB 4.2Å; I336-L357 HydrophobicContact CD1-CD2 3.73Å; C354-L357 PolarHBondContact O-N 3.45Å; C354-L357 VanDerWaalsContact O-N 3.13Å; L355-L357 VanDerWaalsContact C-N 3.31Å; L355-L357 PolarHBondContact O-N 2.95Å; L357-I359 VanDerWaalsContact C-N 3.27Å; L357-I359 PolarHBondContact O-N 3.22Å; L357-I360 PolarHBondContact O-N 3.03Å; L357-I360 VanDerWaalsContact O-N 3.12Å; L357-V361 HydrophobicContact CD1-CG2 4.23Å; L357-V361 HydrophobicContact CG-CG2 4.3Å; L357-V361 WeakPolarHBondContact O-CG2 3.35Å; L357-V361 PolarHBondContact O-N 3.33Å; L357-I392 HydrophobicContact CD2-CD1 3.2Å; L357-I392 HydrophobicContact CD2-CG1 4.42Å; L357-L410 HydrophobicContact CB-CD1 4.46Å; L357-L410 HydrophobicContact CD2-CD1 3.84Å; L357-L410 HydrophobicContact CD2-CD2 3.88Å; L357-L410 HydrophobicContact CG-CD1 4.34Å; L357-L410 HydrophobicContact CG-CD2 4.03Å
358	R	86.5	Confident	78.9	Confident	6 Å²	6	33.7 Å²	33.7	2%	0.023	18%	0.179	C	C	.	.	H	α-helix	trans	-53.1	-47.1	174.5	-78.3	-171	-90.5	-162.7	-22	111.5	D352 C354 L355 V361 L362 L410 F411 E413	D352-R358 IonicContact OD1-CZ 3.73Å; D352-R358 IonicContact OD1-NH2 3.59Å; D352-R358 PolarHBondContact OD1-NH2 2.88Å; D352-R358 IonicContact OD2-CZ 2.84Å; D352-R358 IonicContact OD2-NE 3.2Å; D352-R358 IonicContact OD2-NH2 3.26Å; D352-R358 PolarHBondContact OD2-NH2 3.48Å; C354-R358 WeakPolarHBondContact O-CG 3.37Å; C354-R358 PolarHBondContact O-N 2.65Å; L355-R358 PolarHBondContact O-N 3.43Å; R358-V361 PolarHBondContact O-N 3.38Å; R358-L362 VanDerWaalsContact O-CB 3.32Å; R358-L362 WeakPolarHBondContact O-CB 3.47Å; R358-L362 VanDerWaalsContact O-CG 3.31Å; R358-L362 WeakPolarHBondContact O-CG 3.29Å; R358-L362 PolarHBondContact O-N 3.45Å; R358-L410 VanDerWaalsContact CD-O 3.25Å; R358-L410 WeakPolarHBondContact CD-O 3.47Å; R358-L410 HydrophobicContact CG-CD1 4.08Å; R358-L410 HydrophobicContact CG-CG 3.93Å; R358-L410 WeakPolarHBondContact CG-O 3.48Å; R358-F411 HydrophobicContact CB-CD1 4.26Å; R358-F411 HydrophobicContact CB-CE1 3.59Å; R358-F411 HydrophobicContact CB-CZ 3.98Å; R358-F411 HydrophobicContact CG-CD1 3.76Å; R358-F411 HydrophobicContact CG-CE1 3.53Å; R358-F411 HydrophobicContact CG-CE2 4.47Å; R358-F411 HydrophobicContact CG-CG 4.34Å; R358-F411 HydrophobicContact CG-CZ 3.92Å; R358-E413 IonicContact CZ-OE2 2.86Å; R358-E413 IonicContact NH1-OE2 2.6Å; R358-E413 IonicContact NH2-OE2 2.62Å; R358-E413 PolarHBondContact NH2-OE2 3.47Å
359	I	87.4	Confident	81	Confident	14 Å²	14	27.5 Å²	27.5	7%	0.072	15%	0.146	C	C	.	.	H	α-helix	trans	-63.6	-44.8	177.9	-70.7	170.1	0	0	0	111.3	V272 R273 R276 L355 S356 L357 L362 C363	V272-I359 HydrophobicContact CG1-CB 3.62Å; V272-I359 HydrophobicContact CG1-CD1 4.21Å; V272-I359 HydrophobicContact CG1-CG2 3.39Å; R273-I359 HydrophobicContact CG-CD1 3.7Å; R276-I359 HydrophobicContact CB-CG2 3.64Å; R276-I359 HydrophobicContact CG-CG2 4.08Å; L355-I359 HydrophobicContact CD1-CD1 4.03Å; L355-I359 HydrophobicContact CD1-CG1 4.24Å; L355-I359 HydrophobicContact CG-CD1 3.86Å; L355-I359 HydrophobicContact CG-CG1 4.46Å; L355-I359 WeakPolarHBondContact O-CB 3.33Å; L355-I359 VanDerWaalsContact O-CG1 3.27Å; L355-I359 WeakPolarHBondContact O-CG1 3.49Å; L355-I359 PolarHBondContact O-N 3.05Å; S356-I359 PolarHBondContact O-N 2.92Å; L357-I359 VanDerWaalsContact C-N 3.27Å; L357-I359 PolarHBondContact O-N 3.22Å; I359-L362 PolarHBondContact O-N 3.48Å; I359-C363 WeakPolarHBondContact O-CB 3.23Å; I359-C363 PolarHBondContact O-N 3.49Å; I359-C363 PolarHBondContact O-SG 2.81Å
360	I	88.5	Confident	82.9	Confident	4 Å²	4	24.6 Å²	24.6	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-60.8	-47.8	179.1	-73	161.7	0	0	0	110.5	V272 L305 I332 S356 L357 C363 G364	V272-I360 HydrophobicContact CG1-CD1 4.49Å; V272-I360 HydrophobicContact CG1-CG1 4.05Å; V272-I360 HydrophobicContact CG2-CD1 4.21Å; V272-I360 HydrophobicContact CG2-CG1 4.46Å; L305-I360 HydrophobicContact CD2-CG2 3.46Å; L305-I360 VanDerWaalsContact CD2-CG2 3.46Å; L305-I360 HydrophobicContact CG-CG2 3.85Å; I332-I360 HydrophobicContact CD1-CD1 4.01Å; S356-I360 WeakPolarHBondContact O-CD1 3.47Å; S356-I360 VanDerWaalsContact O-CG1 3.26Å; S356-I360 WeakPolarHBondContact O-CG1 3.11Å; S356-I360 PolarHBondContact O-N 3.27Å; L357-I360 PolarHBondContact O-N 3.03Å; L357-I360 VanDerWaalsContact O-N 3.12Å; I360-C363 PolarHBondContact O-N 3.33Å; I360-G364 PolarHBondContact O-N 3.22Å
361	V	89.6	Confident	84.4	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.006	11%	0.11	C	C	.	.	H	α-helix	trans	-62	-47.2	177.7	171.6	0	0	0	0	111	L357 R358 C363 G364 L365 I385 L410 F411	L357-V361 HydrophobicContact CD1-CG2 4.23Å; L357-V361 HydrophobicContact CG-CG2 4.3Å; L357-V361 WeakPolarHBondContact O-CG2 3.35Å; L357-V361 PolarHBondContact O-N 3.33Å; R358-V361 PolarHBondContact O-N 3.38Å; V361-C363 PolarHBondContact O-N 3.44Å; V361-G364 WeakPolarHBondContact O-CA 3.28Å; V361-G364 PolarHBondContact O-N 3.33Å; V361-G364 VanDerWaalsContact O-N 3.09Å; V361-L365 HydrophobicContact CG1-CD1 4.04Å; V361-L365 HydrophobicContact CG1-CG 4.38Å; V361-L365 WeakPolarHBondContact O-CG 3.15Å; V361-L365 PolarHBondContact O-N 2.9Å; V361-I385 HydrophobicContact CG1-CG2 4.16Å; V361-L410 HydrophobicContact CG2-CD2 4.28Å; V361-F411 HydrophobicContact CB-CZ 4.25Å; V361-F411 HydrophobicContact CG1-CE2 4.2Å; V361-F411 HydrophobicContact CG1-CZ 4.15Å
362	L	89.5	Confident	85.6	Confident	9 Å²	9	22.3 Å²	22.3	5%	0.047	11%	0.114	C	C	.	.	H	α-helix	trans	-58.3	-46.5	177.1	-82.5	168.8	0	0	0	112.4	R358 I359 G364 L365 E366 F411 Q417 R420 V421 L424	R358-L362 VanDerWaalsContact O-CB 3.32Å; R358-L362 WeakPolarHBondContact O-CB 3.47Å; R358-L362 VanDerWaalsContact O-CG 3.31Å; R358-L362 WeakPolarHBondContact O-CG 3.29Å; R358-L362 PolarHBondContact O-N 3.45Å; I359-L362 PolarHBondContact O-N 3.48Å; L362-G364 VanDerWaalsContact C-N 3.29Å; L362-G364 PolarHBondContact O-N 3.15Å; L362-L365 PolarHBondContact O-N 2.86Å; L362-E366 WeakPolarHBondContact O-CB 3.41Å; L362-E366 WeakPolarHBondContact O-CG 3.48Å; L362-E366 PolarHBondContact O-N 2.83Å; L362-F411 HydrophobicContact CD1-CE1 4.02Å; L362-F411 HydrophobicContact CG-CE1 3.96Å; L362-F411 HydrophobicContact CG-CZ 4.23Å; L362-Q417 HydrophobicContact CD1-CB 4.4Å; L362-Q417 HydrophobicContact CD1-CG 4.09Å; L362-R420 HydrophobicContact CD2-CG 4.26Å; L362-V421 HydrophobicContact CD2-CG2 3.44Å; L362-V421 VanDerWaalsContact CD2-CG2 3.44Å; L362-V421 HydrophobicContact CG-CG2 4.04Å; L362-L424 HydrophobicContact CD2-CD1 4.37Å
363	C	90.2	Very high	86.2	Confident	1 Å²	1	20 Å²	20	1%	0.007	10%	0.102	C	C	.	.	H	α-helix	trans	-62	-38.9	175	-79.4	0	0	0	0	111.7	R276 I301 I359 I360 V361 N367	R276-C363 WeakPolarHBondContact CD-SG 3.21Å; I301-C363 HydrophobicContact CD1-CB 3.89Å; I301-C363 HydrophobicContact CG1-CB 4.16Å; I301-C363 HydrophobicContact CG2-CB 4.08Å; I359-C363 WeakPolarHBondContact O-CB 3.23Å; I359-C363 PolarHBondContact O-N 3.49Å; I359-C363 PolarHBondContact O-SG 2.81Å; I360-C363 PolarHBondContact O-N 3.33Å; V361-C363 PolarHBondContact O-N 3.44Å; C363-N367 VanDerWaalsContact O-CB 3.26Å; C363-N367 WeakPolarHBondContact O-CB 3.45Å; C363-N367 PolarHBondContact O-N 3.25Å
364	G	90.6	Very high	87	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.7	-52	175.6	0	0	0	0	0	112.9	I360 V361 L362 N367 A368	I360-G364 PolarHBondContact O-N 3.22Å; V361-G364 WeakPolarHBondContact O-CA 3.28Å; V361-G364 PolarHBondContact O-N 3.33Å; V361-G364 VanDerWaalsContact O-N 3.09Å; L362-G364 VanDerWaalsContact C-N 3.29Å; L362-G364 PolarHBondContact O-N 3.15Å; G364-N367 PolarHBondContact O-N 3.43Å; G364-A368 WeakPolarHBondContact O-CB 3.36Å; G364-A368 PolarHBondContact O-N 3.29Å
365	L	91.2	Very high	87.5	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.8	-43.1	179.9	-66.3	175.5	0	0	0	112.1	V361 L362 N367 A368 L369 I385 V421 L424 W425 I428	V361-L365 HydrophobicContact CG1-CD1 4.04Å; V361-L365 HydrophobicContact CG1-CG 4.38Å; V361-L365 WeakPolarHBondContact O-CG 3.15Å; V361-L365 PolarHBondContact O-N 2.9Å; L362-L365 PolarHBondContact O-N 2.86Å; L365-N367 PolarHBondContact O-N 2.93Å; L365-A368 WeakPolarHBondContact O-CB 3.44Å; L365-A368 PolarHBondContact O-N 3.4Å; L365-L369 PolarHBondContact O-N 3.16Å; L365-I385 HydrophobicContact CD2-CD1 3.69Å; L365-I385 HydrophobicContact CG-CD1 3.95Å; L365-V421 HydrophobicContact CD1-CB 4.45Å; L365-V421 HydrophobicContact CD1-CG1 3.75Å; L365-V421 HydrophobicContact CD1-CG2 4.49Å; L365-L424 HydrophobicContact CB-CB 4.17Å; L365-L424 HydrophobicContact CB-CD1 4.01Å; L365-W425 HydrophobicContact CD2-CE3 3.8Å; L365-W425 HydrophobicContact CD2-CZ3 4.05Å; L365-I428 HydrophobicContact CB-CD1 4.29Å; L365-I428 HydrophobicContact CD2-CD1 3.85Å
366	E	91	Very high	87.8	Confident	27 Å²	27	31.3 Å²	31.3	13%	0.126	16%	0.16	C	C	.	.	H	α-helix	trans	-64.9	-30.3	175.8	-71.9	-179.1	178.6	0	0	112.7	R276 Y279 L362 L424	R276-E366 IonicContact CZ-OE1 3.97Å; R276-E366 IonicContact CZ-OE2 2.81Å; R276-E366 VanDerWaalsContact CZ-OE2 3.31Å; R276-E366 IonicContact NH1-OE1 3.81Å; R276-E366 IonicContact NH1-OE2 3.38Å; R276-E366 PolarHBondContact NH1-OE2 3.29Å; R276-E366 VanDerWaalsContact NH2-CD 3.27Å; R276-E366 IonicContact NH2-OE1 2.65Å; R276-E366 PolarHBondContact NH2-OE1 3.38Å; R276-E366 IonicContact NH2-OE2 3.64Å; R276-E366 PolarHBondContact NH2-OE2 2.85Å; R276-E366 VanDerWaalsContact NH2-OE2 3.12Å; Y279-E366 HydrophobicContact CE1-CB 4.02Å; Y279-E366 WeakPolarHBondContact CE1-OE2 3.24Å; Y279-E366 WeakPolarHBondContact OH-CB 3.19Å; Y279-E366 PolarHBondContact OH-O 2.98Å; L362-E366 WeakPolarHBondContact O-CB 3.41Å; L362-E366 WeakPolarHBondContact O-CG 3.48Å; L362-E366 PolarHBondContact O-N 2.83Å; E366-L424 HydrophobicContact CG-CD1 3.6Å; E366-L424 HydrophobicContact CG-CD2 4.01Å; E366-L424 HydrophobicContact CG-CG 4.47Å
367	N	89.4	Confident	87.9	Confident	3 Å²	3	35 Å²	35	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-74.7	-43.6	173.3	-166.9	51.2	0	0	0	111.3	Y279 S298 C363 G364 L365 L369 K370	Y279-N367 HydrophobicContact CE2-CB 4.42Å; Y279-N367 PolarHBondContact OH-N 3.44Å; S298-N367 WeakPolarHBondContact CB-OD1 3.45Å; S298-N367 PolarHBondContact OG-OD1 3.37Å; C363-N367 VanDerWaalsContact O-CB 3.26Å; C363-N367 WeakPolarHBondContact O-CB 3.45Å; C363-N367 PolarHBondContact O-N 3.25Å; G364-N367 PolarHBondContact O-N 3.43Å; L365-N367 PolarHBondContact O-N 2.93Å; N367-L369 PolarHBondContact O-N 2.94Å; N367-K370 WeakPolarHBondContact O-CB 3.21Å; N367-K370 PolarHBondContact O-N 2.88Å; N367-K370 VanDerWaalsContact O-N 3.1Å
368	A	89.6	Confident	88	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-55.2	-47.4	176.7	0	0	0	0	0	112.1	G364 L365 K370 L371 L378 I381 I428	G364-A368 WeakPolarHBondContact O-CB 3.36Å; G364-A368 PolarHBondContact O-N 3.29Å; L365-A368 WeakPolarHBondContact O-CB 3.44Å; L365-A368 PolarHBondContact O-N 3.4Å; A368-K370 PolarHBondContact O-N 3.1Å; A368-L371 WeakPolarHBondContact O-CB 3.2Å; A368-L371 PolarHBondContact O-N 3.25Å; A368-L378 HydrophobicContact CB-CD1 3.62Å; A368-L378 WeakPolarHBondContact O-CD1 3.5Å; A368-I381 HydrophobicContact CB-CG2 4.08Å; A368-I428 HydrophobicContact CB-CD1 3.92Å
369	L	89.4	Confident	88.1	Confident	43 Å²	43	40.1 Å²	40.1	23%	0.225	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-20.9	179.3	-176.3	61.7	0	0	0	114	L365 N367 L424 Q427 I428	L365-L369 PolarHBondContact O-N 3.16Å; N367-L369 PolarHBondContact O-N 2.94Å; L369-L424 HydrophobicContact CD2-CD2 3.83Å; L369-Q427 HydrophobicContact CD1-CB 3.76Å; L369-Q427 HydrophobicContact CD2-CB 4.24Å; L369-Q427 VanDerWaalsContact CD2-OE1 3.28Å; L369-I428 HydrophobicContact CB-CG1 4.03Å; L369-I428 HydrophobicContact CD1-CG1 4.08Å
370	K	86.4	Confident	88.2	Confident	105 Å²	105	41.4 Å²	41.4	46%	0.457	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-9.2	179.5	-64.3	170.7	-179.2	166	0	113.4	Y279 Y283 N367 A368	Y279-K370 PolarHBondContact OH-NZ 3.02Å; Y283-K370 HydrophobicContact CD1-CD 4.19Å; Y283-K370 HydrophobicContact CE1-CD 3.65Å; N367-K370 WeakPolarHBondContact O-CB 3.21Å; N367-K370 PolarHBondContact O-N 2.88Å; N367-K370 VanDerWaalsContact O-N 3.1Å; A368-K370 PolarHBondContact O-N 3.1Å
371	L	87.5	Confident	88.2	Confident	27 Å²	27	41.2 Å²	41.2	14%	0.141	21%	0.206	C	C	.	.	S	Bend	trans	-83.8	154.5	179.8	-62.4	175	0	0	0	110.6	A368 D375 Q377 L378 I381 H431	A368-L371 WeakPolarHBondContact O-CB 3.2Å; A368-L371 PolarHBondContact O-N 3.25Å; L371-D375 HydrophobicContact CB-CB 4.32Å; L371-Q377 HydrophobicContact CD1-CB 3.79Å; L371-L378 HydrophobicContact CB-CB 4.19Å; L371-L378 HydrophobicContact CD1-CB 4.18Å; L371-I381 HydrophobicContact CD1-CD1 3.9Å; L371-H431 PolarHBondContact O-NE2 3.24Å
372	D	85.8	Confident	88.1	Confident	91 Å²	91	42.2 Å²	42.2	49%	0.487	21%	0.211	S	C	.	.			trans	-65.5	140.5	170	-168.7	-74.9	0	0	0	109.3	N374 D375	D372-N374 PolarHBondContact O-N 3.01Å; D372-N374 VanDerWaalsContact O-N 3.1Å; D372-N374 VanDerWaalsContact OD1-CB 3.25Å; D372-N374 WeakPolarHBondContact OD1-CB 3.2Å; D372-N374 PolarHBondContact OD1-N 2.86Å; D372-N374 PolarHBondContact OD1-ND2 3.44Å; D372-D375 HydrophobicContact CB-CB 4.37Å; D372-D375 WeakPolarHBondContact O-CB 3.33Å; D372-D375 PolarHBondContact O-N 3.19Å
373	P	84.3	Confident	87.9	Confident	8 Å²	8	44.6 Å²	44.6	5%	0.052	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-25.7	176.3	-29.5	40.3	0	0	0	114.4	D375 W379 H431 T435	P373-D375 VanDerWaalsContact C-N 3.33Å; P373-W379 PolarHBondContact O-NE1 2.64Å; P373-H431 WeakPolarHBondContact CD-NE2 3.01Å; P373-H431 WeakPolarHBondContact CG-NE2 3.48Å; P373-T435 HydrophobicContact CB-CG2 3.85Å; P373-T435 WeakPolarHBondContact CB-OG1 3.49Å; P373-T435 HydrophobicContact CG-CG2 3.62Å
374	N	84.2	Confident	87.8	Confident	127 Å²	127	44.8 Å²	44.8	68%	0.679	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-3.7	176.4	-55.8	-71.3	0	0	0	113.2	D372 L376	D372-N374 PolarHBondContact O-N 3.01Å; D372-N374 VanDerWaalsContact O-N 3.1Å; D372-N374 VanDerWaalsContact OD1-CB 3.25Å; D372-N374 WeakPolarHBondContact OD1-CB 3.2Å; D372-N374 PolarHBondContact OD1-N 2.86Å; D372-N374 PolarHBondContact OD1-ND2 3.44Å; N374-L376 PolarHBondContact O-N 3.16Å
375	D	86.3	Confident	87.7	Confident	50 Å²	50	44.8 Å²	44.8	27%	0.267	23%	0.23	S	C	.	.			trans	-74.6	122.6	178.4	-165.1	-25.5	0	0	0	110.6	L371 D372 P373 Q377 L378	L371-D375 HydrophobicContact CB-CB 4.32Å; D372-D375 HydrophobicContact CB-CB 4.37Å; D372-D375 WeakPolarHBondContact O-CB 3.33Å; D372-D375 PolarHBondContact O-N 3.19Å; P373-D375 VanDerWaalsContact C-N 3.33Å; D375-Q377 PolarHBondContact O-N 3.45Å; D375-Q377 VanDerWaalsContact O-N 3.12Å; D375-Q377 WeakPolarHBondContact OD1-CB 3.3Å; D375-Q377 WeakPolarHBondContact OD1-CG 3.47Å; D375-Q377 PolarHBondContact OD1-N 2.94Å; D375-L378 VanDerWaalsContact O-CB 3.3Å; D375-L378 WeakPolarHBondContact O-CB 3.06Å; D375-L378 PolarHBondContact O-N 3.16Å
376	L	86.1	Confident	87.4	Confident	137 Å²	137	48.4 Å²	48.4	72%	0.717	25%	0.247	S	C	*	.	H	α-helix	trans	-58.5	-24.6	175	-66.9	174.2	0	0	0	112.8	N374 L378 S380	N374-L376 PolarHBondContact O-N 3.16Å; L376-L378 VanDerWaalsContact C-N 3.35Å; L376-S380 WeakPolarHBondContact O-CB 3.1Å; L376-S380 PolarHBondContact O-N 2.68Å; L376-S380 PolarHBondContact O-OG 2.92Å
377	Q	87	Confident	87.1	Confident	81 Å²	81	49.5 Å²	49.5	38%	0.379	25%	0.252	S	S	.	.	H	α-helix	trans	-65.7	-37.1	175.2	-67.2	-174.3	27.6	0	0	112	Y302 L371 D375 S380 I381	Y302-Q377 HydrophobicContact CD2-CB 4.49Å; Y302-Q377 HydrophobicContact CE2-CB 4.3Å; Y302-Q377 HydrophobicContact CE2-CG 4.26Å; L371-Q377 HydrophobicContact CD1-CB 3.79Å; D375-Q377 PolarHBondContact O-N 3.45Å; D375-Q377 VanDerWaalsContact O-N 3.12Å; D375-Q377 WeakPolarHBondContact OD1-CB 3.3Å; D375-Q377 WeakPolarHBondContact OD1-CG 3.47Å; D375-Q377 PolarHBondContact OD1-N 2.94Å; Q377-S380 PolarHBondContact O-N 2.95Å; Q377-I381 VanDerWaalsContact O-CG1 3.29Å; Q377-I381 WeakPolarHBondContact O-CG1 3.46Å; Q377-I381 PolarHBondContact O-N 2.84Å
378	L	88.2	Confident	86.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.3	-54.6	176.6	174.9	66.6	0	0	0	110	A368 L371 D375 L376 S380 I381 I382 I428 I432	A368-L378 HydrophobicContact CB-CD1 3.62Å; A368-L378 WeakPolarHBondContact O-CD1 3.5Å; L371-L378 HydrophobicContact CB-CB 4.19Å; L371-L378 HydrophobicContact CD1-CB 4.18Å; D375-L378 VanDerWaalsContact O-CB 3.3Å; D375-L378 WeakPolarHBondContact O-CB 3.06Å; D375-L378 PolarHBondContact O-N 3.16Å; L376-L378 VanDerWaalsContact C-N 3.35Å; L378-S380 VanDerWaalsContact C-N 3.29Å; L378-S380 PolarHBondContact O-N 2.88Å; L378-I381 PolarHBondContact O-N 3.22Å; L378-I382 HydrophobicContact CD1-CD1 3.86Å; L378-I382 HydrophobicContact CD1-CG1 4.41Å; L378-I382 HydrophobicContact CG-CD1 3.87Å; L378-I382 WeakPolarHBondContact O-CG1 3.05Å; L378-I382 PolarHBondContact O-N 3.02Å; L378-I428 HydrophobicContact CD1-CG2 4.37Å; L378-I432 HydrophobicContact CD2-CD1 4.18Å; L378-I432 HydrophobicContact CD2-CG1 3.96Å
379	W	87.6	Confident	86.5	Confident	115 Å²	115	49.4 Å²	49.4	44%	0.436	25%	0.251	S	S	.	.	H	α-helix	trans	-62.9	-36.2	-179.4	-64.2	104.5	0	0	0	112.8	P373 S383 I432	P373-W379 PolarHBondContact O-NE1 2.64Å; W379-S383 VanDerWaalsContact O-CB 3.23Å; W379-S383 WeakPolarHBondContact O-CB 3.42Å; W379-S383 PolarHBondContact O-N 3.12Å; W379-S383 PolarHBondContact O-OG 3.34Å; W379-I432 HydrophobicContact CH2-CD1 3.94Å; W379-I432 HydrophobicContact CH2-CG1 4.43Å; W379-I432 HydrophobicContact CH2-CG2 3.73Å; W379-I432 HydrophobicContact CZ2-CD1 4.32Å; W379-I432 HydrophobicContact CZ2-CG1 4.42Å; W379-I432 HydrophobicContact CZ2-CG2 3.9Å; W379-I432 HydrophobicContact CZ3-CD1 4.32Å
380	S	89.1	Confident	86	Confident	41 Å²	41	50.5 Å²	50.5	29%	0.287	26%	0.257	S	S	.	.	H	α-helix	trans	-66.5	-41.4	175.7	-61.8	0	0	0	0	111.9	L376 Q377 L378 S384	L376-S380 WeakPolarHBondContact O-CB 3.1Å; L376-S380 PolarHBondContact O-N 2.68Å; L376-S380 PolarHBondContact O-OG 2.92Å; Q377-S380 PolarHBondContact O-N 2.95Å; L378-S380 VanDerWaalsContact C-N 3.29Å; L378-S380 PolarHBondContact O-N 2.88Å; S380-S384 VanDerWaalsContact O-CB 3.32Å; S380-S384 WeakPolarHBondContact O-CB 3.49Å; S380-S384 PolarHBondContact O-N 2.74Å; S380-S384 PolarHBondContact O-OG 2.87Å
381	I	88.4	Confident	85.6	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.1	-50.7	175.9	-70.9	167.1	0	0	0	110.3	Y302 L305 A368 L371 Q377 L378 S383 S384 I385	Y302-I381 HydrophobicContact CD2-CD1 4.22Å; Y302-I381 HydrophobicContact CD2-CG1 3.83Å; Y302-I381 HydrophobicContact CE2-CG1 4.45Å; L305-I381 HydrophobicContact CD1-CG2 4.13Å; A368-I381 HydrophobicContact CB-CG2 4.08Å; L371-I381 HydrophobicContact CD1-CD1 3.9Å; Q377-I381 VanDerWaalsContact O-CG1 3.29Å; Q377-I381 WeakPolarHBondContact O-CG1 3.46Å; Q377-I381 PolarHBondContact O-N 2.84Å; L378-I381 PolarHBondContact O-N 3.22Å; I381-S383 VanDerWaalsContact C-N 3.34Å; I381-S383 PolarHBondContact O-N 3.42Å; I381-S384 PolarHBondContact O-N 2.94Å; I381-I385 HydrophobicContact CG2-CD1 3.73Å; I381-I385 HydrophobicContact CG2-CG1 4.42Å; I381-I385 WeakPolarHBondContact O-CG1 3.27Å; I381-I385 PolarHBondContact O-N 3.36Å
382	I	87.4	Confident	85	Confident	22 Å²	22	46.2 Å²	46.2	11%	0.113	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-48.5	-180	-67.9	171.5	0	0	0	110.3	L378 S384 I385 H386 W425 I428 I432	L378-I382 HydrophobicContact CD1-CD1 3.86Å; L378-I382 HydrophobicContact CD1-CG1 4.41Å; L378-I382 HydrophobicContact CG-CD1 3.87Å; L378-I382 WeakPolarHBondContact O-CG1 3.05Å; L378-I382 PolarHBondContact O-N 3.02Å; I382-S384 VanDerWaalsContact C-N 3.34Å; I382-S384 PolarHBondContact O-N 3.37Å; I382-I385 PolarHBondContact O-N 3.28Å; I382-H386 WeakPolarHBondContact O-CB 3.47Å; I382-H386 PolarHBondContact O-N 3.24Å; I382-W425 HydrophobicContact CG2-CH2 3.79Å; I382-W425 HydrophobicContact CG2-CZ3 4.27Å; I382-I428 HydrophobicContact CD1-CG2 3.78Å; I382-I432 HydrophobicContact CD1-CD1 3.91Å
383	S	87.1	Confident	84.2	Confident	58 Å²	58	42.6 Å²	42.6	41%	0.406	22%	0.219	S	C	.	.	H	α-helix	trans	-61.3	-42.3	178.5	-58.2	0	0	0	0	111.8	W379 I381 H386 E387	W379-S383 VanDerWaalsContact O-CB 3.23Å; W379-S383 WeakPolarHBondContact O-CB 3.42Å; W379-S383 PolarHBondContact O-N 3.12Å; W379-S383 PolarHBondContact O-OG 3.34Å; I381-S383 VanDerWaalsContact C-N 3.34Å; I381-S383 PolarHBondContact O-N 3.42Å; S383-H386 PolarHBondContact O-N 2.76Å; S383-E387 WeakPolarHBondContact O-CB 3.37Å; S383-E387 WeakPolarHBondContact O-CG 3.14Å; S383-E387 PolarHBondContact O-N 3.38Å
384	S	87.8	Confident	82.8	Confident	5 Å²	5	45.2 Å²	45.2	4%	0.035	24%	0.237	C	C	.	.	H	α-helix	trans	-66	-40.7	178.8	-56.3	0	0	0	0	112	C306 S309 S380 I381 I382 H386 E387 L388	C306-S384 PolarHBondContact SG-OG 3.26Å; S309-S384 PolarHBondContact OG-OG 2.95Å; S380-S384 VanDerWaalsContact O-CB 3.32Å; S380-S384 WeakPolarHBondContact O-CB 3.49Å; S380-S384 PolarHBondContact O-N 2.74Å; S380-S384 PolarHBondContact O-OG 2.87Å; I381-S384 PolarHBondContact O-N 2.94Å; I382-S384 VanDerWaalsContact C-N 3.34Å; I382-S384 PolarHBondContact O-N 3.37Å; S384-H386 VanDerWaalsContact C-N 3.34Å; S384-E387 PolarHBondContact O-N 2.89Å; S384-L388 WeakPolarHBondContact O-CB 2.99Å; S384-L388 WeakPolarHBondContact O-CD1 3.47Å; S384-L388 WeakPolarHBondContact O-CG 3.18Å; S384-L388 PolarHBondContact O-N 3.44Å
385	I	87.6	Confident	81.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.7	-42.8	175.1	-70	171	0	0	0	110.4	L305 V361 L365 I381 I382 L388 L389 Y403	L305-I385 HydrophobicContact CD2-CG1 3.88Å; V361-I385 HydrophobicContact CG1-CG2 4.16Å; L365-I385 HydrophobicContact CD2-CD1 3.69Å; L365-I385 HydrophobicContact CG-CD1 3.95Å; I381-I385 HydrophobicContact CG2-CD1 3.73Å; I381-I385 HydrophobicContact CG2-CG1 4.42Å; I381-I385 WeakPolarHBondContact O-CG1 3.27Å; I381-I385 PolarHBondContact O-N 3.36Å; I382-I385 PolarHBondContact O-N 3.28Å; I385-L388 WeakPolarHBondContact O-CB 3.37Å; I385-L388 PolarHBondContact O-N 2.93Å; I385-L389 HydrophobicContact CG2-CD1 3.78Å; I385-L389 HydrophobicContact CG2-CG 4.41Å; I385-L389 WeakPolarHBondContact O-CB 3.44Å; I385-L389 VanDerWaalsContact O-CG 3.29Å; I385-L389 WeakPolarHBondContact O-CG 3.4Å; I385-L389 PolarHBondContact O-N 2.85Å; I385-Y403 HydrophobicContact CG2-CE2 4.38Å
386	H	84.7	Confident	79.6	Confident	77 Å²	77	49.3 Å²	49.3	36%	0.356	25%	0.254	S	S	.	.	H	α-helix	trans	-63.2	-47.1	177.3	-177.1	-97	0	0	0	112	I382 S383 S384 L388 L389 L390 Y403	I382-H386 WeakPolarHBondContact O-CB 3.47Å; I382-H386 PolarHBondContact O-N 3.24Å; S383-H386 PolarHBondContact O-N 2.76Å; S384-H386 VanDerWaalsContact C-N 3.34Å; H386-L388 VanDerWaalsContact C-N 3.34Å; H386-L388 PolarHBondContact O-N 2.9Å; H386-L389 PolarHBondContact O-N 3.48Å; H386-L390 WeakPolarHBondContact CE1-CD1 3.27Å; H386-L390 WeakPolarHBondContact O-CB 3.24Å; H386-L390 WeakPolarHBondContact O-CG 3.24Å; H386-L390 PolarHBondContact O-N 2.93Å; H386-Y403 HydrophobicContact CB-CE2 4.41Å; H386-Y403 AromaticContact CD2-CD2 3.53Å
387	E	84.4	Confident	77.7	Confident	50 Å²	50	44.9 Å²	44.9	23%	0.234	23%	0.234	C	C	.	.	H	α-helix	trans	-59.1	-43.6	174.9	-73.7	176.3	-172.4	0	0	111.7	S309 R313 S383 S384 L389 D391	S309-E387 WeakPolarHBondContact CA-OE2 3.41Å; S309-E387 WeakPolarHBondContact CB-OE2 3.38Å; S309-E387 PolarHBondContact OG-OE2 2.65Å; R313-E387 IonicContact NH2-OE1 3.44Å; S383-E387 WeakPolarHBondContact O-CB 3.37Å; S383-E387 WeakPolarHBondContact O-CG 3.14Å; S383-E387 PolarHBondContact O-N 3.38Å; S384-E387 PolarHBondContact O-N 2.89Å; E387-L389 PolarHBondContact O-N 3.3Å; E387-D391 WeakPolarHBondContact O-CB 3.45Å; E387-D391 PolarHBondContact O-N 3.47Å
388	L	85	Confident	75.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-46	176.6	-79.3	166.7	0	0	0	112.6	L305 H308 T329 V333 S384 I385 H386 D391 I392	L305-L388 HydrophobicContact CD2-CD1 3.95Å; H308-L388 HydrophobicContact CB-CD2 3.6Å; H308-L388 HydrophobicContact CB-CG 4.12Å; H308-L388 WeakPolarHBondContact CD2-CD2 2.96Å; T329-L388 HydrophobicContact CG2-CD1 3.88Å; T329-L388 HydrophobicContact CG2-CD2 3.41Å; T329-L388 VanDerWaalsContact CG2-CD2 3.41Å; T329-L388 HydrophobicContact CG2-CG 4.32Å; V333-L388 HydrophobicContact CG2-CD2 3.62Å; S384-L388 WeakPolarHBondContact O-CB 2.99Å; S384-L388 WeakPolarHBondContact O-CD1 3.47Å; S384-L388 WeakPolarHBondContact O-CG 3.18Å; S384-L388 PolarHBondContact O-N 3.44Å; I385-L388 WeakPolarHBondContact O-CB 3.37Å; I385-L388 PolarHBondContact O-N 2.93Å; H386-L388 VanDerWaalsContact C-N 3.34Å; H386-L388 PolarHBondContact O-N 2.9Å; L388-D391 PolarHBondContact O-N 3.17Å; L388-I392 WeakPolarHBondContact O-CD1 3.4Å; L388-I392 VanDerWaalsContact O-CG1 3.3Å; L388-I392 WeakPolarHBondContact O-CG1 3.3Å; L388-I392 PolarHBondContact O-N 3.35Å
389	L	81.6	Confident	74.1	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-68.3	-44.4	-178	-76.4	173.1	0	0	0	111.3	I385 H386 E387 D391 I392 E393 Y403 S406 I407 L410	I385-L389 HydrophobicContact CG2-CD1 3.78Å; I385-L389 HydrophobicContact CG2-CG 4.41Å; I385-L389 WeakPolarHBondContact O-CB 3.44Å; I385-L389 VanDerWaalsContact O-CG 3.29Å; I385-L389 WeakPolarHBondContact O-CG 3.4Å; I385-L389 PolarHBondContact O-N 2.85Å; H386-L389 PolarHBondContact O-N 3.48Å; E387-L389 PolarHBondContact O-N 3.3Å; L389-D391 VanDerWaalsContact C-N 3.32Å; L389-D391 PolarHBondContact O-N 3.25Å; L389-I392 PolarHBondContact O-N 2.83Å; L389-E393 PolarHBondContact O-N 2.87Å; L389-Y403 HydrophobicContact CD1-CD2 3.91Å; L389-Y403 HydrophobicContact CD1-CE2 3.3Å; L389-S406 PolarHBondContact O-OG 2.87Å; L389-I407 HydrophobicContact CD1-CG1 3.84Å; L389-L410 HydrophobicContact CD2-CB 4.35Å; L389-L410 HydrophobicContact CD2-CD2 3.74Å
390	L	79.1	Confident	72.4	Confident	66 Å²	66	54.2 Å²	54.2	35%	0.346	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-40.7	174.3	-74.7	-178.5	0	0	0	112.6	H386 I392 E393 S394	H386-L390 WeakPolarHBondContact CE1-CD1 3.27Å; H386-L390 WeakPolarHBondContact O-CB 3.24Å; H386-L390 WeakPolarHBondContact O-CG 3.24Å; H386-L390 PolarHBondContact O-N 2.93Å; L390-I392 VanDerWaalsContact C-N 3.32Å; L390-I392 PolarHBondContact O-N 2.86Å; L390-E393 PolarHBondContact O-N 3.27Å; L390-S394 WeakPolarHBondContact O-CB 3.01Å; L390-S394 PolarHBondContact O-N 2.91Å; L390-S394 VanDerWaalsContact O-N 3.11Å
391	D	78.5	Confident	70.8	Confident	31 Å²	31	56.9 Å²	56.9	17%	0.166	31%	0.311	C	S	.	.	H	α-helix	trans	-58.2	-48.9	178.5	-162.5	4.4	0	0	0	109.1	H308 Q312 V333 K337 E387 L388 L389 E393 S394	H308-D391 IonicContact CE1-OD2 2.75Å; H308-D391 PolarHBondContact CE1-OD2 3.48Å; H308-D391 VanDerWaalsContact CE1-OD2 3.26Å; H308-D391 IonicContact NE2-OD2 3.36Å; Q312-D391 PolarHBondContact NE2-OD2 3.07Å; V333-D391 HydrophobicContact CG1-CB 4.02Å; K337-D391 WeakPolarHBondContact CE-O 3.48Å; K337-D391 WeakPolarHBondContact CE-OD1 3.3Å; K337-D391 PolarHBondContact NZ-O 3.16Å; K337-D391 IonicContact NZ-OD1 2.95Å; K337-D391 PolarHBondContact NZ-OD1 3.28Å; E387-D391 WeakPolarHBondContact O-CB 3.45Å; E387-D391 PolarHBondContact O-N 3.47Å; L388-D391 PolarHBondContact O-N 3.17Å; L389-D391 VanDerWaalsContact C-N 3.32Å; L389-D391 PolarHBondContact O-N 3.25Å; D391-E393 PolarHBondContact O-N 3.34Å; D391-S394 PolarHBondContact O-N 2.93Å; D391-S394 PolarHBondContact O-OG 3.3Å
392	I	75	Confident	69.6	Low	11 Å²	11	58.2 Å²	58.2	6%	0.056	32%	0.32	C	S	.	.	H	α-helix	trans	-57.6	-26	-179.9	-66.9	161.5	0	0	0	114.7	V333 I336 K340 L357 L388 L389 L390	V333-I392 HydrophobicContact CB-CG1 4.45Å; V333-I392 HydrophobicContact CG1-CG1 3.89Å; V333-I392 HydrophobicContact CG2-CD1 4.28Å; V333-I392 HydrophobicContact CG2-CG1 4.14Å; I336-I392 HydrophobicContact CG2-CG2 4.12Å; K340-I392 PolarHBondContact NZ-O 2.87Å; L357-I392 HydrophobicContact CD2-CD1 3.2Å; L357-I392 HydrophobicContact CD2-CG1 4.42Å; L388-I392 WeakPolarHBondContact O-CD1 3.4Å; L388-I392 VanDerWaalsContact O-CG1 3.3Å; L388-I392 WeakPolarHBondContact O-CG1 3.3Å; L388-I392 PolarHBondContact O-N 3.35Å; L389-I392 PolarHBondContact O-N 2.83Å; L390-I392 VanDerWaalsContact C-N 3.32Å; L390-I392 PolarHBondContact O-N 2.86Å
393	E	68.5	Low	68.5	Low	14 Å²	14	58.2 Å²	58.2	7%	0.065	32%	0.319	C	S	.	.	H	α-helix	trans	-94.1	-26.6	-177.8	-157.3	-178.9	145.6	0	0	113.1	L389 L390 D391 D395 H401 S406	L389-E393 PolarHBondContact O-N 2.87Å; L390-E393 PolarHBondContact O-N 3.27Å; D391-E393 PolarHBondContact O-N 3.34Å; E393-D395 PolarHBondContact O-N 2.82Å; E393-H401 IonicContact OE1-CE1 2.63Å; E393-H401 IonicContact OE1-CG 3.12Å; E393-H401 IonicContact OE1-ND1 3.75Å; E393-H401 PolarHBondContact OE1-ND1 2.8Å; E393-S406 PolarHBondContact OE2-OG 2.81Å
394	S	56.2	Low	67.6	Low	63 Å²	63	60.5 Å²	60.5	44%	0.441	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-1.8	-163.7	57.5	0	0	0	0	118.9	K337 L390 D391	K337-S394 PolarHBondContact NZ-OG 2.68Å; L390-S394 WeakPolarHBondContact O-CB 3.01Å; L390-S394 PolarHBondContact O-N 2.91Å; L390-S394 VanDerWaalsContact O-N 3.11Å; D391-S394 PolarHBondContact O-N 2.93Å; D391-S394 PolarHBondContact O-OG 3.3Å
395	D	52.6	Low	66.6	Low	94 Å²	94	63.4 Å²	63.4	50%	0.503	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-25	-169.7	-81.1	-45.5	0	0	0	117.1	K337 E393	K337-D395 VanDerWaalsContact CD-OD2 3.32Å; K337-D395 WeakPolarHBondContact CD-OD2 3.5Å; K337-D395 WeakPolarHBondContact CE-OD2 2.99Å; K337-D395 IonicContact NZ-OD2 3.68Å; K337-D395 PolarHBondContact NZ-OD2 3.41Å; E393-D395 PolarHBondContact O-N 2.82Å
396	E	49.2	Very low	65.8	Low	169 Å²	169	63.6 Å²	63.6	79%	0.79	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.3	-12.3	-174.9	-70.8	-168.1	163.7	0	0	119.3
397	S	47.5	Very low	65.3	Low	44 Å²	44	60 Å²	60	31%	0.308	32%	0.323	S	S	.	.			trans	-98.8	113.5	-172.1	67	0	0	0	0	113	T399 H401	S397-T399 WeakPolarHBondContact CB-OG1 3.39Å; S397-T399 PolarHBondContact O-N 3.5Å; S397-T399 PolarHBondContact OG-OG1 3.32Å; S397-H401 PolarHBondContact O-CE1 2.92Å; S397-H401 VanDerWaalsContact O-CE1 3.23Å
398	N	48.7	Very low	64.6	Low	182 Å²	182	61.3 Å²	61.3	97%	0.973	33%	0.331	S	S	*	.			trans	-61.9	9.3	164.3	-85.9	-26.8	0	0	0	113.8
399	T	50.7	Low	63.9	Low	82 Å²	82	65 Å²	65	50%	0.503	35%	0.349	S	S	.	.	S	Bend	trans	-72.7	147.9	173.8	44.4	0	0	0	0	110	S397 H401	S397-T399 WeakPolarHBondContact CB-OG1 3.39Å; S397-T399 PolarHBondContact O-N 3.5Å; S397-T399 PolarHBondContact OG-OG1 3.32Å; T399-H401 PolarHBondContact O-N 3.45Å
400	V	51.6	Low	63.7	Low	128 Å²	128	65.2 Å²	65.2	78%	0.776	35%	0.351	S	S	*	.			trans	-53.6	105.8	172.1	178.4	0	0	0	0	108.1	S402	V400-S402 PolarHBondContact O-N 3.34Å
401	H	55.9	Low	63.6	Low	98 Å²	98	62 Å²	62	45%	0.454	33%	0.334	S	S	.	.			trans	-62.6	119.3	176.3	-63.7	-54.2	0	0	0	108.2	E393 S397 T399	E393-H401 IonicContact OE1-CE1 2.63Å; E393-H401 IonicContact OE1-CG 3.12Å; E393-H401 IonicContact OE1-ND1 3.75Å; E393-H401 PolarHBondContact OE1-ND1 2.8Å; S397-H401 PolarHBondContact O-CE1 2.92Å; S397-H401 VanDerWaalsContact O-CE1 3.23Å; T399-H401 PolarHBondContact O-N 3.45Å
402	S	62.7	Low	63.3	Low	28 Å²	28	63.8 Å²	63.8	20%	0.196	35%	0.349	C	S	.	.			trans	-127.3	137.7	176.1	112.1	0	0	0	0	107.5	V400 E404 N405 S406	V400-S402 PolarHBondContact O-N 3.34Å; S402-E404 WeakPolarHBondContact CB-OE2 3.39Å; S402-E404 PolarHBondContact O-N 3.29Å; S402-E404 PolarHBondContact OG-N 3.34Å; S402-E404 PolarHBondContact OG-OE2 3.01Å; S402-N405 WeakPolarHBondContact O-CB 3.46Å; S402-N405 PolarHBondContact O-N 3.48Å; S402-N405 PolarHBondContact OG-N 2.89Å; S402-N405 VanDerWaalsContact OG-N 3.13Å; S402-S406 PolarHBondContact O-N 3.13Å; S402-S406 VanDerWaalsContact O-N 3.17Å
403	Y	64.6	Low	63	Low	22 Å²	22	69.8 Å²	69.8	9%	0.086	38%	0.377	C	S	.	.	H	α-helix	trans	-52.9	-37.4	175.6	175.1	-100.7	0	0	0	111.4	I385 H386 L389 S406 I407 W425	I385-Y403 HydrophobicContact CG2-CE2 4.38Å; H386-Y403 HydrophobicContact CB-CE2 4.41Å; H386-Y403 AromaticContact CD2-CD2 3.53Å; L389-Y403 HydrophobicContact CD1-CD2 3.91Å; L389-Y403 HydrophobicContact CD1-CE2 3.3Å; Y403-S406 PolarHBondContact O-N 3.27Å; Y403-I407 HydrophobicContact CD1-CD1 3.83Å; Y403-I407 HydrophobicContact CE1-CD1 3.12Å; Y403-I407 HydrophobicContact CE1-CG1 4.05Å; Y403-I407 HydrophobicContact CE2-CD1 4.49Å; Y403-I407 VanDerWaalsContact CZ-CD1 3.49Å; Y403-I407 PolarHBondContact O-N 3.1Å; Y403-W425 HydrophobicContact CD1-CH2 4.44Å; Y403-W425 HydrophobicContact CD1-CZ2 4.02Å; Y403-W425 AromaticContact CE1-CD2 3.6Å; Y403-W425 HydrophobicContact CE1-CD2 3.6Å; Y403-W425 AromaticContact CE1-CE2 3.46Å; Y403-W425 VanDerWaalsContact CE1-CE2 3.46Å; Y403-W425 AromaticContact CE1-CE3 3.79Å; Y403-W425 HydrophobicContact CE1-CE3 3.79Å; Y403-W425 HydrophobicContact CE1-CG 4.29Å; Y403-W425 AromaticContact CE1-CH2 3.62Å; Y403-W425 HydrophobicContact CE1-CH2 3.62Å; Y403-W425 AromaticContact CE1-CZ2 3.46Å; Y403-W425 HydrophobicContact CE1-CZ2 3.46Å; Y403-W425 VanDerWaalsContact CE1-CZ2 3.46Å; Y403-W425 AromaticContact CE1-CZ3 3.83Å; Y403-W425 HydrophobicContact CE1-CZ3 3.83Å; Y403-W425 AromaticContact CE2-CH2 3.93Å; Y403-W425 HydrophobicContact CE2-CH2 3.93Å; Y403-W425 HydrophobicContact CE2-CZ2 4.43Å; Y403-W425 HydrophobicContact CE2-CZ3 4.23Å; Y403-W425 AromaticContact CZ-CE3 3.72Å; Y403-W425 AromaticContact CZ-CH2 3.36Å; Y403-W425 AromaticContact CZ-CZ2 3.75Å; Y403-W425 AromaticContact CZ-CZ3 3.39Å; Y403-W425 WeakPolarHBondContact OH-CH2 3.14Å; Y403-W425 WeakPolarHBondContact OH-CZ3 3.22Å
404	E	67.1	Low	63.3	Low	106 Å²	106	71.6 Å²	71.6	50%	0.495	39%	0.387	S	S	.	.	H	α-helix	trans	-62.3	-42.4	176.3	-54.4	83.7	172.9	0	0	111.7	S402 I407 I408	S402-E404 WeakPolarHBondContact CB-OE2 3.39Å; S402-E404 PolarHBondContact O-N 3.29Å; S402-E404 PolarHBondContact OG-N 3.34Å; S402-E404 PolarHBondContact OG-OE2 3.01Å; E404-I407 PolarHBondContact O-N 3.33Å; E404-I408 WeakPolarHBondContact O-CB 3.43Å; E404-I408 WeakPolarHBondContact O-CD1 3.29Å; E404-I408 WeakPolarHBondContact O-CG1 3.34Å; E404-I408 PolarHBondContact O-N 3.46Å
405	N	67.2	Low	64.3	Low	65 Å²	65	73.8 Å²	73.8	35%	0.348	39%	0.393	S	S	.	.	H	α-helix	trans	-62.5	-44.2	175.6	-73.3	-20	0	0	0	111.4	S402 I407 I408 I409	S402-N405 WeakPolarHBondContact O-CB 3.46Å; S402-N405 PolarHBondContact O-N 3.48Å; S402-N405 PolarHBondContact OG-N 2.89Å; S402-N405 VanDerWaalsContact OG-N 3.13Å; N405-I407 PolarHBondContact O-N 3.11Å; N405-I408 PolarHBondContact O-N 2.78Å; N405-I409 WeakPolarHBondContact O-CD1 3.29Å; N405-I409 VanDerWaalsContact O-CG1 3.23Å; N405-I409 WeakPolarHBondContact O-CG1 3.49Å; N405-I409 PolarHBondContact O-N 3.02Å
406	S	71	Confident	65.6	Low	4 Å²	4	72.8 Å²	72.8	3%	0.028	40%	0.398	C	S	.	.	H	α-helix	trans	-60.8	-41.8	176.4	-80.5	0	0	0	0	112.8	L389 E393 S402 Y403 I409 L410	L389-S406 PolarHBondContact O-OG 2.87Å; E393-S406 PolarHBondContact OE2-OG 2.81Å; S402-S406 PolarHBondContact O-N 3.13Å; S402-S406 VanDerWaalsContact O-N 3.17Å; Y403-S406 PolarHBondContact O-N 3.27Å; S406-I409 PolarHBondContact O-N 3.48Å; S406-L410 WeakPolarHBondContact O-CB 3.39Å; S406-L410 PolarHBondContact O-N 3.38Å
407	I	74	Confident	67.2	Low	1 Å²	1	66.6 Å²	66.6	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-61.2	-49.4	172.6	-75.1	176.5	0	0	0	110.4	L389 Y403 E404 N405 I409 L410 F411 L418 V421 L422	L389-I407 HydrophobicContact CD1-CG1 3.84Å; Y403-I407 HydrophobicContact CD1-CD1 3.83Å; Y403-I407 HydrophobicContact CE1-CD1 3.12Å; Y403-I407 HydrophobicContact CE1-CG1 4.05Å; Y403-I407 HydrophobicContact CE2-CD1 4.49Å; Y403-I407 VanDerWaalsContact CZ-CD1 3.49Å; Y403-I407 PolarHBondContact O-N 3.1Å; E404-I407 PolarHBondContact O-N 3.33Å; N405-I407 PolarHBondContact O-N 3.11Å; I407-I409 VanDerWaalsContact C-N 3.28Å; I407-I409 PolarHBondContact O-N 2.79Å; I407-L410 PolarHBondContact O-N 3.47Å; I407-F411 HydrophobicContact CG2-CD2 4.15Å; I407-F411 WeakPolarHBondContact O-CB 3.24Å; I407-F411 WeakPolarHBondContact O-CD2 3.48Å; I407-F411 PolarHBondContact O-N 3.02Å; I407-L418 HydrophobicContact CG2-CD1 3.75Å; I407-V421 HydrophobicContact CD1-CG1 3.87Å; I407-V421 HydrophobicContact CG1-CG1 4.25Å; I407-V421 HydrophobicContact CG2-CB 4.46Å; I407-V421 HydrophobicContact CG2-CG1 3.74Å; I407-L422 HydrophobicContact CG2-CD2 4.14Å
408	I	70.7	Confident	68.9	Low	78 Å²	78	65.6 Å²	65.6	40%	0.4	36%	0.36	S	S	.	.	H	α-helix	trans	-57.5	-46.4	-178.6	-70.4	163.4	0	0	0	109.6	E404 N405 L410 F411 S412 L418	E404-I408 WeakPolarHBondContact O-CB 3.43Å; E404-I408 WeakPolarHBondContact O-CD1 3.29Å; E404-I408 WeakPolarHBondContact O-CG1 3.34Å; E404-I408 PolarHBondContact O-N 3.46Å; N405-I408 PolarHBondContact O-N 2.78Å; I408-L410 PolarHBondContact O-N 3.25Å; I408-F411 PolarHBondContact O-N 2.89Å; I408-S412 VanDerWaalsContact O-CA 3.29Å; I408-S412 WeakPolarHBondContact O-CA 3.36Å; I408-S412 WeakPolarHBondContact O-CB 3.29Å; I408-S412 PolarHBondContact O-N 2.75Å; I408-L418 HydrophobicContact CG1-CD1 4.3Å
409	I	70.5	Confident	70.6	Confident	77 Å²	77	63.6 Å²	63.6	40%	0.395	34%	0.343	S	S	.	.	H	α-helix	trans	-63.4	-42.2	179.1	-67	163.1	0	0	0	111.6	N405 S406 I407 F411 S412	N405-I409 WeakPolarHBondContact O-CD1 3.29Å; N405-I409 VanDerWaalsContact O-CG1 3.23Å; N405-I409 WeakPolarHBondContact O-CG1 3.49Å; N405-I409 PolarHBondContact O-N 3.02Å; S406-I409 PolarHBondContact O-N 3.48Å; I407-I409 VanDerWaalsContact C-N 3.28Å; I407-I409 PolarHBondContact O-N 2.79Å; I409-F411 VanDerWaalsContact C-N 3.31Å; I409-F411 PolarHBondContact O-N 3.37Å; I409-S412 PolarHBondContact O-OG 3.49Å
410	L	76.2	Confident	72.4	Confident	6 Å²	6	64.3 Å²	64.3	3%	0.031	34%	0.337	C	S	.	.	H	α-helix	trans	-70.6	-29.5	-178.2	-178	59.9	0	0	0	112.5	C354 L357 R358 V361 L389 S406 I407 I408	C354-L410 HydrophobicContact CB-CD1 4.08Å; L357-L410 HydrophobicContact CB-CD1 4.46Å; L357-L410 HydrophobicContact CD2-CD1 3.84Å; L357-L410 HydrophobicContact CD2-CD2 3.88Å; L357-L410 HydrophobicContact CG-CD1 4.34Å; L357-L410 HydrophobicContact CG-CD2 4.03Å; R358-L410 VanDerWaalsContact CD-O 3.25Å; R358-L410 WeakPolarHBondContact CD-O 3.47Å; R358-L410 HydrophobicContact CG-CD1 4.08Å; R358-L410 HydrophobicContact CG-CG 3.93Å; R358-L410 WeakPolarHBondContact CG-O 3.48Å; V361-L410 HydrophobicContact CG2-CD2 4.28Å; L389-L410 HydrophobicContact CD2-CB 4.35Å; L389-L410 HydrophobicContact CD2-CD2 3.74Å; S406-L410 WeakPolarHBondContact O-CB 3.39Å; S406-L410 PolarHBondContact O-N 3.38Å; I407-L410 PolarHBondContact O-N 3.47Å; I408-L410 PolarHBondContact O-N 3.25Å
411	F	77.8	Confident	74	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-113.7	3.5	-173	-69.8	-86.7	0	0	0	114.6	R358 V361 L362 I407 I408 I409 E413 D414 Q417 L418 V421	R358-F411 HydrophobicContact CB-CD1 4.26Å; R358-F411 HydrophobicContact CB-CE1 3.59Å; R358-F411 HydrophobicContact CB-CZ 3.98Å; R358-F411 HydrophobicContact CG-CD1 3.76Å; R358-F411 HydrophobicContact CG-CE1 3.53Å; R358-F411 HydrophobicContact CG-CE2 4.47Å; R358-F411 HydrophobicContact CG-CG 4.34Å; R358-F411 HydrophobicContact CG-CZ 3.92Å; V361-F411 HydrophobicContact CB-CZ 4.25Å; V361-F411 HydrophobicContact CG1-CE2 4.2Å; V361-F411 HydrophobicContact CG1-CZ 4.15Å; L362-F411 HydrophobicContact CD1-CE1 4.02Å; L362-F411 HydrophobicContact CG-CE1 3.96Å; L362-F411 HydrophobicContact CG-CZ 4.23Å; I407-F411 HydrophobicContact CG2-CD2 4.15Å; I407-F411 WeakPolarHBondContact O-CB 3.24Å; I407-F411 WeakPolarHBondContact O-CD2 3.48Å; I407-F411 PolarHBondContact O-N 3.02Å; I408-F411 PolarHBondContact O-N 2.89Å; I409-F411 VanDerWaalsContact C-N 3.31Å; I409-F411 PolarHBondContact O-N 3.37Å; F411-E413 PolarHBondContact O-N 3.39Å; F411-D414 CarbonylContact O-C 3.59Å; F411-D414 PolarHBondContact O-N 3.49Å; F411-Q417 HydrophobicContact CD1-CB 3.72Å; F411-Q417 HydrophobicContact CE1-CB 4.2Å; F411-L418 HydrophobicContact CB-CB 3.88Å; F411-L418 HydrophobicContact CB-CD1 3.96Å; F411-V421 HydrophobicContact CD1-CG2 3.98Å; F411-V421 HydrophobicContact CD2-CG2 4.1Å; F411-V421 HydrophobicContact CE1-CG2 3.58Å; F411-V421 HydrophobicContact CE2-CG1 4.28Å; F411-V421 HydrophobicContact CE2-CG2 3.73Å; F411-V421 HydrophobicContact CG-CG2 4.22Å; F411-V421 HydrophobicContact CZ-CG2 3.46Å; F411-V421 VanDerWaalsContact CZ-CG2 3.46Å
412	S	70.8	Confident	75.5	Confident	67 Å²	67	56.3 Å²	56.3	47%	0.469	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.1	-173.9	53	0	0	0	0	114.9	I408 I409	I408-S412 VanDerWaalsContact O-CA 3.29Å; I408-S412 WeakPolarHBondContact O-CA 3.36Å; I408-S412 WeakPolarHBondContact O-CB 3.29Å; I408-S412 PolarHBondContact O-N 2.75Å; I409-S412 PolarHBondContact O-OG 3.49Å
413	E	70.2	Confident	76.8	Confident	138 Å²	138	58 Å²	58	65%	0.645	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-10.3	178.7	-62.2	-179.3	164.5	0	0	113.5	R358 F411	R358-E413 IonicContact CZ-OE2 2.86Å; R358-E413 IonicContact NH1-OE2 2.6Å; R358-E413 IonicContact NH2-OE2 2.62Å; R358-E413 PolarHBondContact NH2-OE2 3.47Å; F411-E413 PolarHBondContact O-N 3.39Å
414	D	74	Confident	77.9	Confident	51 Å²	51	57 Å²	57	27%	0.273	30%	0.296	S	S	.	.			trans	-139.7	90.5	-179.9	-173	-26.7	0	0	0	110	F411 A416 Q417 L418	F411-D414 CarbonylContact O-C 3.59Å; F411-D414 PolarHBondContact O-N 3.49Å; D414-A416 PolarHBondContact O-N 3.24Å; D414-A416 VanDerWaalsContact O-N 3.15Å; D414-A416 WeakPolarHBondContact OD1-CB 3.03Å; D414-A416 PolarHBondContact OD1-N 3.41Å; D414-A416 VanDerWaalsContact OD1-N 3.13Å; D414-Q417 HydrophobicContact CB-CB 4.07Å; D414-Q417 HydrophobicContact CB-CG 4.19Å; D414-Q417 PolarHBondContact O-N 2.99Å; D414-Q417 PolarHBondContact OD1-N 3.01Å; D414-Q417 VanDerWaalsContact OD2-CD 3.27Å; D414-Q417 VanDerWaalsContact OD2-CG 3.3Å; D414-Q417 WeakPolarHBondContact OD2-CG 3.07Å; D414-Q417 PolarHBondContact OD2-NE2 2.84Å; D414-L418 PolarHBondContact O-N 2.88Å
415	D	78.1	Confident	78.8	Confident	109 Å²	109	54 Å²	54	58%	0.583	28%	0.28	S	S	*	.	H	α-helix	trans	-50.7	-39.3	179.2	-69.9	-19.6	0	0	0	112.3	Q417 L418 F419	D415-Q417 PolarHBondContact O-N 3.43Å; D415-L418 PolarHBondContact O-N 3.4Å; D415-F419 HydrophobicContact CB-CD2 4.42Å; D415-F419 HydrophobicContact CB-CE2 4.25Å; D415-F419 WeakPolarHBondContact O-CD2 3.33Å; D415-F419 PolarHBondContact O-N 3.07Å
416	A	80.1	Confident	79.8	Confident	73 Å²	73	55.5 Å²	55.5	60%	0.603	29%	0.287	S	S	*	.	H	α-helix	trans	-67.6	-39	-178.8	0	0	0	0	0	111.6	D414 R420	D414-A416 PolarHBondContact O-N 3.24Å; D414-A416 VanDerWaalsContact O-N 3.15Å; D414-A416 WeakPolarHBondContact OD1-CB 3.03Å; D414-A416 PolarHBondContact OD1-N 3.41Å; D414-A416 VanDerWaalsContact OD1-N 3.13Å; A416-R420 WeakPolarHBondContact O-CB 3.16Å; A416-R420 PolarHBondContact O-N 3.41Å; A416-R420 VanDerWaalsContact O-N 3.16Å
417	Q	82.2	Confident	80.7	Confident	40 Å²	40	58.6 Å²	58.6	19%	0.187	30%	0.301	C	S	.	.	H	α-helix	trans	-70.2	-40.9	172.8	-69.9	-176.7	41.6	0	0	111.9	L362 F411 D414 D415 R420 V421	L362-Q417 HydrophobicContact CD1-CB 4.4Å; L362-Q417 HydrophobicContact CD1-CG 4.09Å; F411-Q417 HydrophobicContact CD1-CB 3.72Å; F411-Q417 HydrophobicContact CE1-CB 4.2Å; D414-Q417 HydrophobicContact CB-CB 4.07Å; D414-Q417 HydrophobicContact CB-CG 4.19Å; D414-Q417 PolarHBondContact O-N 2.99Å; D414-Q417 PolarHBondContact OD1-N 3.01Å; D414-Q417 VanDerWaalsContact OD2-CD 3.27Å; D414-Q417 VanDerWaalsContact OD2-CG 3.3Å; D414-Q417 WeakPolarHBondContact OD2-CG 3.07Å; D414-Q417 PolarHBondContact OD2-NE2 2.84Å; D415-Q417 PolarHBondContact O-N 3.43Å; Q417-R420 PolarHBondContact O-N 2.81Å; Q417-V421 WeakPolarHBondContact O-CG2 3.43Å; Q417-V421 PolarHBondContact O-N 3.18Å
418	L	81.9	Confident	81.3	Confident	22 Å²	22	58.7 Å²	58.7	12%	0.115	30%	0.301	C	S	.	.	H	α-helix	trans	-56.8	-53.3	176.5	176.3	59.8	0	0	0	111	I407 I408 F411 D414 D415 R420 V421 L422	I407-L418 HydrophobicContact CG2-CD1 3.75Å; I408-L418 HydrophobicContact CG1-CD1 4.3Å; F411-L418 HydrophobicContact CB-CB 3.88Å; F411-L418 HydrophobicContact CB-CD1 3.96Å; D414-L418 PolarHBondContact O-N 2.88Å; D415-L418 PolarHBondContact O-N 3.4Å; L418-R420 PolarHBondContact O-N 3.16Å; L418-V421 PolarHBondContact O-N 3.25Å; L418-L422 HydrophobicContact CD1-CD1 4.07Å; L418-L422 HydrophobicContact CD1-CG 4.26Å; L418-L422 HydrophobicContact CG-CD1 4.16Å; L418-L422 WeakPolarHBondContact O-CG 2.85Å; L418-L422 PolarHBondContact O-N 2.97Å
419	F	85.8	Confident	82	Confident	141 Å²	141	58.5 Å²	58.5	62%	0.618	30%	0.299	S	S	*	.	H	α-helix	trans	-59.7	-37.6	177.5	-74.5	-58.8	0	0	0	112.1	D415 D423	D415-F419 HydrophobicContact CB-CD2 4.42Å; D415-F419 HydrophobicContact CB-CE2 4.25Å; D415-F419 WeakPolarHBondContact O-CD2 3.33Å; D415-F419 PolarHBondContact O-N 3.07Å; F419-D423 WeakPolarHBondContact O-CB 3Å; F419-D423 PolarHBondContact O-N 2.79Å
420	R	88	Confident	82.9	Confident	96 Å²	96	59.2 Å²	59.2	36%	0.362	30%	0.303	S	S	.	.	H	α-helix	trans	-66.8	-39.5	177.7	-178.8	55.2	177.9	164	0.7	112.7	L362 A416 Q417 L418 D423 L424	L362-R420 HydrophobicContact CD2-CG 4.26Å; A416-R420 WeakPolarHBondContact O-CB 3.16Å; A416-R420 PolarHBondContact O-N 3.41Å; A416-R420 VanDerWaalsContact O-N 3.16Å; Q417-R420 PolarHBondContact O-N 2.81Å; L418-R420 PolarHBondContact O-N 3.16Å; R420-D423 IonicContact CZ-OD2 2.71Å; R420-D423 IonicContact NH1-OD2 2.95Å; R420-D423 PolarHBondContact NH1-OD2 2.86Å; R420-L424 HydrophobicContact CG-CD1 4.12Å; R420-L424 WeakPolarHBondContact O-CB 3.41Å; R420-L424 VanDerWaalsContact O-CG 3.26Å; R420-L424 WeakPolarHBondContact O-CG 3.5Å; R420-L424 PolarHBondContact O-N 3.36Å
421	V	86.4	Confident	83.3	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-65.4	-46.3	177.4	169.4	0	0	0	0	110.5	L362 L365 I407 F411 Q417 L418 D423 L424 W425	L362-V421 HydrophobicContact CD2-CG2 3.44Å; L362-V421 VanDerWaalsContact CD2-CG2 3.44Å; L362-V421 HydrophobicContact CG-CG2 4.04Å; L365-V421 HydrophobicContact CD1-CB 4.45Å; L365-V421 HydrophobicContact CD1-CG1 3.75Å; L365-V421 HydrophobicContact CD1-CG2 4.49Å; I407-V421 HydrophobicContact CD1-CG1 3.87Å; I407-V421 HydrophobicContact CG1-CG1 4.25Å; I407-V421 HydrophobicContact CG2-CB 4.46Å; I407-V421 HydrophobicContact CG2-CG1 3.74Å; F411-V421 HydrophobicContact CD1-CG2 3.98Å; F411-V421 HydrophobicContact CD2-CG2 4.1Å; F411-V421 HydrophobicContact CE1-CG2 3.58Å; F411-V421 HydrophobicContact CE2-CG1 4.28Å; F411-V421 HydrophobicContact CE2-CG2 3.73Å; F411-V421 HydrophobicContact CG-CG2 4.22Å; F411-V421 HydrophobicContact CZ-CG2 3.46Å; F411-V421 VanDerWaalsContact CZ-CG2 3.46Å; Q417-V421 WeakPolarHBondContact O-CG2 3.43Å; Q417-V421 PolarHBondContact O-N 3.18Å; L418-V421 PolarHBondContact O-N 3.25Å; V421-D423 PolarHBondContact O-N 2.94Å; V421-L424 PolarHBondContact O-N 3.12Å; V421-W425 WeakPolarHBondContact O-CB 3.41Å; V421-W425 PolarHBondContact O-N 3.34Å
422	L	85.9	Confident	83.6	Confident	58 Å²	58	62.8 Å²	62.8	30%	0.304	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-44	177.9	-65.8	173.9	0	0	0	111.5	I407 L418 W425 I426	I407-L422 HydrophobicContact CG2-CD2 4.14Å; L418-L422 HydrophobicContact CD1-CD1 4.07Å; L418-L422 HydrophobicContact CD1-CG 4.26Å; L418-L422 HydrophobicContact CG-CD1 4.16Å; L418-L422 WeakPolarHBondContact O-CG 2.85Å; L418-L422 PolarHBondContact O-N 2.97Å; L422-W425 PolarHBondContact O-N 2.89Å; L422-I426 WeakPolarHBondContact O-CG1 3.16Å; L422-I426 PolarHBondContact O-N 3.39Å
423	D	89.8	Confident	84.3	Confident	64 Å²	64	64.8 Å²	64.8	34%	0.342	32%	0.321	S	S	.	.	H	α-helix	trans	-59.8	-47.1	175	173.4	58.6	0	0	0	112.4	F419 R420 V421 W425 I426 Q427	F419-D423 WeakPolarHBondContact O-CB 3Å; F419-D423 PolarHBondContact O-N 2.79Å; R420-D423 IonicContact CZ-OD2 2.71Å; R420-D423 IonicContact NH1-OD2 2.95Å; R420-D423 PolarHBondContact NH1-OD2 2.86Å; V421-D423 PolarHBondContact O-N 2.94Å; D423-W425 VanDerWaalsContact C-N 3.3Å; D423-W425 PolarHBondContact O-N 3.29Å; D423-I426 PolarHBondContact O-N 2.95Å; D423-Q427 VanDerWaalsContact O-CG 3.3Å; D423-Q427 WeakPolarHBondContact O-CG 3.24Å; D423-Q427 PolarHBondContact O-N 3.02Å; D423-Q427 PolarHBondContact OD1-NE2 2.77Å; D423-Q427 PolarHBondContact OD2-NE2 3.2Å
424	L	89.3	Confident	84.5	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-40.4	175.8	-77.5	168.5	0	0	0	112	L362 L365 E366 L369 R420 V421 Q427 I428	L362-L424 HydrophobicContact CD2-CD1 4.37Å; L365-L424 HydrophobicContact CB-CB 4.17Å; L365-L424 HydrophobicContact CB-CD1 4.01Å; E366-L424 HydrophobicContact CG-CD1 3.6Å; E366-L424 HydrophobicContact CG-CD2 4.01Å; E366-L424 HydrophobicContact CG-CG 4.47Å; L369-L424 HydrophobicContact CD2-CD2 3.83Å; R420-L424 HydrophobicContact CG-CD1 4.12Å; R420-L424 WeakPolarHBondContact O-CB 3.41Å; R420-L424 VanDerWaalsContact O-CG 3.26Å; R420-L424 WeakPolarHBondContact O-CG 3.5Å; R420-L424 PolarHBondContact O-N 3.36Å; V421-L424 PolarHBondContact O-N 3.12Å; L424-Q427 PolarHBondContact O-N 3.47Å; L424-I428 WeakPolarHBondContact O-CD1 3.49Å; L424-I428 VanDerWaalsContact O-CG1 3.24Å; L424-I428 WeakPolarHBondContact O-CG1 3.46Å; L424-I428 PolarHBondContact O-N 3.18Å
425	W	84.7	Confident	84.1	Confident	44 Å²	44	63.5 Å²	63.5	17%	0.167	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-48.6	179.5	-170.7	-93.7	0	0	0	111.8	L365 I382 Y403 V421 L422 D423 Q427 I428 E429	L365-W425 HydrophobicContact CD2-CE3 3.8Å; L365-W425 HydrophobicContact CD2-CZ3 4.05Å; I382-W425 HydrophobicContact CG2-CH2 3.79Å; I382-W425 HydrophobicContact CG2-CZ3 4.27Å; Y403-W425 HydrophobicContact CD1-CH2 4.44Å; Y403-W425 HydrophobicContact CD1-CZ2 4.02Å; Y403-W425 AromaticContact CE1-CD2 3.6Å; Y403-W425 HydrophobicContact CE1-CD2 3.6Å; Y403-W425 AromaticContact CE1-CE2 3.46Å; Y403-W425 VanDerWaalsContact CE1-CE2 3.46Å; Y403-W425 AromaticContact CE1-CE3 3.79Å; Y403-W425 HydrophobicContact CE1-CE3 3.79Å; Y403-W425 HydrophobicContact CE1-CG 4.29Å; Y403-W425 AromaticContact CE1-CH2 3.62Å; Y403-W425 HydrophobicContact CE1-CH2 3.62Å; Y403-W425 AromaticContact CE1-CZ2 3.46Å; Y403-W425 HydrophobicContact CE1-CZ2 3.46Å; Y403-W425 VanDerWaalsContact CE1-CZ2 3.46Å; Y403-W425 AromaticContact CE1-CZ3 3.83Å; Y403-W425 HydrophobicContact CE1-CZ3 3.83Å; Y403-W425 AromaticContact CE2-CH2 3.93Å; Y403-W425 HydrophobicContact CE2-CH2 3.93Å; Y403-W425 HydrophobicContact CE2-CZ2 4.43Å; Y403-W425 HydrophobicContact CE2-CZ3 4.23Å; Y403-W425 AromaticContact CZ-CE3 3.72Å; Y403-W425 AromaticContact CZ-CH2 3.36Å; Y403-W425 AromaticContact CZ-CZ2 3.75Å; Y403-W425 AromaticContact CZ-CZ3 3.39Å; Y403-W425 WeakPolarHBondContact OH-CH2 3.14Å; Y403-W425 WeakPolarHBondContact OH-CZ3 3.22Å; V421-W425 WeakPolarHBondContact O-CB 3.41Å; V421-W425 PolarHBondContact O-N 3.34Å; L422-W425 PolarHBondContact O-N 2.89Å; D423-W425 VanDerWaalsContact C-N 3.3Å; D423-W425 PolarHBondContact O-N 3.29Å; W425-Q427 VanDerWaalsContact C-N 3.28Å; W425-Q427 PolarHBondContact O-N 2.92Å; W425-I428 PolarHBondContact O-N 2.68Å; W425-I428 VanDerWaalsContact O-N 3.12Å; W425-E429 PolarHBondContact O-N 2.96Å; W425-E429 PolarHBondContact NE1-OE1 2.75Å
426	I	87.6	Confident	83.1	Confident	95 Å²	95	68.5 Å²	68.5	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-57.7	-44.1	176.1	-67.2	165.6	0	0	0	110.4	L422 D423 I428 E429 D430	L422-I426 WeakPolarHBondContact O-CG1 3.16Å; L422-I426 PolarHBondContact O-N 3.39Å; D423-I426 PolarHBondContact O-N 2.95Å; I426-I428 VanDerWaalsContact C-N 3.33Å; I426-I428 PolarHBondContact O-N 2.84Å; I426-E429 PolarHBondContact O-N 3.31Å; I426-D430 PolarHBondContact O-N 2.82Å
427	Q	90.1	Very high	83.2	Confident	69 Å²	69	68.3 Å²	68.3	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-62.8	-38.6	177.5	-72.6	173	41.7	0	0	112.7	L369 D423 L424 W425 H431	L369-Q427 HydrophobicContact CD1-CB 3.76Å; L369-Q427 HydrophobicContact CD2-CB 4.24Å; L369-Q427 VanDerWaalsContact CD2-OE1 3.28Å; D423-Q427 VanDerWaalsContact O-CG 3.3Å; D423-Q427 WeakPolarHBondContact O-CG 3.24Å; D423-Q427 PolarHBondContact O-N 3.02Å; D423-Q427 PolarHBondContact OD1-NE2 2.77Å; D423-Q427 PolarHBondContact OD2-NE2 3.2Å; L424-Q427 PolarHBondContact O-N 3.47Å; W425-Q427 VanDerWaalsContact C-N 3.28Å; W425-Q427 PolarHBondContact O-N 2.92Å; Q427-H431 WeakPolarHBondContact O-CB 3.12Å; Q427-H431 PolarHBondContact O-N 3.28Å
428	I	87.2	Confident	83.3	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.015	34%	0.343	C	S	.	.	H	α-helix	trans	-66.2	-43	175.4	-69.8	162.7	0	0	0	110.4	L365 A368 L369 L378 I382 L424 W425 I426 H431 I432	L365-I428 HydrophobicContact CB-CD1 4.29Å; L365-I428 HydrophobicContact CD2-CD1 3.85Å; A368-I428 HydrophobicContact CB-CD1 3.92Å; L369-I428 HydrophobicContact CB-CG1 4.03Å; L369-I428 HydrophobicContact CD1-CG1 4.08Å; L378-I428 HydrophobicContact CD1-CG2 4.37Å; I382-I428 HydrophobicContact CD1-CG2 3.78Å; L424-I428 WeakPolarHBondContact O-CD1 3.49Å; L424-I428 VanDerWaalsContact O-CG1 3.24Å; L424-I428 WeakPolarHBondContact O-CG1 3.46Å; L424-I428 PolarHBondContact O-N 3.18Å; W425-I428 PolarHBondContact O-N 2.68Å; W425-I428 VanDerWaalsContact O-N 3.12Å; I426-I428 VanDerWaalsContact C-N 3.33Å; I426-I428 PolarHBondContact O-N 2.84Å; I428-H431 WeakPolarHBondContact O-CB 3.4Å; I428-H431 PolarHBondContact O-N 3.24Å; I428-I432 HydrophobicContact CG2-CD1 3.78Å; I428-I432 HydrophobicContact CG2-CG1 4.49Å; I428-I432 VanDerWaalsContact O-CG1 3.28Å; I428-I432 WeakPolarHBondContact O-CG1 3.18Å; I428-I432 PolarHBondContact O-N 2.98Å
429	E	85.7	Confident	83.4	Confident	75 Å²	75	72.4 Å²	72.4	35%	0.35	36%	0.355	S	S	.	.	H	α-helix	trans	-61.3	-45.8	176	-75.1	-168	-169.1	0	0	112.3	W425 I426 H431 I432 K433	W425-E429 PolarHBondContact O-N 2.96Å; W425-E429 PolarHBondContact NE1-OE1 2.75Å; I426-E429 PolarHBondContact O-N 3.31Å; E429-H431 VanDerWaalsContact C-N 3.3Å; E429-H431 PolarHBondContact O-N 3.39Å; E429-I432 PolarHBondContact O-N 2.72Å; E429-K433 VanDerWaalsContact O-CG 3.31Å; E429-K433 WeakPolarHBondContact O-CG 3.25Å; E429-K433 PolarHBondContact O-N 3.45Å; E429-K433 IonicContact OE2-NZ 3.87Å; E429-K433 PolarHBondContact OE2-NZ 2.89Å; E429-K433 WeakPolarHBondContact O-CB 3.47Å
430	D	88.7	Confident	83.2	Confident	91 Å²	91	68.4 Å²	68.4	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-64.2	-39	177.9	-73.4	-16.7	0	0	0	111.1	I426 K433 S434	I426-D430 PolarHBondContact O-N 2.82Å; D430-K433 PolarHBondContact O-N 3.21Å; D430-S434 PolarHBondContact O-N 3.08Å; D430-S434 WeakPolarHBondContact O-CB 3.36Å
431	H	84.5	Confident	82.9	Confident	59 Å²	59	66.7 Å²	66.7	27%	0.273	34%	0.338	S	S	.	.	H	α-helix	trans	-60.8	-44.9	175.3	-173.7	55.7	0	0	0	111.6	L371 P373 Q427 I428 E429 S434	L371-H431 PolarHBondContact O-NE2 3.24Å; P373-H431 WeakPolarHBondContact CD-NE2 3.01Å; P373-H431 WeakPolarHBondContact CG-NE2 3.48Å; Q427-H431 WeakPolarHBondContact O-CB 3.12Å; Q427-H431 PolarHBondContact O-N 3.28Å; I428-H431 WeakPolarHBondContact O-CB 3.4Å; I428-H431 PolarHBondContact O-N 3.24Å; E429-H431 VanDerWaalsContact C-N 3.3Å; E429-H431 PolarHBondContact O-N 3.39Å; H431-S434 PolarHBondContact O-OG 3.08Å
432	I	85.1	Confident	82.7	Confident	22 Å²	22	71.1 Å²	71.1	11%	0.113	36%	0.361	C	S	.	.	H	α-helix	trans	-66.8	-46.5	176.3	-67.3	164.6	0	0	0	111.5	L378 W379 I382 I428 E429 S434 T435	L378-I432 HydrophobicContact CD2-CD1 4.18Å; L378-I432 HydrophobicContact CD2-CG1 3.96Å; W379-I432 HydrophobicContact CH2-CD1 3.94Å; W379-I432 HydrophobicContact CH2-CG1 4.43Å; W379-I432 HydrophobicContact CH2-CG2 3.73Å; W379-I432 HydrophobicContact CZ2-CD1 4.32Å; W379-I432 HydrophobicContact CZ2-CG1 4.42Å; W379-I432 HydrophobicContact CZ2-CG2 3.9Å; W379-I432 HydrophobicContact CZ3-CD1 4.32Å; I382-I432 HydrophobicContact CD1-CD1 3.91Å; I428-I432 HydrophobicContact CG2-CD1 3.78Å; I428-I432 HydrophobicContact CG2-CG1 4.49Å; I428-I432 VanDerWaalsContact O-CG1 3.28Å; I428-I432 WeakPolarHBondContact O-CG1 3.18Å; I428-I432 PolarHBondContact O-N 2.98Å; E429-I432 PolarHBondContact O-N 2.72Å; I432-S434 VanDerWaalsContact C-N 3.26Å; I432-S434 PolarHBondContact O-N 2.85Å; I432-T435 PolarHBondContact O-N 3.22Å; I432-T435 VanDerWaalsContact O-N 3.16Å; I432-T435 PolarHBondContact O-OG1 3.01Å
433	K	84.3	Confident	82.5	Confident	110 Å²	110	72.1 Å²	72.1	48%	0.478	37%	0.365	S	S	.	.	H	α-helix	trans	-64.3	-30.6	179.8	-73.2	168.5	-170.6	152.9	0	112.5	E429 D430 T435 E436	E429-K433 VanDerWaalsContact O-CG 3.31Å; E429-K433 WeakPolarHBondContact O-CG 3.25Å; E429-K433 PolarHBondContact O-N 3.45Å; E429-K433 IonicContact OE2-NZ 3.87Å; E429-K433 PolarHBondContact OE2-NZ 2.89Å; E429-K433 WeakPolarHBondContact O-CB 3.47Å; D430-K433 PolarHBondContact O-N 3.21Å; K433-T435 PolarHBondContact O-N 3.3Å; K433-E436 PolarHBondContact O-N 3.32Å
434	S	75.7	Confident	81.9	Confident	88 Å²	88	72.7 Å²	72.7	62%	0.615	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-14	178	76.3	0	0	0	0	114.1	D430 H431 I432	D430-S434 PolarHBondContact O-N 3.08Å; D430-S434 WeakPolarHBondContact O-CB 3.36Å; H431-S434 PolarHBondContact O-OG 3.08Å; I432-S434 VanDerWaalsContact C-N 3.26Å; I432-S434 PolarHBondContact O-N 2.85Å
435	T	65	Low	81.3	Confident	73 Å²	73	78.7 Å²	78.7	45%	0.448	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-11.2	175.7	43.7	0	0	0	0	115.1	P373 I432 K433	P373-T435 HydrophobicContact CB-CG2 3.85Å; P373-T435 WeakPolarHBondContact CB-OG1 3.49Å; P373-T435 HydrophobicContact CG-CG2 3.62Å; I432-T435 PolarHBondContact O-N 3.22Å; I432-T435 VanDerWaalsContact O-N 3.16Å; I432-T435 PolarHBondContact O-OG1 3.01Å; K433-T435 PolarHBondContact O-N 3.3Å
436	E	57	Low	81	Confident	215 Å²	215	81.8 Å²	81.8	100%	1.005	42%	0.418	S	S	*	.			trans	-79.3	0	168.8	-66.7	-174.2	165.2	0	0	110.9	K433	K433-E436 PolarHBondContact O-N 3.32Å

Retrieved 436 of 436 residues in 144.1 ms (Link to these results)

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