A0A087XKZ2_POEFO Loading...

Sorting nexin 22

AlphaFold DB , UniProt , Accession A0A087XKZ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 190 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	33.5	Very low	50.6	Low	239 Å²	239	127 Å²	127	100%	1.177	65%	0.654	S	S	*	*				0	95.6	0	-80.5	179.1	-71.8	0	0	106.5	L3	M1-L3 PolarHBondContact O-N 3.14Å
2	V	34.8	Very low	53.1	Low	141 Å²	141	116.5 Å²	116.5	86%	0.855	60%	0.6	S	S	*	*			trans	-77.6	110.8	173	-175.5	0	0	0	0	104	E4	V2-E4 VanDerWaalsContact C-N 3.32Å; V2-E4 PolarHBondContact O-N 3.01Å
3	L	40.5	Very low	55	Low	162 Å²	162	109.9 Å²	109.9	85%	0.848	57%	0.571	S	S	*	*			trans	-62.3	104.8	167.8	-84.4	154.5	0	0	0	104.9	M1 E5	M1-L3 PolarHBondContact O-N 3.14Å; L3-E5 PolarHBondContact O-N 2.85Å
4	E	39.6	Very low	56.8	Low	160 Å²	160	102.1 Å²	102.1	75%	0.748	53%	0.53	S	S	*	.			trans	-47.3	106.9	167.2	-89.5	172.7	134.4	0	0	107.3	V2 L6	V2-E4 VanDerWaalsContact C-N 3.32Å; V2-E4 PolarHBondContact O-N 3.01Å; E4-L6 HydrophobicContact CB-CD1 4.29Å; E4-L6 HydrophobicContact CB-CG 4.14Å; E4-L6 PolarHBondContact O-N 2.86Å
5	E	45.1	Very low	57.6	Low	186 Å²	186	99.6 Å²	99.6	87%	0.869	52%	0.523	S	S	*	.			trans	-66.4	60.9	160.1	-67.2	-158.9	124.4	0	0	108.5	L3 S7	L3-E5 PolarHBondContact O-N 2.85Å; E5-S7 PolarHBondContact O-N 2.89Å
6	L	42	Very low	58.2	Low	110 Å²	110	96.1 Å²	96.1	58%	0.576	51%	0.509	S	S	*	.			trans	-76.5	63.7	154.2	-70.3	171.4	0	0	0	106.1	E4 H8	E4-L6 HydrophobicContact CB-CD1 4.29Å; E4-L6 HydrophobicContact CB-CG 4.14Å; E4-L6 PolarHBondContact O-N 2.86Å; L6-H8 PolarHBondContact O-N 3.38Å
7	S	44.8	Very low	58.7	Low	99 Å²	99	92.8 Å²	92.8	69%	0.692	49%	0.491	S	S	*	.			trans	-62.5	89.7	162.4	59.1	0	0	0	0	105.7	E5 M9	E5-S7 PolarHBondContact O-N 2.89Å; S7-M9 PolarHBondContact O-N 3.25Å
8	H	53.2	Low	59	Low	71 Å²	71	92.6 Å²	92.6	33%	0.329	49%	0.487	S	S	.	.			trans	-48.5	120.4	156.4	-72.7	94.5	0	0	0	105.1	L6 I10 I95 Y96	L6-H8 PolarHBondContact O-N 3.38Å; H8-I10 CarbonylContact O-C 3.51Å; H8-I10 PolarHBondContact O-N 3.2Å; H8-I95 HydrophobicContact CB-CG2 4.28Å; H8-Y96 AromaticContact CE1-CD2 3.19Å; H8-Y96 WeakPolarHBondContact CE1-CD2 3.4Å; H8-Y96 AromaticContact CE1-CE2 3.5Å; H8-Y96 VanDerWaalsContact CE1-CE2 3.5Å; H8-Y96 WeakPolarHBondContact CE1-CE2 3.47Å; H8-Y96 AromaticContact CE1-CG 3.99Å; H8-Y96 AromaticContact ND1-CD2 3.61Å; H8-Y96 PolarHBondContact NE2-O 3.19Å
9	M	70.2	Confident	59	Low	108 Å²	108	97.5 Å²	97.5	53%	0.532	50%	0.498	S	S	.	.	S	Bend	trans	-55.7	-15.7	-170.4	-151.1	178.4	-163.9	0	0	112	S7 F37 N38 F114	S7-M9 PolarHBondContact O-N 3.25Å; M9-F37 HydrophobicContact CB-CD2 4.44Å; M9-F37 HydrophobicContact CB-CE2 4Å; M9-F37 HydrophobicContact CG-CD2 4.22Å; M9-F37 HydrophobicContact CG-CE2 3.55Å; M9-F37 HydrophobicContact CG-CZ 4.39Å; M9-F37 WeakPolarHBondContact O-CA 3.32Å; M9-F37 WeakPolarHBondContact O-CD2 3.5Å; M9-F37 HydrophobicContact SD-CE2 3.77Å; M9-F37 HydrophobicContact SD-CZ 4.13Å; M9-N38 WeakPolarHBondContact CE-ND2 3.28Å; M9-N38 WeakPolarHBondContact CE-OD1 3.49Å; M9-N38 WeakPolarHBondContact CG-OD1 3.49Å; M9-N38 PolarHBondContact O-N 2.8Å; M9-F114 HydrophobicContact CB-CZ 4.36Å
10	I	73.2	Confident	59.1	Low	7 Å²	7	97.4 Å²	97.4	4%	0.036	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.5	174	-35.3	-176	0	0	0	111.4	H8 V12 V35 L36 F37 I95 V101 L106 F114	H8-I10 CarbonylContact O-C 3.51Å; H8-I10 PolarHBondContact O-N 3.2Å; I10-V12 HydrophobicContact CG2-CG2 3.84Å; I10-V35 HydrophobicContact CG2-CG1 3.69Å; I10-L36 CarbonylContact C-O 3.55Å; I10-L36 WeakPolarHBondContact CA-O 3.31Å; I10-F37 HydrophobicContact CG1-CD2 4Å; I10-I95 HydrophobicContact CB-CD1 4.33Å; I10-I95 HydrophobicContact CB-CG2 4.15Å; I10-I95 HydrophobicContact CG2-CD1 4.15Å; I10-V101 HydrophobicContact CD1-CB 4.12Å; I10-V101 HydrophobicContact CD1-CG1 3.97Å; I10-V101 HydrophobicContact CD1-CG2 3.78Å; I10-L106 HydrophobicContact CD1-CD2 3.99Å; I10-F114 HydrophobicContact CB-CZ 4.49Å; I10-F114 HydrophobicContact CD1-CD2 4.11Å; I10-F114 HydrophobicContact CD1-CE1 4Å; I10-F114 HydrophobicContact CD1-CE2 3.13Å; I10-F114 HydrophobicContact CD1-CZ 3.12Å; I10-F114 HydrophobicContact CG1-CE1 4.13Å; I10-F114 HydrophobicContact CG1-CE2 3.28Å; I10-F114 HydrophobicContact CG1-CZ 3.02Å
11	E	80.2	Confident	58.6	Low	114 Å²	114	97.1 Å²	97.1	53%	0.533	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	137.2	158.8	176.4	-176.1	174.2	0	0	108.9	V35 L36	E11-V35 CarbonylContact O-C 3.6Å; E11-V35 WeakPolarHBondContact O-CA 3.44Å; E11-L36 HydrophobicContact CB-CB 4.16Å; E11-L36 HydrophobicContact CB-CD2 4.45Å; E11-L36 PolarHBondContact N-O 3.49Å; E11-L36 PolarHBondContact O-N 2.76Å; E11-L36 WeakPolarHBondContact OE2-CD2 3.42Å
12	V	79.9	Confident	59.7	Low	1 Å²	1	87.5 Å²	87.5	1%	0.006	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.6	178	178.7	0	0	0	0	109.1	I10 V33 E34 V35 I91 Q92 I95 L109	I10-V12 HydrophobicContact CG2-CG2 3.84Å; V12-V33 HydrophobicContact CG1-CG1 3.55Å; V12-E34 CarbonylContact C-O 3.6Å; V12-E34 WeakPolarHBondContact CA-O 3.39Å; V12-V35 HydrophobicContact CG1-CG2 4.49Å; V12-V35 HydrophobicContact CG2-CG1 4.14Å; V12-V35 HydrophobicContact CG2-CG2 4.25Å; V12-I91 HydrophobicContact CB-CG2 4.06Å; V12-I91 HydrophobicContact CG1-CG2 3.86Å; V12-I91 HydrophobicContact CG2-CG2 4.1Å; V12-Q92 WeakPolarHBondContact O-CG 3.28Å; V12-Q92 PolarHBondContact O-NE2 2.83Å; V12-I95 HydrophobicContact CB-CD1 4.13Å; V12-I95 HydrophobicContact CG2-CD1 3.32Å; V12-L109 HydrophobicContact CG2-CD1 3.95Å
13	S	77.7	Confident	60.9	Low	31 Å²	31	91 Å²	91	22%	0.217	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	155.3	172.8	57.2	0	0	0	0	111.2	P15 V33 E34 E88	S13-P15 VanDerWaalsContact C-CD 3.45Å; S13-P15 WeakPolarHBondContact O-CD 3.46Å; S13-V33 CarbonylContact O-C 3.53Å; S13-E34 PolarHBondContact N-O 3.3Å; S13-E34 PolarHBondContact O-N 3.14Å; S13-E88 WeakPolarHBondContact CA-OE1 3.43Å; S13-E88 VanDerWaalsContact CB-OE1 3.28Å; S13-E88 WeakPolarHBondContact CB-OE1 3.38Å
14	I	80.6	Confident	61.7	Low	0 Å²	0	88.1 Å²	88.1	0%	0	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	66.1	178.1	-50.8	-177.6	0	0	0	109.7	S16 F31 R32 V33 R84 L87 E88	I14-S16 PolarHBondContact O-N 3.05Å; I14-F31 HydrophobicContact CG2-CB 4.13Å; I14-F31 HydrophobicContact CG2-CD1 4.37Å; I14-R32 WeakPolarHBondContact CA-O 3.42Å; I14-R32 WeakPolarHBondContact CG2-O 3.47Å; I14-V33 HydrophobicContact CD1-CG2 4.31Å; I14-V33 HydrophobicContact CG1-CG1 4.37Å; I14-V33 HydrophobicContact CG1-CG2 4.22Å; I14-R84 HydrophobicContact CB-CG 4.11Å; I14-R84 HydrophobicContact CG2-CG 3.69Å; I14-R84 WeakPolarHBondContact O-CD 3.48Å; I14-R84 VanDerWaalsContact O-CZ 3.25Å; I14-R84 PolarHBondContact O-NE 3.06Å; I14-R84 PolarHBondContact O-NH1 3.45Å; I14-L87 HydrophobicContact CD1-CB 4.1Å; I14-E88 HydrophobicContact CB-CB 4.29Å; I14-E88 HydrophobicContact CD1-CB 3.94Å; I14-E88 HydrophobicContact CG1-CB 3.9Å; I14-E88 HydrophobicContact CG1-CG 4.36Å; I14-E88 PolarHBondContact N-OE1 2.88Å
15	P	69.1	Low	62.4	Low	65 Å²	65	83.2 Å²	83.2	42%	0.422	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	-21.8	-166.2	25.4	-36.6	0	0	0	115	S13 R32 E34	S13-P15 VanDerWaalsContact C-CD 3.45Å; S13-P15 WeakPolarHBondContact O-CD 3.46Å; P15-R32 WeakPolarHBondContact CD-O 3.34Å; P15-E34 HydrophobicContact CG-CB 4.28Å; P15-E34 VanDerWaalsContact CG-CD 3.45Å; P15-E34 HydrophobicContact CG-CG 3.59Å
16	S	67	Low	63.3	Low	44 Å²	44	81.3 Å²	81.3	31%	0.308	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	147.6	-177.5	58.3	0	0	0	0	114.6	I14 R32	I14-S16 PolarHBondContact O-N 3.05Å; S16-R32 WeakPolarHBondContact O-CB 3.44Å; S16-R32 PolarHBondContact O-N 3.14Å
17	L	67.1	Low	64.3	Low	39 Å²	39	80.7 Å²	80.7	20%	0.204	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	112.8	164.1	-178.5	86.3	0	0	0	108.6	L30 F31 L80	L17-L30 CarbonylContact C-O 3.57Å; L17-L30 WeakPolarHBondContact CD1-O 3.28Å; L17-F31 HydrophobicContact CD1-CD1 3.47Å; L17-F31 VanDerWaalsContact CD1-CD1 3.47Å; L17-F31 HydrophobicContact CD1-CD2 4.12Å; L17-F31 HydrophobicContact CD1-CE1 3.34Å; L17-F31 HydrophobicContact CD1-CE2 3.99Å; L17-F31 HydrophobicContact CD1-CG 3.87Å; L17-F31 HydrophobicContact CD1-CZ 3.61Å; L17-L80 HydrophobicContact CD2-CD2 3.31Å; L17-L80 HydrophobicContact CD2-CG 3.99Å
18	E	64	Low	65.4	Low	89 Å²	89	80.2 Å²	80.2	42%	0.416	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	136.2	177.5	-155.3	162.4	-167.7	0	0	110.5	L30 L45	E18-L30 HydrophobicContact CB-CB 4.5Å; E18-L30 PolarHBondContact N-O 3.31Å; E18-L30 PolarHBondContact O-N 3.2Å; E18-L45 HydrophobicContact CB-CD2 4.48Å; E18-L45 WeakPolarHBondContact OE2-CD2 3Å
19	R	59	Low	66.3	Low	186 Å²	186	82.4 Å²	82.4	70%	0.702	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	94	174.6	-74.3	-178.2	-84.2	-162.2	-6.5	107	K28	R19-K28 CarbonylContact C-O 3.56Å; R19-K28 WeakPolarHBondContact CA-O 3.45Å
20	E	60.1	Low	66.6	Low	96 Å²	96	77.9 Å²	77.9	45%	0.449	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	124	175.4	-163.2	176.4	-148.9	0	0	108.4	T27 K28 L30	E20-T27 CarbonylContact O-C 3.52Å; E20-K28 PolarHBondContact N-O 3.12Å; E20-K28 PolarHBondContact O-N 2.84Å; E20-L30 HydrophobicContact CB-CD1 3.89Å; E20-L30 WeakPolarHBondContact OE2-CD1 3.49Å
21	V	49.2	Very low	66.9	Low	91 Å²	91	77.7 Å²	77.7	55%	0.552	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	110.4	172.5	180	0	0	0	0	105.9	T27	V21-T27 HydrophobicContact CG2-CG2 3.84Å
22	D	56.7	Low	67	Low	37 Å²	37	75 Å²	75	20%	0.198	39%	0.39	C	S	.	.			trans	-57.2	155	171.6	-70.3	-48.1	0	0	0	110.1	S24 G25 K26 K28	D22-S24 PolarHBondContact O-N 3.05Å; D22-G25 PolarHBondContact O-N 3.34Å; D22-K26 PolarHBondContact N-O 3.36Å; D22-K28 WeakPolarHBondContact OD1-CD 3.37Å; D22-K28 WeakPolarHBondContact OD1-CE 3.42Å; D22-K28 IonicContact OD1-NZ 3.45Å; D22-K28 PolarHBondContact OD1-NZ 3.09Å; D22-K28 WeakPolarHBondContact OD2-CD 3.38Å; D22-K28 WeakPolarHBondContact OD2-CE 3.47Å; D22-K28 WeakPolarHBondContact OD2-CG 3.29Å; D22-K28 IonicContact OD2-NZ 3.76Å; D22-K28 PolarHBondContact OD2-NZ 3.32Å
23	E	58.8	Low	67.1	Low	216 Å²	216	74.9 Å²	74.9	100%	1.009	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-15	172.5	-62.8	-179.2	104.7	0	0	113.2
24	S	57.8	Low	67.4	Low	100 Å²	100	74.6 Å²	74.6	70%	0.699	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	6.9	172.3	-47.6	0	0	0	0	115	D22 K26	D22-S24 PolarHBondContact O-N 3.05Å; S24-K26 VanDerWaalsContact C-N 3.29Å; S24-K26 PolarHBondContact O-N 3.44Å
25	G	55.6	Low	67.5	Low	57 Å²	57	74.6 Å²	74.6	59%	0.588	39%	0.385	S	S	*	.	S	Bend	trans	74.8	8.7	-179.1	0	0	0	0	0	115.3	D22	D22-G25 PolarHBondContact O-N 3.34Å
26	K	63.1	Low	68.1	Low	146 Å²	146	74.5 Å²	74.5	64%	0.635	38%	0.38	S	S	*	.			trans	-89	122.9	179	-67.5	179.4	-176.5	171.9	0	109.7	D22 S24 K28	D22-K26 PolarHBondContact N-O 3.36Å; S24-K26 VanDerWaalsContact C-N 3.29Å; S24-K26 PolarHBondContact O-N 3.44Å; K26-K28 PolarHBondContact O-N 3.49Å
27	T	63	Low	68.5	Low	97 Å²	97	73.1 Å²	73.1	60%	0.595	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	104.8	175.4	44.6	0	0	0	0	110.3	E20 V21	E20-T27 CarbonylContact O-C 3.52Å; V21-T27 HydrophobicContact CG2-CG2 3.84Å
28	K	68.1	Low	68.4	Low	89 Å²	89	74.7 Å²	74.7	39%	0.387	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	135.4	166.3	-74.9	177.2	-179.4	147.9	0	109.3	R19 E20 D22 K26	R19-K28 CarbonylContact C-O 3.56Å; R19-K28 WeakPolarHBondContact CA-O 3.45Å; E20-K28 PolarHBondContact N-O 3.12Å; E20-K28 PolarHBondContact O-N 2.84Å; D22-K28 WeakPolarHBondContact OD1-CD 3.37Å; D22-K28 WeakPolarHBondContact OD1-CE 3.42Å; D22-K28 IonicContact OD1-NZ 3.45Å; D22-K28 PolarHBondContact OD1-NZ 3.09Å; D22-K28 WeakPolarHBondContact OD2-CD 3.38Å; D22-K28 WeakPolarHBondContact OD2-CE 3.47Å; D22-K28 WeakPolarHBondContact OD2-CG 3.29Å; D22-K28 IonicContact OD2-NZ 3.76Å; D22-K28 PolarHBondContact OD2-NZ 3.32Å; K26-K28 PolarHBondContact O-N 3.49Å
29	K	71.6	Confident	68.6	Low	117 Å²	117	79.6 Å²	79.6	51%	0.509	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.7	175.9	-61.1	-177.2	-177.7	-175.2	0	108.8	L80	K29-L80 HydrophobicContact CD-CD2 4.42Å
30	L	77.7	Confident	69.2	Low	13 Å²	13	78.8 Å²	78.8	7%	0.068	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	143.3	178.3	-63.1	179	0	0	0	109.9	L17 E18 E20 L45 R47	L17-L30 CarbonylContact C-O 3.57Å; L17-L30 WeakPolarHBondContact CD1-O 3.28Å; E18-L30 HydrophobicContact CB-CB 4.5Å; E18-L30 PolarHBondContact N-O 3.31Å; E18-L30 PolarHBondContact O-N 3.2Å; E20-L30 HydrophobicContact CB-CD1 3.89Å; E20-L30 WeakPolarHBondContact OE2-CD1 3.49Å; L30-L45 HydrophobicContact CB-CB 4.48Å; L30-L45 HydrophobicContact CD1-CB 4.16Å; L30-L45 HydrophobicContact CD1-CD1 4.33Å; L30-R47 HydrophobicContact CD2-CB 4.32Å; L30-R47 HydrophobicContact CD2-CG 3.23Å
31	F	78.9	Confident	70.2	Confident	4 Å²	4	80.6 Å²	80.6	2%	0.018	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.8	171.8	-64	-91.9	0	0	0	107.6	I14 L17 V33 L45 R46 N48 F51 R84 L87	I14-F31 HydrophobicContact CG2-CB 4.13Å; I14-F31 HydrophobicContact CG2-CD1 4.37Å; L17-F31 HydrophobicContact CD1-CD1 3.47Å; L17-F31 VanDerWaalsContact CD1-CD1 3.47Å; L17-F31 HydrophobicContact CD1-CD2 4.12Å; L17-F31 HydrophobicContact CD1-CE1 3.34Å; L17-F31 HydrophobicContact CD1-CE2 3.99Å; L17-F31 HydrophobicContact CD1-CG 3.87Å; L17-F31 HydrophobicContact CD1-CZ 3.61Å; F31-V33 PolarHBondContact O-N 2.74Å; F31-L45 WeakPolarHBondContact O-CA 3.42Å; F31-R46 PolarHBondContact N-O 2.98Å; F31-R46 PolarHBondContact O-N 3.35Å; F31-N48 HydrophobicContact CE2-CB 4.15Å; F31-F51 HydrophobicContact CB-CE2 3.91Å; F31-F51 HydrophobicContact CB-CZ 3.99Å; F31-F51 AromaticContact CD2-CE2 3.87Å; F31-F51 HydrophobicContact CD2-CE2 3.87Å; F31-F51 HydrophobicContact CG-CE2 4.11Å; F31-F51 HydrophobicContact CG-CZ 4.48Å; F31-R84 HydrophobicContact CD1-CG 4.32Å; F31-R84 HydrophobicContact CE1-CB 4.36Å; F31-L87 HydrophobicContact CE1-CD1 4.32Å; F31-L87 HydrophobicContact CZ-CD1 4.29Å
32	R	82.2	Confident	71.7	Confident	56 Å²	56	78.5 Å²	78.5	21%	0.211	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	103.6	173.4	-176	168.9	174.3	-84.1	-7.7	108.1	I14 P15 S16 E34 L45	I14-R32 WeakPolarHBondContact CA-O 3.42Å; I14-R32 WeakPolarHBondContact CG2-O 3.47Å; P15-R32 WeakPolarHBondContact CD-O 3.34Å; S16-R32 WeakPolarHBondContact O-CB 3.44Å; S16-R32 PolarHBondContact O-N 3.14Å; R32-E34 IonicContact CZ-OE1 3.14Å; R32-E34 IonicContact NH1-OE1 3.31Å; R32-E34 PolarHBondContact NH1-OE1 2.83Å; R32-E34 IonicContact NH2-OE1 3.16Å; R32-E34 PolarHBondContact NH2-OE1 3.36Å; R32-L45 HydrophobicContact CB-CD2 3.82Å; R32-L45 HydrophobicContact CG-CD2 4.04Å
33	V	82.9	Confident	72.9	Confident	0 Å²	0	83.9 Å²	83.9	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	112.6	177.1	-173.7	0	0	0	0	107.2	V12 S13 I14 F31 V35 Y43 V44 F51 L109	V12-V33 HydrophobicContact CG1-CG1 3.55Å; S13-V33 CarbonylContact O-C 3.53Å; I14-V33 HydrophobicContact CD1-CG2 4.31Å; I14-V33 HydrophobicContact CG1-CG1 4.37Å; I14-V33 HydrophobicContact CG1-CG2 4.22Å; F31-V33 PolarHBondContact O-N 2.74Å; V33-V35 HydrophobicContact CG1-CG2 4.04Å; V33-Y43 CarbonylContact O-C 3.57Å; V33-Y43 VanDerWaalsContact O-CA 3.28Å; V33-Y43 WeakPolarHBondContact O-CA 3.3Å; V33-V44 PolarHBondContact N-O 3.3Å; V33-V44 PolarHBondContact O-N 3.47Å; V33-F51 HydrophobicContact CG2-CE1 4.09Å; V33-F51 HydrophobicContact CG2-CZ 3.61Å; V33-L109 HydrophobicContact CG1-CD2 3.92Å
34	E	83.5	Confident	74	Confident	24 Å²	24	74 Å²	74	11%	0.112	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	135.4	168.8	-70.8	-167.2	159.7	0	0	109.7	V12 S13 P15 R32 K41 H42	V12-E34 CarbonylContact C-O 3.6Å; V12-E34 WeakPolarHBondContact CA-O 3.39Å; S13-E34 PolarHBondContact N-O 3.3Å; S13-E34 PolarHBondContact O-N 3.14Å; P15-E34 HydrophobicContact CG-CB 4.28Å; P15-E34 VanDerWaalsContact CG-CD 3.45Å; P15-E34 HydrophobicContact CG-CG 3.59Å; R32-E34 IonicContact CZ-OE1 3.14Å; R32-E34 IonicContact NH1-OE1 3.31Å; R32-E34 PolarHBondContact NH1-OE1 2.83Å; R32-E34 IonicContact NH2-OE1 3.16Å; R32-E34 PolarHBondContact NH2-OE1 3.36Å; E34-K41 VanDerWaalsContact CD-NZ 3.28Å; E34-K41 VanDerWaalsContact OE1-CE 3.32Å; E34-K41 WeakPolarHBondContact OE1-CE 3.28Å; E34-K41 IonicContact OE1-NZ 2.88Å; E34-K41 PolarHBondContact OE1-NZ 3.34Å; E34-K41 WeakPolarHBondContact OE2-CE 3.26Å; E34-K41 IonicContact OE2-NZ 3.23Å; E34-K41 PolarHBondContact OE2-NZ 2.99Å; E34-H42 WeakPolarHBondContact CA-O 2.83Å
35	V	82.5	Confident	75.1	Confident	0 Å²	0	72 Å²	72	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.2	-178.3	-176.2	0	0	0	0	107	I10 E11 V12 V33 K41 H42 L109 V111	I10-V35 HydrophobicContact CG2-CG1 3.69Å; E11-V35 CarbonylContact O-C 3.6Å; E11-V35 WeakPolarHBondContact O-CA 3.44Å; V12-V35 HydrophobicContact CG1-CG2 4.49Å; V12-V35 HydrophobicContact CG2-CG1 4.14Å; V12-V35 HydrophobicContact CG2-CG2 4.25Å; V33-V35 HydrophobicContact CG1-CG2 4.04Å; V35-K41 WeakPolarHBondContact O-CA 3.46Å; V35-H42 WeakPolarHBondContact CB-CE1 3.48Å; V35-H42 WeakPolarHBondContact CB-NE2 3.5Å; V35-H42 WeakPolarHBondContact CG1-CE1 3.42Å; V35-H42 PolarHBondContact N-O 2.8Å; V35-H42 PolarHBondContact O-N 3.31Å; V35-H42 PolarHBondContact O-ND1 2.99Å; V35-H42 VanDerWaalsContact O-ND1 3.11Å; V35-L109 HydrophobicContact CG1-CD1 4.31Å; V35-L109 HydrophobicContact CG2-CB 4.11Å; V35-L109 HydrophobicContact CG2-CD1 4.3Å; V35-L109 HydrophobicContact CG2-CD2 3.66Å; V35-L109 HydrophobicContact CG2-CG 4.2Å; V35-V111 HydrophobicContact CG1-CG2 3.95Å
36	L	80.7	Confident	76.4	Confident	63 Å²	63	70.9 Å²	70.9	33%	0.33	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.6	174.2	-177.7	72.4	0	0	0	107.3	I10 E11 R40 K41	I10-L36 CarbonylContact C-O 3.55Å; I10-L36 WeakPolarHBondContact CA-O 3.31Å; E11-L36 HydrophobicContact CB-CB 4.16Å; E11-L36 HydrophobicContact CB-CD2 4.45Å; E11-L36 PolarHBondContact N-O 3.49Å; E11-L36 PolarHBondContact O-N 2.76Å; E11-L36 WeakPolarHBondContact OE2-CD2 3.42Å; L36-R40 WeakPolarHBondContact CA-O 3.25Å; L36-K41 HydrophobicContact CD1-CB 4.03Å
37	F	75.3	Confident	77.3	Confident	15 Å²	15	69.6 Å²	69.6	7%	0.066	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	118	178.8	174.3	-116.2	0	0	0	109.3	M9 I10 E39 R40 V111 H113 F114	M9-F37 HydrophobicContact CB-CD2 4.44Å; M9-F37 HydrophobicContact CB-CE2 4Å; M9-F37 HydrophobicContact CG-CD2 4.22Å; M9-F37 HydrophobicContact CG-CE2 3.55Å; M9-F37 HydrophobicContact CG-CZ 4.39Å; M9-F37 WeakPolarHBondContact O-CA 3.32Å; M9-F37 WeakPolarHBondContact O-CD2 3.5Å; M9-F37 HydrophobicContact SD-CE2 3.77Å; M9-F37 HydrophobicContact SD-CZ 4.13Å; I10-F37 HydrophobicContact CG1-CD2 4Å; F37-E39 VanDerWaalsContact C-N 3.34Å; F37-E39 PolarHBondContact O-N 3.35Å; F37-R40 PolarHBondContact N-O 2.9Å; F37-R40 WeakPolarHBondContact O-CA 3.01Å; F37-R40 VanDerWaalsContact O-CB 3.26Å; F37-R40 WeakPolarHBondContact O-CB 3.35Å; F37-R40 PolarHBondContact O-N 3.05Å; F37-V111 HydrophobicContact CB-CG1 4.35Å; F37-V111 HydrophobicContact CD1-CG1 3.81Å; F37-V111 HydrophobicContact CE1-CG1 4.27Å; F37-V111 HydrophobicContact CG-CG1 4.04Å; F37-H113 HydrophobicContact CE1-CB 4.34Å; F37-F114 HydrophobicContact CD1-CE2 4.27Å; F37-F114 HydrophobicContact CD2-CD2 4.05Å; F37-F114 AromaticContact CD2-CE2 3.09Å; F37-F114 HydrophobicContact CD2-CE2 3.09Å; F37-F114 AromaticContact CD2-CZ 3.42Å; F37-F114 HydrophobicContact CD2-CZ 3.42Å; F37-F114 VanDerWaalsContact CD2-CZ 3.42Å; F37-F114 HydrophobicContact CE1-CD2 4.16Å; F37-F114 HydrophobicContact CE1-CE2 4.1Å; F37-F114 HydrophobicContact CE2-CD1 4.49Å; F37-F114 AromaticContact CE2-CD2 3.68Å; F37-F114 HydrophobicContact CE2-CD2 3.68Å; F37-F114 AromaticContact CE2-CE1 3.84Å; F37-F114 HydrophobicContact CE2-CE1 3.84Å; F37-F114 AromaticContact CE2-CE2 2.92Å; F37-F114 HydrophobicContact CE2-CE2 2.92Å; F37-F114 HydrophobicContact CE2-CG 4.4Å; F37-F114 AromaticContact CE2-CZ 2.95Å; F37-F114 HydrophobicContact CE2-CZ 2.95Å; F37-F114 HydrophobicContact CG-CD2 4.47Å; F37-F114 AromaticContact CG-CE2 3.79Å; F37-F114 HydrophobicContact CG-CE2 3.79Å; F37-F114 HydrophobicContact CG-CZ 4.5Å; F37-F114 AromaticContact CZ-CD2 3.68Å; F37-F114 HydrophobicContact CZ-CD2 3.68Å; F37-F114 HydrophobicContact CZ-CE1 4.32Å; F37-F114 AromaticContact CZ-CE2 3.44Å; F37-F114 HydrophobicContact CZ-CE2 3.44Å; F37-F114 VanDerWaalsContact CZ-CE2 3.44Å; F37-F114 HydrophobicContact CZ-CG 4.25Å; F37-F114 AromaticContact CZ-CZ 3.72Å; F37-F114 HydrophobicContact CZ-CZ 3.72Å
38	N	65.5	Low	77.9	Confident	73 Å²	73	65.9 Å²	65.9	39%	0.39	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.4	55.9	-178.8	-68	-38.2	0	0	0	113.1	M9 R40	M9-N38 WeakPolarHBondContact CE-ND2 3.28Å; M9-N38 WeakPolarHBondContact CE-OD1 3.49Å; M9-N38 WeakPolarHBondContact CG-OD1 3.49Å; M9-N38 PolarHBondContact O-N 2.8Å; N38-R40 PolarHBondContact O-N 2.97Å
39	E	69.3	Low	78.4	Confident	192 Å²	192	64.5 Å²	64.5	90%	0.897	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	-1.3	-177.7	-48.1	-177.7	118.7	0	0	115.4	F37	F37-E39 VanDerWaalsContact C-N 3.34Å; F37-E39 PolarHBondContact O-N 3.35Å
40	R	70.6	Confident	79	Confident	168 Å²	168	60.8 Å²	60.8	63%	0.634	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	112.7	172.3	-59.7	-176.2	178.6	-162.1	0	110.1	L36 F37 N38	L36-R40 WeakPolarHBondContact CA-O 3.25Å; F37-R40 PolarHBondContact N-O 2.9Å; F37-R40 WeakPolarHBondContact O-CA 3.01Å; F37-R40 VanDerWaalsContact O-CB 3.26Å; F37-R40 WeakPolarHBondContact O-CB 3.35Å; F37-R40 PolarHBondContact O-N 3.05Å; N38-R40 PolarHBondContact O-N 2.97Å
41	K	81.9	Confident	79.1	Confident	134 Å²	134	60.3 Å²	60.3	58%	0.583	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.3	173	-172.8	173.4	179.9	168.4	0	110.6	E34 V35 L36	E34-K41 VanDerWaalsContact CD-NZ 3.28Å; E34-K41 VanDerWaalsContact OE1-CE 3.32Å; E34-K41 WeakPolarHBondContact OE1-CE 3.28Å; E34-K41 IonicContact OE1-NZ 2.88Å; E34-K41 PolarHBondContact OE1-NZ 3.34Å; E34-K41 WeakPolarHBondContact OE2-CE 3.26Å; E34-K41 IonicContact OE2-NZ 3.23Å; E34-K41 PolarHBondContact OE2-NZ 2.99Å; V35-K41 WeakPolarHBondContact O-CA 3.46Å; L36-K41 HydrophobicContact CD1-CB 4.03Å
42	H	81.2	Confident	79	Confident	47 Å²	47	61.6 Å²	61.6	22%	0.218	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	162.7	169.5	58.3	-71.6	0	0	0	110.6	E34 V35 L109 V111	E34-H42 WeakPolarHBondContact CA-O 2.83Å; V35-H42 WeakPolarHBondContact CB-CE1 3.48Å; V35-H42 WeakPolarHBondContact CB-NE2 3.5Å; V35-H42 WeakPolarHBondContact CG1-CE1 3.42Å; V35-H42 PolarHBondContact N-O 2.8Å; V35-H42 PolarHBondContact O-N 3.31Å; V35-H42 PolarHBondContact O-ND1 2.99Å; V35-H42 VanDerWaalsContact O-ND1 3.11Å; H42-L109 PolarHBondContact CD2-O 2.77Å; H42-L109 VanDerWaalsContact CD2-O 3.29Å; H42-L109 PolarHBondContact NE2-O 2.82Å; H42-V111 VanDerWaalsContact NE2-CG2 3.27Å; H42-V111 WeakPolarHBondContact NE2-CG2 3.43Å
43	Y	80.4	Confident	79.1	Confident	150 Å²	150	61.8 Å²	61.8	59%	0.588	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.8	176.5	63.5	-88.9	0	0	0	110.4	V33	V33-Y43 CarbonylContact O-C 3.57Å; V33-Y43 VanDerWaalsContact O-CA 3.28Å; V33-Y43 WeakPolarHBondContact O-CA 3.3Å
44	V	81.6	Confident	79	Confident	9 Å²	9	62.1 Å²	62.1	6%	0.055	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.2	176.9	-169.2	0	0	0	0	109.1	V33 R46 L109 H110	V33-V44 PolarHBondContact N-O 3.3Å; V33-V44 PolarHBondContact O-N 3.47Å; V44-R46 HydrophobicContact CB-CG 4.49Å; V44-R46 HydrophobicContact CG1-CG 3.87Å; V44-L109 VanDerWaalsContact CG2-O 3.25Å; V44-L109 WeakPolarHBondContact CG2-O 3.09Å; V44-H110 HydrophobicContact CG2-CB 4.29Å
45	L	81.9	Confident	78.9	Confident	59 Å²	59	62.2 Å²	62.2	31%	0.309	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	121.3	173.9	-60.7	176.6	0	0	0	109.4	E18 L30 F31 R32	E18-L45 HydrophobicContact CB-CD2 4.48Å; E18-L45 WeakPolarHBondContact OE2-CD2 3Å; L30-L45 HydrophobicContact CB-CB 4.48Å; L30-L45 HydrophobicContact CD1-CB 4.16Å; L30-L45 HydrophobicContact CD1-CD1 4.33Å; F31-L45 WeakPolarHBondContact O-CA 3.42Å; R32-L45 HydrophobicContact CB-CD2 3.82Å; R32-L45 HydrophobicContact CG-CD2 4.04Å
46	R	82.6	Confident	78.8	Confident	32 Å²	32	67.8 Å²	67.8	12%	0.121	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.7	-175.5	-67.5	-65.8	-170.5	-163.5	-8.3	112.1	F31 V44 E50 F51 F108 H110	F31-R46 PolarHBondContact N-O 2.98Å; F31-R46 PolarHBondContact O-N 3.35Å; V44-R46 HydrophobicContact CB-CG 4.49Å; V44-R46 HydrophobicContact CG1-CG 3.87Å; R46-E50 WeakPolarHBondContact CD-OE2 3.31Å; R46-E50 IonicContact CZ-OE2 3.73Å; R46-E50 IonicContact NE-OE2 2.71Å; R46-E50 IonicContact NH1-OE2 2.88Å; R46-E50 PolarHBondContact NH1-OE2 2.97Å; R46-F51 HydrophobicContact CB-CD2 4.28Å; R46-F51 HydrophobicContact CB-CE2 3.5Å; R46-F51 VanDerWaalsContact CB-CE2 3.5Å; R46-F51 HydrophobicContact CB-CZ 3.75Å; R46-F108 HydrophobicContact CB-CE1 4.48Å; R46-F108 HydrophobicContact CB-CE2 4.14Å; R46-F108 HydrophobicContact CB-CZ 3.68Å; R46-F108 VanDerWaalsContact CD-CE2 3.47Å; R46-F108 HydrophobicContact CG-CE1 3.87Å; R46-F108 HydrophobicContact CG-CE2 3.75Å; R46-F108 HydrophobicContact CG-CZ 3.39Å; R46-F108 PolarHBondContact NE-O 2.92Å; R46-F108 PolarHBondContact NH2-O 2.99Å; R46-H110 PolarHBondContact NH2-CD2 3.08Å; R46-H110 VanDerWaalsContact NH2-CD2 3.28Å; R46-H110 PolarHBondContact NH2-CE1 2.77Å; R46-H110 PolarHBondContact NH2-NE2 2.8Å
47	R	81.4	Confident	78.8	Confident	119 Å²	119	69.4 Å²	69.4	45%	0.449	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	152.8	171.9	-69.8	176.4	-66.9	176.3	-3.7	111	L30 S49 E50 F51	L30-R47 HydrophobicContact CD2-CB 4.32Å; L30-R47 HydrophobicContact CD2-CG 3.23Å; R47-S49 PolarHBondContact O-N 3.24Å; R47-S49 VanDerWaalsContact O-N 3.09Å; R47-E50 HydrophobicContact CB-CG 4.21Å; R47-E50 IonicContact CZ-OE1 2.66Å; R47-E50 IonicContact NE-OE1 2.65Å; R47-E50 PolarHBondContact NE-OE1 3.35Å; R47-E50 IonicContact NH2-OE1 2.7Å; R47-E50 PolarHBondContact NH2-OE1 2.93Å; R47-E50 VanDerWaalsContact NH2-OE1 3.16Å; R47-E50 WeakPolarHBondContact O-CB 3.17Å; R47-E50 PolarHBondContact O-N 2.96Å; R47-F51 VanDerWaalsContact O-CD2 3.25Å; R47-F51 WeakPolarHBondContact O-CD2 3.49Å; R47-F51 PolarHBondContact O-N 3.42Å
48	N	75.7	Confident	79	Confident	20 Å²	20	68.7 Å²	68.7	11%	0.107	31%	0.31	C	S	.	.	H	α-helix	trans	-54.6	-33.2	176.5	-159.9	-90.9	0	0	0	113.9	F31 E50 Q52 R83	F31-N48 HydrophobicContact CE2-CB 4.15Å; N48-E50 VanDerWaalsContact C-N 3.29Å; N48-E50 PolarHBondContact O-N 3.32Å; N48-Q52 PolarHBondContact O-N 3.28Å; N48-Q52 PolarHBondContact OD1-NE2 3.5Å; N48-R83 PolarHBondContact ND2-NH2 2.72Å; N48-R83 PolarHBondContact OD1-NH2 3.41Å
49	S	78.6	Confident	79.6	Confident	60 Å²	60	72.2 Å²	72.2	42%	0.42	32%	0.321	S	S	.	.	H	α-helix	trans	-65.8	-32.4	175.8	48.6	0	0	0	0	112.8	R47 Q52 T53	R47-S49 PolarHBondContact O-N 3.24Å; R47-S49 VanDerWaalsContact O-N 3.09Å; S49-Q52 PolarHBondContact O-N 2.88Å; S49-T53 PolarHBondContact O-N 3.09Å; S49-T53 VanDerWaalsContact O-N 3.09Å; S49-T53 PolarHBondContact O-OG1 3.49Å
50	E	83.9	Confident	79.9	Confident	39 Å²	39	71.8 Å²	71.8	18%	0.182	32%	0.317	C	S	.	.	H	α-helix	trans	-71.4	-41.7	-179.6	-61.6	174.1	-143.1	0	0	110.1	R46 R47 N48 Q52 T53 L54 F108	R46-E50 WeakPolarHBondContact CD-OE2 3.31Å; R46-E50 IonicContact CZ-OE2 3.73Å; R46-E50 IonicContact NE-OE2 2.71Å; R46-E50 IonicContact NH1-OE2 2.88Å; R46-E50 PolarHBondContact NH1-OE2 2.97Å; R47-E50 HydrophobicContact CB-CG 4.21Å; R47-E50 IonicContact CZ-OE1 2.66Å; R47-E50 IonicContact NE-OE1 2.65Å; R47-E50 PolarHBondContact NE-OE1 3.35Å; R47-E50 IonicContact NH2-OE1 2.7Å; R47-E50 PolarHBondContact NH2-OE1 2.93Å; R47-E50 VanDerWaalsContact NH2-OE1 3.16Å; R47-E50 WeakPolarHBondContact O-CB 3.17Å; R47-E50 PolarHBondContact O-N 2.96Å; N48-E50 VanDerWaalsContact C-N 3.29Å; N48-E50 PolarHBondContact O-N 3.32Å; E50-Q52 VanDerWaalsContact C-N 3.29Å; E50-Q52 PolarHBondContact O-N 3.41Å; E50-T53 PolarHBondContact O-N 2.86Å; E50-T53 VanDerWaalsContact O-N 3.12Å; E50-L54 WeakPolarHBondContact O-CB 3.27Å; E50-L54 PolarHBondContact O-N 3.33Å; E50-F108 HydrophobicContact CB-CE2 3.78Å
51	F	80.2	Confident	79.9	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.009	31%	0.31	C	S	.	.	H	α-helix	trans	-57.8	-39.6	171	-66.8	-87.8	0	0	0	112.5	F31 V33 R46 R47 T53 L54 H55 F67 L87 I91 F108	F31-F51 HydrophobicContact CB-CE2 3.91Å; F31-F51 HydrophobicContact CB-CZ 3.99Å; F31-F51 AromaticContact CD2-CE2 3.87Å; F31-F51 HydrophobicContact CD2-CE2 3.87Å; F31-F51 HydrophobicContact CG-CE2 4.11Å; F31-F51 HydrophobicContact CG-CZ 4.48Å; V33-F51 HydrophobicContact CG2-CE1 4.09Å; V33-F51 HydrophobicContact CG2-CZ 3.61Å; R46-F51 HydrophobicContact CB-CD2 4.28Å; R46-F51 HydrophobicContact CB-CE2 3.5Å; R46-F51 VanDerWaalsContact CB-CE2 3.5Å; R46-F51 HydrophobicContact CB-CZ 3.75Å; R47-F51 VanDerWaalsContact O-CD2 3.25Å; R47-F51 WeakPolarHBondContact O-CD2 3.49Å; R47-F51 PolarHBondContact O-N 3.42Å; F51-T53 VanDerWaalsContact C-N 3.35Å; F51-T53 PolarHBondContact O-N 3.06Å; F51-L54 PolarHBondContact O-N 3.47Å; F51-H55 WeakPolarHBondContact O-CB 3.47Å; F51-H55 PolarHBondContact O-N 3.16Å; F51-F67 HydrophobicContact CB-CE2 4.14Å; F51-F67 HydrophobicContact CB-CZ 3.88Å; F51-F67 WeakPolarHBondContact O-CE2 3.19Å; F51-L87 HydrophobicContact CB-CD2 4.32Å; F51-L87 HydrophobicContact CD1-CD2 4.3Å; F51-L87 HydrophobicContact CG-CD2 4.36Å; F51-I91 HydrophobicContact CD1-CD1 3.97Å; F51-I91 HydrophobicContact CE1-CD1 3.61Å; F51-F108 AromaticContact CD1-CE1 4Å; F51-F108 HydrophobicContact CD1-CE1 4Å; F51-F108 AromaticContact CD1-CZ 3.57Å; F51-F108 HydrophobicContact CD1-CZ 3.57Å; F51-F108 HydrophobicContact CD2-CZ 4.18Å; F51-F108 AromaticContact CE1-CE1 3.77Å; F51-F108 HydrophobicContact CE1-CE1 3.77Å; F51-F108 AromaticContact CE1-CZ 3.58Å; F51-F108 HydrophobicContact CE1-CZ 3.58Å; F51-F108 HydrophobicContact CE2-CZ 4.18Å; F51-F108 AromaticContact CG-CZ 3.89Å; F51-F108 HydrophobicContact CG-CZ 3.89Å; F51-F108 HydrophobicContact CZ-CE1 4.32Å; F51-F108 AromaticContact CZ-CZ 3.9Å; F51-F108 HydrophobicContact CZ-CZ 3.9Å
52	Q	77.1	Confident	79.3	Confident	31 Å²	31	63.4 Å²	63.4	15%	0.145	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-38.4	176.2	-73.7	-179.1	27.9	0	0	112.7	N48 S49 E50 R56 F67 S69	N48-Q52 PolarHBondContact O-N 3.28Å; N48-Q52 PolarHBondContact OD1-NE2 3.5Å; S49-Q52 PolarHBondContact O-N 2.88Å; E50-Q52 VanDerWaalsContact C-N 3.29Å; E50-Q52 PolarHBondContact O-N 3.41Å; Q52-R56 WeakPolarHBondContact O-CG 3.13Å; Q52-R56 PolarHBondContact O-N 2.83Å; Q52-F67 HydrophobicContact CB-CE1 4.43Å; Q52-F67 HydrophobicContact CB-CZ 4.49Å; Q52-F67 HydrophobicContact CG-CE1 3.6Å; Q52-F67 HydrophobicContact CG-CZ 3.94Å; Q52-S69 PolarHBondContact NE2-OG 2.87Å
53	T	83.4	Confident	78.3	Confident	61 Å²	61	70.7 Å²	70.7	37%	0.374	32%	0.323	S	S	.	.	H	α-helix	trans	-70.6	-40.8	177.8	-61.7	0	0	0	0	110.9	S49 E50 F51 R56 K57	S49-T53 PolarHBondContact O-N 3.09Å; S49-T53 VanDerWaalsContact O-N 3.09Å; S49-T53 PolarHBondContact O-OG1 3.49Å; E50-T53 PolarHBondContact O-N 2.86Å; E50-T53 VanDerWaalsContact O-N 3.12Å; F51-T53 VanDerWaalsContact C-N 3.35Å; F51-T53 PolarHBondContact O-N 3.06Å; T53-R56 PolarHBondContact O-N 3.3Å; T53-R56 PolarHBondContact OG1-NH2 2.88Å; T53-K57 WeakPolarHBondContact O-CG 3.35Å; T53-K57 PolarHBondContact O-N 2.71Å
54	L	82.6	Confident	77.5	Confident	7 Å²	7	64.5 Å²	64.5	4%	0.037	30%	0.301	C	S	.	.	H	α-helix	trans	-55.3	-51.9	170.5	172.8	67.6	0	0	0	110.8	E50 F51 R56 K57 L58 V104 L105 F108	E50-L54 WeakPolarHBondContact O-CB 3.27Å; E50-L54 PolarHBondContact O-N 3.33Å; F51-L54 PolarHBondContact O-N 3.47Å; L54-R56 PolarHBondContact O-N 3.11Å; L54-K57 CarbonylContact O-C 3.56Å; L54-K57 WeakPolarHBondContact O-CB 3.25Å; L54-K57 PolarHBondContact O-N 2.81Å; L54-L58 HydrophobicContact CD1-CD1 3.81Å; L54-L58 HydrophobicContact CD1-CD2 4.48Å; L54-L58 HydrophobicContact CD1-CG 3.9Å; L54-L58 HydrophobicContact CD2-CD1 4.29Å; L54-L58 HydrophobicContact CG-CD1 3.72Å; L54-L58 HydrophobicContact CG-CG 4.2Å; L54-L58 WeakPolarHBondContact O-CG 3.23Å; L54-L58 PolarHBondContact O-N 2.84Å; L54-V104 HydrophobicContact CD1-CG1 3.86Å; L54-L105 HydrophobicContact CD1-CB 4.4Å; L54-L105 HydrophobicContact CD1-CD1 4.3Å; L54-L105 HydrophobicContact CD2-CD1 3.81Å; L54-F108 HydrophobicContact CB-CD2 4.07Å; L54-F108 HydrophobicContact CB-CE2 4.36Å; L54-F108 HydrophobicContact CB-CG 4.37Å; L54-F108 HydrophobicContact CD1-CB 3.81Å; L54-F108 HydrophobicContact CD1-CG 4.17Å; L54-F108 HydrophobicContact CD2-CB 4.16Å; L54-F108 HydrophobicContact CD2-CD1 3.54Å; L54-F108 HydrophobicContact CD2-CD2 4.04Å; L54-F108 HydrophobicContact CD2-CE1 3.82Å; L54-F108 HydrophobicContact CD2-CE2 4.28Å; L54-F108 HydrophobicContact CD2-CG 3.64Å; L54-F108 HydrophobicContact CD2-CZ 4.17Å; L54-F108 HydrophobicContact CG-CB 4.43Å; L54-F108 HydrophobicContact CG-CD2 4.46Å; L54-F108 HydrophobicContact CG-CG 4.26Å
55	H	79.8	Confident	76.5	Confident	26 Å²	26	66.3 Å²	66.3	12%	0.12	31%	0.313	C	S	.	.	H	α-helix	trans	-57.3	-45.4	178.1	172.8	61.7	0	0	0	112.9	F51 K57 L58 K59 T64 F67 Y90	F51-H55 WeakPolarHBondContact O-CB 3.47Å; F51-H55 PolarHBondContact O-N 3.16Å; H55-K57 PolarHBondContact O-N 2.71Å; H55-L58 PolarHBondContact O-N 3.48Å; H55-K59 VanDerWaalsContact O-CB 3.31Å; H55-K59 WeakPolarHBondContact O-CB 2.91Å; H55-K59 PolarHBondContact O-N 2.81Å; H55-T64 PolarHBondContact CE1-OG1 2.99Å; H55-F67 HydrophobicContact CB-CB 4.29Å; H55-F67 HydrophobicContact CB-CD1 4.47Å; H55-F67 HydrophobicContact CB-CD2 3.32Å; H55-F67 HydrophobicContact CB-CE2 3.64Å; H55-F67 HydrophobicContact CB-CG 3.78Å; H55-F67 HydrophobicContact CB-CZ 4.37Å; H55-F67 WeakPolarHBondContact CD2-CB 3.4Å; H55-F67 AromaticContact CD2-CG 3.65Å; H55-F67 VanDerWaalsContact CE1-CB 3.43Å; H55-F67 WeakPolarHBondContact CE1-CB 3.46Å; H55-F67 VanDerWaalsContact CG-CB 3.44Å; H55-F67 AromaticContact CG-CD2 3.46Å; H55-F67 VanDerWaalsContact CG-CD2 3.46Å; H55-F67 AromaticContact CG-CG 3.48Å; H55-F67 VanDerWaalsContact CG-CG 3.48Å; H55-F67 WeakPolarHBondContact ND1-CB 3.19Å; H55-F67 AromaticContact ND1-CD2 3.87Å; H55-F67 AromaticContact ND1-CG 3.95Å; H55-F67 WeakPolarHBondContact NE2-CB 3.38Å; H55-Y90 AromaticContact ND1-CZ 3.65Å; H55-Y90 PolarHBondContact ND1-OH 2.89Å
56	R	81	Confident	75.6	Confident	116 Å²	116	70 Å²	70	44%	0.438	33%	0.334	S	S	.	.	H	α-helix	trans	-60	-35.1	176.7	-80.2	-174	-75.9	-108.2	-2.8	112.7	Q52 T53 L54 K60	Q52-R56 WeakPolarHBondContact O-CG 3.13Å; Q52-R56 PolarHBondContact O-N 2.83Å; T53-R56 PolarHBondContact O-N 3.3Å; T53-R56 PolarHBondContact OG1-NH2 2.88Å; L54-R56 PolarHBondContact O-N 3.11Å; R56-K60 WeakPolarHBondContact O-CG 3.22Å
57	K	80.7	Confident	74.8	Confident	98 Å²	98	69 Å²	69	43%	0.426	33%	0.33	S	S	.	.	H	α-helix	trans	-75.3	-44	176.1	-70.3	-179.5	178.5	-174.9	0	110.9	T53 L54 H55 K59 K60 I61 V104	T53-K57 WeakPolarHBondContact O-CG 3.35Å; T53-K57 PolarHBondContact O-N 2.71Å; L54-K57 CarbonylContact O-C 3.56Å; L54-K57 WeakPolarHBondContact O-CB 3.25Å; L54-K57 PolarHBondContact O-N 2.81Å; H55-K57 PolarHBondContact O-N 2.71Å; K57-K59 PolarHBondContact O-N 3.06Å; K57-K60 WeakPolarHBondContact O-CB 3.12Å; K57-K60 PolarHBondContact O-N 3.38Å; K57-K60 VanDerWaalsContact O-N 3.14Å; K57-I61 WeakPolarHBondContact O-CG1 3.43Å; K57-V104 HydrophobicContact CB-CG1 3.68Å; K57-V104 HydrophobicContact CB-CG2 4.48Å; K57-V104 HydrophobicContact CD-CG1 3.43Å; K57-V104 VanDerWaalsContact CD-CG1 3.43Å; K57-V104 HydrophobicContact CG-CG1 4.22Å
58	L	79	Confident	73.8	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.6	-43	178.4	-71.6	174.6	0	0	0	112	L54 H55 K60 I61 I62 T64 I94 P102 L105	L54-L58 HydrophobicContact CD1-CD1 3.81Å; L54-L58 HydrophobicContact CD1-CD2 4.48Å; L54-L58 HydrophobicContact CD1-CG 3.9Å; L54-L58 HydrophobicContact CD2-CD1 4.29Å; L54-L58 HydrophobicContact CG-CD1 3.72Å; L54-L58 HydrophobicContact CG-CG 4.2Å; L54-L58 WeakPolarHBondContact O-CG 3.23Å; L54-L58 PolarHBondContact O-N 2.84Å; H55-L58 PolarHBondContact O-N 3.48Å; L58-K60 PolarHBondContact O-N 3.5Å; L58-I61 PolarHBondContact O-N 3.09Å; L58-I62 HydrophobicContact CB-CD1 4.47Å; L58-I62 HydrophobicContact CB-CG1 4.32Å; L58-I62 HydrophobicContact CD2-CD1 4.26Å; L58-I62 VanDerWaalsContact O-CG1 3.28Å; L58-I62 WeakPolarHBondContact O-CG1 3.47Å; L58-I62 PolarHBondContact O-N 3.13Å; L58-I62 VanDerWaalsContact O-O 3.09Å; L58-T64 HydrophobicContact CB-CG2 3.47Å; L58-T64 VanDerWaalsContact CB-CG2 3.47Å; L58-I94 HydrophobicContact CD1-CD1 3.67Å; L58-P102 HydrophobicContact CD2-CB 3.71Å; L58-P102 HydrophobicContact CD2-CG 3.7Å; L58-L105 HydrophobicContact CD2-CB 4.21Å
59	K	78	Confident	72.9	Confident	146 Å²	146	63.5 Å²	63.5	64%	0.635	31%	0.311	S	S	*	.	H	α-helix	trans	-55.7	-23.5	175.7	-176.5	172.6	-179.7	173.1	0	113.6	H55 K57 I62	H55-K59 VanDerWaalsContact O-CB 3.31Å; H55-K59 WeakPolarHBondContact O-CB 2.91Å; H55-K59 PolarHBondContact O-N 2.81Å; K57-K59 PolarHBondContact O-N 3.06Å; K59-I62 CarbonylContact C-O 3.55Å
60	K	75.8	Confident	71.7	Confident	184 Å²	184	67.2 Å²	67.2	80%	0.8	32%	0.319	S	S	*	.	H	α-helix	trans	-83	-25	176.7	-66.6	179.3	177.2	-169	0	113.3	R56 K57 L58	R56-K60 WeakPolarHBondContact O-CG 3.22Å; K57-K60 WeakPolarHBondContact O-CB 3.12Å; K57-K60 PolarHBondContact O-N 3.38Å; K57-K60 VanDerWaalsContact O-N 3.14Å; L58-K60 PolarHBondContact O-N 3.5Å
61	I	70.4	Confident	70.1	Confident	98 Å²	98	74.7 Å²	74.7	50%	0.503	35%	0.346	S	S	.	.	H	α-helix	trans	-101.1	-40.9	-171.7	-56.2	166.7	0	0	0	109.9	K57 L58 P102 V104	K57-I61 WeakPolarHBondContact O-CG1 3.43Å; L58-I61 PolarHBondContact O-N 3.09Å; I61-P102 HydrophobicContact CG2-CB 4.49Å; I61-V104 HydrophobicContact CD1-CB 4.39Å; I61-V104 HydrophobicContact CD1-CG2 3.51Å
62	I	70.1	Confident	68.9	Low	28 Å²	28	76.7 Å²	76.7	14%	0.144	36%	0.357	C	S	.	.	S	Bend	trans	-130.9	155	-177	56.1	163.7	0	0	0	109.8	L58 K59 T64 I94 N98 P102	L58-I62 HydrophobicContact CB-CD1 4.47Å; L58-I62 HydrophobicContact CB-CG1 4.32Å; L58-I62 HydrophobicContact CD2-CD1 4.26Å; L58-I62 VanDerWaalsContact O-CG1 3.28Å; L58-I62 WeakPolarHBondContact O-CG1 3.47Å; L58-I62 PolarHBondContact O-N 3.13Å; L58-I62 VanDerWaalsContact O-O 3.09Å; K59-I62 CarbonylContact C-O 3.55Å; I62-T64 HydrophobicContact CD1-CG2 3.76Å; I62-T64 HydrophobicContact CG1-CG2 3.64Å; I62-T64 PolarHBondContact O-N 3.45Å; I62-I94 HydrophobicContact CD1-CG2 3.83Å; I62-N98 WeakPolarHBondContact CD1-ND2 3.44Å; I62-N98 WeakPolarHBondContact CD1-OD1 3.46Å; I62-N98 WeakPolarHBondContact CG2-OD1 3.36Å; I62-P102 HydrophobicContact CD1-CG 4.04Å; I62-P102 HydrophobicContact CG1-CG 4.37Å; I62-P102 HydrophobicContact CG2-CG 4.02Å
63	Q	60.7	Low	67.8	Low	199 Å²	199	79.8 Å²	79.8	93%	0.93	38%	0.38	S	S	*	.			trans	-73.9	81.3	172.8	-166.3	174.4	34.2	0	0	109
64	T	62.1	Low	66.4	Low	21 Å²	21	84.8 Å²	84.8	13%	0.129	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-72.1	143.7	-177.9	54.7	0	0	0	0	112.3	H55 L58 I62 Y90	H55-T64 PolarHBondContact CE1-OG1 2.99Å; L58-T64 HydrophobicContact CB-CG2 3.47Å; L58-T64 VanDerWaalsContact CB-CG2 3.47Å; I62-T64 HydrophobicContact CD1-CG2 3.76Å; I62-T64 HydrophobicContact CG1-CG2 3.64Å; I62-T64 PolarHBondContact O-N 3.45Å; T64-Y90 WeakPolarHBondContact CB-OH 3.07Å
65	P	62.2	Low	64.9	Low	47 Å²	47	85.8 Å²	85.8	31%	0.305	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-61.5	168.3	168.3	24.2	-30.6	0	0	0	112.3	Y90 D93	P65-Y90 HydrophobicContact CG-CD2 4.2Å; P65-Y90 HydrophobicContact CG-CE2 3.86Å; P65-Y90 WeakPolarHBondContact O-CE2 2.95Å; P65-D93 WeakPolarHBondContact CG-OD2 3.5Å
66	D	62.6	Low	63.3	Low	137 Å²	137	95 Å²	95	73%	0.733	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-64.4	135.2	-176.8	-167.1	20.2	0	0	0	111.4
67	F	64.7	Low	61.9	Low	10 Å²	10	95.5 Å²	95.5	4%	0.044	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-93.2	134.1	-169	176.3	-91.6	0	0	0	112.1	F51 Q52 H55 S69 N72 L87 Y90	F51-F67 HydrophobicContact CB-CE2 4.14Å; F51-F67 HydrophobicContact CB-CZ 3.88Å; F51-F67 WeakPolarHBondContact O-CE2 3.19Å; Q52-F67 HydrophobicContact CB-CE1 4.43Å; Q52-F67 HydrophobicContact CB-CZ 4.49Å; Q52-F67 HydrophobicContact CG-CE1 3.6Å; Q52-F67 HydrophobicContact CG-CZ 3.94Å; H55-F67 HydrophobicContact CB-CB 4.29Å; H55-F67 HydrophobicContact CB-CD1 4.47Å; H55-F67 HydrophobicContact CB-CD2 3.32Å; H55-F67 HydrophobicContact CB-CE2 3.64Å; H55-F67 HydrophobicContact CB-CG 3.78Å; H55-F67 HydrophobicContact CB-CZ 4.37Å; H55-F67 WeakPolarHBondContact CD2-CB 3.4Å; H55-F67 AromaticContact CD2-CG 3.65Å; H55-F67 VanDerWaalsContact CE1-CB 3.43Å; H55-F67 WeakPolarHBondContact CE1-CB 3.46Å; H55-F67 VanDerWaalsContact CG-CB 3.44Å; H55-F67 AromaticContact CG-CD2 3.46Å; H55-F67 VanDerWaalsContact CG-CD2 3.46Å; H55-F67 AromaticContact CG-CG 3.48Å; H55-F67 VanDerWaalsContact CG-CG 3.48Å; H55-F67 WeakPolarHBondContact ND1-CB 3.19Å; H55-F67 AromaticContact ND1-CD2 3.87Å; H55-F67 AromaticContact ND1-CG 3.95Å; H55-F67 WeakPolarHBondContact NE2-CB 3.38Å; F67-S69 PolarHBondContact O-N 3.06Å; F67-N72 PolarHBondContact O-ND2 2.85Å; F67-L87 HydrophobicContact CE2-CD2 4.09Å; F67-L87 HydrophobicContact CZ-CD2 4.08Å; F67-Y90 HydrophobicContact CB-CE2 4.49Å; F67-Y90 HydrophobicContact CD2-CD1 4.04Å; F67-Y90 AromaticContact CD2-CE1 3.62Å; F67-Y90 HydrophobicContact CD2-CE1 3.62Å; F67-Y90 HydrophobicContact CD2-CE2 4.42Å; F67-Y90 AromaticContact CD2-CZ 3.88Å; F67-Y90 HydrophobicContact CE2-CD1 4.38Å; F67-Y90 HydrophobicContact CE2-CE1 4.14Å
68	P	60.8	Low	61	Low	11 Å²	11	94.7 Å²	94.7	7%	0.071	45%	0.45	C	S	.	.			trans	-77.2	65.8	-178.9	31.3	-34.1	0	0	0	112.5	L75 R83 E86 L87	P68-L75 HydrophobicContact CB-CD1 4.18Å; P68-R83 PolarHBondContact O-NE 3.32Å; P68-R83 PolarHBondContact O-NH2 3.46Å; P68-E86 HydrophobicContact CB-CB 4.01Å; P68-E86 HydrophobicContact CG-CB 4.18Å; P68-L87 HydrophobicContact CG-CD2 3.89Å; P68-L87 HydrophobicContact CG-CG 4.27Å
69	S	58.3	Low	60.4	Low	12 Å²	12	98.4 Å²	98.4	8%	0.084	47%	0.474	C	S	.	.			trans	-85.9	153.8	176.2	-171.2	0	0	0	0	113.1	Q52 F67 R71 N72	Q52-S69 PolarHBondContact NE2-OG 2.87Å; F67-S69 PolarHBondContact O-N 3.06Å; S69-R71 PolarHBondContact O-N 3.25Å; S69-R71 PolarHBondContact OG-N 3Å; S69-N72 PolarHBondContact O-N 3.01Å; S69-N72 VanDerWaalsContact O-N 3.08Å
70	K	52	Low	59.8	Low	138 Å²	138	94.7 Å²	94.7	60%	0.6	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-19.1	167.7	-66.8	-173.4	-179.7	179.1	0	114.3	N72	K70-N72 VanDerWaalsContact C-N 3.32Å
71	R	51.6	Low	59.4	Low	196 Å²	196	91.2 Å²	91.2	74%	0.74	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-12.4	-177.6	-65.1	-174.2	-174	-179.6	-0.9	113.1	S69 P73	S69-R71 PolarHBondContact O-N 3.25Å; S69-R71 PolarHBondContact OG-N 3Å; R71-P73 WeakPolarHBondContact O-CD 3.33Å
72	N	54.1	Low	59.5	Low	44 Å²	44	90.4 Å²	90.4	24%	0.235	44%	0.442	C	S	.	.	S	Bend	trans	-83	119.1	176.7	-71.6	-21	0	0	0	109.6	F67 S69 K70 H74 L75 R76	F67-N72 PolarHBondContact O-ND2 2.85Å; S69-N72 PolarHBondContact O-N 3.01Å; S69-N72 VanDerWaalsContact O-N 3.08Å; K70-N72 VanDerWaalsContact C-N 3.32Å; N72-H74 PolarHBondContact O-N 3.21Å; N72-L75 HydrophobicContact CB-CB 4.12Å; N72-L75 HydrophobicContact CB-CD1 3.62Å; N72-L75 HydrophobicContact CB-CG 4.25Å; N72-L75 WeakPolarHBondContact O-CB 3.11Å; N72-L75 PolarHBondContact O-N 2.89Å; N72-R76 PolarHBondContact O-N 3.21Å
73	P	53.3	Low	59.5	Low	96 Å²	96	90.1 Å²	90.1	62%	0.623	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-62.1	-29.5	-174.3	20.6	-30	0	0	0	113.2	R71 L75	R71-P73 WeakPolarHBondContact O-CD 3.33Å; P73-L75 PolarHBondContact O-N 2.81Å
74	H	54	Low	60.3	Low	166 Å²	166	82.2 Å²	82.2	77%	0.769	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-70.4	-16.2	174.3	-59.1	128.6	0	0	0	114.2	N72	N72-H74 PolarHBondContact O-N 3.21Å
75	L	51	Low	60.8	Low	29 Å²	29	86 Å²	86	15%	0.152	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-105.8	-8.7	-176.1	-76.2	161.6	0	0	0	113.1	P68 N72 P73 T77 K78 E86	P68-L75 HydrophobicContact CB-CD1 4.18Å; N72-L75 HydrophobicContact CB-CB 4.12Å; N72-L75 HydrophobicContact CB-CD1 3.62Å; N72-L75 HydrophobicContact CB-CG 4.25Å; N72-L75 WeakPolarHBondContact O-CB 3.11Å; N72-L75 PolarHBondContact O-N 2.89Å; P73-L75 PolarHBondContact O-N 2.81Å; L75-T77 PolarHBondContact O-N 3.16Å; L75-K78 HydrophobicContact CD2-CD 3.85Å; L75-K78 HydrophobicContact CD2-CG 4.47Å; L75-K78 PolarHBondContact O-N 3.06Å; L75-E86 WeakPolarHBondContact CD2-OE2 3.42Å
76	R	47.1	Very low	61.6	Low	218 Å²	218	85.7 Å²	85.7	82%	0.823	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-25	179.6	-170.3	-179.2	165.4	-159.5	-4.8	112.6	N72	N72-R76 PolarHBondContact O-N 3.21Å
77	T	51.2	Low	62.3	Low	127 Å²	127	79.2 Å²	79.2	78%	0.779	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-6.4	-173.9	-12.3	0	0	0	0	113.6	L75	L75-T77 PolarHBondContact O-N 3.16Å
78	K	62.3	Low	63.1	Low	81 Å²	81	79.9 Å²	79.9	35%	0.352	38%	0.38	S	S	.	.	S	Bend	trans	-82.7	142.5	-171.9	-63.6	-160.3	-169.6	179.2	0	112.5	L75 Q82 E86	L75-K78 HydrophobicContact CD2-CD 3.85Å; L75-K78 HydrophobicContact CD2-CG 4.47Å; L75-K78 PolarHBondContact O-N 3.06Å; K78-Q82 HydrophobicContact CD-CG 4.25Å; K78-E86 WeakPolarHBondContact CD-OE1 3.48Å; K78-E86 IonicContact NZ-OE1 3.42Å; K78-E86 PolarHBondContact NZ-OE1 3.04Å
79	P	66.6	Low	64.1	Low	79 Å²	79	83.4 Å²	83.4	51%	0.513	40%	0.398	S	S	.	.			trans	-60.7	148.3	177.1	22.3	-29.7	0	0	0	111.3	E81 Q82 R83	P79-E81 PolarHBondContact O-N 3.24Å; P79-E81 VanDerWaalsContact O-N 3.15Å; P79-Q82 HydrophobicContact CG-CB 3.99Å; P79-Q82 PolarHBondContact O-N 2.95Å; P79-R83 PolarHBondContact O-N 3.01Å
80	L	64.3	Low	65.1	Low	68 Å²	68	83.5 Å²	83.5	36%	0.356	40%	0.397	S	S	.	.	H	α-helix	trans	-58.6	-30.6	-173.7	-170.9	64.1	0	0	0	113	L17 K29 R83 R84	L17-L80 HydrophobicContact CD2-CD2 3.31Å; L17-L80 HydrophobicContact CD2-CG 3.99Å; K29-L80 HydrophobicContact CD-CD2 4.42Å; L80-R83 WeakPolarHBondContact O-CB 3.37Å; L80-R83 PolarHBondContact O-N 3.29Å; L80-R84 PolarHBondContact O-N 3.4Å; L80-R84 VanDerWaalsContact O-N 3.09Å
81	E	68.9	Low	66.4	Low	111 Å²	111	77 Å²	77	52%	0.519	37%	0.368	S	S	.	.	H	α-helix	trans	-69.8	-41.9	177.1	-151.9	60.6	-141.1	0	0	112.2	P79 R83 R84 Q85	P79-E81 PolarHBondContact O-N 3.24Å; P79-E81 VanDerWaalsContact O-N 3.15Å; E81-R83 PolarHBondContact O-N 2.85Å; E81-R84 WeakPolarHBondContact O-CB 3.45Å; E81-R84 PolarHBondContact O-N 2.92Å; E81-R84 VanDerWaalsContact O-N 3.09Å; E81-R84 WeakPolarHBondContact OE1-CD 3.28Å; E81-R84 IonicContact OE1-NE 2.83Å; E81-R84 PolarHBondContact OE1-NE 2.86Å; E81-R84 VanDerWaalsContact OE1-NE 3.14Å; E81-Q85 PolarHBondContact O-N 3.29Å; E81-Q85 VanDerWaalsContact O-N 3.12Å
82	Q	72.1	Confident	67.8	Low	80 Å²	80	71.2 Å²	71.2	37%	0.374	35%	0.35	S	S	.	.	H	α-helix	trans	-65.1	-34.9	175.8	-173.7	170.1	7.1	0	0	110.9	K78 P79 R84 Q85 E86	K78-Q82 HydrophobicContact CD-CG 4.25Å; P79-Q82 HydrophobicContact CG-CB 3.99Å; P79-Q82 PolarHBondContact O-N 2.95Å; Q82-R84 VanDerWaalsContact C-N 3.31Å; Q82-R84 PolarHBondContact O-N 3.18Å; Q82-Q85 PolarHBondContact O-N 2.97Å; Q82-E86 WeakPolarHBondContact O-CG 3.33Å; Q82-E86 PolarHBondContact O-N 2.94Å
83	R	70.6	Confident	69	Low	22 Å²	22	72 Å²	72	8%	0.083	35%	0.354	C	S	.	.	H	α-helix	trans	-68.2	-31.2	174.3	-171	169.9	-175.3	-154	-6.2	113.4	N48 P68 P79 L80 E81 Q85 L87	N48-R83 PolarHBondContact ND2-NH2 2.72Å; N48-R83 PolarHBondContact OD1-NH2 3.41Å; P68-R83 PolarHBondContact O-NE 3.32Å; P68-R83 PolarHBondContact O-NH2 3.46Å; P79-R83 PolarHBondContact O-N 3.01Å; L80-R83 WeakPolarHBondContact O-CB 3.37Å; L80-R83 PolarHBondContact O-N 3.29Å; E81-R83 PolarHBondContact O-N 2.85Å; R83-Q85 VanDerWaalsContact C-N 3.35Å; R83-L87 HydrophobicContact CG-CD1 4.5Å; R83-L87 WeakPolarHBondContact O-CG 3.39Å; R83-L87 PolarHBondContact O-N 2.75Å; R83-L87 VanDerWaalsContact O-N 3.12Å
84	R	76.1	Confident	70.1	Confident	33 Å²	33	67.4 Å²	67.4	13%	0.125	32%	0.324	C	S	.	.	H	α-helix	trans	-61.2	-49.3	171.9	-175	-155.6	72.2	57.8	2.9	109.2	I14 F31 L80 E81 Q82 L87 E88	I14-R84 HydrophobicContact CB-CG 4.11Å; I14-R84 HydrophobicContact CG2-CG 3.69Å; I14-R84 WeakPolarHBondContact O-CD 3.48Å; I14-R84 VanDerWaalsContact O-CZ 3.25Å; I14-R84 PolarHBondContact O-NE 3.06Å; I14-R84 PolarHBondContact O-NH1 3.45Å; F31-R84 HydrophobicContact CD1-CG 4.32Å; F31-R84 HydrophobicContact CE1-CB 4.36Å; L80-R84 PolarHBondContact O-N 3.4Å; L80-R84 VanDerWaalsContact O-N 3.09Å; E81-R84 WeakPolarHBondContact O-CB 3.45Å; E81-R84 PolarHBondContact O-N 2.92Å; E81-R84 VanDerWaalsContact O-N 3.09Å; E81-R84 WeakPolarHBondContact OE1-CD 3.28Å; E81-R84 IonicContact OE1-NE 2.83Å; E81-R84 PolarHBondContact OE1-NE 2.86Å; E81-R84 VanDerWaalsContact OE1-NE 3.14Å; Q82-R84 VanDerWaalsContact C-N 3.31Å; Q82-R84 PolarHBondContact O-N 3.18Å; R84-L87 PolarHBondContact O-N 3.25Å; R84-E88 IonicContact CZ-OE2 2.8Å; R84-E88 IonicContact NH1-OE1 2.65Å; R84-E88 IonicContact NH1-OE2 3.92Å; R84-E88 PolarHBondContact NH1-OE2 2.78Å; R84-E88 IonicContact NH2-OE2 3.13Å; R84-E88 PolarHBondContact NH2-OE2 3.35Å; R84-E88 PolarHBondContact O-N 2.96Å
85	Q	72.6	Confident	71.2	Confident	102 Å²	102	59.9 Å²	59.9	48%	0.477	29%	0.289	S	S	.	.	H	α-helix	trans	-63.6	-42.6	179.1	-168.1	172	4.2	0	0	112.4	E81 Q82 R83 L87 E88 D89	E81-Q85 PolarHBondContact O-N 3.29Å; E81-Q85 VanDerWaalsContact O-N 3.12Å; Q82-Q85 PolarHBondContact O-N 2.97Å; R83-Q85 VanDerWaalsContact C-N 3.35Å; Q85-L87 VanDerWaalsContact C-N 3.3Å; Q85-L87 PolarHBondContact O-N 3.2Å; Q85-E88 WeakPolarHBondContact O-CB 3.38Å; Q85-E88 PolarHBondContact O-N 2.83Å; Q85-E88 VanDerWaalsContact O-N 3.15Å; Q85-D89 WeakPolarHBondContact O-CB 3.45Å; Q85-D89 PolarHBondContact O-N 3.03Å
86	E	79.4	Confident	72.3	Confident	40 Å²	40	65.4 Å²	65.4	19%	0.187	31%	0.309	C	S	.	.	H	α-helix	trans	-65	-32.6	176.1	-72.1	173.4	175.6	0	0	113.1	P68 L75 K78 Q82 Y90	P68-E86 HydrophobicContact CB-CB 4.01Å; P68-E86 HydrophobicContact CG-CB 4.18Å; L75-E86 WeakPolarHBondContact CD2-OE2 3.42Å; K78-E86 WeakPolarHBondContact CD-OE1 3.48Å; K78-E86 IonicContact NZ-OE1 3.42Å; K78-E86 PolarHBondContact NZ-OE1 3.04Å; Q82-E86 WeakPolarHBondContact O-CG 3.33Å; Q82-E86 PolarHBondContact O-N 2.94Å; E86-Y90 WeakPolarHBondContact O-CB 3.48Å; E86-Y90 PolarHBondContact O-N 3.41Å
87	L	76.8	Confident	73.5	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-71.5	-35	173.9	-76.6	169.1	0	0	0	111.9	I14 F31 F51 F67 P68 R83 R84 Q85 I91	I14-L87 HydrophobicContact CD1-CB 4.1Å; F31-L87 HydrophobicContact CE1-CD1 4.32Å; F31-L87 HydrophobicContact CZ-CD1 4.29Å; F51-L87 HydrophobicContact CB-CD2 4.32Å; F51-L87 HydrophobicContact CD1-CD2 4.3Å; F51-L87 HydrophobicContact CG-CD2 4.36Å; F67-L87 HydrophobicContact CE2-CD2 4.09Å; F67-L87 HydrophobicContact CZ-CD2 4.08Å; P68-L87 HydrophobicContact CG-CD2 3.89Å; P68-L87 HydrophobicContact CG-CG 4.27Å; R83-L87 HydrophobicContact CG-CD1 4.5Å; R83-L87 WeakPolarHBondContact O-CG 3.39Å; R83-L87 PolarHBondContact O-N 2.75Å; R83-L87 VanDerWaalsContact O-N 3.12Å; R84-L87 PolarHBondContact O-N 3.25Å; Q85-L87 VanDerWaalsContact C-N 3.3Å; Q85-L87 PolarHBondContact O-N 3.2Å; L87-I91 WeakPolarHBondContact O-CG1 3.37Å; L87-I91 PolarHBondContact O-N 2.81Å; L87-I91 VanDerWaalsContact O-N 3.16Å
88	E	83.3	Confident	74.4	Confident	25 Å²	25	56.5 Å²	56.5	12%	0.117	27%	0.269	C	S	.	.	H	α-helix	trans	-64.8	-56.2	173.5	177	172.7	-140.1	0	0	110.3	S13 I14 R84 Q85 Y90 I91 Q92	S13-E88 WeakPolarHBondContact CA-OE1 3.43Å; S13-E88 VanDerWaalsContact CB-OE1 3.28Å; S13-E88 WeakPolarHBondContact CB-OE1 3.38Å; I14-E88 HydrophobicContact CB-CB 4.29Å; I14-E88 HydrophobicContact CD1-CB 3.94Å; I14-E88 HydrophobicContact CG1-CB 3.9Å; I14-E88 HydrophobicContact CG1-CG 4.36Å; I14-E88 PolarHBondContact N-OE1 2.88Å; R84-E88 IonicContact CZ-OE2 2.8Å; R84-E88 IonicContact NH1-OE1 2.65Å; R84-E88 IonicContact NH1-OE2 3.92Å; R84-E88 PolarHBondContact NH1-OE2 2.78Å; R84-E88 IonicContact NH2-OE2 3.13Å; R84-E88 PolarHBondContact NH2-OE2 3.35Å; R84-E88 PolarHBondContact O-N 2.96Å; Q85-E88 WeakPolarHBondContact O-CB 3.38Å; Q85-E88 PolarHBondContact O-N 2.83Å; Q85-E88 VanDerWaalsContact O-N 3.15Å; E88-Y90 PolarHBondContact O-N 3.47Å; E88-I91 PolarHBondContact O-N 3.15Å; E88-Q92 WeakPolarHBondContact O-CG 3.43Å; E88-Q92 PolarHBondContact O-N 3.35Å
89	D	80	Confident	74.5	Confident	85 Å²	85	61.8 Å²	61.8	46%	0.455	30%	0.295	S	S	.	.	H	α-helix	trans	-54.1	-41.5	175.4	-76.7	15.9	0	0	0	110.9	Q85 I91 Q92 D93	Q85-D89 WeakPolarHBondContact O-CB 3.45Å; Q85-D89 PolarHBondContact O-N 3.03Å; D89-I91 PolarHBondContact O-N 3.26Å; D89-Q92 PolarHBondContact O-N 2.78Å; D89-D93 WeakPolarHBondContact O-CB 3.4Å; D89-D93 PolarHBondContact O-N 2.84Å
90	Y	80.5	Confident	74.4	Confident	14 Å²	14	63.1 Å²	63.1	6%	0.055	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-43.6	177.9	176.8	-101.7	0	0	0	113	H55 T64 P65 F67 E86 E88 I94	H55-Y90 AromaticContact ND1-CZ 3.65Å; H55-Y90 PolarHBondContact ND1-OH 2.89Å; T64-Y90 WeakPolarHBondContact CB-OH 3.07Å; P65-Y90 HydrophobicContact CG-CD2 4.2Å; P65-Y90 HydrophobicContact CG-CE2 3.86Å; P65-Y90 WeakPolarHBondContact O-CE2 2.95Å; F67-Y90 HydrophobicContact CB-CE2 4.49Å; F67-Y90 HydrophobicContact CD2-CD1 4.04Å; F67-Y90 AromaticContact CD2-CE1 3.62Å; F67-Y90 HydrophobicContact CD2-CE1 3.62Å; F67-Y90 HydrophobicContact CD2-CE2 4.42Å; F67-Y90 AromaticContact CD2-CZ 3.88Å; F67-Y90 HydrophobicContact CE2-CD1 4.38Å; F67-Y90 HydrophobicContact CE2-CE1 4.14Å; E86-Y90 WeakPolarHBondContact O-CB 3.48Å; E86-Y90 PolarHBondContact O-N 3.41Å; E88-Y90 PolarHBondContact O-N 3.47Å; Y90-I94 HydrophobicContact CD1-CD1 3.75Å; Y90-I94 HydrophobicContact CE1-CD1 3.18Å; Y90-I94 HydrophobicContact CE1-CG1 4.33Å; Y90-I94 HydrophobicContact CE2-CD1 4.1Å; Y90-I94 HydrophobicContact CE2-CG1 4.48Å; Y90-I94 HydrophobicContact CG-CD1 4.39Å; Y90-I94 WeakPolarHBondContact O-CD1 3.42Å; Y90-I94 VanDerWaalsContact O-CG1 3.28Å; Y90-I94 WeakPolarHBondContact O-CG1 3.48Å; Y90-I94 PolarHBondContact O-N 2.74Å
91	I	78.9	Confident	74.8	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-72.3	-40.2	179.2	-68.1	169.2	0	0	0	110.5	V12 F51 L87 E88 D89 D93 I94 I95 L105	V12-I91 HydrophobicContact CB-CG2 4.06Å; V12-I91 HydrophobicContact CG1-CG2 3.86Å; V12-I91 HydrophobicContact CG2-CG2 4.1Å; F51-I91 HydrophobicContact CD1-CD1 3.97Å; F51-I91 HydrophobicContact CE1-CD1 3.61Å; L87-I91 WeakPolarHBondContact O-CG1 3.37Å; L87-I91 PolarHBondContact O-N 2.81Å; L87-I91 VanDerWaalsContact O-N 3.16Å; E88-I91 PolarHBondContact O-N 3.15Å; D89-I91 PolarHBondContact O-N 3.26Å; I91-D93 VanDerWaalsContact C-N 3.35Å; I91-I94 PolarHBondContact O-N 2.81Å; I91-I95 HydrophobicContact CG2-CD1 3.85Å; I91-I95 VanDerWaalsContact O-CG1 3.31Å; I91-I95 WeakPolarHBondContact O-CG1 3.2Å; I91-I95 PolarHBondContact O-N 3.25Å; I91-L105 HydrophobicContact CG2-CD1 4.29Å
92	Q	80.9	Confident	75	Confident	75 Å²	75	56 Å²	56	35%	0.35	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-44.4	174.7	-71.8	-179.3	-13.4	0	0	111.2	V12 E88 D89 I94 I95 Y96	V12-Q92 WeakPolarHBondContact O-CG 3.28Å; V12-Q92 PolarHBondContact O-NE2 2.83Å; E88-Q92 WeakPolarHBondContact O-CG 3.43Å; E88-Q92 PolarHBondContact O-N 3.35Å; D89-Q92 PolarHBondContact O-N 2.78Å; Q92-I94 VanDerWaalsContact C-N 3.35Å; Q92-I94 PolarHBondContact O-N 2.99Å; Q92-I95 PolarHBondContact O-N 3.12Å; Q92-I95 VanDerWaalsContact O-N 3.13Å; Q92-Y96 WeakPolarHBondContact O-CB 3.5Å; Q92-Y96 PolarHBondContact O-N 3.12Å
93	D	79.9	Confident	75.1	Confident	60 Å²	60	59.6 Å²	59.6	32%	0.321	28%	0.282	S	S	.	.	H	α-helix	trans	-64	-39.5	177.5	-167.6	53.6	0	0	0	111	P65 D89 I91 I95 Y96 Q97	P65-D93 WeakPolarHBondContact CG-OD2 3.5Å; D89-D93 WeakPolarHBondContact O-CB 3.4Å; D89-D93 PolarHBondContact O-N 2.84Å; I91-D93 VanDerWaalsContact C-N 3.35Å; D93-I95 VanDerWaalsContact C-N 3.35Å; D93-I95 PolarHBondContact O-N 2.91Å; D93-Y96 PolarHBondContact O-N 3.3Å; D93-Q97 WeakPolarHBondContact O-CB 3.31Å; D93-Q97 WeakPolarHBondContact O-CG 3.19Å; D93-Q97 PolarHBondContact O-N 3.35Å; D93-Q97 WeakPolarHBondContact OD1-CG 3.05Å
94	I	75.9	Confident	75.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.4	-45.5	171.7	-68.8	159.7	0	0	0	111.2	L58 I62 Y90 I91 Q92 Y96 N98 L105	L58-I94 HydrophobicContact CD1-CD1 3.67Å; I62-I94 HydrophobicContact CD1-CG2 3.83Å; Y90-I94 HydrophobicContact CD1-CD1 3.75Å; Y90-I94 HydrophobicContact CE1-CD1 3.18Å; Y90-I94 HydrophobicContact CE1-CG1 4.33Å; Y90-I94 HydrophobicContact CE2-CD1 4.1Å; Y90-I94 HydrophobicContact CE2-CG1 4.48Å; Y90-I94 HydrophobicContact CG-CD1 4.39Å; Y90-I94 WeakPolarHBondContact O-CD1 3.42Å; Y90-I94 VanDerWaalsContact O-CG1 3.28Å; Y90-I94 WeakPolarHBondContact O-CG1 3.48Å; Y90-I94 PolarHBondContact O-N 2.74Å; I91-I94 PolarHBondContact O-N 2.81Å; Q92-I94 VanDerWaalsContact C-N 3.35Å; Q92-I94 PolarHBondContact O-N 2.99Å; I94-Y96 VanDerWaalsContact C-N 3.32Å; I94-Y96 PolarHBondContact O-N 2.66Å; I94-N98 VanDerWaalsContact O-CB 3.29Å; I94-N98 WeakPolarHBondContact O-CB 3.34Å; I94-N98 PolarHBondContact O-N 3.44Å; I94-N98 PolarHBondContact O-ND2 3.48Å; I94-L105 HydrophobicContact CG2-CD2 3.89Å
95	I	77	Confident	75.7	Confident	7 Å²	7	58.5 Å²	58.5	4%	0.036	28%	0.281	C	S	.	.	H	α-helix	trans	-67.5	-36.3	-178.3	-68.3	167.2	0	0	0	111.1	H8 I10 V12 I91 Q92 D93 N98 V101 L105	H8-I95 HydrophobicContact CB-CG2 4.28Å; I10-I95 HydrophobicContact CB-CD1 4.33Å; I10-I95 HydrophobicContact CB-CG2 4.15Å; I10-I95 HydrophobicContact CG2-CD1 4.15Å; V12-I95 HydrophobicContact CB-CD1 4.13Å; V12-I95 HydrophobicContact CG2-CD1 3.32Å; I91-I95 HydrophobicContact CG2-CD1 3.85Å; I91-I95 VanDerWaalsContact O-CG1 3.31Å; I91-I95 WeakPolarHBondContact O-CG1 3.2Å; I91-I95 PolarHBondContact O-N 3.25Å; Q92-I95 PolarHBondContact O-N 3.12Å; Q92-I95 VanDerWaalsContact O-N 3.13Å; D93-I95 VanDerWaalsContact C-N 3.35Å; D93-I95 PolarHBondContact O-N 2.91Å; I95-N98 VanDerWaalsContact O-O 3.14Å; I95-V101 HydrophobicContact CG2-CG2 4.42Å; I95-L105 HydrophobicContact CD1-CD2 4.34Å; I95-L105 HydrophobicContact CG1-CD2 3.82Å
96	Y	74.3	Confident	76	Confident	145 Å²	145	54 Å²	54	57%	0.569	26%	0.261	S	S	*	.	H	α-helix	trans	-73.7	-40.3	179.2	-173.6	-94.7	0	0	0	112.4	H8 Q92 D93 I94	H8-Y96 AromaticContact CE1-CD2 3.19Å; H8-Y96 WeakPolarHBondContact CE1-CD2 3.4Å; H8-Y96 AromaticContact CE1-CE2 3.5Å; H8-Y96 VanDerWaalsContact CE1-CE2 3.5Å; H8-Y96 WeakPolarHBondContact CE1-CE2 3.47Å; H8-Y96 AromaticContact CE1-CG 3.99Å; H8-Y96 AromaticContact ND1-CD2 3.61Å; H8-Y96 PolarHBondContact NE2-O 3.19Å; Q92-Y96 WeakPolarHBondContact O-CB 3.5Å; Q92-Y96 PolarHBondContact O-N 3.12Å; D93-Y96 PolarHBondContact O-N 3.3Å; I94-Y96 VanDerWaalsContact C-N 3.32Å; I94-Y96 PolarHBondContact O-N 2.66Å
97	Q	72.7	Confident	76.2	Confident	127 Å²	127	57.2 Å²	57.2	59%	0.593	28%	0.279	S	S	*	.	H	α-helix	trans	-81.4	-18.5	-176.8	-61.6	-74.5	50.6	0	0	113	D93	D93-Q97 WeakPolarHBondContact O-CB 3.31Å; D93-Q97 WeakPolarHBondContact O-CG 3.19Å; D93-Q97 PolarHBondContact O-N 3.35Å; D93-Q97 WeakPolarHBondContact OD1-CG 3.05Å
98	N	69.7	Low	76.4	Confident	31 Å²	31	57.8 Å²	57.8	17%	0.166	28%	0.281	C	S	.	.			trans	-112.1	109.3	-179.8	-62.2	-90.9	0	0	0	109.7	I62 I94 I95 D100	I62-N98 WeakPolarHBondContact CD1-ND2 3.44Å; I62-N98 WeakPolarHBondContact CD1-OD1 3.46Å; I62-N98 WeakPolarHBondContact CG2-OD1 3.36Å; I94-N98 VanDerWaalsContact O-CB 3.29Å; I94-N98 WeakPolarHBondContact O-CB 3.34Å; I94-N98 PolarHBondContact O-N 3.44Å; I94-N98 PolarHBondContact O-ND2 3.48Å; I95-N98 VanDerWaalsContact O-O 3.14Å; N98-D100 PolarHBondContact O-N 2.85Å
99	E	65.3	Low	76.1	Confident	192 Å²	192	56.6 Å²	56.6	90%	0.897	28%	0.276	S	S	*	.	S	Bend	trans	-58.1	-38.4	174.5	-167.6	174.1	-175.9	0	0	111.2
100	D	64.5	Low	75.7	Confident	108 Å²	108	57.7 Å²	57.7	58%	0.578	28%	0.278	S	S	*	.	S	Bend	trans	-103.1	110.7	170.3	-75.1	-57.5	0	0	0	111.4	N98 P102	N98-D100 PolarHBondContact O-N 2.85Å; D100-P102 WeakPolarHBondContact O-CD 3.49Å
101	V	70.6	Confident	75.1	Confident	16 Å²	16	57.5 Å²	57.5	10%	0.097	28%	0.278	C	S	.	.			trans	-71.7	121.1	178.7	180	0	0	0	0	110.3	I10 I95 Q103 L105 L106	I10-V101 HydrophobicContact CD1-CB 4.12Å; I10-V101 HydrophobicContact CD1-CG1 3.97Å; I10-V101 HydrophobicContact CD1-CG2 3.78Å; I95-V101 HydrophobicContact CG2-CG2 4.42Å; V101-Q103 PolarHBondContact O-N 3.09Å; V101-L105 HydrophobicContact CG1-CB 4.06Å; V101-L105 HydrophobicContact CG1-CD2 3.71Å; V101-L105 HydrophobicContact CG1-CG 4.05Å; V101-L106 HydrophobicContact CB-CD2 4.3Å; V101-L106 HydrophobicContact CG1-CD2 3.76Å; V101-L106 HydrophobicContact CG1-CG 3.97Å; V101-L106 WeakPolarHBondContact O-CD1 3.28Å
102	P	73.8	Confident	74	Confident	12 Å²	12	65.4 Å²	65.4	8%	0.078	31%	0.313	C	S	.	.			trans	-60.6	139.6	-176	-26.5	35.8	0	0	0	112.4	L58 I61 I62 D100 V104 L105 L106	L58-P102 HydrophobicContact CD2-CB 3.71Å; L58-P102 HydrophobicContact CD2-CG 3.7Å; I61-P102 HydrophobicContact CG2-CB 4.49Å; I62-P102 HydrophobicContact CD1-CG 4.04Å; I62-P102 HydrophobicContact CG1-CG 4.37Å; I62-P102 HydrophobicContact CG2-CG 4.02Å; D100-P102 WeakPolarHBondContact O-CD 3.49Å; P102-V104 PolarHBondContact O-N 3.42Å; P102-L105 WeakPolarHBondContact O-CA 3.26Å; P102-L105 WeakPolarHBondContact O-CB 3.42Å; P102-L105 PolarHBondContact O-N 2.94Å; P102-L106 PolarHBondContact O-N 3.09Å; P102-L106 VanDerWaalsContact O-N 3.14Å
103	Q	73.7	Confident	72.7	Confident	157 Å²	157	67.4 Å²	67.4	73%	0.734	32%	0.322	S	S	*	.	H	α-helix	trans	-55.1	-26.4	177.8	-68	-158.2	-4.2	0	0	113.8	V101 L106 D107	V101-Q103 PolarHBondContact O-N 3.09Å; Q103-L106 HydrophobicContact CG-CD1 4.42Å; Q103-L106 PolarHBondContact O-N 3.08Å; Q103-D107 VanDerWaalsContact O-CB 3.26Å; Q103-D107 WeakPolarHBondContact O-CB 3.45Å; Q103-D107 PolarHBondContact O-N 2.77Å
104	V	80.7	Confident	71.4	Confident	32 Å²	32	66.1 Å²	66.1	19%	0.194	31%	0.313	C	S	.	.	H	α-helix	trans	-67.3	-37.8	174.6	-172.4	0	0	0	0	112.2	L54 K57 I61 P102 F108	L54-V104 HydrophobicContact CD1-CG1 3.86Å; K57-V104 HydrophobicContact CB-CG1 3.68Å; K57-V104 HydrophobicContact CB-CG2 4.48Å; K57-V104 HydrophobicContact CD-CG1 3.43Å; K57-V104 VanDerWaalsContact CD-CG1 3.43Å; K57-V104 HydrophobicContact CG-CG1 4.22Å; I61-V104 HydrophobicContact CD1-CB 4.39Å; I61-V104 HydrophobicContact CD1-CG2 3.51Å; P102-V104 PolarHBondContact O-N 3.42Å; V104-F108 VanDerWaalsContact O-CB 3.3Å; V104-F108 WeakPolarHBondContact O-CB 3.42Å; V104-F108 PolarHBondContact O-N 3.15Å
105	L	80.4	Confident	70	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-68.5	-40.9	173.2	-179	58.7	0	0	0	109.8	L54 L58 I91 I94 I95 V101 P102 F108 L109	L54-L105 HydrophobicContact CD1-CB 4.4Å; L54-L105 HydrophobicContact CD1-CD1 4.3Å; L54-L105 HydrophobicContact CD2-CD1 3.81Å; L58-L105 HydrophobicContact CD2-CB 4.21Å; I91-L105 HydrophobicContact CG2-CD1 4.29Å; I94-L105 HydrophobicContact CG2-CD2 3.89Å; I95-L105 HydrophobicContact CD1-CD2 4.34Å; I95-L105 HydrophobicContact CG1-CD2 3.82Å; V101-L105 HydrophobicContact CG1-CB 4.06Å; V101-L105 HydrophobicContact CG1-CD2 3.71Å; V101-L105 HydrophobicContact CG1-CG 4.05Å; P102-L105 WeakPolarHBondContact O-CA 3.26Å; P102-L105 WeakPolarHBondContact O-CB 3.42Å; P102-L105 PolarHBondContact O-N 2.94Å; L105-F108 CarbonylContact O-C 3.59Å; L105-F108 WeakPolarHBondContact O-CB 2.94Å; L105-F108 PolarHBondContact O-N 3.07Å; L105-L109 HydrophobicContact CD1-CD1 3.99Å; L105-L109 HydrophobicContact CD1-CG 4.05Å; L105-L109 HydrophobicContact CG-CD1 3.92Å; L105-L109 HydrophobicContact CG-CG 4.34Å; L105-L109 WeakPolarHBondContact O-CB 3.38Å; L105-L109 VanDerWaalsContact O-CG 3.23Å; L105-L109 WeakPolarHBondContact O-CG 3.13Å; L105-L109 PolarHBondContact O-N 3.22Å
106	L	78.6	Confident	68.3	Low	8 Å²	8	77.1 Å²	77.1	4%	0.042	37%	0.371	C	S	.	.	H	α-helix	trans	-62.8	-44.7	177.9	-60.3	167.8	0	0	0	112.5	I10 V101 P102 Q103 L109 H110 V111 F114	I10-L106 HydrophobicContact CD1-CD2 3.99Å; V101-L106 HydrophobicContact CB-CD2 4.3Å; V101-L106 HydrophobicContact CG1-CD2 3.76Å; V101-L106 HydrophobicContact CG1-CG 3.97Å; V101-L106 WeakPolarHBondContact O-CD1 3.28Å; P102-L106 PolarHBondContact O-N 3.09Å; P102-L106 VanDerWaalsContact O-N 3.14Å; Q103-L106 HydrophobicContact CG-CD1 4.42Å; Q103-L106 PolarHBondContact O-N 3.08Å; L106-L109 CarbonylContact O-C 3.59Å; L106-L109 PolarHBondContact O-N 3.26Å; L106-H110 CarbonylContact O-C 3.38Å; L106-H110 WeakPolarHBondContact O-CA 3.49Å; L106-H110 PolarHBondContact O-N 2.84Å; L106-V111 HydrophobicContact CD2-CB 4.23Å; L106-V111 PolarHBondContact O-N 2.75Å; L106-F114 HydrophobicContact CD1-CB 3.16Å; L106-F114 HydrophobicContact CD1-CD1 4.15Å; L106-F114 HydrophobicContact CD1-CD2 4.32Å; L106-F114 HydrophobicContact CD1-CG 3.65Å; L106-F114 HydrophobicContact CD2-CB 3.66Å; L106-F114 HydrophobicContact CD2-CD1 4.08Å; L106-F114 HydrophobicContact CD2-CD2 3.14Å; L106-F114 HydrophobicContact CD2-CE2 3.71Å; L106-F114 HydrophobicContact CD2-CG 3.34Å; L106-F114 HydrophobicContact CD2-CZ 4.44Å; L106-F114 HydrophobicContact CG-CB 3.91Å; L106-F114 HydrophobicContact CG-CD2 4.27Å; L106-F114 HydrophobicContact CG-CG 4.08Å
107	D	82.2	Confident	66.5	Low	106 Å²	106	72.2 Å²	72.2	57%	0.567	37%	0.365	S	S	*	.	H	α-helix	trans	-61.8	-43.6	172.9	-178.4	51.5	0	0	0	110.9	Q103 L109 H110	Q103-D107 VanDerWaalsContact O-CB 3.26Å; Q103-D107 WeakPolarHBondContact O-CB 3.45Å; Q103-D107 PolarHBondContact O-N 2.77Å; D107-L109 VanDerWaalsContact C-N 3.29Å; D107-L109 PolarHBondContact O-N 2.8Å; D107-H110 PolarHBondContact O-CD2 3.18Å; D107-H110 PolarHBondContact O-N 3.17Å
108	F	80.8	Confident	65.1	Low	13 Å²	13	74.1 Å²	74.1	6%	0.057	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-35.2	174.6	178.2	-92.1	0	0	0	113	R46 E50 F51 L54 V104 L105 H110	R46-F108 HydrophobicContact CB-CE1 4.48Å; R46-F108 HydrophobicContact CB-CE2 4.14Å; R46-F108 HydrophobicContact CB-CZ 3.68Å; R46-F108 VanDerWaalsContact CD-CE2 3.47Å; R46-F108 HydrophobicContact CG-CE1 3.87Å; R46-F108 HydrophobicContact CG-CE2 3.75Å; R46-F108 HydrophobicContact CG-CZ 3.39Å; R46-F108 PolarHBondContact NE-O 2.92Å; R46-F108 PolarHBondContact NH2-O 2.99Å; E50-F108 HydrophobicContact CB-CE2 3.78Å; F51-F108 AromaticContact CD1-CE1 4Å; F51-F108 HydrophobicContact CD1-CE1 4Å; F51-F108 AromaticContact CD1-CZ 3.57Å; F51-F108 HydrophobicContact CD1-CZ 3.57Å; F51-F108 HydrophobicContact CD2-CZ 4.18Å; F51-F108 AromaticContact CE1-CE1 3.77Å; F51-F108 HydrophobicContact CE1-CE1 3.77Å; F51-F108 AromaticContact CE1-CZ 3.58Å; F51-F108 HydrophobicContact CE1-CZ 3.58Å; F51-F108 HydrophobicContact CE2-CZ 4.18Å; F51-F108 AromaticContact CG-CZ 3.89Å; F51-F108 HydrophobicContact CG-CZ 3.89Å; F51-F108 HydrophobicContact CZ-CE1 4.32Å; F51-F108 AromaticContact CZ-CZ 3.9Å; F51-F108 HydrophobicContact CZ-CZ 3.9Å; L54-F108 HydrophobicContact CB-CD2 4.07Å; L54-F108 HydrophobicContact CB-CE2 4.36Å; L54-F108 HydrophobicContact CB-CG 4.37Å; L54-F108 HydrophobicContact CD1-CB 3.81Å; L54-F108 HydrophobicContact CD1-CG 4.17Å; L54-F108 HydrophobicContact CD2-CB 4.16Å; L54-F108 HydrophobicContact CD2-CD1 3.54Å; L54-F108 HydrophobicContact CD2-CD2 4.04Å; L54-F108 HydrophobicContact CD2-CE1 3.82Å; L54-F108 HydrophobicContact CD2-CE2 4.28Å; L54-F108 HydrophobicContact CD2-CG 3.64Å; L54-F108 HydrophobicContact CD2-CZ 4.17Å; L54-F108 HydrophobicContact CG-CB 4.43Å; L54-F108 HydrophobicContact CG-CD2 4.46Å; L54-F108 HydrophobicContact CG-CG 4.26Å; V104-F108 VanDerWaalsContact O-CB 3.3Å; V104-F108 WeakPolarHBondContact O-CB 3.42Å; V104-F108 PolarHBondContact O-N 3.15Å; L105-F108 CarbonylContact O-C 3.59Å; L105-F108 WeakPolarHBondContact O-CB 2.94Å; L105-F108 PolarHBondContact O-N 3.07Å; F108-H110 VanDerWaalsContact C-N 3.25Å
109	L	78.2	Confident	63.8	Low	0 Å²	0	81 Å²	81	0%	0	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-1.3	174.7	-62.2	177.8	0	0	0	112.1	V12 V33 V35 H42 V44 L105 L106 D107 V111	V12-L109 HydrophobicContact CG2-CD1 3.95Å; V33-L109 HydrophobicContact CG1-CD2 3.92Å; V35-L109 HydrophobicContact CG1-CD1 4.31Å; V35-L109 HydrophobicContact CG2-CB 4.11Å; V35-L109 HydrophobicContact CG2-CD1 4.3Å; V35-L109 HydrophobicContact CG2-CD2 3.66Å; V35-L109 HydrophobicContact CG2-CG 4.2Å; H42-L109 PolarHBondContact CD2-O 2.77Å; H42-L109 VanDerWaalsContact CD2-O 3.29Å; H42-L109 PolarHBondContact NE2-O 2.82Å; V44-L109 VanDerWaalsContact CG2-O 3.25Å; V44-L109 WeakPolarHBondContact CG2-O 3.09Å; L105-L109 HydrophobicContact CD1-CD1 3.99Å; L105-L109 HydrophobicContact CD1-CG 4.05Å; L105-L109 HydrophobicContact CG-CD1 3.92Å; L105-L109 HydrophobicContact CG-CG 4.34Å; L105-L109 WeakPolarHBondContact O-CB 3.38Å; L105-L109 VanDerWaalsContact O-CG 3.23Å; L105-L109 WeakPolarHBondContact O-CG 3.13Å; L105-L109 PolarHBondContact O-N 3.22Å; L106-L109 CarbonylContact O-C 3.59Å; L106-L109 PolarHBondContact O-N 3.26Å; D107-L109 VanDerWaalsContact C-N 3.29Å; D107-L109 PolarHBondContact O-N 2.8Å; L109-V111 HydrophobicContact CB-CG2 3.54Å; L109-V111 PolarHBondContact O-N 3.29Å
110	H	71.6	Confident	62.5	Low	107 Å²	107	79.3 Å²	79.3	50%	0.495	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	29.4	-171	-64.7	161.7	0	0	0	113.8	V44 R46 L106 D107 F108 K112	V44-H110 HydrophobicContact CG2-CB 4.29Å; R46-H110 PolarHBondContact NH2-CD2 3.08Å; R46-H110 VanDerWaalsContact NH2-CD2 3.28Å; R46-H110 PolarHBondContact NH2-CE1 2.77Å; R46-H110 PolarHBondContact NH2-NE2 2.8Å; L106-H110 CarbonylContact O-C 3.38Å; L106-H110 WeakPolarHBondContact O-CA 3.49Å; L106-H110 PolarHBondContact O-N 2.84Å; D107-H110 PolarHBondContact O-CD2 3.18Å; D107-H110 PolarHBondContact O-N 3.17Å; F108-H110 VanDerWaalsContact C-N 3.25Å; H110-K112 VanDerWaalsContact C-N 3.32Å; H110-K112 PolarHBondContact O-N 2.96Å
111	V	68.3	Low	61.1	Low	11 Å²	11	80.4 Å²	80.4	7%	0.067	42%	0.419	C	S	.	.			trans	-82.3	81.3	176.2	-166.1	0	0	0	0	107.9	V35 F37 H42 L106 L109 H113 F114	V35-V111 HydrophobicContact CG1-CG2 3.95Å; F37-V111 HydrophobicContact CB-CG1 4.35Å; F37-V111 HydrophobicContact CD1-CG1 3.81Å; F37-V111 HydrophobicContact CE1-CG1 4.27Å; F37-V111 HydrophobicContact CG-CG1 4.04Å; H42-V111 VanDerWaalsContact NE2-CG2 3.27Å; H42-V111 WeakPolarHBondContact NE2-CG2 3.43Å; L106-V111 HydrophobicContact CD2-CB 4.23Å; L106-V111 PolarHBondContact O-N 2.75Å; L109-V111 HydrophobicContact CB-CG2 3.54Å; L109-V111 PolarHBondContact O-N 3.29Å; V111-H113 PolarHBondContact O-N 2.8Å; V111-F114 HydrophobicContact CB-CD2 4.24Å; V111-F114 HydrophobicContact CG1-CD2 3.56Å; V111-F114 HydrophobicContact CG1-CE2 4Å
112	K	56	Low	59.7	Low	167 Å²	167	83.9 Å²	83.9	73%	0.726	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-7.7	179.9	-68.1	-171.2	175.8	-175.8	0	114.4	H110 H115	H110-K112 VanDerWaalsContact C-N 3.32Å; H110-K112 PolarHBondContact O-N 2.96Å; K112-H115 PolarHBondContact O-CE1 2.84Å; K112-H115 VanDerWaalsContact O-CE1 3.25Å
113	H	53.8	Low	58.4	Low	117 Å²	117	89.1 Å²	89.1	54%	0.542	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	25.2	-171.8	-79.5	-73.6	0	0	0	115.4	F37 V111 H115	F37-H113 HydrophobicContact CE1-CB 4.34Å; V111-H113 PolarHBondContact O-N 2.8Å; H113-H115 AromaticContact ND1-CE1 3.83Å; H113-H115 AromaticContact ND1-ND1 3.96Å; H113-H115 PolarHBondContact O-N 2.89Å; H113-H115 VanDerWaalsContact O-N 3.09Å
114	F	52.3	Low	56.8	Low	32 Å²	32	90.4 Å²	90.4	14%	0.14	48%	0.482	C	S	.	.			trans	-83.1	69.3	158.9	-98.5	-93.7	0	0	0	110.5	M9 I10 F37 L106 V111 T116	M9-F114 HydrophobicContact CB-CZ 4.36Å; I10-F114 HydrophobicContact CB-CZ 4.49Å; I10-F114 HydrophobicContact CD1-CD2 4.11Å; I10-F114 HydrophobicContact CD1-CE1 4Å; I10-F114 HydrophobicContact CD1-CE2 3.13Å; I10-F114 HydrophobicContact CD1-CZ 3.12Å; I10-F114 HydrophobicContact CG1-CE1 4.13Å; I10-F114 HydrophobicContact CG1-CE2 3.28Å; I10-F114 HydrophobicContact CG1-CZ 3.02Å; F37-F114 HydrophobicContact CD1-CE2 4.27Å; F37-F114 HydrophobicContact CD2-CD2 4.05Å; F37-F114 AromaticContact CD2-CE2 3.09Å; F37-F114 HydrophobicContact CD2-CE2 3.09Å; F37-F114 AromaticContact CD2-CZ 3.42Å; F37-F114 HydrophobicContact CD2-CZ 3.42Å; F37-F114 VanDerWaalsContact CD2-CZ 3.42Å; F37-F114 HydrophobicContact CE1-CD2 4.16Å; F37-F114 HydrophobicContact CE1-CE2 4.1Å; F37-F114 HydrophobicContact CE2-CD1 4.49Å; F37-F114 AromaticContact CE2-CD2 3.68Å; F37-F114 HydrophobicContact CE2-CD2 3.68Å; F37-F114 AromaticContact CE2-CE1 3.84Å; F37-F114 HydrophobicContact CE2-CE1 3.84Å; F37-F114 AromaticContact CE2-CE2 2.92Å; F37-F114 HydrophobicContact CE2-CE2 2.92Å; F37-F114 HydrophobicContact CE2-CG 4.4Å; F37-F114 AromaticContact CE2-CZ 2.95Å; F37-F114 HydrophobicContact CE2-CZ 2.95Å; F37-F114 HydrophobicContact CG-CD2 4.47Å; F37-F114 AromaticContact CG-CE2 3.79Å; F37-F114 HydrophobicContact CG-CE2 3.79Å; F37-F114 HydrophobicContact CG-CZ 4.5Å; F37-F114 AromaticContact CZ-CD2 3.68Å; F37-F114 HydrophobicContact CZ-CD2 3.68Å; F37-F114 HydrophobicContact CZ-CE1 4.32Å; F37-F114 AromaticContact CZ-CE2 3.44Å; F37-F114 HydrophobicContact CZ-CE2 3.44Å; F37-F114 VanDerWaalsContact CZ-CE2 3.44Å; F37-F114 HydrophobicContact CZ-CG 4.25Å; F37-F114 AromaticContact CZ-CZ 3.72Å; F37-F114 HydrophobicContact CZ-CZ 3.72Å; L106-F114 HydrophobicContact CD1-CB 3.16Å; L106-F114 HydrophobicContact CD1-CD1 4.15Å; L106-F114 HydrophobicContact CD1-CD2 4.32Å; L106-F114 HydrophobicContact CD1-CG 3.65Å; L106-F114 HydrophobicContact CD2-CB 3.66Å; L106-F114 HydrophobicContact CD2-CD1 4.08Å; L106-F114 HydrophobicContact CD2-CD2 3.14Å; L106-F114 HydrophobicContact CD2-CE2 3.71Å; L106-F114 HydrophobicContact CD2-CG 3.34Å; L106-F114 HydrophobicContact CD2-CZ 4.44Å; L106-F114 HydrophobicContact CG-CB 3.91Å; L106-F114 HydrophobicContact CG-CD2 4.27Å; L106-F114 HydrophobicContact CG-CG 4.08Å; V111-F114 HydrophobicContact CB-CD2 4.24Å; V111-F114 HydrophobicContact CG1-CD2 3.56Å; V111-F114 HydrophobicContact CG1-CE2 4Å; F114-T116 PolarHBondContact O-N 2.78Å; F114-T116 VanDerWaalsContact O-N 3.14Å
115	H	46.4	Very low	54.8	Low	134 Å²	134	94.1 Å²	94.1	62%	0.62	51%	0.51	S	S	*	.			trans	-80.4	90.8	160.4	-56.8	67.2	0	0	0	104.1	K112 H113 G117	K112-H115 PolarHBondContact O-CE1 2.84Å; K112-H115 VanDerWaalsContact O-CE1 3.25Å; H113-H115 AromaticContact ND1-CE1 3.83Å; H113-H115 AromaticContact ND1-ND1 3.96Å; H113-H115 PolarHBondContact O-N 2.89Å; H113-H115 VanDerWaalsContact O-N 3.09Å; H115-G117 PolarHBondContact O-N 2.88Å
116	T	40.6	Very low	53.2	Low	104 Å²	104	102.8 Å²	102.8	64%	0.638	56%	0.555	S	S	*	*	S	Bend	trans	-57.8	78.1	163	-63.5	0	0	0	0	107.6	F114	F114-T116 PolarHBondContact O-N 2.78Å; F114-T116 VanDerWaalsContact O-N 3.14Å
117	G	36	Very low	51.7	Low	43 Å²	43	109.3 Å²	109.3	44%	0.443	59%	0.59	S	S	.	*			trans	155.1	69.7	-165.1	0	0	0	0	0	112.8	H115 K119	H115-G117 PolarHBondContact O-N 2.88Å; G117-K119 PolarHBondContact O-N 3.11Å
118	N	44.3	Very low	49.9	Very low	166 Å²	166	113 Å²	113	89%	0.888	60%	0.604	S	S	*	*			trans	-66	50.6	152.7	-173.3	33.7	0	0	0	111.1
119	K	41.5	Very low	48	Very low	176 Å²	176	121 Å²	121	77%	0.765	65%	0.646	S	S	*	*	S	Bend	trans	-141.8	117.6	178.9	-60.2	-77.7	-179.6	176.2	0	105	G117	G117-K119 PolarHBondContact O-N 3.11Å
120	I	37.4	Very low	46.4	Very low	157 Å²	157	128.4 Å²	128.4	81%	0.805	69%	0.685	S	S	*	*			trans	66.2	68	172.3	62.6	163.1	0	0	0	118.4	S122	I120-S122 PolarHBondContact O-N 2.83Å
121	S	35.9	Very low	45.1	Very low	130 Å²	130	128.4 Å²	128.4	91%	0.909	70%	0.698	S	S	*	*			trans	-83.7	56.2	137.9	73.1	0	0	0	0	109.2
122	S	41.6	Very low	44	Very low	90 Å²	90	135.9 Å²	135.9	63%	0.629	73%	0.732	S	S	*	*			trans	-88.6	119.2	156.1	-91	0	0	0	0	105.5	I120	I120-S122 PolarHBondContact O-N 2.83Å
123	V	46.4	Very low	43.4	Very low	121 Å²	121	134.3 Å²	134.3	73%	0.733	73%	0.727	S	S	*	*	S	Bend	trans	25.8	139.9	146.3	-44.2	0	0	0	0	118.2
124	E	40.2	Very low	42.8	Very low	185 Å²	185	138.7 Å²	138.7	86%	0.864	74%	0.74	S	S	*	*			trans	91.6	92	167.6	-56.9	174.1	165.6	0	0	116.4
125	S	38.6	Very low	42.3	Very low	110 Å²	110	142.6 Å²	142.6	77%	0.769	76%	0.763	S	S	*	*				-172.4	91.7	106.1	60.1	0	0	0	0	108.6	D127	S125-D127 PolarHBondContact O-N 2.79Å
126	L	46.6	Very low	42.4	Very low	181 Å²	181	146.7 Å²	146.7	95%	0.948	77%	0.774	S	S	*	*			trans	-83.2	67.5	168.3	-161.2	164.3	0	0	0	106.6
127	D	46.6	Very low	42.6	Very low	145 Å²	145	148.9 Å²	148.9	78%	0.775	78%	0.777	S	S	*	*			trans	-163.9	142.8	170.4	-155	22.6	0	0	0	108	S125	S125-D127 PolarHBondContact O-N 2.79Å
128	E	45.3	Very low	43.4	Very low	184 Å²	184	154.3 Å²	154.3	86%	0.86	80%	0.795	S	S	*	*			trans	77.7	62.8	-171	-62.1	-168.9	129.3	0	0	117.8
129	L	39.7	Very low	43.9	Very low	181 Å²	181	151.8 Å²	151.8	95%	0.948	79%	0.788	S	S	*	*			trans	-121.3	76.9	146.8	-88.5	167.4	0	0	0	109.3
130	D	44.9	Very low	44.7	Very low	155 Å²	155	152.6 Å²	152.6	83%	0.829	80%	0.795	S	S	*	*			trans	-122.5	79.3	156.6	-168.8	24.5	0	0	0	108.4
131	S	44.3	Very low	45.6	Very low	107 Å²	107	153.4 Å²	153.4	75%	0.748	80%	0.795	S	S	*	*	S	Bend	trans	-171.8	82.9	162.5	-81	0	0	0	0	110.9
132	Q	45.3	Very low	46.8	Very low	168 Å²	168	158.6 Å²	158.6	79%	0.785	79%	0.794	S	S	*	*			trans	57.9	108.8	141.7	-63.1	-147.6	-59.6	0	0	120.6
133	E	44.2	Very low	47.8	Very low	135 Å²	135	160.5 Å²	160.5	63%	0.631	80%	0.802	S	S	*	*				85.4	65.9	116	-154.4	174.5	-140.2	0	0	117.7
134	Y	39.9	Very low	48.7	Very low	209 Å²	209	161.5 Å²	161.5	82%	0.82	80%	0.802	S	S	*	*			trans	-137.9	82	136.2	-59.3	-73.4	0	0	0	108.2	Y136	Y134-Y136 PolarHBondContact O-N 2.65Å
135	N	43	Very low	49.7	Very low	114 Å²	114	155.6 Å²	155.6	61%	0.61	79%	0.791	S	S	*	*			trans	-66.1	86.1	178.7	-89.7	-81.1	0	0	0	110.8	Q137	N135-Q137 HydrophobicContact CB-CG 4.02Å; N135-Q137 PolarHBondContact O-N 2.95Å; N135-Q137 VanDerWaalsContact OD1-CG 3.28Å; N135-Q137 WeakPolarHBondContact OD1-CG 3.49Å; N135-Q137 PolarHBondContact OD1-NE2 2.7Å; N135-Q137 VanDerWaalsContact OD1-NE2 3.11Å
136	Y	49	Very low	50.9	Low	219 Å²	219	157.2 Å²	157.2	86%	0.859	79%	0.785	S	S	*	*			trans	-78.6	80.2	144.2	-67.7	-78.2	0	0	0	106.6	Y134 L138	Y134-Y136 PolarHBondContact O-N 2.65Å; Y136-L138 PolarHBondContact O-N 3.23Å
137	Q	44.8	Very low	51.5	Low	151 Å²	151	159.4 Å²	159.4	71%	0.706	79%	0.787	S	S	*	*			trans	-65.9	87.7	169.7	-76.2	172.5	-3.7	0	0	107.6	N135 P139	N135-Q137 HydrophobicContact CB-CG 4.02Å; N135-Q137 PolarHBondContact O-N 2.95Å; N135-Q137 VanDerWaalsContact OD1-CG 3.28Å; N135-Q137 WeakPolarHBondContact OD1-CG 3.49Å; N135-Q137 PolarHBondContact OD1-NE2 2.7Å; N135-Q137 VanDerWaalsContact OD1-NE2 3.11Å; Q137-P139 WeakPolarHBondContact O-CD 3.4Å
138	L	52.9	Low	52.3	Low	157 Å²	157	159.3 Å²	159.3	82%	0.822	78%	0.782	S	S	*	*			trans	-59.2	111.4	148.9	-74.4	160.3	0	0	0	104.4	Y136 Q140	Y136-L138 PolarHBondContact O-N 3.23Å; L138-Q140 PolarHBondContact O-N 2.6Å
139	P	53.2	Low	53.2	Low	113 Å²	113	154.3 Å²	154.3	73%	0.734	76%	0.761	S	S	*	*			trans	-59.8	118.9	174.2	24.3	-29.1	0	0	0	105.6	Q137 Q141	Q137-P139 WeakPolarHBondContact O-CD 3.4Å; P139-Q141 VanDerWaalsContact C-N 3.28Å; P139-Q141 PolarHBondContact O-N 3.42Å
140	Q	58.3	Low	54.4	Low	193 Å²	193	149.9 Å²	149.9	90%	0.902	74%	0.743	S	S	*	*			trans	-48.9	101.5	168.4	-73	161.4	-26.3	0	0	106.4	L138 R142	L138-Q140 PolarHBondContact O-N 2.6Å; Q140-R142 PolarHBondContact O-N 3.03Å
141	Q	58.1	Low	55.4	Low	173 Å²	173	152.4 Å²	152.4	81%	0.808	74%	0.742	S	S	*	*			trans	-60.6	116.9	179.5	-171.3	172.3	-15.4	0	0	104.8	P139 V143	P139-Q141 VanDerWaalsContact C-N 3.28Å; P139-Q141 PolarHBondContact O-N 3.42Å; Q141-V143 PolarHBondContact O-N 3.21Å
142	R	60.1	Low	56.3	Low	239 Å²	239	152.6 Å²	152.6	90%	0.902	74%	0.735	S	S	*	*			trans	-57.4	107.8	173.4	-72.1	-172.2	-157.1	177.3	6.4	106.3	Q140 L144	Q140-R142 PolarHBondContact O-N 3.03Å; R142-L144 PolarHBondContact O-N 2.91Å
143	V	61.7	Low	57	Low	131 Å²	131	149.8 Å²	149.8	79%	0.794	73%	0.731	S	S	*	*			trans	-74.5	115.3	174.2	-178.1	0	0	0	0	105.7	Q141 G145	Q141-V143 PolarHBondContact O-N 3.21Å; V143-G145 PolarHBondContact O-N 2.96Å; V143-G145 VanDerWaalsContact O-N 3.08Å
144	L	66.6	Low	57.7	Low	141 Å²	141	146.1 Å²	146.1	74%	0.738	73%	0.729	S	S	*	*			trans	-68.7	101.7	166.9	-122.1	96.5	0	0	0	106.7	R142 F146	R142-L144 PolarHBondContact O-N 2.91Å; L144-F146 HydrophobicContact CD2-CZ 4.36Å
145	G	60.9	Low	58.6	Low	61 Å²	61	142 Å²	142	63%	0.629	73%	0.731	S	S	*	*			trans	-84.3	118.4	167.8	0	0	0	0	0	108.9	V143	V143-G145 PolarHBondContact O-N 2.96Å; V143-G145 VanDerWaalsContact O-N 3.08Å
146	F	63.6	Low	59.3	Low	145 Å²	145	141.9 Å²	141.9	64%	0.636	74%	0.739	S	S	*	*			trans	-75.2	130.4	167	-62.1	-85.1	0	0	0	108	L144 Q148	L144-F146 HydrophobicContact CD2-CZ 4.36Å; F146-Q148 VanDerWaalsContact CB-O 3.31Å; F146-Q148 WeakPolarHBondContact CB-O 3.45Å; F146-Q148 PolarHBondContact O-N 3.1Å
147	F	59.6	Low	59.6	Low	226 Å²	226	136 Å²	136	99%	0.991	73%	0.73	S	S	*	*	S	Bend	trans	-66.1	-14	174	-95.5	-92.3	0	0	0	112.6
148	Q	62.7	Low	60.3	Low	144 Å²	144	132.8 Å²	132.8	67%	0.673	74%	0.737	S	S	*	*	S	Bend	trans	-139.6	141.9	-177.2	-162.2	160	25.2	0	0	110.2	F146	F146-Q148 VanDerWaalsContact CB-O 3.31Å; F146-Q148 WeakPolarHBondContact CB-O 3.45Å; F146-Q148 PolarHBondContact O-N 3.1Å
149	D	65.3	Low	60.6	Low	79 Å²	79	131.9 Å²	131.9	42%	0.422	73%	0.732	S	S	.	*			trans	-59.6	120.1	-175.1	-175.1	-15.5	0	0	0	111.1	Y151 L152	D149-Y151 PolarHBondContact O-N 2.89Å; D149-Y151 VanDerWaalsContact O-N 3.11Å; D149-Y151 WeakPolarHBondContact OD1-CB 3.37Å; D149-Y151 WeakPolarHBondContact OD1-CD2 3.32Å; D149-Y151 PolarHBondContact OD1-N 3.11Å; D149-L152 HydrophobicContact CB-CB 4.25Å; D149-L152 HydrophobicContact CB-CD1 3.84Å; D149-L152 HydrophobicContact CB-CG 3.84Å; D149-L152 PolarHBondContact O-N 2.8Å; D149-L152 VanDerWaalsContact O-N 3.1Å
150	P	64.8	Low	61.1	Low	87 Å²	87	132 Å²	132	57%	0.565	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-11.9	-179.6	25.9	-33.5	0	0	0	114
151	Y	65.1	Low	61.6	Low	208 Å²	208	127.7 Å²	127.7	82%	0.816	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-4.8	177	-57.2	-75.1	0	0	0	113.5	D149	D149-Y151 PolarHBondContact O-N 2.89Å; D149-Y151 VanDerWaalsContact O-N 3.11Å; D149-Y151 WeakPolarHBondContact OD1-CB 3.37Å; D149-Y151 WeakPolarHBondContact OD1-CD2 3.32Å; D149-Y151 PolarHBondContact OD1-N 3.11Å
152	L	63.5	Low	62.3	Low	112 Å²	112	126.7 Å²	126.7	59%	0.586	71%	0.714	S	S	*	*	S	Bend	trans	-89.7	120.5	170.2	-68	179	0	0	0	109.2	D149 G154	D149-L152 HydrophobicContact CB-CB 4.25Å; D149-L152 HydrophobicContact CB-CD1 3.84Å; D149-L152 HydrophobicContact CB-CG 3.84Å; D149-L152 PolarHBondContact O-N 2.8Å; D149-L152 VanDerWaalsContact O-N 3.1Å; L152-G154 PolarHBondContact O-N 2.65Å
153	P	59.8	Low	63.1	Low	109 Å²	109	120.4 Å²	120.4	71%	0.708	70%	0.702	S	S	*	*			trans	-64	109.4	172.9	24.5	-29.9	0	0	0	108.7	S155	P153-S155 PolarHBondContact O-N 3.14Å; P153-S155 PolarHBondContact O-OG 2.85Å
154	G	58.5	Low	63.7	Low	58 Å²	58	117.7 Å²	117.7	60%	0.598	69%	0.685	S	S	*	*			trans	-50.9	106.7	170.2	0	0	0	0	0	108.7	L152 S156	L152-G154 PolarHBondContact O-N 2.65Å; G154-S156 PolarHBondContact O-N 3.33Å
155	S	59	Low	64	Low	123 Å²	123	116 Å²	116	86%	0.86	68%	0.677	S	S	*	*	S	Bend	trans	-78.2	74.8	-173.4	-59.1	0	0	0	0	109.4	P153	P153-S155 PolarHBondContact O-N 3.14Å; P153-S155 PolarHBondContact O-OG 2.85Å
156	S	59	Low	64.7	Low	110 Å²	110	114.9 Å²	114.9	77%	0.769	67%	0.666	S	S	*	*			trans	-146.9	29.1	168.1	85.4	0	0	0	0	112.6	G154 G158	G154-S156 PolarHBondContact O-N 3.33Å; S156-G158 VanDerWaalsContact C-N 3.33Å; S156-G158 PolarHBondContact O-N 2.94Å
157	S	54.8	Low	65.6	Low	96 Å²	96	111.6 Å²	111.6	67%	0.671	66%	0.657	S	S	*	*			trans	-66.3	101.9	161.9	57.4	0	0	0	0	106.8	L159	S157-L159 PolarHBondContact O-N 3.39Å
158	G	59.3	Low	66.4	Low	83 Å²	83	104.7 Å²	104.7	86%	0.856	63%	0.63	S	S	*	*			trans	-64.6	25.8	172	0	0	0	0	0	113.7	S156	S156-G158 VanDerWaalsContact C-N 3.33Å; S156-G158 PolarHBondContact O-N 2.94Å
159	L	59.6	Low	66.9	Low	138 Å²	138	104.6 Å²	104.6	72%	0.723	63%	0.63	S	S	*	*	S	Bend	trans	-111.9	134.5	176.8	-62.3	177.5	0	0	0	107.9	S157	S157-L159 PolarHBondContact O-N 3.39Å
160	P	62.3	Low	67.2	Low	117 Å²	117	103.9 Å²	103.9	76%	0.76	64%	0.641	S	S	*	*			trans	-64.9	140.4	179.9	26.3	-32.9	0	0	0	110.9	M162	P160-M162 VanDerWaalsContact C-N 3.29Å; P160-M162 PolarHBondContact O-N 3.31Å
161	D	69.7	Low	67.6	Low	101 Å²	101	107.5 Å²	107.5	54%	0.54	65%	0.648	S	S	.	*			trans	-72.7	85	176.1	-169.8	-18.3	0	0	0	110.4	V163 V164 D165	D161-V163 PolarHBondContact O-N 2.98Å; D161-V163 PolarHBondContact OD1-N 2.91Å; D161-V164 HydrophobicContact CB-CB 4.22Å; D161-V164 HydrophobicContact CB-CG2 4.43Å; D161-V164 VanDerWaalsContact CG-CG2 3.45Å; D161-V164 PolarHBondContact O-N 3.44Å; D161-V164 PolarHBondContact OD1-N 2.77Å; D161-V164 VanDerWaalsContact OD1-N 3.09Å; D161-V164 WeakPolarHBondContact OD2-CG2 3.42Å; D161-D165 WeakPolarHBondContact O-CB 3.31Å; D161-D165 PolarHBondContact O-N 3.18Å
162	M	72.4	Confident	67.9	Low	153 Å²	153	104.2 Å²	104.2	75%	0.754	64%	0.635	S	S	*	*	H	α-helix	trans	-64.3	-23.4	-177.1	-162.2	-176	78.9	0	0	112.6	P160 G166	P160-M162 VanDerWaalsContact C-N 3.29Å; P160-M162 PolarHBondContact O-N 3.31Å; M162-G166 PolarHBondContact O-N 3.4Å
163	V	77.3	Confident	67.9	Low	107 Å²	107	104.5 Å²	104.5	65%	0.648	64%	0.644	S	S	*	*	H	α-helix	trans	-75	-47.5	178.6	180	0	0	0	0	109.5	D161 D165 G166 V167	D161-V163 PolarHBondContact O-N 2.98Å; D161-V163 PolarHBondContact OD1-N 2.91Å; V163-D165 VanDerWaalsContact C-N 3.32Å; V163-D165 PolarHBondContact O-N 3.49Å; V163-G166 PolarHBondContact O-N 3.09Å; V163-V167 WeakPolarHBondContact O-CB 3.09Å; V163-V167 VanDerWaalsContact O-CG2 3.26Å; V163-V167 WeakPolarHBondContact O-CG2 3.47Å; V163-V167 PolarHBondContact O-N 3.33Å
164	V	74.6	Confident	67.8	Low	73 Å²	73	107.6 Å²	107.6	44%	0.442	64%	0.642	S	S	.	*	H	α-helix	trans	-63.3	-41.2	174.9	172.9	0	0	0	0	110.9	D161 V167 L168	D161-V164 HydrophobicContact CB-CB 4.22Å; D161-V164 HydrophobicContact CB-CG2 4.43Å; D161-V164 VanDerWaalsContact CG-CG2 3.45Å; D161-V164 PolarHBondContact O-N 3.44Å; D161-V164 PolarHBondContact OD1-N 2.77Å; D161-V164 VanDerWaalsContact OD1-N 3.09Å; D161-V164 WeakPolarHBondContact OD2-CG2 3.42Å; V164-V167 PolarHBondContact O-N 2.92Å; V164-L168 HydrophobicContact CG1-CD1 3.84Å; V164-L168 HydrophobicContact CG1-CG 4.37Å; V164-L168 WeakPolarHBondContact O-CB 3.4Å; V164-L168 VanDerWaalsContact O-CG 3.31Å; V164-L168 WeakPolarHBondContact O-CG 3.47Å; V164-L168 PolarHBondContact O-N 3.26Å
165	D	72.5	Confident	67.7	Low	106 Å²	106	113.3 Å²	113.3	57%	0.567	66%	0.659	S	S	*	*	H	α-helix	trans	-61.8	-47.5	177.2	-167	49.3	0	0	0	112.1	D161 V163 V167 L168 Q169	D161-D165 WeakPolarHBondContact O-CB 3.31Å; D161-D165 PolarHBondContact O-N 3.18Å; V163-D165 VanDerWaalsContact C-N 3.32Å; V163-D165 PolarHBondContact O-N 3.49Å; D165-V167 PolarHBondContact O-N 2.98Å; D165-L168 PolarHBondContact O-N 2.88Å; D165-Q169 WeakPolarHBondContact O-CB 3.26Å; D165-Q169 PolarHBondContact O-N 2.96Å
166	G	75.9	Confident	67.5	Low	38 Å²	38	112 Å²	112	39%	0.392	65%	0.645	S	S	.	*	H	α-helix	trans	-63.2	-39.3	177.6	0	0	0	0	0	113.3	M162 V163 Q169 G170	M162-G166 PolarHBondContact O-N 3.4Å; V163-G166 PolarHBondContact O-N 3.09Å; G166-Q169 PolarHBondContact O-N 2.83Å; G166-G170 PolarHBondContact O-N 3.42Å
167	V	82.9	Confident	67.2	Low	76 Å²	76	119 Å²	119	46%	0.461	66%	0.655	S	S	.	*	H	α-helix	trans	-64.5	-47.9	175.3	170.5	0	0	0	0	110.3	V163 V164 D165 Q169 G170 F171	V163-V167 WeakPolarHBondContact O-CB 3.09Å; V163-V167 VanDerWaalsContact O-CG2 3.26Å; V163-V167 WeakPolarHBondContact O-CG2 3.47Å; V163-V167 PolarHBondContact O-N 3.33Å; V164-V167 PolarHBondContact O-N 2.92Å; D165-V167 PolarHBondContact O-N 2.98Å; V167-Q169 VanDerWaalsContact C-N 3.31Å; V167-Q169 PolarHBondContact O-N 3.24Å; V167-G170 PolarHBondContact O-N 3.01Å; V167-G170 VanDerWaalsContact O-N 3.14Å; V167-F171 HydrophobicContact CG1-CD2 3.67Å; V167-F171 HydrophobicContact CG1-CE2 3.8Å; V167-F171 VanDerWaalsContact O-CD2 3.26Å; V167-F171 WeakPolarHBondContact O-CD2 3.26Å; V167-F171 PolarHBondContact O-N 3.05Å
168	L	75	Confident	66.7	Low	81 Å²	81	117.8 Å²	117.8	42%	0.424	64%	0.643	S	S	.	*	H	α-helix	trans	-62.9	-37	178.1	-72.6	172.3	0	0	0	112.2	V164 D165 G170 F171 Y172	V164-L168 HydrophobicContact CG1-CD1 3.84Å; V164-L168 HydrophobicContact CG1-CG 4.37Å; V164-L168 WeakPolarHBondContact O-CB 3.4Å; V164-L168 VanDerWaalsContact O-CG 3.31Å; V164-L168 WeakPolarHBondContact O-CG 3.47Å; V164-L168 PolarHBondContact O-N 3.26Å; D165-L168 PolarHBondContact O-N 2.88Å; L168-G170 VanDerWaalsContact C-N 3.32Å; L168-G170 PolarHBondContact O-N 3.48Å; L168-F171 PolarHBondContact O-N 3.14Å; L168-Y172 HydrophobicContact CD2-CD2 3.99Å; L168-Y172 HydrophobicContact CD2-CE2 3.94Å; L168-Y172 WeakPolarHBondContact O-CA 3.48Å; L168-Y172 WeakPolarHBondContact O-CB 3.42Å; L168-Y172 PolarHBondContact O-N 2.93Å
169	Q	73.5	Confident	66.4	Low	141 Å²	141	119.2 Å²	119.2	66%	0.659	64%	0.64	S	S	*	*	H	α-helix	trans	-64.3	-36.5	174.4	-171.3	173.6	24.9	0	0	112.3	D165 G166 V167	D165-Q169 WeakPolarHBondContact O-CB 3.26Å; D165-Q169 PolarHBondContact O-N 2.96Å; G166-Q169 PolarHBondContact O-N 2.83Å; V167-Q169 VanDerWaalsContact C-N 3.31Å; V167-Q169 PolarHBondContact O-N 3.24Å
170	G	71.4	Confident	66	Low	65 Å²	65	121 Å²	121	67%	0.67	64%	0.642	S	S	*	*	H	α-helix	trans	-70.5	-37.4	176.6	0	0	0	0	0	113.6	G166 V167 L168	G166-G170 PolarHBondContact O-N 3.42Å; V167-G170 PolarHBondContact O-N 3.01Å; V167-G170 VanDerWaalsContact O-N 3.14Å; L168-G170 VanDerWaalsContact C-N 3.32Å; L168-G170 PolarHBondContact O-N 3.48Å
171	F	74.1	Confident	65.4	Low	162 Å²	162	120.9 Å²	120.9	71%	0.711	64%	0.644	S	S	*	*	H	α-helix	trans	-85.9	-26.4	179.8	-78.6	-75.3	0	0	0	113.7	V167 L168	V167-F171 HydrophobicContact CG1-CD2 3.67Å; V167-F171 HydrophobicContact CG1-CE2 3.8Å; V167-F171 VanDerWaalsContact O-CD2 3.26Å; V167-F171 WeakPolarHBondContact O-CD2 3.26Å; V167-F171 PolarHBondContact O-N 3.05Å; L168-F171 PolarHBondContact O-N 3.14Å
172	Y	70.1	Confident	64.2	Low	139 Å²	139	120.5 Å²	120.5	55%	0.545	66%	0.655	S	S	.	*	S	Bend	trans	-131.7	89.3	-177.9	-56.1	-82.2	0	0	0	109.7	L168 R174	L168-Y172 HydrophobicContact CD2-CD2 3.99Å; L168-Y172 HydrophobicContact CD2-CE2 3.94Å; L168-Y172 WeakPolarHBondContact O-CA 3.48Å; L168-Y172 WeakPolarHBondContact O-CB 3.42Å; L168-Y172 PolarHBondContact O-N 2.93Å; Y172-R174 PolarHBondContact O-N 3.29Å
173	P	63.8	Low	62.8	Low	119 Å²	119	118.3 Å²	118.3	77%	0.773	66%	0.655	S	S	*	*			trans	-63.2	107.2	174.1	24.3	-31.1	0	0	0	109
174	R	58.6	Low	61.5	Low	173 Å²	173	121 Å²	121	65%	0.653	66%	0.664	S	S	*	*			trans	-103.1	111.4	-179.9	-69.4	-171.3	-173.1	-160.5	2.9	110.4	Y172 V176	Y172-R174 PolarHBondContact O-N 3.29Å; R174-V176 PolarHBondContact O-N 3.39Å
175	D	55.2	Low	60	Low	178 Å²	178	124.7 Å²	124.7	95%	0.952	68%	0.68	S	S	*	*	S	Bend	trans	-68	32.3	156.1	-91.6	-44.9	0	0	0	112.4
176	V	55.9	Low	58.7	Low	96 Å²	96	124.5 Å²	124.5	58%	0.582	69%	0.685	S	S	*	*			trans	-138.5	102.8	-178.9	-173.3	0	0	0	0	108.2	R174 V178	R174-V176 PolarHBondContact O-N 3.39Å; V176-V178 HydrophobicContact CG1-CG2 3.83Å; V176-V178 PolarHBondContact O-N 2.87Å
177	R	52.3	Low	57.3	Low	258 Å²	258	130.4 Å²	130.4	97%	0.974	71%	0.707	S	S	*	*			trans	-63.3	112.4	167.7	-87.2	-178.2	155.2	-160.4	-5.3	108.6
178	V	44.9	Very low	55.3	Low	70 Å²	70	135.9 Å²	135.9	42%	0.424	73%	0.728	S	S	.	*			trans	-117.8	104.4	167.2	-160.8	0	0	0	0	108.1	V176 F180	V176-V178 HydrophobicContact CG1-CG2 3.83Å; V176-V178 PolarHBondContact O-N 2.87Å; V178-F180 HydrophobicContact CB-CD2 4.32Å; V178-F180 HydrophobicContact CB-CE2 3.77Å; V178-F180 HydrophobicContact CB-CZ 4.12Å; V178-F180 HydrophobicContact CG1-CD1 4.23Å; V178-F180 HydrophobicContact CG1-CD2 3.9Å; V178-F180 HydrophobicContact CG1-CE1 3.73Å; V178-F180 HydrophobicContact CG1-CE2 3.36Å; V178-F180 HydrophobicContact CG1-CG 4.32Å; V178-F180 HydrophobicContact CG1-CZ 3.28Å
179	S	51.7	Low	53.6	Low	113 Å²	113	139.1 Å²	139.1	79%	0.79	75%	0.745	S	S	*	*			trans	-85	108.1	167.3	49.9	0	0	0	0	108.3	S181	S179-S181 PolarHBondContact O-N 3.44Å
180	F	51.8	Low	51.8	Low	176 Å²	176	140.8 Å²	140.8	77%	0.772	78%	0.783	S	S	*	*			trans	-89	96.5	168.1	-64.9	-76.8	0	0	0	108.2	V178	V178-F180 HydrophobicContact CB-CD2 4.32Å; V178-F180 HydrophobicContact CB-CE2 3.77Å; V178-F180 HydrophobicContact CB-CZ 4.12Å; V178-F180 HydrophobicContact CG1-CD1 4.23Å; V178-F180 HydrophobicContact CG1-CD2 3.9Å; V178-F180 HydrophobicContact CG1-CE1 3.73Å; V178-F180 HydrophobicContact CG1-CE2 3.36Å; V178-F180 HydrophobicContact CG1-CG 4.32Å; V178-F180 HydrophobicContact CG1-CZ 3.28Å
181	S	49.2	Very low	50.8	Low	113 Å²	113	144.6 Å²	144.6	79%	0.79	79%	0.789	S	S	*	*			trans	-69.1	131.9	162.2	49.6	0	0	0	0	108.6	S179 S183	S179-S181 PolarHBondContact O-N 3.44Å; S181-S183 PolarHBondContact O-N 3.43Å
182	A	46	Very low	49.6	Very low	94 Å²	94	143.6 Å²	143.6	78%	0.777	79%	0.793	S	S	*	*			trans	-52.3	127.5	-179.7	0	0	0	0	0	111.4	I184	A182-I184 PolarHBondContact O-N 2.99Å
183	S	43	Very low	48.5	Very low	107 Å²	107	143.9 Å²	143.9	75%	0.748	81%	0.807	S	S	*	*			trans	-69.1	108.3	169.5	48.4	0	0	0	0	108.8	S181 L185	S181-S183 PolarHBondContact O-N 3.43Å; S183-L185 PolarHBondContact O-N 3.43Å
184	I	48.8	Very low	47.6	Very low	164 Å²	164	145.4 Å²	145.4	84%	0.841	81%	0.809	S	S	*	*			trans	-66	108.6	163.8	-56.8	170.1	0	0	0	106	A182	A182-I184 PolarHBondContact O-N 2.99Å
185	L	42.9	Very low	46.9	Very low	149 Å²	149	143.6 Å²	143.6	78%	0.78	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-93.8	137.1	162.2	-86.9	164.7	0	0	0	107.9	S183	S183-L185 PolarHBondContact O-N 3.43Å
186	P	46.7	Very low	46.3	Very low	103 Å²	103	141.3 Å²	141.3	67%	0.669	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-74.6	144.6	-172.9	31.4	-32	0	0	0	110.6	H188	P186-H188 PolarHBondContact O-N 2.96Å
187	D	45.6	Very low	45.6	Very low	161 Å²	161	144.6 Å²	144.6	86%	0.861	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-48.3	124.8	165.7	-71.1	-57	0	0	0	109.9
188	H	40.2	Very low	45.1	Very low	191 Å²	191	135.8 Å²	135.8	88%	0.884	81%	0.814	S	S	*	*			trans	-96.4	103.3	165.6	-133.7	-72.3	0	0	0	107.3	P186	P186-H188 PolarHBondContact O-N 2.96Å
189	D	39.6	Very low	45.1	Very low	149 Å²	149	141.3 Å²	141.3	80%	0.797	85%	0.847	S	S	*	*			trans	-60.4	147.8	167.3	-97.8	-54.2	0	0	0	111.4
190	A	36.2	Very low	44.5	Very low	176 Å²	176	143.9 Å²	143.9	100%	1.455	85%	0.852	S	S	*	*			trans	83	0	166.5	0	0	0	0	0	118.9

Retrieved 190 of 190 residues in 98.1 ms (Link to these results)

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