A0A077ZAR8_TRITR Loading...

HTH Tnp IS630 and DnaJ domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZAR8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 503 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.3	Very low	46	Very low	234 Å²	234	71.9 Å²	71.9	100%	1.153	38%	0.381	S	S	*	.				0	86.4	0	-79.5	-172.9	-86.9	0	0	108.2	V3	M1-V3 PolarHBondContact O-N 3.17Å; M1-V3 VanDerWaalsContact O-N 3.16Å
2	T	31.1	Very low	46.6	Very low	143 Å²	143	72.1 Å²	72.1	88%	0.877	39%	0.387	S	S	*	.			trans	-70.6	101.6	160.2	31	0	0	0	0	105.8	S4	T2-S4 PolarHBondContact O-N 3.44Å
3	V	35.8	Very low	47	Very low	78 Å²	78	69.9 Å²	69.9	47%	0.473	37%	0.374	S	S	.	.			trans	-58.8	112.9	163.9	180	0	0	0	0	104.5	M1 F5 V7	M1-V3 PolarHBondContact O-N 3.17Å; M1-V3 VanDerWaalsContact O-N 3.16Å; V3-F5 PolarHBondContact O-N 3.13Å; V3-V7 HydrophobicContact CG1-CB 3.98Å; V3-V7 HydrophobicContact CG1-CG1 3.95Å
4	S	54.3	Low	46.7	Very low	37 Å²	37	71.6 Å²	71.6	26%	0.259	39%	0.388	S	S	.	.			trans	-50.9	131.8	175.8	161.8	0	0	0	0	107.5	T2 V6 V7 Q8 D55	T2-S4 PolarHBondContact O-N 3.44Å; S4-V6 PolarHBondContact O-N 2.99Å; S4-V6 VanDerWaalsContact O-N 3.1Å; S4-V6 WeakPolarHBondContact OG-CB 3.45Å; S4-V6 WeakPolarHBondContact OG-CG2 3.48Å; S4-V6 PolarHBondContact OG-N 2.7Å; S4-V7 WeakPolarHBondContact O-CA 3.49Å; S4-V7 VanDerWaalsContact O-CB 3.31Å; S4-V7 WeakPolarHBondContact O-CB 3.17Å; S4-V7 PolarHBondContact O-N 2.88Å; S4-Q8 PolarHBondContact O-N 3.16Å; S4-D55 PolarHBondContact OG-OD1 3.08Å; S4-D55 VanDerWaalsContact OG-OD1 3.07Å; S4-D55 PolarHBondContact OG-OD2 3.4Å
5	F	52.6	Low	46.4	Very low	100 Å²	100	78.2 Å²	78.2	44%	0.439	42%	0.415	S	S	.	.	H	α-helix	trans	-57.9	-20.6	175.2	-91.2	-94.6	0	0	0	111.1	V3 Q8 Y9 D55	V3-F5 PolarHBondContact O-N 3.13Å; F5-Q8 PolarHBondContact O-N 3.38Å; F5-Y9 WeakPolarHBondContact O-CA 3.47Å; F5-Y9 WeakPolarHBondContact O-CB 3.49Å; F5-Y9 PolarHBondContact O-N 3.2Å; F5-D55 VanDerWaalsContact C-OD1 3.29Å; F5-D55 WeakPolarHBondContact CA-OD1 3.43Å; F5-D55 WeakPolarHBondContact CB-OD1 3.42Å; F5-D55 PolarHBondContact N-OD1 3.46Å
6	V	48	Very low	45.9	Very low	9 Å²	9	81.7 Å²	81.7	6%	0.055	43%	0.429	C	S	.	.	H	α-helix	trans	-61	-45.5	166.2	-176.7	0	0	0	0	111.5	S4 Y9 L10 H53 P54 D55 V124	S4-V6 PolarHBondContact O-N 2.99Å; S4-V6 VanDerWaalsContact O-N 3.1Å; S4-V6 WeakPolarHBondContact OG-CB 3.45Å; S4-V6 WeakPolarHBondContact OG-CG2 3.48Å; S4-V6 PolarHBondContact OG-N 2.7Å; V6-Y9 PolarHBondContact O-N 3.2Å; V6-L10 HydrophobicContact CG1-CD1 3.8Å; V6-L10 HydrophobicContact CG1-CG 4.27Å; V6-L10 VanDerWaalsContact O-CB 3.27Å; V6-L10 WeakPolarHBondContact O-CB 3.5Å; V6-L10 WeakPolarHBondContact O-CG 3.23Å; V6-L10 PolarHBondContact O-N 3.39Å; V6-H53 WeakPolarHBondContact CG2-CE1 3.27Å; V6-H53 WeakPolarHBondContact CG2-NE2 3.44Å; V6-P54 HydrophobicContact CB-CG 4.23Å; V6-P54 HydrophobicContact CG2-CG 3.77Å; V6-D55 PolarHBondContact N-OD1 3.23Å; V6-V124 HydrophobicContact CG1-CG2 4.32Å
7	V	49.3	Very low	45.5	Very low	12 Å²	12	84.2 Å²	84.2	7%	0.073	46%	0.455	C	S	.	.	H	α-helix	trans	-67	-43.4	177.5	177.6	0	0	0	0	109.3	V3 S4 Y9 L11 P125	V3-V7 HydrophobicContact CG1-CB 3.98Å; V3-V7 HydrophobicContact CG1-CG1 3.95Å; S4-V7 WeakPolarHBondContact O-CA 3.49Å; S4-V7 VanDerWaalsContact O-CB 3.31Å; S4-V7 WeakPolarHBondContact O-CB 3.17Å; S4-V7 PolarHBondContact O-N 2.88Å; V7-Y9 PolarHBondContact O-N 3.37Å; V7-L11 HydrophobicContact CG1-CD1 3.75Å; V7-L11 HydrophobicContact CG1-CG 4.44Å; V7-L11 VanDerWaalsContact O-CB 3.23Å; V7-L11 WeakPolarHBondContact O-CB 3.23Å; V7-L11 WeakPolarHBondContact O-CD1 3.49Å; V7-L11 WeakPolarHBondContact O-CG 3.49Å; V7-L11 PolarHBondContact O-N 3.46Å; V7-P125 HydrophobicContact CG2-CG 3.75Å
8	Q	50.7	Low	45.2	Very low	89 Å²	89	82.7 Å²	82.7	42%	0.416	45%	0.449	S	S	.	.	H	α-helix	trans	-61.5	-43.9	174.6	-163.7	66.3	19.1	0	0	111.3	S4 F5 L11 T12	S4-Q8 PolarHBondContact O-N 3.16Å; F5-Q8 PolarHBondContact O-N 3.38Å; Q8-L11 CarbonylContact O-C 3.45Å; Q8-L11 WeakPolarHBondContact O-CB 3.37Å; Q8-L11 PolarHBondContact O-N 3.32Å; Q8-T12 HydrophobicContact CG-CG2 4.22Å; Q8-T12 WeakPolarHBondContact O-CB 3.46Å; Q8-T12 VanDerWaalsContact O-CG2 3.23Å; Q8-T12 WeakPolarHBondContact O-CG2 3.24Å; Q8-T12 PolarHBondContact O-N 2.96Å; Q8-T12 PolarHBondContact O-OG1 2.89Å
9	Y	55	Low	45.4	Very low	16 Å²	16	85.6 Å²	85.6	6%	0.063	47%	0.469	C	S	.	.	H	α-helix	trans	-65.9	-45	179.2	169.3	-108	0	0	0	112.5	F5 V6 V7 L11 T12 M13 P54 A64 F67	F5-Y9 WeakPolarHBondContact O-CA 3.47Å; F5-Y9 WeakPolarHBondContact O-CB 3.49Å; F5-Y9 PolarHBondContact O-N 3.2Å; V6-Y9 PolarHBondContact O-N 3.2Å; V7-Y9 PolarHBondContact O-N 3.37Å; Y9-L11 PolarHBondContact O-N 3.03Å; Y9-T12 WeakPolarHBondContact CA-OG1 3.43Å; Y9-T12 PolarHBondContact O-N 3.03Å; Y9-T12 PolarHBondContact O-OG1 2.9Å; Y9-M13 HydrophobicContact CD2-CE 4.26Å; Y9-M13 HydrophobicContact CE2-CE 3.26Å; Y9-M13 HydrophobicContact CE2-CG 4.25Å; Y9-M13 VanDerWaalsContact O-CG 3.24Å; Y9-M13 WeakPolarHBondContact O-CG 3.4Å; Y9-M13 PolarHBondContact O-N 3.34Å; Y9-M13 WeakPolarHBondContact OH-CE 3.37Å; Y9-P54 HydrophobicContact CD1-CB 4.35Å; Y9-P54 HydrophobicContact CD1-CG 3.87Å; Y9-P54 HydrophobicContact CG-CB 4.02Å; Y9-P54 HydrophobicContact CG-CG 4.02Å; Y9-A64 HydrophobicContact CD2-CB 3.57Å; Y9-A64 HydrophobicContact CE2-CB 3Å; Y9-A64 PolarHBondContact OH-O 3.44Å; Y9-F67 HydrophobicContact CE1-CD1 4.19Å
10	L	51.8	Low	45.8	Very low	11 Å²	11	83 Å²	83	6%	0.058	45%	0.454	C	S	.	.	H	α-helix	trans	-64.5	-32	173.5	-70.3	170.3	0	0	0	111	V6 R110 V113 V124	V6-L10 HydrophobicContact CG1-CD1 3.8Å; V6-L10 HydrophobicContact CG1-CG 4.27Å; V6-L10 VanDerWaalsContact O-CB 3.27Å; V6-L10 WeakPolarHBondContact O-CB 3.5Å; V6-L10 WeakPolarHBondContact O-CG 3.23Å; V6-L10 PolarHBondContact O-N 3.39Å; L10-R110 VanDerWaalsContact C-CZ 3.5Å; L10-R110 HydrophobicContact CB-CG 4.32Å; L10-R110 HydrophobicContact CD2-CG 3.88Å; L10-R110 VanDerWaalsContact O-CD 3.22Å; L10-R110 WeakPolarHBondContact O-CD 3.22Å; L10-R110 PolarHBondContact O-NE 3.24Å; L10-R110 PolarHBondContact O-NH1 3.06Å; L10-V113 HydrophobicContact CD2-CG1 4.22Å; L10-V124 HydrophobicContact CD1-CG1 3.37Å; L10-V124 HydrophobicContact CD1-CG2 4.37Å
11	L	49.5	Very low	46.3	Very low	62 Å²	62	82.8 Å²	82.8	33%	0.325	45%	0.453	S	S	.	.	H	α-helix	trans	-76.8	-36.1	174.7	-73.6	166.2	0	0	0	113.2	V7 Q8 Y9 M13 T14 R110	V7-L11 HydrophobicContact CG1-CD1 3.75Å; V7-L11 HydrophobicContact CG1-CG 4.44Å; V7-L11 VanDerWaalsContact O-CB 3.23Å; V7-L11 WeakPolarHBondContact O-CB 3.23Å; V7-L11 WeakPolarHBondContact O-CD1 3.49Å; V7-L11 WeakPolarHBondContact O-CG 3.49Å; V7-L11 PolarHBondContact O-N 3.46Å; Q8-L11 CarbonylContact O-C 3.45Å; Q8-L11 WeakPolarHBondContact O-CB 3.37Å; Q8-L11 PolarHBondContact O-N 3.32Å; Y9-L11 PolarHBondContact O-N 3.03Å; L11-M13 VanDerWaalsContact C-N 3.33Å; L11-T14 VanDerWaalsContact O-CG2 3.3Å; L11-T14 WeakPolarHBondContact O-CG2 3.35Å; L11-T14 PolarHBondContact O-OG1 3.37Å; L11-R110 VanDerWaalsContact CD2-NH2 3.32Å
12	T	52.9	Low	47.6	Very low	74 Å²	74	73.7 Å²	73.7	45%	0.454	42%	0.415	S	S	.	.	H	α-helix	trans	-83.5	-7.5	-179.1	55.1	0	0	0	0	113.5	Q8 Y9 T14	Q8-T12 HydrophobicContact CG-CG2 4.22Å; Q8-T12 WeakPolarHBondContact O-CB 3.46Å; Q8-T12 VanDerWaalsContact O-CG2 3.23Å; Q8-T12 WeakPolarHBondContact O-CG2 3.24Å; Q8-T12 PolarHBondContact O-N 2.96Å; Q8-T12 PolarHBondContact O-OG1 2.89Å; Y9-T12 WeakPolarHBondContact CA-OG1 3.43Å; Y9-T12 PolarHBondContact O-N 3.03Å; Y9-T12 PolarHBondContact O-OG1 2.9Å; T12-T14 PolarHBondContact O-N 2.95Å
13	M	52.1	Low	49.1	Very low	44 Å²	44	73.6 Å²	73.6	22%	0.217	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	30.5	164.5	-82.2	-78.2	150.1	0	0	113.2	Y9 L11 M106	Y9-M13 HydrophobicContact CD2-CE 4.26Å; Y9-M13 HydrophobicContact CE2-CE 3.26Å; Y9-M13 HydrophobicContact CE2-CG 4.25Å; Y9-M13 VanDerWaalsContact O-CG 3.24Å; Y9-M13 WeakPolarHBondContact O-CG 3.4Å; Y9-M13 PolarHBondContact O-N 3.34Å; Y9-M13 WeakPolarHBondContact OH-CE 3.37Å; L11-M13 VanDerWaalsContact C-N 3.33Å; M13-M106 VanDerWaalsContact O-CE 3.27Å; M13-M106 WeakPolarHBondContact O-CE 3.15Å; M13-M106 WeakPolarHBondContact O-CG 3.41Å; M13-M106 HydrophobicContact SD-CE 4.1Å
14	T	42.6	Very low	50.9	Low	94 Å²	94	73.1 Å²	73.1	58%	0.577	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-6.1	178.6	46.8	0	0	0	0	113.5	L11 T12	L11-T14 VanDerWaalsContact O-CG2 3.3Å; L11-T14 WeakPolarHBondContact O-CG2 3.35Å; L11-T14 PolarHBondContact O-OG1 3.37Å; T12-T14 PolarHBondContact O-N 2.95Å
15	E	41.7	Very low	52.5	Low	170 Å²	170	73.1 Å²	73.1	79%	0.794	40%	0.398	S	S	*	.	S	Bend	trans	-129.5	4.4	-164.3	-70.8	-177.8	172	0	0	116.8
16	Q	38.9	Very low	54.3	Low	134 Å²	134	68.6 Å²	68.6	63%	0.626	38%	0.378	S	S	*	.			trans	-139.3	98.8	-179.5	-66.5	-173.2	-6.2	0	0	113.9	T18 M106	Q16-T18 VanDerWaalsContact C-N 3.26Å; Q16-T18 HydrophobicContact CB-CG2 4.36Å; Q16-T18 PolarHBondContact O-N 2.74Å; Q16-M106 WeakPolarHBondContact O-CE 3.47Å
17	S	39.4	Very low	56.4	Low	125 Å²	125	68.3 Å²	68.3	87%	0.874	38%	0.376	S	S	*	.			trans	-64.2	79.9	168.4	-41.5	0	0	0	0	110.6
18	T	40.5	Very low	58.5	Low	57 Å²	57	75.6 Å²	75.6	35%	0.35	41%	0.406	S	S	.	.			trans	-98.6	109	173.2	57.8	0	0	0	0	110.2	Q16 I20 K68	Q16-T18 VanDerWaalsContact C-N 3.26Å; Q16-T18 HydrophobicContact CB-CG2 4.36Å; Q16-T18 PolarHBondContact O-N 2.74Å; T18-I20 PolarHBondContact O-N 3.3Å; T18-K68 PolarHBondContact O-NZ 3.19Å; T18-K68 PolarHBondContact OG1-NZ 3.16Å
19	V	48.3	Very low	60.4	Low	138 Å²	138	72.6 Å²	72.6	84%	0.836	39%	0.393	S	S	*	.			trans	-55.9	120.1	167.9	179.8	0	0	0	0	107.4	D21	V19-D21 PolarHBondContact O-N 3.07Å
20	I	52.5	Low	62.2	Low	32 Å²	32	71.9 Å²	71.9	16%	0.164	39%	0.39	C	S	.	.			trans	-62.1	120.3	169.6	-55.7	152.2	0	0	0	105.4	T18 A22 I72	T18-I20 PolarHBondContact O-N 3.3Å; I20-A22 PolarHBondContact O-N 3.3Å; I20-I72 HydrophobicContact CD1-CD1 3.42Å; I20-I72 VanDerWaalsContact CD1-CD1 3.42Å; I20-I72 HydrophobicContact CD1-CG1 4.46Å; I20-I72 HydrophobicContact CG1-CD1 3.87Å
21	D	58.1	Low	64.2	Low	79 Å²	79	78 Å²	78	42%	0.422	42%	0.423	S	S	.	.			trans	-57	108.6	177.5	-177.3	1.6	0	0	0	108.6	V19 N23 K24	V19-D21 PolarHBondContact O-N 3.07Å; D21-N23 PolarHBondContact O-N 2.87Å; D21-N23 WeakPolarHBondContact OD1-CB 3.28Å; D21-N23 PolarHBondContact OD1-N 3.47Å; D21-N23 PolarHBondContact OD1-ND2 3.15Å; D21-N23 VanDerWaalsContact OD1-ND2 3.11Å; D21-K24 HydrophobicContact CB-CD 4.29Å; D21-K24 HydrophobicContact CB-CG 4.13Å; D21-K24 PolarHBondContact O-N 2.97Å
22	A	55.6	Low	66.3	Low	43 Å²	43	76.4 Å²	76.4	36%	0.355	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-3	-175.1	0	0	0	0	0	113.1	I20 P91	I20-A22 PolarHBondContact O-N 3.3Å; A22-P91 WeakPolarHBondContact O-CB 3.3Å; A22-P91 WeakPolarHBondContact O-CG 3.48Å
23	N	62.4	Low	68.2	Low	141 Å²	141	79.9 Å²	79.9	75%	0.754	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-4.5	176.5	-61.2	-51.1	0	0	0	114.6	D21 D25	D21-N23 PolarHBondContact O-N 2.87Å; D21-N23 WeakPolarHBondContact OD1-CB 3.28Å; D21-N23 PolarHBondContact OD1-N 3.47Å; D21-N23 PolarHBondContact OD1-ND2 3.15Å; D21-N23 VanDerWaalsContact OD1-ND2 3.11Å; N23-D25 PolarHBondContact O-N 3.42Å
24	K	72.3	Confident	70.1	Confident	68 Å²	68	84.3 Å²	84.3	30%	0.296	45%	0.445	S	S	.	.			trans	-79.4	124.4	-178	-68.6	-176.2	178.7	-175	0	111.8	D21 F26 I29 E69	D21-K24 HydrophobicContact CB-CD 4.29Å; D21-K24 HydrophobicContact CB-CG 4.13Å; D21-K24 PolarHBondContact O-N 2.97Å; K24-F26 PolarHBondContact O-N 3.05Å; K24-I29 HydrophobicContact CB-CD1 3.97Å; K24-I29 HydrophobicContact CB-CG1 4.48Å; K24-E69 IonicContact NZ-OE1 3.52Å; K24-E69 PolarHBondContact NZ-OE1 3.22Å; K24-E69 IonicContact NZ-OE2 2.77Å; K24-E69 PolarHBondContact NZ-OE2 3.19Å; K24-E69 VanDerWaalsContact NZ-OE2 3.14Å
25	D	87.4	Confident	72.5	Confident	38 Å²	38	85 Å²	85	20%	0.203	45%	0.449	C	S	.	.			trans	-77.1	114.6	177.4	-175	-3.1	0	0	0	110.9	N23 Y27 K28 I29 Y86	N23-D25 PolarHBondContact O-N 3.42Å; D25-Y27 PolarHBondContact O-N 3.31Å; D25-Y27 WeakPolarHBondContact OD1-CD2 3.38Å; D25-Y27 PolarHBondContact OD1-N 3.33Å; D25-Y27 VanDerWaalsContact OD1-N 3.14Å; D25-K28 HydrophobicContact CB-CB 4.14Å; D25-K28 HydrophobicContact CB-CD 3.98Å; D25-K28 HydrophobicContact CB-CG 3.91Å; D25-K28 WeakPolarHBondContact O-CA 3.5Å; D25-K28 WeakPolarHBondContact O-CB 3.45Å; D25-K28 PolarHBondContact O-N 2.87Å; D25-I29 WeakPolarHBondContact O-CG1 3.25Å; D25-I29 PolarHBondContact O-N 3.45Å; D25-Y86 VanDerWaalsContact CA-OH 3.28Å; D25-Y86 WeakPolarHBondContact CA-OH 3.43Å; D25-Y86 PolarHBondContact OD1-OH 2.85Å
26	F	90.9	Very high	74.9	Confident	4 Å²	4	77.1 Å²	77.1	2%	0.018	41%	0.413	C	S	.	.	H	α-helix	trans	-56.5	-32.6	-179.8	-65.1	-17.7	0	0	0	113.5	K24 K28 I29 L30 I72 A73 V76 L77 Y86 P91	K24-F26 PolarHBondContact O-N 3.05Å; F26-K28 VanDerWaalsContact C-N 3.34Å; F26-I29 HydrophobicContact CD1-CD1 3.87Å; F26-I29 HydrophobicContact CE1-CD1 4.48Å; F26-I29 PolarHBondContact O-N 3.19Å; F26-L30 PolarHBondContact O-N 3.22Å; F26-L30 VanDerWaalsContact O-N 3.13Å; F26-I72 HydrophobicContact CE1-CG2 4.19Å; F26-I72 HydrophobicContact CZ-CG2 4.02Å; F26-A73 HydrophobicContact CB-CB 3.81Å; F26-A73 HydrophobicContact CD1-CB 4.07Å; F26-A73 HydrophobicContact CG-CB 4.03Å; F26-V76 HydrophobicContact CD2-CB 3.83Å; F26-V76 HydrophobicContact CD2-CG1 3.79Å; F26-V76 HydrophobicContact CD2-CG2 4.24Å; F26-V76 HydrophobicContact CE2-CB 3.82Å; F26-V76 HydrophobicContact CE2-CG1 3.82Å; F26-V76 HydrophobicContact CE2-CG2 3.71Å; F26-V76 HydrophobicContact CZ-CG2 4.49Å; F26-L77 HydrophobicContact CB-CD1 3.68Å; F26-L77 HydrophobicContact CB-CD2 4.27Å; F26-L77 HydrophobicContact CB-CG 3.92Å; F26-Y86 HydrophobicContact CB-CE1 4.2Å; F26-Y86 HydrophobicContact CB-CE2 4.09Å; F26-Y86 HydrophobicContact CD1-CE2 4.33Å; F26-Y86 HydrophobicContact CD2-CD1 4.46Å; F26-Y86 AromaticContact CD2-CD2 3.31Å; F26-Y86 HydrophobicContact CD2-CD2 3.31Å; F26-Y86 HydrophobicContact CD2-CE1 4.34Å; F26-Y86 AromaticContact CD2-CE2 3.15Å; F26-Y86 HydrophobicContact CD2-CE2 3.15Å; F26-Y86 AromaticContact CD2-CG 3.99Å; F26-Y86 HydrophobicContact CD2-CG 3.99Å; F26-Y86 AromaticContact CD2-CZ 3.74Å; F26-Y86 AromaticContact CE2-CD2 3.48Å; F26-Y86 HydrophobicContact CE2-CD2 3.48Å; F26-Y86 VanDerWaalsContact CE2-CD2 3.48Å; F26-Y86 AromaticContact CE2-CE2 3.51Å; F26-Y86 HydrophobicContact CE2-CE2 3.51Å; F26-Y86 HydrophobicContact CE2-CG 4.42Å; F26-Y86 HydrophobicContact CG-CD2 4.22Å; F26-Y86 AromaticContact CG-CE2 3.61Å; F26-Y86 HydrophobicContact CG-CE2 3.61Å; F26-Y86 AromaticContact CG-CZ 3.83Å; F26-Y86 HydrophobicContact CZ-CE2 4.26Å; F26-Y86 PolarHBondContact N-OH 3.19Å; F26-P91 HydrophobicContact CZ-CB 4.41Å
27	Y	93.4	Very high	77.3	Confident	4 Å²	4	74.2 Å²	74.2	2%	0.016	40%	0.404	C	S	.	.	H	α-helix	trans	-66.1	-39.4	175.4	-67.1	-76.8	0	0	0	111.1	D25 L30 D31 V32 K34 L77 R83 Y86 D87	D25-Y27 PolarHBondContact O-N 3.31Å; D25-Y27 WeakPolarHBondContact OD1-CD2 3.38Å; D25-Y27 PolarHBondContact OD1-N 3.33Å; D25-Y27 VanDerWaalsContact OD1-N 3.14Å; Y27-L30 PolarHBondContact O-N 3.23Å; Y27-D31 PolarHBondContact O-N 2.91Å; Y27-V32 HydrophobicContact CD1-CG2 4.13Å; Y27-V32 PolarHBondContact O-N 2.91Å; Y27-K34 HydrophobicContact CD1-CG 4.44Å; Y27-K34 HydrophobicContact CD2-CD 4.38Å; Y27-K34 HydrophobicContact CD2-CG 3.73Å; Y27-K34 HydrophobicContact CE2-CB 4.42Å; Y27-K34 HydrophobicContact CE2-CD 4.38Å; Y27-K34 HydrophobicContact CE2-CG 3.93Å; Y27-K34 HydrophobicContact CG-CG 4Å; Y27-L77 HydrophobicContact CD1-CD1 3.83Å; Y27-L77 HydrophobicContact CD1-CD2 4.26Å; Y27-L77 HydrophobicContact CD2-CD2 4.39Å; Y27-L77 HydrophobicContact CE1-CD1 4.08Å; Y27-L77 HydrophobicContact CE1-CD2 3.75Å; Y27-L77 HydrophobicContact CE2-CD2 3.93Å; Y27-L77 HydrophobicContact CG-CD1 4.14Å; Y27-R83 WeakPolarHBondContact OH-CG 3.5Å; Y27-R83 PolarHBondContact OH-NE 2.9Å; Y27-Y86 HydrophobicContact CD2-CD1 4.5Å; Y27-Y86 AromaticContact CD2-CE1 3.71Å; Y27-Y86 HydrophobicContact CD2-CE1 3.71Å; Y27-Y86 AromaticContact CE2-CD1 3.88Å; Y27-Y86 HydrophobicContact CE2-CD1 3.88Å; Y27-Y86 AromaticContact CE2-CE1 3.51Å; Y27-Y86 HydrophobicContact CE2-CE1 3.51Å; Y27-D87 VanDerWaalsContact CE2-OD1 3.23Å; Y27-D87 WeakPolarHBondContact CE2-OD1 3.31Å; Y27-D87 VanDerWaalsContact OH-CG 3.32Å; Y27-D87 PolarHBondContact OH-OD1 3.47Å; Y27-D87 PolarHBondContact OH-OD2 2.85Å
28	K	92.5	Very high	79.5	Confident	164 Å²	164	74.2 Å²	74.2	71%	0.713	39%	0.39	S	S	*	.	H	α-helix	trans	-70.6	-34.5	175.2	-63.9	-175.6	-176.1	177.4	0	112.7	D25 F26 L30 D31	D25-K28 HydrophobicContact CB-CB 4.14Å; D25-K28 HydrophobicContact CB-CD 3.98Å; D25-K28 HydrophobicContact CB-CG 3.91Å; D25-K28 WeakPolarHBondContact O-CA 3.5Å; D25-K28 WeakPolarHBondContact O-CB 3.45Å; D25-K28 PolarHBondContact O-N 2.87Å; F26-K28 VanDerWaalsContact C-N 3.34Å; K28-L30 VanDerWaalsContact C-N 3.27Å; K28-L30 PolarHBondContact O-N 3.45Å; K28-D31 PolarHBondContact O-N 3.22Å; K28-D31 VanDerWaalsContact O-N 3.17Å
29	I	91.6	Very high	81.5	Confident	27 Å²	27	74.5 Å²	74.5	14%	0.138	40%	0.399	C	S	.	.	H	α-helix	trans	-61.9	-40.8	175.4	-64.8	175.6	0	0	0	110.3	K24 D25 F26 D31 L48 E69 I70 A73	K24-I29 HydrophobicContact CB-CD1 3.97Å; K24-I29 HydrophobicContact CB-CG1 4.48Å; D25-I29 WeakPolarHBondContact O-CG1 3.25Å; D25-I29 PolarHBondContact O-N 3.45Å; F26-I29 HydrophobicContact CD1-CD1 3.87Å; F26-I29 HydrophobicContact CE1-CD1 4.48Å; F26-I29 PolarHBondContact O-N 3.19Å; I29-D31 VanDerWaalsContact C-N 3.32Å; I29-L48 VanDerWaalsContact O-CD1 3.3Å; I29-L48 WeakPolarHBondContact O-CD1 3.48Å; I29-E69 HydrophobicContact CD1-CB 4.26Å; I29-E69 HydrophobicContact CG2-CB 4.1Å; I29-I70 HydrophobicContact CG2-CG1 3.99Å; I29-A73 HydrophobicContact CB-CB 4.03Å; I29-A73 HydrophobicContact CD1-CB 4.4Å; I29-A73 HydrophobicContact CG2-CB 3.9Å
30	L	92.1	Very high	83.5	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.005	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-4.1	176.8	-66.3	-172.9	0	0	0	114	F26 Y27 K28 V32 I41 A44 L48 I70 A73 L77	F26-L30 PolarHBondContact O-N 3.22Å; F26-L30 VanDerWaalsContact O-N 3.13Å; Y27-L30 PolarHBondContact O-N 3.23Å; K28-L30 VanDerWaalsContact C-N 3.27Å; K28-L30 PolarHBondContact O-N 3.45Å; L30-V32 VanDerWaalsContact C-N 3.35Å; L30-V32 HydrophobicContact CB-CG1 4.5Å; L30-V32 HydrophobicContact CB-CG2 3.9Å; L30-V32 PolarHBondContact O-N 3.4Å; L30-I41 HydrophobicContact CD1-CG2 3.87Å; L30-A44 WeakPolarHBondContact O-CB 3.42Å; L30-L48 HydrophobicContact CD2-CD1 4.23Å; L30-I70 HydrophobicContact CD2-CG2 3.94Å; L30-A73 HydrophobicContact CD1-CB 4.36Å; L30-A73 HydrophobicContact CD2-CB 4.18Å; L30-A73 HydrophobicContact CG-CB 3.88Å; L30-L77 HydrophobicContact CD1-CD1 3.91Å
31	D	93.3	Very high	85.2	Confident	138 Å²	138	71.3 Å²	71.3	74%	0.738	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	46.8	-176.3	-162.3	33.6	0	0	0	112.6	Y27 K28 I29	Y27-D31 PolarHBondContact O-N 2.91Å; K28-D31 PolarHBondContact O-N 3.22Å; K28-D31 VanDerWaalsContact O-N 3.17Å; I29-D31 VanDerWaalsContact C-N 3.32Å
32	V	94.3	Very high	86.4	Confident	29 Å²	29	71.3 Å²	71.3	18%	0.176	37%	0.37	C	S	.	.			trans	-130.7	154.4	179.4	-64.5	0	0	0	0	111.4	Y27 L30 A36 I41 A44	Y27-V32 HydrophobicContact CD1-CG2 4.13Å; Y27-V32 PolarHBondContact O-N 2.91Å; L30-V32 VanDerWaalsContact C-N 3.35Å; L30-V32 HydrophobicContact CB-CG1 4.5Å; L30-V32 HydrophobicContact CB-CG2 3.9Å; L30-V32 PolarHBondContact O-N 3.4Å; V32-A36 HydrophobicContact CB-CB 3.86Å; V32-A36 HydrophobicContact CG2-CB 4.25Å; V32-I41 HydrophobicContact CG2-CG1 4.41Å; V32-A44 HydrophobicContact CG1-CB 3.39Å
33	E	93.1	Very high	87.8	Confident	147 Å²	147	73.1 Å²	73.1	69%	0.687	38%	0.377	S	S	*	.			trans	-73.6	157.4	172.9	-63.8	-168	169.8	0	0	112	T35 A36	E33-T35 WeakPolarHBondContact CB-OG1 3.23Å; E33-T35 PolarHBondContact O-N 3.07Å; E33-T35 VanDerWaalsContact O-N 3.13Å; E33-T35 PolarHBondContact OE2-OG1 3.48Å; E33-A36 WeakPolarHBondContact O-CB 3.37Å; E33-A36 PolarHBondContact O-N 3.36Å
34	K	91.5	Very high	89	Confident	138 Å²	138	67 Å²	67	60%	0.6	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-20.7	174.7	-66	-165.9	175.5	-170.9	0	113.5	Y27 A36 R83	Y27-K34 HydrophobicContact CD1-CG 4.44Å; Y27-K34 HydrophobicContact CD2-CD 4.38Å; Y27-K34 HydrophobicContact CD2-CG 3.73Å; Y27-K34 HydrophobicContact CE2-CB 4.42Å; Y27-K34 HydrophobicContact CE2-CD 4.38Å; Y27-K34 HydrophobicContact CE2-CG 3.93Å; Y27-K34 HydrophobicContact CG-CG 4Å; K34-A36 VanDerWaalsContact C-N 3.33Å; K34-R83 PolarHBondContact O-NH2 3.44Å
35	T	91.9	Very high	89.6	Confident	108 Å²	108	63.8 Å²	63.8	66%	0.663	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-5.4	176	46.2	0	0	0	0	113.2	E33 T37	E33-T35 WeakPolarHBondContact CB-OG1 3.23Å; E33-T35 PolarHBondContact O-N 3.07Å; E33-T35 VanDerWaalsContact O-N 3.13Å; E33-T35 PolarHBondContact OE2-OG1 3.48Å; T35-T37 PolarHBondContact O-N 3.4Å
36	A	91.9	Very high	89.3	Confident	4 Å²	4	66.9 Å²	66.9	3%	0.033	34%	0.341	C	S	.	.			trans	-58.3	135.7	-174.3	0	0	0	0	0	112.2	V32 E33 K34 E40 I41 R83	V32-A36 HydrophobicContact CB-CB 3.86Å; V32-A36 HydrophobicContact CG2-CB 4.25Å; E33-A36 WeakPolarHBondContact O-CB 3.37Å; E33-A36 PolarHBondContact O-N 3.36Å; K34-A36 VanDerWaalsContact C-N 3.33Å; A36-E40 VanDerWaalsContact CA-OE2 3.28Å; A36-E40 WeakPolarHBondContact CA-OE2 3.36Å; A36-E40 HydrophobicContact CB-CB 4.15Å; A36-I41 HydrophobicContact CB-CG1 4.14Å; A36-R83 VanDerWaalsContact O-CZ 3.28Å; A36-R83 PolarHBondContact O-NH1 2.99Å; A36-R83 PolarHBondContact O-NH2 3.23Å
37	T	90.4	Very high	89.1	Confident	73 Å²	73	73.9 Å²	73.9	45%	0.448	37%	0.371	S	S	.	.			trans	-68.6	161.1	173.6	62.5	0	0	0	0	111	T35 A39 E40 I41	T35-T37 PolarHBondContact O-N 3.4Å; T37-A39 PolarHBondContact O-N 3.46Å; T37-E40 PolarHBondContact N-OE2 3.47Å; T37-E40 PolarHBondContact O-N 3.34Å; T37-E40 VanDerWaalsContact O-N 3.15Å; T37-E40 VanDerWaalsContact OG1-CD 3.31Å; T37-E40 WeakPolarHBondContact OG1-CG 3.3Å; T37-E40 PolarHBondContact OG1-N 2.68Å; T37-E40 PolarHBondContact OG1-OE2 2.92Å; T37-I41 WeakPolarHBondContact O-CG1 3.49Å; T37-I41 PolarHBondContact O-N 2.89Å
38	E	85.4	Confident	88.8	Confident	125 Å²	125	74.8 Å²	74.8	58%	0.584	38%	0.376	S	S	*	.	H	α-helix	trans	-56.8	-35.1	174.7	-168.5	-172.8	158.1	0	0	111.9	K42	E38-K42 WeakPolarHBondContact O-CB 3.44Å; E38-K42 PolarHBondContact O-N 3.25Å
39	A	82.9	Confident	88.1	Confident	64 Å²	64	67 Å²	67	53%	0.529	34%	0.342	S	S	.	.	H	α-helix	trans	-64.2	-44.9	176.7	0	0	0	0	0	112.1	T37 K42 V43	T37-A39 PolarHBondContact O-N 3.46Å; A39-K42 PolarHBondContact O-N 3.37Å; A39-V43 WeakPolarHBondContact O-CG2 3.46Å; A39-V43 PolarHBondContact O-N 2.89Å
40	E	88.9	Confident	87.4	Confident	102 Å²	102	67.5 Å²	67.5	48%	0.477	35%	0.345	S	S	.	.	H	α-helix	trans	-65.6	-44.3	178	-72.9	161.9	156.3	0	0	111.5	A36 T37 K42 V43 A44	A36-E40 VanDerWaalsContact CA-OE2 3.28Å; A36-E40 WeakPolarHBondContact CA-OE2 3.36Å; A36-E40 HydrophobicContact CB-CB 4.15Å; T37-E40 PolarHBondContact N-OE2 3.47Å; T37-E40 PolarHBondContact O-N 3.34Å; T37-E40 VanDerWaalsContact O-N 3.15Å; T37-E40 VanDerWaalsContact OG1-CD 3.31Å; T37-E40 WeakPolarHBondContact OG1-CG 3.3Å; T37-E40 PolarHBondContact OG1-N 2.68Å; T37-E40 PolarHBondContact OG1-OE2 2.92Å; E40-K42 VanDerWaalsContact C-N 3.26Å; E40-K42 PolarHBondContact O-N 3.03Å; E40-V43 PolarHBondContact O-N 3.3Å; E40-V43 VanDerWaalsContact O-N 3.14Å; E40-A44 WeakPolarHBondContact O-CB 3.21Å; E40-A44 PolarHBondContact O-N 3.44Å
41	I	88.6	Confident	87	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-56	-43.3	174.4	-70.7	166.4	0	0	0	110.7	L30 V32 A36 T37 A44 Y45 Y74 L77	L30-I41 HydrophobicContact CD1-CG2 3.87Å; V32-I41 HydrophobicContact CG2-CG1 4.41Å; A36-I41 HydrophobicContact CB-CG1 4.14Å; T37-I41 WeakPolarHBondContact O-CG1 3.49Å; T37-I41 PolarHBondContact O-N 2.89Å; I41-A44 PolarHBondContact O-N 3.03Å; I41-Y45 WeakPolarHBondContact O-CB 3.32Å; I41-Y45 PolarHBondContact O-N 2.77Å; I41-Y74 HydrophobicContact CG2-CD2 3.79Å; I41-Y74 HydrophobicContact CG2-CE2 4.08Å; I41-L77 HydrophobicContact CD1-CB 4.2Å; I41-L77 HydrophobicContact CG2-CB 4.2Å
42	K	83.7	Confident	86.4	Confident	79 Å²	79	68.4 Å²	68.4	34%	0.343	34%	0.342	S	S	.	.	H	α-helix	trans	-69.9	-34.8	178.4	-172.1	176.5	-177.4	178.6	0	113.3	E38 A39 E40 R46 Y74	E38-K42 WeakPolarHBondContact O-CB 3.44Å; E38-K42 PolarHBondContact O-N 3.25Å; A39-K42 PolarHBondContact O-N 3.37Å; E40-K42 VanDerWaalsContact C-N 3.26Å; E40-K42 PolarHBondContact O-N 3.03Å; K42-R46 WeakPolarHBondContact O-CB 3.5Å; K42-R46 VanDerWaalsContact O-CG 3.3Å; K42-R46 WeakPolarHBondContact O-CG 3.48Å; K42-R46 PolarHBondContact O-N 3.08Å; K42-R46 PolarHBondContact O-NE 3.42Å; K42-Y74 HydrophobicContact CB-CE2 4.18Å; K42-Y74 HydrophobicContact CG-CE2 4.41Å
43	V	84.7	Confident	85.3	Confident	81 Å²	81	67.5 Å²	67.5	49%	0.491	34%	0.335	S	S	.	.	H	α-helix	trans	-68.3	-45.7	173.9	170.7	0	0	0	0	110.2	A39 E40 R46 K47	A39-V43 WeakPolarHBondContact O-CG2 3.46Å; A39-V43 PolarHBondContact O-N 2.89Å; E40-V43 PolarHBondContact O-N 3.3Å; E40-V43 VanDerWaalsContact O-N 3.14Å; V43-R46 PolarHBondContact O-N 2.69Å; V43-K47 PolarHBondContact O-N 3.37Å
44	A	88.9	Confident	84.1	Confident	14 Å²	14	60.5 Å²	60.5	12%	0.116	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-46.6	-179.8	0	0	0	0	0	112.4	L30 V32 E40 I41 R46 K47 L48	L30-A44 WeakPolarHBondContact O-CB 3.42Å; V32-A44 HydrophobicContact CG1-CB 3.39Å; E40-A44 WeakPolarHBondContact O-CB 3.21Å; E40-A44 PolarHBondContact O-N 3.44Å; I41-A44 PolarHBondContact O-N 3.03Å; A44-R46 VanDerWaalsContact C-N 3.33Å; A44-R46 PolarHBondContact O-N 3Å; A44-K47 PolarHBondContact O-N 3.46Å; A44-L48 WeakPolarHBondContact O-CG 3.49Å; A44-L48 PolarHBondContact O-N 3.33Å
45	Y	84.8	Confident	82.7	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-55.3	-47.6	172.5	171.4	-110.4	0	0	0	111.8	I41 K47 L48 A49 I70 Y74 L116 I120	I41-Y45 WeakPolarHBondContact O-CB 3.32Å; I41-Y45 PolarHBondContact O-N 2.77Å; Y45-K47 PolarHBondContact O-N 2.85Å; Y45-L48 PolarHBondContact O-N 3.24Å; Y45-A49 HydrophobicContact CE1-CB 4.48Å; Y45-A49 HydrophobicContact CE2-CB 4.16Å; Y45-A49 WeakPolarHBondContact O-CB 3.43Å; Y45-A49 PolarHBondContact O-N 3.28Å; Y45-I70 HydrophobicContact CD2-CG2 3.52Å; Y45-I70 HydrophobicContact CE2-CG2 3.81Å; Y45-Y74 AromaticContact CD1-CD1 3.82Å; Y45-Y74 HydrophobicContact CD1-CD1 3.82Å; Y45-Y74 AromaticContact CD1-CD2 3.94Å; Y45-Y74 HydrophobicContact CD1-CD2 3.94Å; Y45-Y74 AromaticContact CD1-CE1 4Å; Y45-Y74 HydrophobicContact CD1-CE1 4Å; Y45-Y74 HydrophobicContact CD1-CE2 4.11Å; Y45-Y74 AromaticContact CD1-CG 3.78Å; Y45-Y74 HydrophobicContact CD1-CG 3.78Å; Y45-Y74 HydrophobicContact CD2-CD1 4.18Å; Y45-Y74 HydrophobicContact CD2-CD2 4.21Å; Y45-Y74 AromaticContact CD2-CG 3.66Å; Y45-Y74 HydrophobicContact CD2-CG 3.66Å; Y45-Y74 HydrophobicContact CE1-CD1 4Å; Y45-Y74 HydrophobicContact CE1-CE1 4.21Å; Y45-Y74 HydrophobicContact CE1-CG 4.34Å; Y45-Y74 HydrophobicContact CE2-CD1 4.38Å; Y45-Y74 HydrophobicContact CE2-CG 4.27Å; Y45-Y74 AromaticContact CG-CD1 3.93Å; Y45-Y74 HydrophobicContact CG-CD1 3.93Å; Y45-Y74 AromaticContact CG-CD2 3.56Å; Y45-Y74 HydrophobicContact CG-CD2 3.56Å; Y45-Y74 HydrophobicContact CG-CE1 4.48Å; Y45-Y74 HydrophobicContact CG-CE2 4.16Å; Y45-Y74 AromaticContact CG-CG 3.42Å; Y45-Y74 HydrophobicContact CG-CG 3.42Å; Y45-Y74 VanDerWaalsContact CG-CG 3.42Å; Y45-L116 HydrophobicContact CE1-CB 4.47Å; Y45-L116 WeakPolarHBondContact OH-CB 3.36Å; Y45-I120 HydrophobicContact CD1-CG2 3.76Å; Y45-I120 HydrophobicContact CE1-CB 4.47Å; Y45-I120 HydrophobicContact CE1-CD1 3.76Å; Y45-I120 HydrophobicContact CE1-CG1 4.24Å; Y45-I120 HydrophobicContact CE1-CG2 3.49Å; Y45-I120 VanDerWaalsContact CE1-CG2 3.49Å
46	R	80.2	Confident	81.6	Confident	103 Å²	103	56.3 Å²	56.3	39%	0.389	27%	0.274	S	S	.	.	H	α-helix	trans	-58.8	-47.9	179.3	-80.4	-178.6	-75.2	176.3	-0.3	112.1	K42 V43 A44 L48 A49 I50 I120	K42-R46 WeakPolarHBondContact O-CB 3.5Å; K42-R46 VanDerWaalsContact O-CG 3.3Å; K42-R46 WeakPolarHBondContact O-CG 3.48Å; K42-R46 PolarHBondContact O-N 3.08Å; K42-R46 PolarHBondContact O-NE 3.42Å; V43-R46 PolarHBondContact O-N 2.69Å; A44-R46 VanDerWaalsContact C-N 3.33Å; A44-R46 PolarHBondContact O-N 3Å; R46-L48 VanDerWaalsContact C-N 3.35Å; R46-L48 PolarHBondContact O-N 2.88Å; R46-A49 PolarHBondContact O-N 3.3Å; R46-I50 WeakPolarHBondContact O-CD1 3.33Å; R46-I50 VanDerWaalsContact O-CG1 3.28Å; R46-I50 WeakPolarHBondContact O-CG1 3.38Å; R46-I50 PolarHBondContact O-N 2.71Å; R46-I50 VanDerWaalsContact O-N 3.08Å; R46-I120 HydrophobicContact CG-CB 4.11Å; R46-I120 HydrophobicContact CG-CG2 3.65Å
47	K	86.3	Confident	80.8	Confident	150 Å²	150	58.5 Å²	58.5	65%	0.652	29%	0.285	S	S	*	.	H	α-helix	trans	-58.3	-46.7	178.6	-175.7	-179.5	179.4	-176.9	0	111.6	V43 A44 Y45 K51	V43-K47 PolarHBondContact O-N 3.37Å; A44-K47 PolarHBondContact O-N 3.46Å; Y45-K47 PolarHBondContact O-N 2.85Å; K47-K51 WeakPolarHBondContact O-CB 3.33Å; K47-K51 PolarHBondContact O-N 3.45Å; K47-K51 VanDerWaalsContact O-N 3.12Å
48	L	86.7	Confident	80	Confident	23 Å²	23	61.5 Å²	61.5	12%	0.12	30%	0.298	C	S	.	.	H	α-helix	trans	-73.4	-38.4	-178.2	-68.4	172	0	0	0	112.6	I29 L30 A44 Y45 R46 I50 K51 Y52 I70	I29-L48 VanDerWaalsContact O-CD1 3.3Å; I29-L48 WeakPolarHBondContact O-CD1 3.48Å; L30-L48 HydrophobicContact CD2-CD1 4.23Å; A44-L48 WeakPolarHBondContact O-CG 3.49Å; A44-L48 PolarHBondContact O-N 3.33Å; Y45-L48 PolarHBondContact O-N 3.24Å; R46-L48 VanDerWaalsContact C-N 3.35Å; R46-L48 PolarHBondContact O-N 2.88Å; L48-I50 VanDerWaalsContact C-N 3.33Å; L48-I50 PolarHBondContact O-N 3.32Å; L48-K51 PolarHBondContact O-N 2.88Å; L48-Y52 HydrophobicContact CD2-CD2 4.39Å; L48-Y52 HydrophobicContact CD2-CE2 3.94Å; L48-Y52 WeakPolarHBondContact O-CD2 3.09Å; L48-Y52 PolarHBondContact O-N 3.26Å; L48-I70 HydrophobicContact CB-CD1 3.69Å; L48-I70 HydrophobicContact CB-CG1 4.1Å; L48-I70 HydrophobicContact CB-CG2 3.87Å; L48-I70 HydrophobicContact CD1-CG1 4.33Å
49	A	79.8	Confident	78.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-42.8	176.2	0	0	0	0	0	111.4	Y45 R46 H53 F67 I120	Y45-A49 HydrophobicContact CE1-CB 4.48Å; Y45-A49 HydrophobicContact CE2-CB 4.16Å; Y45-A49 WeakPolarHBondContact O-CB 3.43Å; Y45-A49 PolarHBondContact O-N 3.28Å; R46-A49 PolarHBondContact O-N 3.3Å; A49-H53 WeakPolarHBondContact O-CB 3.45Å; A49-H53 PolarHBondContact O-N 3.27Å; A49-H53 VanDerWaalsContact O-N 3.12Å; A49-F67 HydrophobicContact CB-CD2 4.49Å; A49-F67 HydrophobicContact CB-CE2 3.75Å; A49-F67 VanDerWaalsContact O-CE2 3.28Å; A49-F67 WeakPolarHBondContact O-CE2 3.47Å; A49-I120 HydrophobicContact CB-CD1 3.85Å
50	I	76.9	Confident	78.6	Confident	38 Å²	38	55.8 Å²	55.8	20%	0.195	27%	0.273	C	S	.	.	H	α-helix	trans	-68.5	-40.1	176.4	-63.2	164.8	0	0	0	111	R46 L48 R56 L341 E345	R46-I50 WeakPolarHBondContact O-CD1 3.33Å; R46-I50 VanDerWaalsContact O-CG1 3.28Å; R46-I50 WeakPolarHBondContact O-CG1 3.38Å; R46-I50 PolarHBondContact O-N 2.71Å; R46-I50 VanDerWaalsContact O-N 3.08Å; L48-I50 VanDerWaalsContact C-N 3.33Å; L48-I50 PolarHBondContact O-N 3.32Å; I50-R56 WeakPolarHBondContact O-CD 3.28Å; I50-L341 HydrophobicContact CD1-CD2 4.12Å; I50-E345 WeakPolarHBondContact CG2-OE1 3.14Å
51	K	83.3	Confident	77.9	Confident	109 Å²	109	55.6 Å²	55.6	47%	0.474	28%	0.281	S	S	.	.	H	α-helix	trans	-63	-47.4	178.8	-176.4	178.4	179.3	-174.9	0	112.6	K47 L48 N57	K47-K51 WeakPolarHBondContact O-CB 3.33Å; K47-K51 PolarHBondContact O-N 3.45Å; K47-K51 VanDerWaalsContact O-N 3.12Å; L48-K51 PolarHBondContact O-N 2.88Å; K51-N57 PolarHBondContact O-ND2 2.97Å
52	Y	80.9	Confident	77.5	Confident	50 Å²	50	62.7 Å²	62.7	20%	0.196	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	13.4	-175	-66.5	-73.1	0	0	0	113.6	L48 A63 R66 I70	L48-Y52 HydrophobicContact CD2-CD2 4.39Å; L48-Y52 HydrophobicContact CD2-CE2 3.94Å; L48-Y52 WeakPolarHBondContact O-CD2 3.09Å; L48-Y52 PolarHBondContact O-N 3.26Å; Y52-A63 HydrophobicContact CD1-CB 4.4Å; Y52-R66 HydrophobicContact CD1-CB 3.61Å; Y52-R66 HydrophobicContact CD1-CG 4.04Å; Y52-R66 HydrophobicContact CD2-CB 4.29Å; Y52-R66 HydrophobicContact CE1-CB 3.99Å; Y52-R66 HydrophobicContact CE1-CG 3.94Å; Y52-R66 HydrophobicContact CG-CB 3.77Å; Y52-I70 HydrophobicContact CD2-CD1 3.31Å; Y52-I70 HydrophobicContact CE2-CD1 3.99Å; Y52-I70 HydrophobicContact CG-CD1 3.99Å
53	H	70.8	Confident	77.1	Confident	9 Å²	9	59.1 Å²	59.1	4%	0.042	30%	0.299	C	S	.	.			trans	-61.2	134.3	179.7	-165.7	-98.2	0	0	0	111.5	V6 A49 D55 R56 N57	V6-H53 WeakPolarHBondContact CG2-CE1 3.27Å; V6-H53 WeakPolarHBondContact CG2-NE2 3.44Å; A49-H53 WeakPolarHBondContact O-CB 3.45Å; A49-H53 PolarHBondContact O-N 3.27Å; A49-H53 VanDerWaalsContact O-N 3.12Å; H53-D55 VanDerWaalsContact C-N 3.28Å; H53-D55 IonicContact CE1-OD2 3.82Å; H53-D55 WeakPolarHBondContact ND1-CB 3.4Å; H53-D55 PolarHBondContact ND1-N 2.94Å; H53-D55 PolarHBondContact O-N 2.94Å; H53-R56 HydrophobicContact CB-CB 4.34Å; H53-R56 WeakPolarHBondContact O-CB 3.45Å; H53-R56 PolarHBondContact O-N 3.5Å; H53-N57 PolarHBondContact O-N 3.43Å; H53-N57 PolarHBondContact O-ND2 2.88Å
54	P	67	Low	76.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.1	-176.8	24.3	-34.5	0	0	0	113	V6 Y9 R56 N57 D58 G59	V6-P54 HydrophobicContact CB-CG 4.23Å; V6-P54 HydrophobicContact CG2-CG 3.77Å; Y9-P54 HydrophobicContact CD1-CB 4.35Å; Y9-P54 HydrophobicContact CD1-CG 3.87Å; Y9-P54 HydrophobicContact CG-CB 4.02Å; Y9-P54 HydrophobicContact CG-CG 4.02Å; P54-R56 PolarHBondContact O-N 3.36Å; P54-N57 PolarHBondContact O-N 2.97Å; P54-D58 PolarHBondContact O-N 2.9Å; P54-G59 PolarHBondContact O-N 3.25Å
55	D	62.9	Low	75.9	Confident	38 Å²	38	59.2 Å²	59.2	20%	0.203	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-21.1	174	-67.9	-0.8	0	0	0	113.4	S4 F5 V6 H53 L338	S4-D55 PolarHBondContact OG-OD1 3.08Å; S4-D55 VanDerWaalsContact OG-OD1 3.07Å; S4-D55 PolarHBondContact OG-OD2 3.4Å; F5-D55 VanDerWaalsContact C-OD1 3.29Å; F5-D55 WeakPolarHBondContact CA-OD1 3.43Å; F5-D55 WeakPolarHBondContact CB-OD1 3.42Å; F5-D55 PolarHBondContact N-OD1 3.46Å; V6-D55 PolarHBondContact N-OD1 3.23Å; H53-D55 VanDerWaalsContact C-N 3.28Å; H53-D55 IonicContact CE1-OD2 3.82Å; H53-D55 WeakPolarHBondContact ND1-CB 3.4Å; H53-D55 PolarHBondContact ND1-N 2.94Å; H53-D55 PolarHBondContact O-N 2.94Å; D55-L338 WeakPolarHBondContact OD2-CD1 3.33Å
56	R	68.9	Low	75.8	Confident	120 Å²	120	65.5 Å²	65.5	45%	0.453	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-23.8	178	-172.3	178.3	-176.4	156.8	6.2	112.2	I50 H53 P54 E345	I50-R56 WeakPolarHBondContact O-CD 3.28Å; H53-R56 HydrophobicContact CB-CB 4.34Å; H53-R56 WeakPolarHBondContact O-CB 3.45Å; H53-R56 PolarHBondContact O-N 3.5Å; P54-R56 PolarHBondContact O-N 3.36Å; R56-E345 IonicContact CZ-OE2 2.81Å; R56-E345 IonicContact NH1-OE1 2.77Å; R56-E345 PolarHBondContact NH1-OE1 3.1Å; R56-E345 IonicContact NH1-OE2 2.72Å; R56-E345 PolarHBondContact NH1-OE2 2.88Å; R56-E345 IonicContact NH2-OE2 2.99Å; R56-E345 PolarHBondContact NH2-OE2 2.83Å
57	N	74.6	Confident	75.8	Confident	51 Å²	51	60.7 Å²	60.7	27%	0.273	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	24.5	-171.1	-63.8	-83.4	0	0	0	111.7	K51 H53 P54 G59 S60 A63	K51-N57 PolarHBondContact O-ND2 2.97Å; H53-N57 PolarHBondContact O-N 3.43Å; H53-N57 PolarHBondContact O-ND2 2.88Å; P54-N57 PolarHBondContact O-N 2.97Å; N57-G59 PolarHBondContact O-N 3.37Å; N57-S60 WeakPolarHBondContact O-CB 3.27Å; N57-S60 PolarHBondContact O-N 3.02Å; N57-A63 HydrophobicContact CB-CB 3.37Å; N57-A63 VanDerWaalsContact CG-CB 3.46Å
58	D	72.8	Confident	75.3	Confident	135 Å²	135	54.3 Å²	54.3	72%	0.722	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	34.4	178.7	-59.5	-35.4	0	0	0	114.1	P54 S60	P54-D58 PolarHBondContact O-N 2.9Å; D58-S60 VanDerWaalsContact C-N 3.28Å; D58-S60 PolarHBondContact O-N 3.29Å
59	G	63.5	Low	75.1	Confident	29 Å²	29	53.9 Å²	53.9	30%	0.299	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	19.3	-176	0	0	0	0	0	115.1	P54 N57	P54-G59 PolarHBondContact O-N 3.25Å; N57-G59 PolarHBondContact O-N 3.37Å
60	S	75.5	Confident	75.4	Confident	41 Å²	41	54.1 Å²	54.1	29%	0.287	27%	0.269	S	S	.	.			trans	-51.1	126.3	177.6	169.7	0	0	0	0	111.1	N57 D58 E62 A63 A64	N57-S60 WeakPolarHBondContact O-CB 3.27Å; N57-S60 PolarHBondContact O-N 3.02Å; D58-S60 VanDerWaalsContact C-N 3.28Å; D58-S60 PolarHBondContact O-N 3.29Å; S60-E62 PolarHBondContact O-N 3.3Å; S60-E62 PolarHBondContact OG-N 2.91Å; S60-A63 PolarHBondContact O-N 3.41Å; S60-A64 VanDerWaalsContact O-CB 3.31Å; S60-A64 WeakPolarHBondContact O-CB 3.45Å; S60-A64 PolarHBondContact O-N 3.1Å
61	P	75.2	Confident	75.5	Confident	98 Å²	98	52.3 Å²	52.3	64%	0.636	26%	0.26	S	S	*	.	H	α-helix	trans	-61	-29.6	-178.9	24.3	-33.3	0	0	0	112.4	A64 E65	P61-A64 WeakPolarHBondContact O-CB 3.23Å; P61-E65 WeakPolarHBondContact O-CB 3.43Å; P61-E65 PolarHBondContact O-N 3.17Å
62	E	79.5	Confident	75.4	Confident	148 Å²	148	47.3 Å²	47.3	69%	0.692	24%	0.238	S	C	*	.	H	α-helix	trans	-70.9	-44.4	177.5	-63.1	-177.7	173.5	0	0	112.1	S60 A64 E65 R66	S60-E62 PolarHBondContact O-N 3.3Å; S60-E62 PolarHBondContact OG-N 2.91Å; E62-A64 VanDerWaalsContact C-N 3.28Å; E62-A64 PolarHBondContact O-N 2.98Å; E62-E65 PolarHBondContact O-N 3.13Å; E62-R66 WeakPolarHBondContact O-CG 3.23Å; E62-R66 PolarHBondContact O-N 2.96Å
63	A	76.9	Confident	75.7	Confident	5 Å²	5	45 Å²	45	4%	0.041	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-40.5	177	0	0	0	0	0	110.8	Y52 N57 S60 R66 F67	Y52-A63 HydrophobicContact CD1-CB 4.4Å; N57-A63 HydrophobicContact CB-CB 3.37Å; N57-A63 VanDerWaalsContact CG-CB 3.46Å; S60-A63 PolarHBondContact O-N 3.41Å; A63-R66 PolarHBondContact O-N 2.73Å; A63-F67 WeakPolarHBondContact O-CB 3.35Å; A63-F67 PolarHBondContact O-N 2.9Å
64	A	69.4	Low	76.4	Confident	5 Å²	5	44.8 Å²	44.8	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-51.3	-54.4	168.1	0	0	0	0	0	112.9	Y9 S60 P61 E62 R66 F67 K68	Y9-A64 HydrophobicContact CD2-CB 3.57Å; Y9-A64 HydrophobicContact CE2-CB 3Å; Y9-A64 PolarHBondContact OH-O 3.44Å; S60-A64 VanDerWaalsContact O-CB 3.31Å; S60-A64 WeakPolarHBondContact O-CB 3.45Å; S60-A64 PolarHBondContact O-N 3.1Å; P61-A64 WeakPolarHBondContact O-CB 3.23Å; E62-A64 VanDerWaalsContact C-N 3.28Å; E62-A64 PolarHBondContact O-N 2.98Å; A64-R66 VanDerWaalsContact C-N 3.34Å; A64-R66 PolarHBondContact O-N 2.96Å; A64-F67 PolarHBondContact O-N 3.34Å; A64-K68 PolarHBondContact O-N 2.95Å; A64-K68 VanDerWaalsContact O-N 3.08Å
65	E	77.6	Confident	77	Confident	91 Å²	91	45.1 Å²	45.1	43%	0.425	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-41.1	179.8	-170.7	172.8	-155.9	0	0	111.8	P61 E62 F67 K68 E69	P61-E65 WeakPolarHBondContact O-CB 3.43Å; P61-E65 PolarHBondContact O-N 3.17Å; E62-E65 PolarHBondContact O-N 3.13Å; E65-F67 PolarHBondContact O-N 3.15Å; E65-K68 WeakPolarHBondContact O-CB 3.12Å; E65-K68 PolarHBondContact O-N 3.43Å; E65-E69 WeakPolarHBondContact O-CG 3.33Å; E65-E69 PolarHBondContact O-N 3Å; E65-E69 VanDerWaalsContact O-N 3.08Å
66	R	83.2	Confident	77.9	Confident	133 Å²	133	43.5 Å²	43.5	50%	0.502	22%	0.222	S	C	.	.	H	α-helix	trans	-61	-46	174.1	-71.2	-66.5	-172.1	142	0.5	112.4	Y52 E62 A63 A64 K68 E69 I70	Y52-R66 HydrophobicContact CD1-CB 3.61Å; Y52-R66 HydrophobicContact CD1-CG 4.04Å; Y52-R66 HydrophobicContact CD2-CB 4.29Å; Y52-R66 HydrophobicContact CE1-CB 3.99Å; Y52-R66 HydrophobicContact CE1-CG 3.94Å; Y52-R66 HydrophobicContact CG-CB 3.77Å; E62-R66 WeakPolarHBondContact O-CG 3.23Å; E62-R66 PolarHBondContact O-N 2.96Å; A63-R66 PolarHBondContact O-N 2.73Å; A64-R66 VanDerWaalsContact C-N 3.34Å; A64-R66 PolarHBondContact O-N 2.96Å; R66-K68 VanDerWaalsContact C-N 3.26Å; R66-K68 PolarHBondContact O-N 3.29Å; R66-E69 WeakPolarHBondContact O-CB 3.37Å; R66-E69 PolarHBondContact O-N 2.95Å; R66-I70 HydrophobicContact CB-CD1 4.41Å; R66-I70 WeakPolarHBondContact O-CB 3.33Å; R66-I70 VanDerWaalsContact O-CD1 3.26Å; R66-I70 WeakPolarHBondContact O-CD1 3.44Å; R66-I70 WeakPolarHBondContact O-CG1 3.32Å; R66-I70 PolarHBondContact O-N 2.67Å
67	F	79.8	Confident	78.9	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.009	20%	0.201	C	C	.	.	H	α-helix	trans	-60.9	-38.3	179.7	-170.3	-100.4	0	0	0	112.1	Y9 A49 A63 A64 E65 S71 V113 C117	Y9-F67 HydrophobicContact CE1-CD1 4.19Å; A49-F67 HydrophobicContact CB-CD2 4.49Å; A49-F67 HydrophobicContact CB-CE2 3.75Å; A49-F67 VanDerWaalsContact O-CE2 3.28Å; A49-F67 WeakPolarHBondContact O-CE2 3.47Å; A63-F67 WeakPolarHBondContact O-CB 3.35Å; A63-F67 PolarHBondContact O-N 2.9Å; A64-F67 PolarHBondContact O-N 3.34Å; E65-F67 PolarHBondContact O-N 3.15Å; F67-S71 WeakPolarHBondContact O-CB 3.49Å; F67-S71 PolarHBondContact O-N 2.88Å; F67-S71 PolarHBondContact O-OG 2.72Å; F67-V113 HydrophobicContact CD1-CG1 4.03Å; F67-V113 HydrophobicContact CE1-CG1 3.48Å; F67-V113 VanDerWaalsContact CE1-CG1 3.48Å; F67-C117 VanDerWaalsContact CZ-SG 3.57Å
68	K	75.6	Confident	79.3	Confident	16 Å²	16	36.6 Å²	36.6	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-51.4	173	173.7	177.1	157.6	-178.5	0	111.1	T18 A64 E65 R66 I70 S71 I72 L109	T18-K68 PolarHBondContact O-NZ 3.19Å; T18-K68 PolarHBondContact OG1-NZ 3.16Å; A64-K68 PolarHBondContact O-N 2.95Å; A64-K68 VanDerWaalsContact O-N 3.08Å; E65-K68 WeakPolarHBondContact O-CB 3.12Å; E65-K68 PolarHBondContact O-N 3.43Å; R66-K68 VanDerWaalsContact C-N 3.26Å; R66-K68 PolarHBondContact O-N 3.29Å; K68-I70 PolarHBondContact O-N 3.41Å; K68-S71 PolarHBondContact O-N 3.41Å; K68-I72 HydrophobicContact CG-CD1 3.98Å; K68-I72 WeakPolarHBondContact O-CD1 3.35Å; K68-I72 WeakPolarHBondContact O-CG1 3.48Å; K68-I72 PolarHBondContact O-N 2.85Å; K68-L109 HydrophobicContact CD-CD2 3.5Å; K68-L109 HydrophobicContact CG-CD2 3.56Å
69	E	83	Confident	79.5	Confident	14 Å²	14	32.9 Å²	32.9	7%	0.065	18%	0.176	C	C	.	.	H	α-helix	trans	-59.2	-46.7	178.1	-72.9	177	-173.7	0	0	112.7	K24 I29 E65 R66 S71 I72 A73	K24-E69 IonicContact NZ-OE1 3.52Å; K24-E69 PolarHBondContact NZ-OE1 3.22Å; K24-E69 IonicContact NZ-OE2 2.77Å; K24-E69 PolarHBondContact NZ-OE2 3.19Å; K24-E69 VanDerWaalsContact NZ-OE2 3.14Å; I29-E69 HydrophobicContact CD1-CB 4.26Å; I29-E69 HydrophobicContact CG2-CB 4.1Å; E65-E69 WeakPolarHBondContact O-CG 3.33Å; E65-E69 PolarHBondContact O-N 3Å; E65-E69 VanDerWaalsContact O-N 3.08Å; R66-E69 WeakPolarHBondContact O-CB 3.37Å; R66-E69 PolarHBondContact O-N 2.95Å; E69-S71 VanDerWaalsContact C-N 3.29Å; E69-S71 PolarHBondContact O-N 3.32Å; E69-I72 PolarHBondContact O-N 2.78Å; E69-A73 WeakPolarHBondContact O-CB 3.46Å; E69-A73 PolarHBondContact O-N 3.23Å
70	I	86.5	Confident	80.4	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-59.4	-41.8	178.5	-70.3	157.2	0	0	0	111.1	I29 L30 Y45 L48 Y52 R66 K68 Y74	I29-I70 HydrophobicContact CG2-CG1 3.99Å; L30-I70 HydrophobicContact CD2-CG2 3.94Å; Y45-I70 HydrophobicContact CD2-CG2 3.52Å; Y45-I70 HydrophobicContact CE2-CG2 3.81Å; L48-I70 HydrophobicContact CB-CD1 3.69Å; L48-I70 HydrophobicContact CB-CG1 4.1Å; L48-I70 HydrophobicContact CB-CG2 3.87Å; L48-I70 HydrophobicContact CD1-CG1 4.33Å; Y52-I70 HydrophobicContact CD2-CD1 3.31Å; Y52-I70 HydrophobicContact CE2-CD1 3.99Å; Y52-I70 HydrophobicContact CG-CD1 3.99Å; R66-I70 HydrophobicContact CB-CD1 4.41Å; R66-I70 WeakPolarHBondContact O-CB 3.33Å; R66-I70 VanDerWaalsContact O-CD1 3.26Å; R66-I70 WeakPolarHBondContact O-CD1 3.44Å; R66-I70 WeakPolarHBondContact O-CG1 3.32Å; R66-I70 PolarHBondContact O-N 2.67Å; K68-I70 PolarHBondContact O-N 3.41Å; I70-Y74 WeakPolarHBondContact O-CB 3.15Å; I70-Y74 PolarHBondContact O-N 3.03Å
71	S	78.9	Confident	80.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.3	-42.6	178.7	-63.4	0	0	0	0	112.2	F67 K68 E69 A75 L116	F67-S71 WeakPolarHBondContact O-CB 3.49Å; F67-S71 PolarHBondContact O-N 2.88Å; F67-S71 PolarHBondContact O-OG 2.72Å; K68-S71 PolarHBondContact O-N 3.41Å; E69-S71 VanDerWaalsContact C-N 3.29Å; E69-S71 PolarHBondContact O-N 3.32Å; S71-A75 WeakPolarHBondContact O-CB 3.37Å; S71-A75 PolarHBondContact O-N 3.31Å; S71-L116 WeakPolarHBondContact O-CD1 3.42Å
72	I	80.6	Confident	80.6	Confident	5 Å²	5	37.1 Å²	37.1	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-48.8	176	-65.9	155	0	0	0	110.5	I20 F26 K68 E69 Y74 A75 V76 L95 L109	I20-I72 HydrophobicContact CD1-CD1 3.42Å; I20-I72 VanDerWaalsContact CD1-CD1 3.42Å; I20-I72 HydrophobicContact CD1-CG1 4.46Å; I20-I72 HydrophobicContact CG1-CD1 3.87Å; F26-I72 HydrophobicContact CE1-CG2 4.19Å; F26-I72 HydrophobicContact CZ-CG2 4.02Å; K68-I72 HydrophobicContact CG-CD1 3.98Å; K68-I72 WeakPolarHBondContact O-CD1 3.35Å; K68-I72 WeakPolarHBondContact O-CG1 3.48Å; K68-I72 PolarHBondContact O-N 2.85Å; E69-I72 PolarHBondContact O-N 2.78Å; I72-Y74 VanDerWaalsContact C-N 3.3Å; I72-Y74 PolarHBondContact O-N 3.04Å; I72-A75 PolarHBondContact O-N 3.14Å; I72-A75 VanDerWaalsContact O-N 3.15Å; I72-V76 PolarHBondContact O-N 2.84Å; I72-V76 VanDerWaalsContact O-N 3.15Å; I72-L95 HydrophobicContact CG2-CD2 4.27Å; I72-L109 HydrophobicContact CD1-CD1 3.76Å; I72-L109 HydrophobicContact CD1-CD2 4.35Å; I72-L109 HydrophobicContact CG1-CD1 3.54Å
73	A	87.2	Confident	80.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.9	-45.3	179.6	0	0	0	0	0	111.3	F26 I29 L30 E69 V76 L77	F26-A73 HydrophobicContact CB-CB 3.81Å; F26-A73 HydrophobicContact CD1-CB 4.07Å; F26-A73 HydrophobicContact CG-CB 4.03Å; I29-A73 HydrophobicContact CB-CB 4.03Å; I29-A73 HydrophobicContact CD1-CB 4.4Å; I29-A73 HydrophobicContact CG2-CB 3.9Å; L30-A73 HydrophobicContact CD1-CB 4.36Å; L30-A73 HydrophobicContact CD2-CB 4.18Å; L30-A73 HydrophobicContact CG-CB 3.88Å; E69-A73 WeakPolarHBondContact O-CB 3.46Å; E69-A73 PolarHBondContact O-N 3.23Å; A73-V76 PolarHBondContact O-N 3.15Å; A73-L77 WeakPolarHBondContact O-CB 3.4Å; A73-L77 VanDerWaalsContact O-CG 3.31Å; A73-L77 WeakPolarHBondContact O-CG 3.37Å; A73-L77 PolarHBondContact O-N 2.94Å
74	Y	85.8	Confident	81.2	Confident	6 Å²	6	39.8 Å²	39.8	2%	0.024	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-43	176.2	180	-102.6	0	0	0	112.8	I41 K42 Y45 I70 I72 V76 L77 S78 L116	I41-Y74 HydrophobicContact CG2-CD2 3.79Å; I41-Y74 HydrophobicContact CG2-CE2 4.08Å; K42-Y74 HydrophobicContact CB-CE2 4.18Å; K42-Y74 HydrophobicContact CG-CE2 4.41Å; Y45-Y74 AromaticContact CD1-CD1 3.82Å; Y45-Y74 HydrophobicContact CD1-CD1 3.82Å; Y45-Y74 AromaticContact CD1-CD2 3.94Å; Y45-Y74 HydrophobicContact CD1-CD2 3.94Å; Y45-Y74 AromaticContact CD1-CE1 4Å; Y45-Y74 HydrophobicContact CD1-CE1 4Å; Y45-Y74 HydrophobicContact CD1-CE2 4.11Å; Y45-Y74 AromaticContact CD1-CG 3.78Å; Y45-Y74 HydrophobicContact CD1-CG 3.78Å; Y45-Y74 HydrophobicContact CD2-CD1 4.18Å; Y45-Y74 HydrophobicContact CD2-CD2 4.21Å; Y45-Y74 AromaticContact CD2-CG 3.66Å; Y45-Y74 HydrophobicContact CD2-CG 3.66Å; Y45-Y74 HydrophobicContact CE1-CD1 4Å; Y45-Y74 HydrophobicContact CE1-CE1 4.21Å; Y45-Y74 HydrophobicContact CE1-CG 4.34Å; Y45-Y74 HydrophobicContact CE2-CD1 4.38Å; Y45-Y74 HydrophobicContact CE2-CG 4.27Å; Y45-Y74 AromaticContact CG-CD1 3.93Å; Y45-Y74 HydrophobicContact CG-CD1 3.93Å; Y45-Y74 AromaticContact CG-CD2 3.56Å; Y45-Y74 HydrophobicContact CG-CD2 3.56Å; Y45-Y74 HydrophobicContact CG-CE1 4.48Å; Y45-Y74 HydrophobicContact CG-CE2 4.16Å; Y45-Y74 AromaticContact CG-CG 3.42Å; Y45-Y74 HydrophobicContact CG-CG 3.42Å; Y45-Y74 VanDerWaalsContact CG-CG 3.42Å; I70-Y74 WeakPolarHBondContact O-CB 3.15Å; I70-Y74 PolarHBondContact O-N 3.03Å; I72-Y74 VanDerWaalsContact C-N 3.3Å; I72-Y74 PolarHBondContact O-N 3.04Å; Y74-V76 PolarHBondContact O-N 3.5Å; Y74-L77 PolarHBondContact O-N 2.68Å; Y74-S78 WeakPolarHBondContact O-CB 3.42Å; Y74-S78 PolarHBondContact O-N 2.72Å; Y74-S78 PolarHBondContact O-OG 3.42Å; Y74-L116 HydrophobicContact CD1-CD1 3.9Å; Y74-L116 HydrophobicContact CD1-CD2 3.49Å; Y74-L116 VanDerWaalsContact CD1-CD2 3.49Å; Y74-L116 HydrophobicContact CD1-CG 4.26Å; Y74-L116 HydrophobicContact CE1-CD2 3.58Å
75	A	78.7	Confident	81.5	Confident	7 Å²	7	42.2 Å²	42.2	6%	0.058	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-25	178.7	0	0	0	0	0	114.3	S71 I72 R82 L112 L116	S71-A75 WeakPolarHBondContact O-CB 3.37Å; S71-A75 PolarHBondContact O-N 3.31Å; I72-A75 PolarHBondContact O-N 3.14Å; I72-A75 VanDerWaalsContact O-N 3.15Å; A75-R82 PolarHBondContact O-NH1 3Å; A75-L112 HydrophobicContact CB-CD1 3.82Å; A75-L112 HydrophobicContact CB-CD2 3.72Å; A75-L112 HydrophobicContact CB-CG 4.02Å; A75-L116 HydrophobicContact CB-CD1 4.19Å
76	V	83.6	Confident	81.8	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.024	18%	0.177	C	C	.	.	H	α-helix	trans	-88.3	-48.7	174.7	175.6	0	0	0	0	111	F26 I72 A73 Y74 R82 R83 Y86 A94	F26-V76 HydrophobicContact CD2-CB 3.83Å; F26-V76 HydrophobicContact CD2-CG1 3.79Å; F26-V76 HydrophobicContact CD2-CG2 4.24Å; F26-V76 HydrophobicContact CE2-CB 3.82Å; F26-V76 HydrophobicContact CE2-CG1 3.82Å; F26-V76 HydrophobicContact CE2-CG2 3.71Å; F26-V76 HydrophobicContact CZ-CG2 4.49Å; I72-V76 PolarHBondContact O-N 2.84Å; I72-V76 VanDerWaalsContact O-N 3.15Å; A73-V76 PolarHBondContact O-N 3.15Å; Y74-V76 PolarHBondContact O-N 3.5Å; V76-R82 HydrophobicContact CG1-CB 4.27Å; V76-R82 WeakPolarHBondContact O-CB 3.45Å; V76-R83 PolarHBondContact O-N 3.06Å; V76-Y86 HydrophobicContact CG1-CD2 4.27Å; V76-Y86 HydrophobicContact CG1-CG 4.07Å; V76-A94 HydrophobicContact CG1-CB 4.01Å
77	L	88.2	Confident	81.9	Confident	2 Å²	2	36 Å²	36	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-77.6	-23	-172.6	-65.1	-178.5	0	0	0	114.4	F26 Y27 L30 I41 A73 Y74 R83 Y86	F26-L77 HydrophobicContact CB-CD1 3.68Å; F26-L77 HydrophobicContact CB-CD2 4.27Å; F26-L77 HydrophobicContact CB-CG 3.92Å; Y27-L77 HydrophobicContact CD1-CD1 3.83Å; Y27-L77 HydrophobicContact CD1-CD2 4.26Å; Y27-L77 HydrophobicContact CD2-CD2 4.39Å; Y27-L77 HydrophobicContact CE1-CD1 4.08Å; Y27-L77 HydrophobicContact CE1-CD2 3.75Å; Y27-L77 HydrophobicContact CE2-CD2 3.93Å; Y27-L77 HydrophobicContact CG-CD1 4.14Å; L30-L77 HydrophobicContact CD1-CD1 3.91Å; I41-L77 HydrophobicContact CD1-CB 4.2Å; I41-L77 HydrophobicContact CG2-CB 4.2Å; A73-L77 WeakPolarHBondContact O-CB 3.4Å; A73-L77 VanDerWaalsContact O-CG 3.31Å; A73-L77 WeakPolarHBondContact O-CG 3.37Å; A73-L77 PolarHBondContact O-N 2.94Å; Y74-L77 PolarHBondContact O-N 2.68Å; L77-R83 HydrophobicContact CD2-CG 4.06Å; L77-Y86 HydrophobicContact CD2-CD1 3.86Å; L77-Y86 HydrophobicContact CD2-CE1 4.19Å
78	S	83.2	Confident	82	Confident	24 Å²	24	42.3 Å²	42.3	17%	0.168	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-22.5	178.1	61.2	0	0	0	0	113.8	Y74	Y74-S78 WeakPolarHBondContact O-CB 3.42Å; Y74-S78 PolarHBondContact O-N 2.72Å; Y74-S78 PolarHBondContact O-OG 3.42Å
79	D	78.3	Confident	82.2	Confident	56 Å²	56	47.4 Å²	47.4	30%	0.299	23%	0.229	S	C	.	.	S	Bend	trans	-92.8	120.5	175	-179.3	-74.6	0	0	0	109.9	N81 R82 R83	D79-N81 PolarHBondContact O-N 3.03Å; D79-N81 WeakPolarHBondContact OD1-CA 3.42Å; D79-N81 VanDerWaalsContact OD1-CB 3.31Å; D79-N81 WeakPolarHBondContact OD1-CB 3.22Å; D79-N81 PolarHBondContact OD1-N 3.47Å; D79-R82 HydrophobicContact CB-CB 4.03Å; D79-R82 HydrophobicContact CB-CG 4.04Å; D79-R82 PolarHBondContact O-N 3.44Å; D79-R82 PolarHBondContact OD1-N 3.22Å; D79-R83 WeakPolarHBondContact O-CB 3.46Å; D79-R83 PolarHBondContact O-N 2.86Å
80	P	80.8	Confident	81.6	Confident	76 Å²	76	47.8 Å²	47.8	49%	0.494	24%	0.237	S	C	.	.	H	α-helix	trans	-58.8	-31.4	-176.9	-27	34.9	0	0	0	114.7	R84	P80-R84 VanDerWaalsContact O-CG 3.23Å; P80-R84 WeakPolarHBondContact O-CG 3.31Å; P80-R84 PolarHBondContact O-N 2.85Å
81	N	74.3	Confident	80.6	Confident	100 Å²	100	48.9 Å²	48.9	54%	0.535	24%	0.244	S	C	.	.	H	α-helix	trans	-75.9	-45	179.5	-61.7	-49.1	0	0	0	110.5	D79 R84 Q85	D79-N81 PolarHBondContact O-N 3.03Å; D79-N81 WeakPolarHBondContact OD1-CA 3.42Å; D79-N81 VanDerWaalsContact OD1-CB 3.31Å; D79-N81 WeakPolarHBondContact OD1-CB 3.22Å; D79-N81 PolarHBondContact OD1-N 3.47Å; N81-R84 WeakPolarHBondContact O-CB 3.35Å; N81-R84 PolarHBondContact O-N 3.49Å; N81-Q85 WeakPolarHBondContact O-CG 3.39Å; N81-Q85 PolarHBondContact O-N 3.26Å
82	R	80.6	Confident	79.7	Confident	81 Å²	81	52.2 Å²	52.2	31%	0.306	27%	0.267	S	S	.	.	H	α-helix	trans	-66.7	-38.5	177.3	-66.1	-178.8	174.6	171.6	-3.9	112.4	A75 V76 D79 R84 Q85 Y86	A75-R82 PolarHBondContact O-NH1 3Å; V76-R82 HydrophobicContact CG1-CB 4.27Å; V76-R82 WeakPolarHBondContact O-CB 3.45Å; D79-R82 HydrophobicContact CB-CB 4.03Å; D79-R82 HydrophobicContact CB-CG 4.04Å; D79-R82 PolarHBondContact O-N 3.44Å; D79-R82 PolarHBondContact OD1-N 3.22Å; R82-R84 VanDerWaalsContact C-N 3.32Å; R82-R84 PolarHBondContact O-N 3.48Å; R82-Q85 PolarHBondContact O-N 3.43Å; R82-Y86 WeakPolarHBondContact O-CB 3.32Å; R82-Y86 PolarHBondContact O-N 3.3Å
83	R	86.5	Confident	78.4	Confident	43 Å²	43	55.3 Å²	55.3	16%	0.162	28%	0.284	C	S	.	.	H	α-helix	trans	-58.8	-45.2	172.7	-177	176.2	177.2	175.5	1.5	111	Y27 K34 A36 V76 L77 D79 Q85 Y86 D87	Y27-R83 WeakPolarHBondContact OH-CG 3.5Å; Y27-R83 PolarHBondContact OH-NE 2.9Å; K34-R83 PolarHBondContact O-NH2 3.44Å; A36-R83 VanDerWaalsContact O-CZ 3.28Å; A36-R83 PolarHBondContact O-NH1 2.99Å; A36-R83 PolarHBondContact O-NH2 3.23Å; V76-R83 PolarHBondContact O-N 3.06Å; L77-R83 HydrophobicContact CD2-CG 4.06Å; D79-R83 WeakPolarHBondContact O-CB 3.46Å; D79-R83 PolarHBondContact O-N 2.86Å; R83-Q85 PolarHBondContact O-N 3.32Å; R83-Y86 WeakPolarHBondContact O-CB 3.34Å; R83-Y86 PolarHBondContact O-N 2.83Å; R83-D87 WeakPolarHBondContact O-CB 3.17Å; R83-D87 PolarHBondContact O-N 2.95Å
84	R	82.7	Confident	76.8	Confident	167 Å²	167	55.5 Å²	55.5	63%	0.63	29%	0.285	S	S	*	.	H	α-helix	trans	-61.1	-43.1	174.7	-75.1	171.8	-176.5	-178.8	2.1	112.3	P80 N81 R82 D87 L88	P80-R84 VanDerWaalsContact O-CG 3.23Å; P80-R84 WeakPolarHBondContact O-CG 3.31Å; P80-R84 PolarHBondContact O-N 2.85Å; N81-R84 WeakPolarHBondContact O-CB 3.35Å; N81-R84 PolarHBondContact O-N 3.49Å; R82-R84 VanDerWaalsContact C-N 3.32Å; R82-R84 PolarHBondContact O-N 3.48Å; R84-D87 PolarHBondContact O-N 2.99Å; R84-L88 WeakPolarHBondContact O-CB 3.33Å; R84-L88 VanDerWaalsContact O-CG 3.27Å; R84-L88 WeakPolarHBondContact O-CG 3.38Å; R84-L88 PolarHBondContact O-N 3.34Å
85	Q	77.4	Confident	75.1	Confident	55 Å²	55	57.2 Å²	57.2	26%	0.257	29%	0.294	S	S	.	.	H	α-helix	trans	-62.6	-43.9	176.3	-71	168	-20.6	0	0	111.5	N81 R82 R83 L88 F89 D97	N81-Q85 WeakPolarHBondContact O-CG 3.39Å; N81-Q85 PolarHBondContact O-N 3.26Å; R82-Q85 PolarHBondContact O-N 3.43Å; R83-Q85 PolarHBondContact O-N 3.32Å; Q85-L88 PolarHBondContact O-N 3.2Å; Q85-F89 WeakPolarHBondContact O-CD2 3.34Å; Q85-F89 PolarHBondContact O-N 2.8Å; Q85-D97 PolarHBondContact NE2-OD2 2.83Å; Q85-D97 PolarHBondContact OE1-OD2 3.36Å; Q85-D97 VanDerWaalsContact OE1-OD2 3.05Å
86	Y	82.7	Confident	73.3	Confident	14 Å²	14	60.3 Å²	60.3	6%	0.055	31%	0.312	C	S	.	.	H	α-helix	trans	-60.4	-43.9	173.9	175.2	-97.7	0	0	0	112.4	D25 F26 Y27 V76 L77 R82 R83 L88 G90 P91 A94	D25-Y86 VanDerWaalsContact CA-OH 3.28Å; D25-Y86 WeakPolarHBondContact CA-OH 3.43Å; D25-Y86 PolarHBondContact OD1-OH 2.85Å; F26-Y86 HydrophobicContact CB-CE1 4.2Å; F26-Y86 HydrophobicContact CB-CE2 4.09Å; F26-Y86 HydrophobicContact CD1-CE2 4.33Å; F26-Y86 HydrophobicContact CD2-CD1 4.46Å; F26-Y86 AromaticContact CD2-CD2 3.31Å; F26-Y86 HydrophobicContact CD2-CD2 3.31Å; F26-Y86 HydrophobicContact CD2-CE1 4.34Å; F26-Y86 AromaticContact CD2-CE2 3.15Å; F26-Y86 HydrophobicContact CD2-CE2 3.15Å; F26-Y86 AromaticContact CD2-CG 3.99Å; F26-Y86 HydrophobicContact CD2-CG 3.99Å; F26-Y86 AromaticContact CD2-CZ 3.74Å; F26-Y86 AromaticContact CE2-CD2 3.48Å; F26-Y86 HydrophobicContact CE2-CD2 3.48Å; F26-Y86 VanDerWaalsContact CE2-CD2 3.48Å; F26-Y86 AromaticContact CE2-CE2 3.51Å; F26-Y86 HydrophobicContact CE2-CE2 3.51Å; F26-Y86 HydrophobicContact CE2-CG 4.42Å; F26-Y86 HydrophobicContact CG-CD2 4.22Å; F26-Y86 AromaticContact CG-CE2 3.61Å; F26-Y86 HydrophobicContact CG-CE2 3.61Å; F26-Y86 AromaticContact CG-CZ 3.83Å; F26-Y86 HydrophobicContact CZ-CE2 4.26Å; F26-Y86 PolarHBondContact N-OH 3.19Å; Y27-Y86 HydrophobicContact CD2-CD1 4.5Å; Y27-Y86 AromaticContact CD2-CE1 3.71Å; Y27-Y86 HydrophobicContact CD2-CE1 3.71Å; Y27-Y86 AromaticContact CE2-CD1 3.88Å; Y27-Y86 HydrophobicContact CE2-CD1 3.88Å; Y27-Y86 AromaticContact CE2-CE1 3.51Å; Y27-Y86 HydrophobicContact CE2-CE1 3.51Å; V76-Y86 HydrophobicContact CG1-CD2 4.27Å; V76-Y86 HydrophobicContact CG1-CG 4.07Å; L77-Y86 HydrophobicContact CD2-CD1 3.86Å; L77-Y86 HydrophobicContact CD2-CE1 4.19Å; R82-Y86 WeakPolarHBondContact O-CB 3.32Å; R82-Y86 PolarHBondContact O-N 3.3Å; R83-Y86 WeakPolarHBondContact O-CB 3.34Å; R83-Y86 PolarHBondContact O-N 2.83Å; Y86-L88 VanDerWaalsContact C-N 3.31Å; Y86-L88 PolarHBondContact O-N 3.24Å; Y86-G90 VanDerWaalsContact O-CA 3.22Å; Y86-G90 WeakPolarHBondContact O-CA 3.28Å; Y86-G90 PolarHBondContact O-N 2.84Å; Y86-P91 HydrophobicContact CE2-CB 4.07Å; Y86-P91 HydrophobicContact CE2-CG 3.81Å; Y86-A94 HydrophobicContact CD2-CB 3.97Å; Y86-A94 HydrophobicContact CG-CB 4.44Å
87	D	86.5	Confident	71.3	Confident	81 Å²	81	64.1 Å²	64.1	43%	0.433	33%	0.333	S	S	.	.	H	α-helix	trans	-66	-33.3	178.7	-68.8	-26	0	0	0	112.2	Y27 R83 R84	Y27-D87 VanDerWaalsContact CE2-OD1 3.23Å; Y27-D87 WeakPolarHBondContact CE2-OD1 3.31Å; Y27-D87 VanDerWaalsContact OH-CG 3.32Å; Y27-D87 PolarHBondContact OH-OD1 3.47Å; Y27-D87 PolarHBondContact OH-OD2 2.85Å; R83-D87 WeakPolarHBondContact O-CB 3.17Å; R83-D87 PolarHBondContact O-N 2.95Å; R84-D87 PolarHBondContact O-N 2.99Å
88	L	82.1	Confident	69.4	Low	133 Å²	133	64.8 Å²	64.8	70%	0.696	34%	0.335	S	S	*	.	H	α-helix	trans	-80.9	-42	-179.9	-74.2	170.5	0	0	0	113.4	R84 Q85 Y86	R84-L88 WeakPolarHBondContact O-CB 3.33Å; R84-L88 VanDerWaalsContact O-CG 3.27Å; R84-L88 WeakPolarHBondContact O-CG 3.38Å; R84-L88 PolarHBondContact O-N 3.34Å; Q85-L88 PolarHBondContact O-N 3.2Å; Y86-L88 VanDerWaalsContact C-N 3.31Å; Y86-L88 PolarHBondContact O-N 3.24Å
89	F	78.2	Confident	67.1	Low	124 Å²	124	71.6 Å²	71.6	54%	0.544	37%	0.365	S	S	.	.	H	α-helix	trans	-119.9	-3.5	-166.6	-56.4	-72.5	0	0	0	114.4	Q85 N93	Q85-F89 WeakPolarHBondContact O-CD2 3.34Å; Q85-F89 PolarHBondContact O-N 2.8Å; F89-N93 HydrophobicContact CB-CB 3.3Å; F89-N93 WeakPolarHBondContact CB-ND2 3.4Å; F89-N93 HydrophobicContact CG-CB 4.12Å
90	G	71.4	Confident	65.1	Low	22 Å²	22	72.9 Å²	72.9	23%	0.227	39%	0.391	C	S	.	.	H	α-helix	trans	75.1	-176	-178.8	0	0	0	0	0	114.5	Y86 S92 N93 A94	Y86-G90 VanDerWaalsContact O-CA 3.22Å; Y86-G90 WeakPolarHBondContact O-CA 3.28Å; Y86-G90 PolarHBondContact O-N 2.84Å; G90-S92 VanDerWaalsContact C-N 3.3Å; G90-S92 PolarHBondContact O-N 3.14Å; G90-N93 PolarHBondContact O-N 2.9Å; G90-A94 PolarHBondContact O-N 3.41Å
91	P	65.6	Low	63	Low	26 Å²	26	70.8 Å²	70.8	17%	0.169	38%	0.376	C	S	.	.	H	α-helix	trans	-61.4	-35.4	-171.2	-18.4	28.4	0	0	0	113.3	A22 F26 Y86 N93 L95	A22-P91 WeakPolarHBondContact O-CB 3.3Å; A22-P91 WeakPolarHBondContact O-CG 3.48Å; F26-P91 HydrophobicContact CZ-CB 4.41Å; Y86-P91 HydrophobicContact CE2-CB 4.07Å; Y86-P91 HydrophobicContact CE2-CG 3.81Å; P91-N93 PolarHBondContact O-N 3.38Å; P91-L95 WeakPolarHBondContact O-CG 3.35Å
92	S	59.1	Low	61.3	Low	70 Å²	70	71 Å²	71	49%	0.49	38%	0.377	S	S	.	.	H	α-helix	trans	-63.4	-38.5	-176.4	-59.2	0	0	0	0	112.9	G90 V96	G90-S92 VanDerWaalsContact C-N 3.3Å; G90-S92 PolarHBondContact O-N 3.14Å; S92-V96 VanDerWaalsContact O-CG2 3.3Å; S92-V96 WeakPolarHBondContact O-CG2 3Å
93	N	54.2	Low	59.4	Low	71 Å²	71	69.4 Å²	69.4	38%	0.38	37%	0.374	S	S	.	.	H	α-helix	trans	-87.8	-30	-178.2	-92.8	15.9	0	0	0	113.3	F89 G90 P91 L95 V96 D97	F89-N93 HydrophobicContact CB-CB 3.3Å; F89-N93 WeakPolarHBondContact CB-ND2 3.4Å; F89-N93 HydrophobicContact CG-CB 4.12Å; G90-N93 PolarHBondContact O-N 2.9Å; P91-N93 PolarHBondContact O-N 3.38Å; N93-L95 PolarHBondContact O-N 2.9Å; N93-L95 VanDerWaalsContact O-N 3.15Å; N93-V96 WeakPolarHBondContact O-CB 3.36Å; N93-V96 PolarHBondContact O-N 3.13Å; N93-D97 PolarHBondContact O-N 3.46Å
94	A	52.3	Low	57	Low	3 Å²	3	71 Å²	71	3%	0.025	40%	0.404	C	S	.	.	H	α-helix	trans	-61.9	-22.4	175.7	0	0	0	0	0	112.8	V76 Y86 G90	V76-A94 HydrophobicContact CG1-CB 4.01Å; Y86-A94 HydrophobicContact CD2-CB 3.97Å; Y86-A94 HydrophobicContact CG-CB 4.44Å; G90-A94 PolarHBondContact O-N 3.41Å
95	L	51.1	Low	54.9	Low	42 Å²	42	68.6 Å²	68.6	22%	0.22	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-20	173.1	-64.4	171.9	0	0	0	113.1	I72 P91 N93 F98 I103	I72-L95 HydrophobicContact CG2-CD2 4.27Å; P91-L95 WeakPolarHBondContact O-CG 3.35Å; N93-L95 PolarHBondContact O-N 2.9Å; N93-L95 VanDerWaalsContact O-N 3.15Å; L95-F98 WeakPolarHBondContact O-CB 3.2Å; L95-F98 PolarHBondContact O-N 3.17Å; L95-I103 HydrophobicContact CD2-CD1 3.88Å
96	V	41	Very low	53.1	Low	72 Å²	72	68.7 Å²	68.7	44%	0.436	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-76.5	-38.8	-179.4	-179.4	0	0	0	0	110.7	S92 N93 F98 E99	S92-V96 VanDerWaalsContact O-CG2 3.3Å; S92-V96 WeakPolarHBondContact O-CG2 3Å; N93-V96 WeakPolarHBondContact O-CB 3.36Å; N93-V96 PolarHBondContact O-N 3.13Å; V96-F98 PolarHBondContact O-N 3.03Å; V96-E99 VanDerWaalsContact O-CG 3.3Å; V96-E99 WeakPolarHBondContact O-CG 3.19Å; V96-E99 PolarHBondContact O-N 3.31Å
97	D	42.3	Very low	51.1	Low	84 Å²	84	70.9 Å²	70.9	45%	0.449	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-69.5	1.1	173.9	-74.9	-36.8	0	0	0	113.9	Q85 N93 E99	Q85-D97 PolarHBondContact NE2-OD2 2.83Å; Q85-D97 PolarHBondContact OE1-OD2 3.36Å; Q85-D97 VanDerWaalsContact OE1-OD2 3.05Å; N93-D97 PolarHBondContact O-N 3.46Å; D97-E99 PolarHBondContact O-N 2.92Å
98	F	46.7	Very low	49.6	Very low	16 Å²	16	67.2 Å²	67.2	7%	0.07	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-77.7	19	166.6	-127.6	-102.1	0	0	0	112.5	L95 V96 G100 L101 I103 L112	L95-F98 WeakPolarHBondContact O-CB 3.2Å; L95-F98 PolarHBondContact O-N 3.17Å; V96-F98 PolarHBondContact O-N 3.03Å; F98-G100 PolarHBondContact O-N 3.47Å; F98-L101 HydrophobicContact CD1-CB 3.2Å; F98-L101 HydrophobicContact CD1-CD1 4Å; F98-L101 HydrophobicContact CD1-CG 4.17Å; F98-L101 HydrophobicContact CE1-CB 3.33Å; F98-L101 HydrophobicContact CE1-CD1 3.31Å; F98-L101 HydrophobicContact CE1-CD2 4.42Å; F98-L101 HydrophobicContact CE1-CG 3.82Å; F98-L101 HydrophobicContact CG-CB 4.37Å; F98-L101 HydrophobicContact CZ-CD1 3.86Å; F98-L101 CarbonylContact O-C 3Å; F98-L101 WeakPolarHBondContact O-CA 3.47Å; F98-L101 PolarHBondContact O-N 2.99Å; F98-I103 HydrophobicContact CB-CD1 3.63Å; F98-I103 HydrophobicContact CB-CG1 4.31Å; F98-I103 HydrophobicContact CD1-CD1 3.37Å; F98-I103 HydrophobicContact CD1-CG1 3.57Å; F98-I103 HydrophobicContact CD2-CD1 4.21Å; F98-I103 HydrophobicContact CE1-CD1 4.05Å; F98-I103 HydrophobicContact CE1-CG1 4.18Å; F98-I103 HydrophobicContact CG-CD1 3.49Å; F98-I103 VanDerWaalsContact CG-CD1 3.49Å; F98-I103 HydrophobicContact CG-CG1 4.17Å; F98-L112 HydrophobicContact CE1-CD1 3.96Å; F98-L112 HydrophobicContact CE2-CD1 4.05Å; F98-L112 HydrophobicContact CZ-CD1 3.33Å; F98-L112 HydrophobicContact CZ-CG 4.32Å
99	E	35.5	Very low	48.1	Very low	168 Å²	168	61.6 Å²	61.6	79%	0.785	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	3.3	-177.2	-101.7	173.4	-166.8	0	0	117.2	V96 D97	V96-E99 VanDerWaalsContact O-CG 3.3Å; V96-E99 WeakPolarHBondContact O-CG 3.19Å; V96-E99 PolarHBondContact O-N 3.31Å; D97-E99 PolarHBondContact O-N 2.92Å
100	G	36.4	Very low	46.9	Very low	82 Å²	82	59.9 Å²	59.9	85%	0.845	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-3.2	166	0	0	0	0	0	115.1	F98	F98-G100 PolarHBondContact O-N 3.47Å
101	L	37.5	Very low	46.2	Very low	33 Å²	33	62.4 Å²	62.4	17%	0.173	36%	0.362	C	S	.	.	S	Bend	trans	-136.8	97.5	-176.3	-92.9	150.3	0	0	0	106.5	F98 I103 F382	F98-L101 HydrophobicContact CD1-CB 3.2Å; F98-L101 HydrophobicContact CD1-CD1 4Å; F98-L101 HydrophobicContact CD1-CG 4.17Å; F98-L101 HydrophobicContact CE1-CB 3.33Å; F98-L101 HydrophobicContact CE1-CD1 3.31Å; F98-L101 HydrophobicContact CE1-CD2 4.42Å; F98-L101 HydrophobicContact CE1-CG 3.82Å; F98-L101 HydrophobicContact CG-CB 4.37Å; F98-L101 HydrophobicContact CZ-CD1 3.86Å; F98-L101 CarbonylContact O-C 3Å; F98-L101 WeakPolarHBondContact O-CA 3.47Å; F98-L101 PolarHBondContact O-N 2.99Å; L101-I103 VanDerWaalsContact C-N 3.31Å; L101-I103 PolarHBondContact O-N 3.29Å; L101-F382 HydrophobicContact CD1-CE1 4.23Å
102	D	38.8	Very low	45.7	Very low	104 Å²	104	62 Å²	62	56%	0.556	36%	0.358	S	S	*	.			trans	-60	88.3	178.1	-151.9	-1	0	0	0	109.6	G104 Q105	D102-G104 PolarHBondContact O-N 3.02Å; D102-Q105 HydrophobicContact CB-CB 4.4Å; D102-Q105 HydrophobicContact CB-CG 4.3Å; D102-Q105 CarbonylContact O-C 3.59Å; D102-Q105 WeakPolarHBondContact O-CA 3.43Å; D102-Q105 PolarHBondContact O-N 3.04Å; D102-Q105 PolarHBondContact OD2-NE2 3.23Å
103	I	40.1	Very low	45.8	Very low	48 Å²	48	58.9 Å²	58.9	25%	0.246	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.7	-179.7	-69.4	176.4	0	0	0	110.5	L95 F98 L101 Q105	L95-I103 HydrophobicContact CD2-CD1 3.88Å; F98-I103 HydrophobicContact CB-CD1 3.63Å; F98-I103 HydrophobicContact CB-CG1 4.31Å; F98-I103 HydrophobicContact CD1-CD1 3.37Å; F98-I103 HydrophobicContact CD1-CG1 3.57Å; F98-I103 HydrophobicContact CD2-CD1 4.21Å; F98-I103 HydrophobicContact CE1-CD1 4.05Å; F98-I103 HydrophobicContact CE1-CG1 4.18Å; F98-I103 HydrophobicContact CG-CD1 3.49Å; F98-I103 VanDerWaalsContact CG-CD1 3.49Å; F98-I103 HydrophobicContact CG-CG1 4.17Å; L101-I103 VanDerWaalsContact C-N 3.31Å; L101-I103 PolarHBondContact O-N 3.29Å; I103-Q105 PolarHBondContact O-N 3.45Å
104	G	36.6	Very low	45.9	Very low	77 Å²	77	56 Å²	56	79%	0.794	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-14.1	167.1	0	0	0	0	0	113.7	D102	D102-G104 PolarHBondContact O-N 3.02Å
105	Q	37.8	Very low	46.1	Very low	116 Å²	116	57.6 Å²	57.6	54%	0.542	34%	0.337	S	S	.	.	S	Bend	trans	-109.8	117.2	170.1	-59.7	-166.3	33	0	0	109.8	D102 I103 S107 G108	D102-Q105 HydrophobicContact CB-CB 4.4Å; D102-Q105 HydrophobicContact CB-CG 4.3Å; D102-Q105 CarbonylContact O-C 3.59Å; D102-Q105 WeakPolarHBondContact O-CA 3.43Å; D102-Q105 PolarHBondContact O-N 3.04Å; D102-Q105 PolarHBondContact OD2-NE2 3.23Å; I103-Q105 PolarHBondContact O-N 3.45Å; Q105-S107 PolarHBondContact O-N 3.02Å; Q105-G108 PolarHBondContact O-N 3.39Å
106	M	38.6	Very low	46.6	Very low	57 Å²	57	56.1 Å²	56.1	28%	0.281	33%	0.329	S	S	.	.	H	α-helix	trans	-44.4	-21.3	176.7	-122.1	161	169.5	0	0	115.1	M13 Q16 R110	M13-M106 VanDerWaalsContact O-CE 3.27Å; M13-M106 WeakPolarHBondContact O-CE 3.15Å; M13-M106 WeakPolarHBondContact O-CG 3.41Å; M13-M106 HydrophobicContact SD-CE 4.1Å; Q16-M106 WeakPolarHBondContact O-CE 3.47Å; M106-R110 PolarHBondContact O-N 3.05Å
107	S	42.4	Very low	47.2	Very low	59 Å²	59	52.8 Å²	52.8	41%	0.413	31%	0.309	S	S	.	.	H	α-helix	trans	-60.7	-39.6	172.4	-161	0	0	0	0	114	Q105 R111	Q105-S107 PolarHBondContact O-N 3.02Å; S107-R111 VanDerWaalsContact O-CG 3.31Å; S107-R111 WeakPolarHBondContact O-CG 3.32Å; S107-R111 PolarHBondContact O-NE 3.01Å; S107-R111 PolarHBondContact OG-NH2 3.02Å
108	G	53.4	Low	47.8	Very low	4 Å²	4	52 Å²	52	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-70.8	-40.3	-175.4	0	0	0	0	0	113.1	Q105 R111 L112	Q105-G108 PolarHBondContact O-N 3.39Å; G108-R111 WeakPolarHBondContact O-CB 3.32Å; G108-R111 PolarHBondContact O-N 3.23Å; G108-L112 PolarHBondContact O-N 3.4Å
109	L	50.2	Low	48.1	Very low	15 Å²	15	56.7 Å²	56.7	8%	0.079	33%	0.329	C	S	.	.	H	α-helix	trans	-70.8	-39.7	-178.3	-165.4	72.7	0	0	0	112.7	K68 I72 R111 L112 V113	K68-L109 HydrophobicContact CD-CD2 3.5Å; K68-L109 HydrophobicContact CG-CD2 3.56Å; I72-L109 HydrophobicContact CD1-CD1 3.76Å; I72-L109 HydrophobicContact CD1-CD2 4.35Å; I72-L109 HydrophobicContact CG1-CD1 3.54Å; L109-R111 PolarHBondContact O-N 2.64Å; L109-L112 PolarHBondContact O-N 2.81Å; L109-V113 WeakPolarHBondContact O-CG2 3.5Å; L109-V113 PolarHBondContact O-N 3.28Å
110	R	53.9	Low	48.8	Very low	88 Å²	88	50 Å²	50	33%	0.332	30%	0.299	S	S	.	.	H	α-helix	trans	-55.6	-38.1	174.1	-174.1	-178.1	173.5	164.8	2.7	111.8	L10 L11 M106 G114	L10-R110 VanDerWaalsContact C-CZ 3.5Å; L10-R110 HydrophobicContact CB-CG 4.32Å; L10-R110 HydrophobicContact CD2-CG 3.88Å; L10-R110 VanDerWaalsContact O-CD 3.22Å; L10-R110 WeakPolarHBondContact O-CD 3.22Å; L10-R110 PolarHBondContact O-NE 3.24Å; L10-R110 PolarHBondContact O-NH1 3.06Å; L11-R110 VanDerWaalsContact CD2-NH2 3.32Å; M106-R110 PolarHBondContact O-N 3.05Å; R110-G114 PolarHBondContact O-N 3.33Å
111	R	56.2	Low	49.3	Very low	75 Å²	75	48.4 Å²	48.4	28%	0.283	28%	0.282	S	S	.	.	H	α-helix	trans	-68.1	-44.1	178.1	-64.1	175.3	-163.1	176.8	6.4	112.1	S107 G108 L109 G114 A115 W381	S107-R111 VanDerWaalsContact O-CG 3.31Å; S107-R111 WeakPolarHBondContact O-CG 3.32Å; S107-R111 PolarHBondContact O-NE 3.01Å; S107-R111 PolarHBondContact OG-NH2 3.02Å; G108-R111 WeakPolarHBondContact O-CB 3.32Å; G108-R111 PolarHBondContact O-N 3.23Å; L109-R111 PolarHBondContact O-N 2.64Å; R111-G114 PolarHBondContact O-N 3.49Å; R111-A115 WeakPolarHBondContact O-CB 3.47Å; R111-A115 PolarHBondContact O-N 2.86Å; R111-W381 HydrophobicContact CB-CD2 4.42Å; R111-W381 HydrophobicContact CB-CE3 4.33Å; R111-W381 VanDerWaalsContact CD-CE3 3.45Å; R111-W381 HydrophobicContact CG-CD2 4Å; R111-W381 HydrophobicContact CG-CE3 3.46Å; R111-W381 VanDerWaalsContact CG-CE3 3.46Å; R111-W381 HydrophobicContact CG-CH2 3.9Å; R111-W381 HydrophobicContact CG-CZ2 4.4Å; R111-W381 HydrophobicContact CG-CZ3 3.42Å; R111-W381 VanDerWaalsContact CG-CZ3 3.42Å
112	L	56.7	Low	49.7	Very low	17 Å²	17	47.5 Å²	47.5	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-60.6	-51.6	178	-173.9	169.6	0	0	0	110.2	A75 F98 G108 L109 G114 A115 L116	A75-L112 HydrophobicContact CB-CD1 3.82Å; A75-L112 HydrophobicContact CB-CD2 3.72Å; A75-L112 HydrophobicContact CB-CG 4.02Å; F98-L112 HydrophobicContact CE1-CD1 3.96Å; F98-L112 HydrophobicContact CE2-CD1 4.05Å; F98-L112 HydrophobicContact CZ-CD1 3.33Å; F98-L112 HydrophobicContact CZ-CG 4.32Å; G108-L112 PolarHBondContact O-N 3.4Å; L109-L112 PolarHBondContact O-N 2.81Å; L112-G114 VanDerWaalsContact C-N 3.35Å; L112-G114 PolarHBondContact O-N 2.9Å; L112-A115 PolarHBondContact O-N 3.44Å; L112-L116 HydrophobicContact CD2-CD1 3.39Å; L112-L116 HydrophobicContact CD2-CG 3.92Å; L112-L116 WeakPolarHBondContact O-CG 3.39Å; L112-L116 PolarHBondContact O-N 2.88Å
113	V	59.9	Low	50.1	Low	6 Å²	6	45.3 Å²	45.3	4%	0.036	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-47.3	178.7	176.5	0	0	0	0	110.8	L10 F67 L109 A115 L116 C117	L10-V113 HydrophobicContact CD2-CG1 4.22Å; F67-V113 HydrophobicContact CD1-CG1 4.03Å; F67-V113 HydrophobicContact CE1-CG1 3.48Å; F67-V113 VanDerWaalsContact CE1-CG1 3.48Å; L109-V113 WeakPolarHBondContact O-CG2 3.5Å; L109-V113 PolarHBondContact O-N 3.28Å; V113-A115 PolarHBondContact O-N 3.47Å; V113-L116 PolarHBondContact O-N 3.44Å; V113-C117 PolarHBondContact O-N 3.25Å; V113-C117 PolarHBondContact O-SG 3.44Å
114	G	57.5	Low	50.5	Low	9 Å²	9	43.6 Å²	43.6	9%	0.093	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-41.4	178	0	0	0	0	0	114	R110 R111 L112 T118	R110-G114 PolarHBondContact O-N 3.33Å; R111-G114 PolarHBondContact O-N 3.49Å; L112-G114 VanDerWaalsContact C-N 3.35Å; L112-G114 PolarHBondContact O-N 2.9Å; G114-T118 PolarHBondContact O-N 3.39Å; G114-T118 PolarHBondContact O-OG1 3.42Å
115	A	56.6	Low	51.3	Low	38 Å²	38	43 Å²	43	31%	0.314	24%	0.243	S	C	.	.	H	α-helix	trans	-65.7	-42.3	176.8	0	0	0	0	0	112	R111 L112 V113 T118 Q119	R111-A115 WeakPolarHBondContact O-CB 3.47Å; R111-A115 PolarHBondContact O-N 2.86Å; L112-A115 PolarHBondContact O-N 3.44Å; V113-A115 PolarHBondContact O-N 3.47Å; A115-T118 PolarHBondContact O-N 3.43Å; A115-Q119 PolarHBondContact O-N 3.39Å
116	L	59.7	Low	52.4	Low	11 Å²	11	38.6 Å²	38.6	6%	0.058	22%	0.224	C	C	.	.	H	α-helix	trans	-66.3	-44.2	179	-71	-176	0	0	0	112.7	Y45 S71 Y74 A75 L112 V113 T118 Q119 I120	Y45-L116 HydrophobicContact CE1-CB 4.47Å; Y45-L116 WeakPolarHBondContact OH-CB 3.36Å; S71-L116 WeakPolarHBondContact O-CD1 3.42Å; Y74-L116 HydrophobicContact CD1-CD1 3.9Å; Y74-L116 HydrophobicContact CD1-CD2 3.49Å; Y74-L116 VanDerWaalsContact CD1-CD2 3.49Å; Y74-L116 HydrophobicContact CD1-CG 4.26Å; Y74-L116 HydrophobicContact CE1-CD2 3.58Å; A75-L116 HydrophobicContact CB-CD1 4.19Å; L112-L116 HydrophobicContact CD2-CD1 3.39Å; L112-L116 HydrophobicContact CD2-CG 3.92Å; L112-L116 WeakPolarHBondContact O-CG 3.39Å; L112-L116 PolarHBondContact O-N 2.88Å; V113-L116 PolarHBondContact O-N 3.44Å; L116-T118 VanDerWaalsContact C-N 3.26Å; L116-T118 PolarHBondContact O-N 3.04Å; L116-Q119 WeakPolarHBondContact O-CB 3.46Å; L116-Q119 PolarHBondContact O-N 2.85Å; L116-I120 WeakPolarHBondContact O-CG1 3.48Å; L116-I120 PolarHBondContact O-N 3.43Å; L116-I120 VanDerWaalsContact O-N 3.15Å
117	C	54.5	Low	53.9	Low	1 Å²	1	41.4 Å²	41.4	1%	0.007	24%	0.236	C	C	.	.	H	α-helix	trans	-54.2	-47	173.1	-67.7	0	0	0	0	111	F67 V113 Q119 I120 G121 I122 V124	F67-C117 VanDerWaalsContact CZ-SG 3.57Å; V113-C117 PolarHBondContact O-N 3.25Å; V113-C117 PolarHBondContact O-SG 3.44Å; C117-Q119 VanDerWaalsContact C-N 3.28Å; C117-Q119 PolarHBondContact O-N 3.05Å; C117-I120 WeakPolarHBondContact O-CG1 3.41Å; C117-I120 PolarHBondContact O-N 2.92Å; C117-I120 VanDerWaalsContact O-N 3.16Å; C117-G121 PolarHBondContact O-N 2.84Å; C117-I122 CarbonylContact C-O 3.58Å; C117-I122 HydrophobicContact CB-CB 4.29Å; C117-I122 CarbonylContact O-C 3.57Å; C117-I122 WeakPolarHBondContact O-CA 3.33Å; C117-I122 PolarHBondContact O-N 3.28Å; C117-V124 HydrophobicContact CB-CG2 3.34Å
118	T	54.5	Low	55.8	Low	68 Å²	68	39.2 Å²	39.2	42%	0.417	22%	0.219	S	C	.	.	H	α-helix	trans	-61.3	-38.6	178.7	-52.5	0	0	0	0	111.3	G114 A115 L116 I120 G121 I122	G114-T118 PolarHBondContact O-N 3.39Å; G114-T118 PolarHBondContact O-OG1 3.42Å; A115-T118 PolarHBondContact O-N 3.43Å; L116-T118 VanDerWaalsContact C-N 3.26Å; L116-T118 PolarHBondContact O-N 3.04Å; T118-I120 VanDerWaalsContact C-N 3.3Å; T118-I120 PolarHBondContact O-N 3.15Å; T118-G121 PolarHBondContact O-N 3.35Å; T118-G121 VanDerWaalsContact O-N 3.14Å; T118-I122 WeakPolarHBondContact CA-O 3.41Å; T118-I122 PolarHBondContact N-O 2.78Å
119	Q	53.5	Low	57.3	Low	114 Å²	114	42.5 Å²	42.5	53%	0.533	24%	0.236	S	C	.	.	H	α-helix	trans	-67.3	-26	179.1	-170.5	177.5	-12.7	0	0	113.6	A115 L116 C117 G121	A115-Q119 PolarHBondContact O-N 3.39Å; L116-Q119 WeakPolarHBondContact O-CB 3.46Å; L116-Q119 PolarHBondContact O-N 2.85Å; C117-Q119 VanDerWaalsContact C-N 3.28Å; C117-Q119 PolarHBondContact O-N 3.05Å; Q119-G121 VanDerWaalsContact C-N 3.34Å
120	I	50.8	Low	59.1	Low	29 Å²	29	46.8 Å²	46.8	15%	0.149	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	10.4	173.9	58.2	169.8	0	0	0	113.6	Y45 R46 A49 L116 C117 T118 I122	Y45-I120 HydrophobicContact CD1-CG2 3.76Å; Y45-I120 HydrophobicContact CE1-CB 4.47Å; Y45-I120 HydrophobicContact CE1-CD1 3.76Å; Y45-I120 HydrophobicContact CE1-CG1 4.24Å; Y45-I120 HydrophobicContact CE1-CG2 3.49Å; Y45-I120 VanDerWaalsContact CE1-CG2 3.49Å; R46-I120 HydrophobicContact CG-CB 4.11Å; R46-I120 HydrophobicContact CG-CG2 3.65Å; A49-I120 HydrophobicContact CB-CD1 3.85Å; L116-I120 WeakPolarHBondContact O-CG1 3.48Å; L116-I120 PolarHBondContact O-N 3.43Å; L116-I120 VanDerWaalsContact O-N 3.15Å; C117-I120 WeakPolarHBondContact O-CG1 3.41Å; C117-I120 PolarHBondContact O-N 2.92Å; C117-I120 VanDerWaalsContact O-N 3.16Å; T118-I120 VanDerWaalsContact C-N 3.3Å; T118-I120 PolarHBondContact O-N 3.15Å; I120-I122 VanDerWaalsContact C-N 3.29Å; I120-I122 HydrophobicContact CD1-CD1 3.54Å; I120-I122 HydrophobicContact CD1-CG1 4.02Å; I120-I122 HydrophobicContact CG1-CB 4.36Å; I120-I122 HydrophobicContact CG1-CD1 4.1Å; I120-I122 HydrophobicContact CG1-CG1 4.01Å
121	G	45.4	Very low	60.8	Low	47 Å²	47	51.1 Å²	51.1	49%	0.485	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	12	179.1	0	0	0	0	0	114	C117 T118 Q119 P123	C117-G121 PolarHBondContact O-N 2.84Å; T118-G121 PolarHBondContact O-N 3.35Å; T118-G121 VanDerWaalsContact O-N 3.14Å; Q119-G121 VanDerWaalsContact C-N 3.34Å; G121-P123 VanDerWaalsContact O-CD 3.3Å; G121-P123 WeakPolarHBondContact O-CD 3.46Å
122	I	46.6	Very low	62.4	Low	14 Å²	14	47.6 Å²	47.6	7%	0.072	27%	0.268	C	S	.	.			trans	-93.4	103	170.9	-57.6	-179.5	0	0	0	107.1	C117 T118 I120 V124 L341	C117-I122 CarbonylContact C-O 3.58Å; C117-I122 HydrophobicContact CB-CB 4.29Å; C117-I122 CarbonylContact O-C 3.57Å; C117-I122 WeakPolarHBondContact O-CA 3.33Å; C117-I122 PolarHBondContact O-N 3.28Å; T118-I122 WeakPolarHBondContact CA-O 3.41Å; T118-I122 PolarHBondContact N-O 2.78Å; I120-I122 VanDerWaalsContact C-N 3.29Å; I120-I122 HydrophobicContact CD1-CD1 3.54Å; I120-I122 HydrophobicContact CD1-CG1 4.02Å; I120-I122 HydrophobicContact CG1-CB 4.36Å; I120-I122 HydrophobicContact CG1-CD1 4.1Å; I120-I122 HydrophobicContact CG1-CG1 4.01Å; I122-V124 PolarHBondContact O-N 3.28Å; I122-V124 VanDerWaalsContact O-N 3.15Å; I122-L341 HydrophobicContact CG1-CD1 4.34Å
123	P	46.6	Very low	64.1	Low	58 Å²	58	49.7 Å²	49.7	38%	0.377	28%	0.279	S	S	.	.			trans	-64.8	121.7	-178.2	26.7	-32.7	0	0	0	109.2	G121 P125 F335	G121-P123 VanDerWaalsContact O-CD 3.3Å; G121-P123 WeakPolarHBondContact O-CD 3.46Å; P123-P125 VanDerWaalsContact O-CD 3.23Å; P123-P125 WeakPolarHBondContact O-CD 3.43Å; P123-F335 HydrophobicContact CB-CD1 3.98Å; P123-F335 HydrophobicContact CB-CE1 3.87Å; P123-F335 HydrophobicContact CB-CG 4.49Å; P123-F335 HydrophobicContact CB-CZ 4.3Å; P123-F335 HydrophobicContact CG-CB 4.48Å; P123-F335 HydrophobicContact CG-CD1 3.82Å; P123-F335 HydrophobicContact CG-CE1 4.24Å; P123-F335 HydrophobicContact CG-CG 4.07Å
124	V	49.6	Very low	65.7	Low	13 Å²	13	51 Å²	51	8%	0.079	29%	0.293	C	S	.	.			trans	-92.4	104	162.4	173.9	0	0	0	0	106.3	V6 L10 C117 I122 T126	V6-V124 HydrophobicContact CG1-CG2 4.32Å; L10-V124 HydrophobicContact CD1-CG1 3.37Å; L10-V124 HydrophobicContact CD1-CG2 4.37Å; C117-V124 HydrophobicContact CB-CG2 3.34Å; I122-V124 PolarHBondContact O-N 3.28Å; I122-V124 VanDerWaalsContact O-N 3.15Å; V124-T126 PolarHBondContact O-N 3.49Å
125	P	52.4	Low	67.5	Low	65 Å²	65	51.6 Å²	51.6	42%	0.422	29%	0.294	S	S	.	.			trans	-64.3	106	178.3	26.3	-32.6	0	0	0	108.1	V7 P123 Q127	V7-P125 HydrophobicContact CG2-CG 3.75Å; P123-P125 VanDerWaalsContact O-CD 3.23Å; P123-P125 WeakPolarHBondContact O-CD 3.43Å; P125-Q127 PolarHBondContact O-N 3.25Å
126	T	60.4	Low	69.3	Low	23 Å²	23	49.8 Å²	49.8	14%	0.141	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-69.4	118.2	170.2	39.5	0	0	0	0	108.4	V124 K295 D379 W381	V124-T126 PolarHBondContact O-N 3.49Å; T126-K295 PolarHBondContact O-NZ 3.46Å; T126-K295 VanDerWaalsContact OG1-CE 3.29Å; T126-K295 WeakPolarHBondContact OG1-CE 3.45Å; T126-K295 PolarHBondContact OG1-NZ 3.42Å; T126-D379 WeakPolarHBondContact CB-OD1 3.34Å; T126-D379 WeakPolarHBondContact CG2-OD1 3.47Å; T126-D379 PolarHBondContact OG1-OD1 3.48Å; T126-D379 PolarHBondContact OG1-OD2 3.19Å; T126-W381 HydrophobicContact CG2-CZ2 4.17Å
127	Q	70.6	Confident	70.9	Confident	116 Å²	116	54.7 Å²	54.7	54%	0.542	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-75.9	147.6	174.3	-67.2	-177.3	-12.5	0	0	109.5	P125 L129	P125-Q127 PolarHBondContact O-N 3.25Å; Q127-L129 PolarHBondContact O-N 2.97Å
128	I	83	Confident	72.9	Confident	12 Å²	12	58 Å²	58	6%	0.062	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-62.3	129.6	169.4	-55.1	-57.4	0	0	0	107.6	V132 L133 K295 V297 I308 Y377	I128-V132 HydrophobicContact CG2-CB 3.78Å; I128-V132 HydrophobicContact CG2-CG1 3.65Å; I128-L133 HydrophobicContact CB-CD2 4.05Å; I128-L133 HydrophobicContact CB-CG 4.43Å; I128-L133 HydrophobicContact CG2-CD2 3.71Å; I128-L133 HydrophobicContact CG2-CG 4.07Å; I128-K295 HydrophobicContact CD1-CD 4.19Å; I128-V297 HydrophobicContact CD1-CG2 3.67Å; I128-V297 HydrophobicContact CG1-CG2 4.07Å; I128-I308 HydrophobicContact CG1-CD1 4.26Å; I128-Y377 HydrophobicContact CD1-CD1 3.43Å; I128-Y377 VanDerWaalsContact CD1-CD1 3.43Å; I128-Y377 HydrophobicContact CD1-CD2 4.14Å; I128-Y377 HydrophobicContact CD1-CE1 3.88Å; I128-Y377 HydrophobicContact CD1-CG 3.56Å; I128-Y377 HydrophobicContact CG2-CD2 4.37Å; I128-Y377 HydrophobicContact CG2-CE2 4.39Å
129	L	85.6	Confident	74.8	Confident	73 Å²	73	54.8 Å²	54.8	38%	0.382	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-59.1	140	-177.9	-75.6	175.7	0	0	0	111.2	Q127 R131 V132 L133 Q167	Q127-L129 PolarHBondContact O-N 2.97Å; L129-R131 PolarHBondContact O-N 2.96Å; L129-V132 PolarHBondContact O-N 3.2Å; L129-L133 PolarHBondContact O-N 3.2Å; L129-Q167 HydrophobicContact CD1-CB 3.76Å
130	P	86.4	Confident	76.7	Confident	106 Å²	106	51.2 Å²	51.2	69%	0.688	28%	0.284	S	S	*	.	H	α-helix	trans	-53.4	-32	178.1	-28.6	35.1	0	0	0	113.9	L133 G134	P130-L133 PolarHBondContact O-N 3.38Å; P130-G134 PolarHBondContact O-N 3.15Å
131	R	90.3	Very high	78.7	Confident	178 Å²	178	53 Å²	53	67%	0.672	29%	0.294	S	S	*	.	H	α-helix	trans	-58.3	-47.1	173.8	178.9	-178.6	169.5	-167.1	-7	112.1	L129 L133 G134 I135	L129-R131 PolarHBondContact O-N 2.96Å; R131-L133 VanDerWaalsContact C-N 3.3Å; R131-L133 PolarHBondContact O-N 3.15Å; R131-G134 PolarHBondContact O-N 3Å; R131-I135 HydrophobicContact CG-CD1 4.2Å; R131-I135 WeakPolarHBondContact O-CG1 3.3Å; R131-I135 PolarHBondContact O-N 2.93Å
132	V	90.8	Very high	80.9	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.006	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-37.6	179.3	172.3	0	0	0	0	110.8	I128 L129 I135 A136 A169 F171 Y377	I128-V132 HydrophobicContact CG2-CB 3.78Å; I128-V132 HydrophobicContact CG2-CG1 3.65Å; L129-V132 PolarHBondContact O-N 3.2Å; V132-I135 PolarHBondContact O-N 3.02Å; V132-A136 PolarHBondContact O-N 2.62Å; V132-A169 HydrophobicContact CG1-CB 3.56Å; V132-A169 HydrophobicContact CG2-CB 4.26Å; V132-F171 HydrophobicContact CG1-CZ 3.99Å; V132-Y377 HydrophobicContact CG1-CD2 4.32Å; V132-Y377 HydrophobicContact CG2-CD2 4.22Å; V132-Y377 HydrophobicContact CG2-CE2 3.93Å
133	L	92.4	Very high	83.1	Confident	62 Å²	62	62.4 Å²	62.4	33%	0.325	33%	0.326	S	S	.	.	H	α-helix	trans	-65.2	-40.4	174.6	-58.6	-178.9	0	0	0	112	I128 L129 P130 R131 A136 K137 F299 V305	I128-L133 HydrophobicContact CB-CD2 4.05Å; I128-L133 HydrophobicContact CB-CG 4.43Å; I128-L133 HydrophobicContact CG2-CD2 3.71Å; I128-L133 HydrophobicContact CG2-CG 4.07Å; L129-L133 PolarHBondContact O-N 3.2Å; P130-L133 PolarHBondContact O-N 3.38Å; R131-L133 VanDerWaalsContact C-N 3.3Å; R131-L133 PolarHBondContact O-N 3.15Å; L133-A136 PolarHBondContact O-N 2.79Å; L133-K137 PolarHBondContact O-N 2.9Å; L133-K137 VanDerWaalsContact O-N 3.08Å; L133-F299 HydrophobicContact CD2-CE1 4.2Å; L133-V305 HydrophobicContact CD2-CG2 3.48Å; L133-V305 VanDerWaalsContact CD2-CG2 3.48Å
134	G	92.9	Very high	85.3	Confident	32 Å²	32	61.5 Å²	61.5	33%	0.33	32%	0.317	S	S	.	.	H	α-helix	trans	-59.8	-47.5	173.5	0	0	0	0	0	112	P130 R131 A136 K137 D138	P130-G134 PolarHBondContact O-N 3.15Å; R131-G134 PolarHBondContact O-N 3Å; G134-A136 VanDerWaalsContact C-N 3.34Å; G134-A136 PolarHBondContact O-N 3.43Å; G134-K137 WeakPolarHBondContact O-CB 3.21Å; G134-K137 PolarHBondContact O-N 3.35Å; G134-D138 PolarHBondContact O-N 3Å
135	I	94.2	Very high	87.2	Confident	23 Å²	23	65 Å²	65	12%	0.118	34%	0.335	C	S	.	.	H	α-helix	trans	-59	-44.7	176	-67.7	166.3	0	0	0	111.2	R131 V132 K137 D138 I139 V149 F171	R131-I135 HydrophobicContact CG-CD1 4.2Å; R131-I135 WeakPolarHBondContact O-CG1 3.3Å; R131-I135 PolarHBondContact O-N 2.93Å; V132-I135 PolarHBondContact O-N 3.02Å; I135-K137 VanDerWaalsContact C-N 3.29Å; I135-K137 PolarHBondContact O-N 3.16Å; I135-D138 PolarHBondContact O-N 3.15Å; I135-I139 HydrophobicContact CG2-CD1 3.78Å; I135-I139 HydrophobicContact CG2-CG1 4.35Å; I135-I139 VanDerWaalsContact O-CG1 3.29Å; I135-I139 WeakPolarHBondContact O-CG1 3.42Å; I135-I139 PolarHBondContact O-N 3.39Å; I135-V149 HydrophobicContact CD1-CG2 4.32Å; I135-V149 HydrophobicContact CG1-CG2 4.48Å; I135-V149 HydrophobicContact CG2-CB 4.27Å; I135-V149 HydrophobicContact CG2-CG1 3.75Å; I135-V149 HydrophobicContact CG2-CG2 3.88Å; I135-F171 HydrophobicContact CB-CE2 4.27Å; I135-F171 HydrophobicContact CB-CZ 4.16Å; I135-F171 HydrophobicContact CG2-CD2 4.2Å; I135-F171 HydrophobicContact CG2-CE2 3.46Å; I135-F171 VanDerWaalsContact CG2-CE2 3.46Å; I135-F171 HydrophobicContact CG2-CZ 3.69Å
136	A	94.7	Very high	89	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.4	-43.5	178.1	0	0	0	0	0	111.8	V132 L133 G134 I139 V140 F171 F299 L373	V132-A136 PolarHBondContact O-N 2.62Å; L133-A136 PolarHBondContact O-N 2.79Å; G134-A136 VanDerWaalsContact C-N 3.34Å; G134-A136 PolarHBondContact O-N 3.43Å; A136-I139 PolarHBondContact O-N 3.24Å; A136-V140 WeakPolarHBondContact O-CG2 3.11Å; A136-V140 PolarHBondContact O-N 3.45Å; A136-F171 HydrophobicContact CB-CE1 3.78Å; A136-F171 HydrophobicContact CB-CZ 4.32Å; A136-F299 HydrophobicContact CB-CD1 3.61Å; A136-F299 HydrophobicContact CB-CD2 4.3Å; A136-F299 HydrophobicContact CB-CE1 3.38Å; A136-F299 HydrophobicContact CB-CE2 4.11Å; A136-F299 HydrophobicContact CB-CG 4.07Å; A136-F299 HydrophobicContact CB-CZ 3.66Å; A136-L373 HydrophobicContact CB-CD2 4.44Å
137	K	94.3	Very high	90.2	Very high	113 Å²	113	69.5 Å²	69.5	49%	0.491	37%	0.367	S	S	.	.	H	α-helix	trans	-63.1	-44.5	176.1	-169.5	176.1	-176.9	175.4	0	112	L133 G134 I135 I139 V140 D141	L133-K137 PolarHBondContact O-N 2.9Å; L133-K137 VanDerWaalsContact O-N 3.08Å; G134-K137 WeakPolarHBondContact O-CB 3.21Å; G134-K137 PolarHBondContact O-N 3.35Å; I135-K137 VanDerWaalsContact C-N 3.29Å; I135-K137 PolarHBondContact O-N 3.16Å; K137-I139 VanDerWaalsContact C-N 3.27Å; K137-I139 PolarHBondContact O-N 3.12Å; K137-V140 PolarHBondContact O-N 3.09Å; K137-D141 WeakPolarHBondContact O-CB 3.49Å; K137-D141 PolarHBondContact O-N 3.1Å
138	D	95.6	Very high	91	Very high	71 Å²	71	69.1 Å²	69.1	38%	0.38	37%	0.372	S	S	.	.	H	α-helix	trans	-63.7	-33.3	176.7	-68.1	-22.8	0	0	0	112.2	G134 I135 N142 K143 H144	G134-D138 PolarHBondContact O-N 3Å; I135-D138 PolarHBondContact O-N 3.15Å; D138-N142 PolarHBondContact O-N 3.32Å; D138-N142 VanDerWaalsContact O-N 3.16Å; D138-K143 PolarHBondContact O-N 3.44Å; D138-H144 HydrophobicContact CB-CB 4.05Å; D138-H144 PolarHBondContact O-N 2.73Å
139	I	95.6	Very high	91.3	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-67.2	-46.2	174.5	-68.2	163	0	0	0	111.1	I135 A136 K137 D141 N142 H144 V149 V151 F171 R173 L373	I135-I139 HydrophobicContact CG2-CD1 3.78Å; I135-I139 HydrophobicContact CG2-CG1 4.35Å; I135-I139 VanDerWaalsContact O-CG1 3.29Å; I135-I139 WeakPolarHBondContact O-CG1 3.42Å; I135-I139 PolarHBondContact O-N 3.39Å; A136-I139 PolarHBondContact O-N 3.24Å; K137-I139 VanDerWaalsContact C-N 3.27Å; K137-I139 PolarHBondContact O-N 3.12Å; I139-D141 VanDerWaalsContact C-N 3.34Å; I139-N142 PolarHBondContact O-N 3.14Å; I139-N142 VanDerWaalsContact O-N 3.13Å; I139-H144 HydrophobicContact CG1-CB 3.93Å; I139-V149 HydrophobicContact CD1-CG1 4.08Å; I139-V151 HydrophobicContact CD1-CG2 3.7Å; I139-V151 HydrophobicContact CG1-CG2 3.87Å; I139-V151 HydrophobicContact CG2-CG2 3.82Å; I139-F171 HydrophobicContact CD1-CB 3.91Å; I139-F171 HydrophobicContact CD1-CD1 3.61Å; I139-F171 HydrophobicContact CD1-CD2 3.77Å; I139-F171 HydrophobicContact CD1-CE1 4.01Å; I139-F171 HydrophobicContact CD1-CE2 4.16Å; I139-F171 HydrophobicContact CD1-CG 3.48Å; I139-F171 VanDerWaalsContact CD1-CG 3.48Å; I139-F171 HydrophobicContact CD1-CZ 4.26Å; I139-R173 PolarHBondContact O-NH2 2.96Å; I139-L373 HydrophobicContact CB-CD2 4.01Å; I139-L373 HydrophobicContact CG2-CD1 3.72Å; I139-L373 HydrophobicContact CG2-CD2 3.78Å; I139-L373 HydrophobicContact CG2-CG 4.41Å
140	V	92.7	Very high	91.5	Very high	39 Å²	39	73.3 Å²	73.3	24%	0.236	39%	0.391	C	S	.	.	H	α-helix	trans	-63.8	-41.6	179.3	170.1	0	0	0	0	111.1	A136 K137 N142 R301 L373	A136-V140 WeakPolarHBondContact O-CG2 3.11Å; A136-V140 PolarHBondContact O-N 3.45Å; K137-V140 PolarHBondContact O-N 3.09Å; V140-N142 PolarHBondContact O-N 2.96Å; V140-R301 WeakPolarHBondContact CG1-O 3.3Å; V140-L373 HydrophobicContact CG2-CD2 3.78Å
141	D	92.7	Very high	91.9	Very high	68 Å²	68	69.9 Å²	69.9	36%	0.364	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-4.5	175.9	-80.9	3.6	0	0	0	113.4	K137 I139 K143	K137-D141 WeakPolarHBondContact O-CB 3.49Å; K137-D141 PolarHBondContact O-N 3.1Å; I139-D141 VanDerWaalsContact C-N 3.34Å; D141-K143 HydrophobicContact CB-CB 4.4Å; D141-K143 HydrophobicContact CB-CD 3.81Å; D141-K143 HydrophobicContact CB-CG 3.97Å; D141-K143 PolarHBondContact O-N 3.08Å; D141-K143 IonicContact OD2-NZ 3.48Å; D141-K143 PolarHBondContact OD2-NZ 2.68Å
142	N	91.5	Very high	92.1	Very high	114 Å²	114	63.6 Å²	63.6	61%	0.61	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	35.1	-171.2	-57.9	-72.2	0	0	0	113.7	D138 I139 V140 R173	D138-N142 PolarHBondContact O-N 3.32Å; D138-N142 VanDerWaalsContact O-N 3.16Å; I139-N142 PolarHBondContact O-N 3.14Å; I139-N142 VanDerWaalsContact O-N 3.13Å; V140-N142 PolarHBondContact O-N 2.96Å; N142-R173 PolarHBondContact OD1-NH2 3.08Å
143	K	93.1	Very high	92.1	Very high	144 Å²	144	67.8 Å²	67.8	63%	0.626	38%	0.376	S	S	*	.			trans	-104.5	-9.2	177	-67.3	172.4	-170	154	0	113.8	D138 D141	D138-K143 PolarHBondContact O-N 3.44Å; D141-K143 HydrophobicContact CB-CB 4.4Å; D141-K143 HydrophobicContact CB-CD 3.81Å; D141-K143 HydrophobicContact CB-CG 3.97Å; D141-K143 PolarHBondContact O-N 3.08Å; D141-K143 IonicContact OD2-NZ 3.48Å; D141-K143 PolarHBondContact OD2-NZ 2.68Å
144	H	92.4	Very high	92	Very high	38 Å²	38	65.2 Å²	65.2	18%	0.176	36%	0.362	C	S	.	.	S	Bend	trans	-61.7	148	176.9	72.8	-66.3	0	0	0	111.8	D138 I139 P146 V149	D138-H144 HydrophobicContact CB-CB 4.05Å; D138-H144 PolarHBondContact O-N 2.73Å; I139-H144 HydrophobicContact CG1-CB 3.93Å; H144-P146 VanDerWaalsContact O-CD 3.28Å; H144-P146 WeakPolarHBondContact O-CD 3.14Å; H144-V149 PolarHBondContact CD2-O 2.91Å
145	D	90.5	Very high	91.4	Very high	87 Å²	87	66.2 Å²	66.2	47%	0.465	37%	0.367	S	S	.	.			trans	-82.1	112.4	170.2	-174.9	-16.5	0	0	0	109.6	S147 V148 V149	D145-S147 PolarHBondContact O-N 3.25Å; D145-S147 VanDerWaalsContact O-N 3.17Å; D145-S147 VanDerWaalsContact OD1-CB 3.3Å; D145-S147 WeakPolarHBondContact OD1-CB 3.35Å; D145-S147 PolarHBondContact OD1-N 3.5Å; D145-S147 PolarHBondContact OD1-OG 3.24Å; D145-S147 PolarHBondContact OD2-OG 2.81Å; D145-S147 VanDerWaalsContact OD2-OG 3.14Å; D145-V148 HydrophobicContact CB-CB 4.28Å; D145-V148 HydrophobicContact CB-CG2 4.06Å; D145-V148 PolarHBondContact O-N 3.11Å; D145-V149 PolarHBondContact O-N 3.27Å
146	P	88.4	Confident	90.9	Very high	86 Å²	86	67.8 Å²	67.8	56%	0.558	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.3	-178.7	-20.2	34.2	0	0	0	113.7	H144 V148	H144-P146 VanDerWaalsContact O-CD 3.28Å; H144-P146 WeakPolarHBondContact O-CD 3.14Å; P146-V148 VanDerWaalsContact C-N 3.32Å
147	S	86.9	Confident	90.1	Very high	96 Å²	96	69.7 Å²	69.7	67%	0.671	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-23.4	174.7	74	0	0	0	0	112.7	D145	D145-S147 PolarHBondContact O-N 3.25Å; D145-S147 VanDerWaalsContact O-N 3.17Å; D145-S147 VanDerWaalsContact OD1-CB 3.3Å; D145-S147 WeakPolarHBondContact OD1-CB 3.35Å; D145-S147 PolarHBondContact OD1-N 3.5Å; D145-S147 PolarHBondContact OD1-OG 3.24Å; D145-S147 PolarHBondContact OD2-OG 2.81Å; D145-S147 VanDerWaalsContact OD2-OG 3.14Å
148	V	86.9	Confident	89.6	Confident	108 Å²	108	68.8 Å²	68.8	66%	0.655	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-44.7	-179.2	-178.5	0	0	0	0	111.2	D145 P146	D145-V148 HydrophobicContact CB-CB 4.28Å; D145-V148 HydrophobicContact CB-CG2 4.06Å; D145-V148 PolarHBondContact O-N 3.11Å; P146-V148 VanDerWaalsContact C-N 3.32Å
149	V	89.6	Confident	89.4	Confident	26 Å²	26	68.9 Å²	68.9	16%	0.158	39%	0.394	C	S	.	.	S	Bend	trans	-124.8	111	-178.7	-175	0	0	0	0	109.8	I135 I139 H144 D145 F171	I135-V149 HydrophobicContact CD1-CG2 4.32Å; I135-V149 HydrophobicContact CG1-CG2 4.48Å; I135-V149 HydrophobicContact CG2-CB 4.27Å; I135-V149 HydrophobicContact CG2-CG1 3.75Å; I135-V149 HydrophobicContact CG2-CG2 3.88Å; I139-V149 HydrophobicContact CD1-CG1 4.08Å; H144-V149 PolarHBondContact CD2-O 2.91Å; D145-V149 PolarHBondContact O-N 3.27Å; V149-F171 HydrophobicContact CG1-CD2 3.9Å; V149-F171 HydrophobicContact CG1-CE2 4.31Å
150	Q	89.8	Confident	89.3	Confident	148 Å²	148	69.2 Å²	69.2	69%	0.692	40%	0.396	S	S	*	.			trans	-86.1	137.6	174.6	-65.6	-177.6	-6.4	0	0	110.7
151	V	94.7	Very high	89.4	Confident	34 Å²	34	70.7 Å²	70.7	21%	0.206	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	116.4	175	-171.7	0	0	0	0	108.8	I139 F171 R173 L373	I139-V151 HydrophobicContact CD1-CG2 3.7Å; I139-V151 HydrophobicContact CG1-CG2 3.87Å; I139-V151 HydrophobicContact CG2-CG2 3.82Å; V151-F171 HydrophobicContact CG1-CB 4.23Å; V151-F171 HydrophobicContact CG2-CB 4.18Å; V151-R173 HydrophobicContact CG1-CB 4.37Å; V151-R173 HydrophobicContact CG1-CG 3.59Å; V151-L373 HydrophobicContact CG1-CD1 4.02Å
152	E	94.5	Very high	89.5	Confident	46 Å²	46	70.6 Å²	70.6	22%	0.215	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	129.6	-175.5	-171.6	180	151.3	0	0	110.7	S160 K170 F171 Y172 R173	E152-S160 WeakPolarHBondContact OE1-CB 3.28Å; E152-S160 PolarHBondContact OE1-OG 2.85Å; E152-S160 PolarHBondContact OE2-OG 3.22Å; E152-K170 VanDerWaalsContact OE2-CE 3.26Å; E152-K170 WeakPolarHBondContact OE2-CE 3.26Å; E152-K170 IonicContact OE2-NZ 2.9Å; E152-F171 PolarHBondContact N-O 3.24Å; E152-Y172 HydrophobicContact CB-CD1 3.78Å; E152-Y172 HydrophobicContact CB-CE1 3.93Å; E152-Y172 HydrophobicContact CG-CD1 4.22Å; E152-Y172 HydrophobicContact CG-CE1 4.16Å; E152-Y172 CarbonylContact O-C 3.43Å; E152-Y172 WeakPolarHBondContact O-CA 3.42Å; E152-Y172 VanDerWaalsContact OE2-CE1 3.29Å; E152-Y172 WeakPolarHBondContact OE2-CE1 3.4Å; E152-R173 PolarHBondContact O-N 2.9Å
153	S	91.8	Very high	89.6	Confident	88 Å²	88	72 Å²	72	62%	0.615	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.8	174.7	-64.5	0	0	0	0	109.5	R173	S153-R173 WeakPolarHBondContact CA-O 3.36Å
154	L	88.8	Confident	89.5	Confident	8 Å²	8	65.5 Å²	65.5	4%	0.042	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-102.7	120.8	-175.2	-162.9	64.9	0	0	0	110.9	E158 R173 F374 V389 V391	L154-E158 HydrophobicContact CD1-CB 4.33Å; L154-E158 HydrophobicContact CD1-CG 4.23Å; L154-R173 PolarHBondContact N-O 3.03Å; L154-F374 HydrophobicContact CD2-CZ 4.45Å; L154-V389 HydrophobicContact CD2-CG1 4.17Å; L154-V389 HydrophobicContact CD2-CG2 4.4Å; L154-V391 HydrophobicContact CD2-CG2 3.76Å; L154-V391 HydrophobicContact CG-CG2 4.41Å
155	A	81.3	Confident	89.2	Confident	53 Å²	53	69.5 Å²	69.5	44%	0.438	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-78.8	158.1	174.8	0	0	0	0	0	111.9	G157 E158	A155-G157 PolarHBondContact O-N 3.14Å; A155-E158 HydrophobicContact CB-CB 4.23Å; A155-E158 WeakPolarHBondContact CB-OE2 3.48Å; A155-E158 PolarHBondContact N-OE2 2.8Å; A155-E158 WeakPolarHBondContact O-CB 3.23Å; A155-E158 PolarHBondContact O-N 3.43Å
156	F	82.6	Confident	88.7	Confident	57 Å²	57	72 Å²	72	25%	0.25	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-64.1	132.6	174.6	-77	-91.6	0	0	0	110.9	E158 L176 F273 I282 V391	F156-E158 PolarHBondContact O-N 3.07Å; F156-L176 HydrophobicContact CE2-CD2 3.77Å; F156-L176 HydrophobicContact CZ-CD2 3.44Å; F156-L176 VanDerWaalsContact CZ-CD2 3.44Å; F156-F273 HydrophobicContact CB-CD2 4.26Å; F156-F273 HydrophobicContact CB-CE2 3.81Å; F156-F273 HydrophobicContact CD1-CD2 4.48Å; F156-F273 AromaticContact CD1-CE2 3.43Å; F156-F273 HydrophobicContact CD1-CE2 3.43Å; F156-F273 VanDerWaalsContact CD1-CE2 3.43Å; F156-F273 AromaticContact CD1-CZ 3.53Å; F156-F273 HydrophobicContact CD1-CZ 3.53Å; F156-F273 HydrophobicContact CD2-CD2 4.46Å; F156-F273 HydrophobicContact CD2-CE2 4.07Å; F156-F273 HydrophobicContact CD2-CZ 4.38Å; F156-F273 HydrophobicContact CE1-CE1 4.34Å; F156-F273 AromaticContact CE1-CE2 3.93Å; F156-F273 HydrophobicContact CE1-CE2 3.93Å; F156-F273 AromaticContact CE1-CZ 3.52Å; F156-F273 HydrophobicContact CE1-CZ 3.52Å; F156-F273 HydrophobicContact CE2-CZ 4.37Å; F156-F273 HydrophobicContact CG-CD2 4.16Å; F156-F273 AromaticContact CG-CE2 3.49Å; F156-F273 HydrophobicContact CG-CE2 3.49Å; F156-F273 VanDerWaalsContact CG-CE2 3.49Å; F156-F273 AromaticContact CG-CZ 3.97Å; F156-F273 HydrophobicContact CG-CZ 3.97Å; F156-F273 HydrophobicContact CZ-CE1 4.38Å; F156-F273 HydrophobicContact CZ-CE2 4.43Å; F156-F273 AromaticContact CZ-CZ 3.96Å; F156-F273 HydrophobicContact CZ-CZ 3.96Å; F156-I282 HydrophobicContact CE1-CD1 4.38Å; F156-I282 HydrophobicContact CE1-CG1 4.14Å; F156-I282 HydrophobicContact CE1-CG2 4.06Å; F156-I282 HydrophobicContact CZ-CD1 4.12Å; F156-I282 HydrophobicContact CZ-CG1 4.38Å; F156-V391 HydrophobicContact CD1-CG1 3.83Å; F156-V391 HydrophobicContact CE1-CG1 3.59Å; F156-V391 HydrophobicContact CZ-CG1 4.11Å
157	G	78.3	Confident	88.3	Confident	40 Å²	40	69.3 Å²	69.3	41%	0.412	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	-24.3	-178.8	0	0	0	0	0	114.4	A155 R390 V391	A155-G157 PolarHBondContact O-N 3.14Å; G157-R390 PolarHBondContact O-NH2 3.2Å; G157-V391 PolarHBondContact N-O 2.67Å
158	E	83.8	Confident	88.4	Confident	94 Å²	94	66.8 Å²	66.8	44%	0.439	36%	0.355	S	S	.	.			trans	-64.2	147.8	176.4	-170.9	175.8	-170.2	0	0	111.7	L154 A155 F156 R390	L154-E158 HydrophobicContact CD1-CB 4.33Å; L154-E158 HydrophobicContact CD1-CG 4.23Å; A155-E158 HydrophobicContact CB-CB 4.23Å; A155-E158 WeakPolarHBondContact CB-OE2 3.48Å; A155-E158 PolarHBondContact N-OE2 2.8Å; A155-E158 WeakPolarHBondContact O-CB 3.23Å; A155-E158 PolarHBondContact O-N 3.43Å; F156-E158 PolarHBondContact O-N 3.07Å; E158-R390 WeakPolarHBondContact O-CA 3.14Å; E158-R390 VanDerWaalsContact O-CB 3.22Å; E158-R390 WeakPolarHBondContact O-CB 3.37Å
159	V	91.1	Very high	88.8	Confident	72 Å²	72	62.2 Å²	62.2	44%	0.436	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	114.8	178.7	-177.2	0	0	0	0	108.9	K388 R390	V159-K388 HydrophobicContact CG1-CB 4.13Å; V159-K388 HydrophobicContact CG1-CD 4.34Å; V159-R390 HydrophobicContact CG2-CB 4.11Å
160	S	93.4	Very high	89.1	Confident	7 Å²	7	62.8 Å²	62.8	5%	0.049	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	132.8	172.7	177.8	0	0	0	0	109.8	E152 E162 K388 V389	E152-S160 WeakPolarHBondContact OE1-CB 3.28Å; E152-S160 PolarHBondContact OE1-OG 2.85Å; E152-S160 PolarHBondContact OE2-OG 3.22Å; S160-E162 VanDerWaalsContact OG-CG 3.31Å; S160-E162 WeakPolarHBondContact OG-CG 3.49Å; S160-K388 CarbonylContact O-C 3.56Å; S160-K388 VanDerWaalsContact O-CA 3.24Å; S160-K388 WeakPolarHBondContact O-CA 3.39Å; S160-V389 PolarHBondContact N-O 2.64Å; S160-V389 PolarHBondContact O-N 3.5Å
161	S	95.7	Very high	89.4	Confident	71 Å²	71	55.8 Å²	55.8	50%	0.497	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	109.9	-178.4	-62.9	0	0	0	0	109.6	Y387 K388	S161-Y387 WeakPolarHBondContact CA-O 3.2Å; S161-K388 WeakPolarHBondContact OG-CE 3.47Å; S161-K388 WeakPolarHBondContact OG-CG 3.43Å
162	E	94.7	Very high	89.6	Confident	66 Å²	66	54.2 Å²	54.2	31%	0.308	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	169.9	-160.2	-75.8	-64.5	177.2	0	0	113.3	S160 K170 Y172 K386 Y387	S160-E162 VanDerWaalsContact OG-CG 3.31Å; S160-E162 WeakPolarHBondContact OG-CG 3.49Å; E162-K170 HydrophobicContact CB-CD 4.11Å; E162-K170 HydrophobicContact CG-CD 4.1Å; E162-K170 IonicContact OE1-NZ 3.59Å; E162-K170 PolarHBondContact OE1-NZ 2.69Å; E162-K170 IonicContact OE2-NZ 3.78Å; E162-K170 PolarHBondContact OE2-NZ 3.24Å; E162-Y172 WeakPolarHBondContact CG-OH 3.33Å; E162-K386 WeakPolarHBondContact O-CA 3.31Å; E162-Y387 HydrophobicContact CB-CE1 4.18Å; E162-Y387 HydrophobicContact CB-CE2 3.94Å; E162-Y387 PolarHBondContact N-O 3.13Å; E162-Y387 PolarHBondContact O-N 3.33Å
163	R	93.5	Very high	89.6	Confident	144 Å²	144	53.9 Å²	53.9	54%	0.543	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	138.1	173.3	-177.6	-178.1	177.4	164.6	-1.9	110	D384 I385	R163-D384 HydrophobicContact CG-CB 4.17Å; R163-D384 IonicContact CZ-OD2 3.15Å; R163-D384 IonicContact NE-OD2 3.6Å; R163-D384 PolarHBondContact NE-OD2 3.17Å; R163-D384 IonicContact NH2-OD2 3Å; R163-D384 PolarHBondContact NH2-OD2 3.42Å; R163-I385 CarbonylContact C-O 3.48Å; R163-I385 WeakPolarHBondContact CA-O 3.42Å
164	V	91.2	Very high	89.5	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	138.1	167.8	65.4	0	0	0	0	109.8	D168 D384 I385 Y387	V164-D168 VanDerWaalsContact CG2-C 3.49Å; V164-D168 HydrophobicContact CG2-CB 4.28Å; V164-D168 VanDerWaalsContact CG2-O 3.3Å; V164-D168 WeakPolarHBondContact CG2-O 3.29Å; V164-D384 WeakPolarHBondContact O-CA 3.46Å; V164-D384 WeakPolarHBondContact O-CB 3.26Å; V164-I385 HydrophobicContact CG1-CB 3.77Å; V164-I385 HydrophobicContact CG1-CG1 4.3Å; V164-I385 PolarHBondContact N-O 3.18Å; V164-I385 PolarHBondContact O-N 3.29Å; V164-Y387 HydrophobicContact CB-CE1 4.03Å; V164-Y387 HydrophobicContact CG1-CD1 4.25Å; V164-Y387 HydrophobicContact CG1-CE1 3.82Å
165	E	86.3	Confident	89.4	Confident	122 Å²	122	56.2 Å²	56.2	57%	0.57	28%	0.278	S	S	*	.			trans	-68.6	161.8	176.1	-64.3	-169.3	179.9	0	0	111.6	Q167 D168	E165-Q167 PolarHBondContact O-N 2.95Å; E165-D168 HydrophobicContact CB-CB 4.18Å; E165-D168 PolarHBondContact O-N 3.43Å
166	R	79	Confident	89.4	Confident	140 Å²	140	53.7 Å²	53.7	53%	0.528	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	134.2	173.8	59.3	-179.2	-178.5	160.5	-2	112.1	D168 N380 W381 D384	R166-D168 PolarHBondContact O-N 3.46Å; R166-D168 VanDerWaalsContact O-N 3.13Å; R166-N380 WeakPolarHBondContact CB-O 3.47Å; R166-W381 WeakPolarHBondContact CD-O 3.26Å; R166-D384 PolarHBondContact N-OD1 2.89Å
167	Q	80.5	Confident	88.8	Confident	28 Å²	28	53.1 Å²	53.1	13%	0.131	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	27.5	179.7	-57.7	-66.8	-58.7	0	0	113.9	L129 E165 Y377 G378 N380 W381	L129-Q167 HydrophobicContact CD1-CB 3.76Å; E165-Q167 PolarHBondContact O-N 2.95Å; Q167-Y377 PolarHBondContact OE1-OH 2.9Å; Q167-G378 VanDerWaalsContact CA-O 3.26Å; Q167-G378 WeakPolarHBondContact CA-O 3.25Å; Q167-G378 PolarHBondContact N-O 3.16Å; Q167-N380 PolarHBondContact NE2-O 3.43Å; Q167-W381 HydrophobicContact CG-CE3 4.15Å; Q167-W381 HydrophobicContact CG-CZ3 4.27Å
168	D	89.9	Confident	88	Confident	43 Å²	43	52.2 Å²	52.2	23%	0.23	25%	0.247	C	C	.	.			trans	-123.8	175.5	177	-152.6	-5.6	0	0	0	111.3	V164 E165 R166 Y377 G378	V164-D168 VanDerWaalsContact CG2-C 3.49Å; V164-D168 HydrophobicContact CG2-CB 4.28Å; V164-D168 VanDerWaalsContact CG2-O 3.3Å; V164-D168 WeakPolarHBondContact CG2-O 3.29Å; E165-D168 HydrophobicContact CB-CB 4.18Å; E165-D168 PolarHBondContact O-N 3.43Å; R166-D168 PolarHBondContact O-N 3.46Å; R166-D168 VanDerWaalsContact O-N 3.13Å; D168-Y377 WeakPolarHBondContact O-CA 3.49Å; D168-Y377 VanDerWaalsContact O-CD2 3.32Å; D168-Y377 WeakPolarHBondContact O-CD2 3.36Å; D168-G378 PolarHBondContact O-N 3.04Å
169	A	94.3	Very high	86.5	Confident	12 Å²	12	49 Å²	49	10%	0.099	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	140.9	-178.3	0	0	0	0	0	112.6	V132 F171 C375 V376 Y377	V132-A169 HydrophobicContact CG1-CB 3.56Å; V132-A169 HydrophobicContact CG2-CB 4.26Å; A169-F171 HydrophobicContact CB-CD2 4.42Å; A169-F171 HydrophobicContact CB-CE2 3.79Å; A169-F171 HydrophobicContact CB-CZ 3.98Å; A169-C375 HydrophobicContact CB-CB 4.09Å; A169-V376 WeakPolarHBondContact CA-O 3.44Å; A169-Y377 HydrophobicContact CB-CD2 4.28Å
170	K	95.8	Very high	84.9	Confident	38 Å²	38	53.8 Å²	53.8	17%	0.165	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129	163.7	179.1	159.4	176.5	157	0	110	E152 E162 Y172 C375 V376 Y387	E152-K170 VanDerWaalsContact OE2-CE 3.26Å; E152-K170 WeakPolarHBondContact OE2-CE 3.26Å; E152-K170 IonicContact OE2-NZ 2.9Å; E162-K170 HydrophobicContact CB-CD 4.11Å; E162-K170 HydrophobicContact CG-CD 4.1Å; E162-K170 IonicContact OE1-NZ 3.59Å; E162-K170 PolarHBondContact OE1-NZ 2.69Å; E162-K170 IonicContact OE2-NZ 3.78Å; E162-K170 PolarHBondContact OE2-NZ 3.24Å; K170-Y172 HydrophobicContact CB-CE2 4.37Å; K170-Y172 HydrophobicContact CG-CE2 3.94Å; K170-C375 WeakPolarHBondContact O-CA 3.25Å; K170-C375 WeakPolarHBondContact O-CB 3.38Å; K170-V376 PolarHBondContact N-O 3.46Å; K170-V376 VanDerWaalsContact N-O 3.13Å; K170-V376 PolarHBondContact O-N 2.89Å; K170-Y387 WeakPolarHBondContact CB-OH 3.21Å
171	F	97.4	Very high	83.2	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.009	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	143	-169.7	-68.5	-92.2	0	0	0	112.2	V132 I135 A136 I139 V149 V151 E152 A169 F299 L373 C375	V132-F171 HydrophobicContact CG1-CZ 3.99Å; I135-F171 HydrophobicContact CB-CE2 4.27Å; I135-F171 HydrophobicContact CB-CZ 4.16Å; I135-F171 HydrophobicContact CG2-CD2 4.2Å; I135-F171 HydrophobicContact CG2-CE2 3.46Å; I135-F171 VanDerWaalsContact CG2-CE2 3.46Å; I135-F171 HydrophobicContact CG2-CZ 3.69Å; A136-F171 HydrophobicContact CB-CE1 3.78Å; A136-F171 HydrophobicContact CB-CZ 4.32Å; I139-F171 HydrophobicContact CD1-CB 3.91Å; I139-F171 HydrophobicContact CD1-CD1 3.61Å; I139-F171 HydrophobicContact CD1-CD2 3.77Å; I139-F171 HydrophobicContact CD1-CE1 4.01Å; I139-F171 HydrophobicContact CD1-CE2 4.16Å; I139-F171 HydrophobicContact CD1-CG 3.48Å; I139-F171 VanDerWaalsContact CD1-CG 3.48Å; I139-F171 HydrophobicContact CD1-CZ 4.26Å; V149-F171 HydrophobicContact CG1-CD2 3.9Å; V149-F171 HydrophobicContact CG1-CE2 4.31Å; V151-F171 HydrophobicContact CG1-CB 4.23Å; V151-F171 HydrophobicContact CG2-CB 4.18Å; E152-F171 PolarHBondContact N-O 3.24Å; A169-F171 HydrophobicContact CB-CD2 4.42Å; A169-F171 HydrophobicContact CB-CE2 3.79Å; A169-F171 HydrophobicContact CB-CZ 3.98Å; F171-F299 HydrophobicContact CD1-CE2 4.27Å; F171-F299 AromaticContact CE1-CE2 3.86Å; F171-F299 HydrophobicContact CE1-CE2 3.86Å; F171-F299 HydrophobicContact CE1-CZ 4.05Å; F171-L373 HydrophobicContact CB-CD1 4.29Å; F171-L373 HydrophobicContact CD1-CD1 4.23Å; F171-L373 HydrophobicContact CD1-CD2 4.28Å; F171-L373 HydrophobicContact CD1-CG 4.34Å; F171-C375 HydrophobicContact CD1-CB 3.66Å; F171-C375 HydrophobicContact CE1-CB 3.89Å; F171-C375 HydrophobicContact CG-CB 4.06Å; F171-C375 HydrophobicContact CZ-CB 4.48Å
172	Y	97.4	Very high	81.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.7	-177.9	-64.3	-88.3	0	0	0	111.1	E152 E162 K170 F374 V376 Y387 V389	E152-Y172 HydrophobicContact CB-CD1 3.78Å; E152-Y172 HydrophobicContact CB-CE1 3.93Å; E152-Y172 HydrophobicContact CG-CD1 4.22Å; E152-Y172 HydrophobicContact CG-CE1 4.16Å; E152-Y172 CarbonylContact O-C 3.43Å; E152-Y172 WeakPolarHBondContact O-CA 3.42Å; E152-Y172 VanDerWaalsContact OE2-CE1 3.29Å; E152-Y172 WeakPolarHBondContact OE2-CE1 3.4Å; E162-Y172 WeakPolarHBondContact CG-OH 3.33Å; K170-Y172 HydrophobicContact CB-CE2 4.37Å; K170-Y172 HydrophobicContact CG-CE2 3.94Å; Y172-F374 AromaticContact CD2-CE2 3.9Å; Y172-F374 HydrophobicContact CD2-CE2 3.9Å; Y172-F374 HydrophobicContact CD2-CZ 4.05Å; Y172-F374 HydrophobicContact CG-CE1 4.19Å; Y172-F374 HydrophobicContact CG-CE2 4.08Å; Y172-F374 AromaticContact CG-CZ 3.74Å; Y172-F374 HydrophobicContact CG-CZ 3.74Å; Y172-F374 PolarHBondContact N-O 2.85Å; Y172-F374 PolarHBondContact O-N 3.44Å; Y172-V376 HydrophobicContact CE2-CG2 4.07Å; Y172-Y387 HydrophobicContact CE2-CE2 4.25Å; Y172-Y387 WeakPolarHBondContact CE2-OH 3.48Å; Y172-Y387 VanDerWaalsContact OH-CE2 3.29Å; Y172-Y387 WeakPolarHBondContact OH-CE2 3.2Å; Y172-Y387 PolarHBondContact OH-OH 3.33Å; Y172-V389 HydrophobicContact CD1-CG1 4.33Å; Y172-V389 HydrophobicContact CE1-CG1 3.7Å; Y172-V389 HydrophobicContact CE2-CG1 4.06Å
173	R	94.5	Very high	79.5	Confident	39 Å²	39	52.8 Å²	52.8	15%	0.147	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	138.9	171.2	-77.8	167.4	-179.8	-154.4	8.1	110.4	I139 N142 V151 E152 S153 L154 E371 H372 L373	I139-R173 PolarHBondContact O-NH2 2.96Å; N142-R173 PolarHBondContact OD1-NH2 3.08Å; V151-R173 HydrophobicContact CG1-CB 4.37Å; V151-R173 HydrophobicContact CG1-CG 3.59Å; E152-R173 PolarHBondContact O-N 2.9Å; S153-R173 WeakPolarHBondContact CA-O 3.36Å; L154-R173 PolarHBondContact N-O 3.03Å; R173-E371 HydrophobicContact CB-CG 4.17Å; R173-E371 VanDerWaalsContact CD-CD 3.5Å; R173-E371 WeakPolarHBondContact CD-OE1 3.43Å; R173-E371 HydrophobicContact CG-CG 4.07Å; R173-E371 IonicContact CZ-OE1 3.3Å; R173-E371 IonicContact NE-OE1 2.74Å; R173-E371 PolarHBondContact NE-OE1 3.43Å; R173-E371 VanDerWaalsContact NE-OE1 3.15Å; R173-E371 IonicContact NH1-OE1 2.95Å; R173-E371 PolarHBondContact NH1-OE1 3.36Å; R173-E371 IonicContact NH1-OE2 3.74Å; R173-E371 IonicContact NH2-OE1 2.75Å; R173-H372 WeakPolarHBondContact CA-O 3.46Å; R173-L373 HydrophobicContact CG-CD1 4.11Å
174	I	90.6	Very high	77.9	Confident	1 Å²	1	49 Å²	49	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.1	164.3	57.8	176.3	0	0	0	109.1	I284 L367 E371 H372 F374 V391	I174-I284 HydrophobicContact CD1-CD1 4.18Å; I174-L367 HydrophobicContact CD1-CD1 4.07Å; I174-E371 CarbonylContact O-C 3.55Å; I174-E371 WeakPolarHBondContact O-CA 3.26Å; I174-H372 HydrophobicContact CD1-CB 4.25Å; I174-H372 HydrophobicContact CG1-CB 3.78Å; I174-H372 PolarHBondContact N-O 3Å; I174-H372 PolarHBondContact O-N 3.49Å; I174-F374 HydrophobicContact CG2-CE1 3.98Å; I174-V391 HydrophobicContact CG2-CB 4.33Å; I174-V391 HydrophobicContact CG2-CG1 4.31Å; I174-V391 HydrophobicContact CG2-CG2 3.54Å
175	R	85.9	Confident	76.5	Confident	144 Å²	144	52 Å²	52	54%	0.543	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.9	175.4	-170.7	175.4	179	-166.7	-0.4	110.1	V177 E181	R175-V177 HydrophobicContact CG-CG2 4.13Å; R175-E181 IonicContact CZ-OE1 2.84Å; R175-E181 IonicContact NH2-OE1 3.96Å; R175-E181 PolarHBondContact NH2-OE1 2.82Å
176	L	81.5	Confident	75.3	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	105.8	173.1	-54.9	-172.4	0	0	0	108.3	F156 Y278 I282 L367 P369 G370	F156-L176 HydrophobicContact CE2-CD2 3.77Å; F156-L176 HydrophobicContact CZ-CD2 3.44Å; F156-L176 VanDerWaalsContact CZ-CD2 3.44Å; L176-Y278 VanDerWaalsContact C-OH 3.3Å; L176-Y278 HydrophobicContact CB-CE1 3.88Å; L176-Y278 HydrophobicContact CD1-CE1 4.41Å; L176-Y278 HydrophobicContact CD2-CE1 4.25Å; L176-Y278 HydrophobicContact CG-CE1 4.4Å; L176-I282 HydrophobicContact CD1-CD1 3.73Å; L176-I282 HydrophobicContact CD2-CD1 3.65Å; L176-I282 HydrophobicContact CG-CD1 4.38Å; L176-L367 HydrophobicContact CD1-CB 3.45Å; L176-L367 VanDerWaalsContact CD1-CB 3.45Å; L176-L367 HydrophobicContact CD1-CD1 4.05Å; L176-L367 HydrophobicContact CD1-CG 4.39Å; L176-P369 CarbonylContact O-C 3.59Å; L176-P369 WeakPolarHBondContact O-CA 3.47Å; L176-G370 PolarHBondContact N-O 2.87Å; L176-G370 PolarHBondContact O-N 3.23Å
177	V	69.5	Low	74.5	Confident	45 Å²	45	42.8 Å²	42.8	27%	0.273	22%	0.218	S	C	.	.			trans	-86.1	119.5	-177.8	-174.8	0	0	0	0	110.4	R175 E181 A182 Y278	R175-V177 HydrophobicContact CG-CG2 4.13Å; V177-E181 HydrophobicContact CG1-CB 4.07Å; V177-E181 HydrophobicContact CG1-CG 4.34Å; V177-A182 HydrophobicContact CG1-CB 3.98Å; V177-Y278 PolarHBondContact N-OH 3.32Å; V177-Y278 WeakPolarHBondContact O-CE2 3.49Å; V177-Y278 PolarHBondContact O-OH 3.24Å
178	A	62.3	Low	73.8	Confident	21 Å²	21	45 Å²	45	17%	0.174	24%	0.235	C	C	.	.			trans	-59.6	144	173.4	0	0	0	0	0	109.6	K180 E181 A182 P369	A178-K180 PolarHBondContact O-N 3.35Å; A178-E181 HydrophobicContact CB-CB 4.21Å; A178-E181 CarbonylContact O-C 2.99Å; A178-E181 WeakPolarHBondContact O-CA 3.44Å; A178-E181 WeakPolarHBondContact O-CB 3.21Å; A178-E181 PolarHBondContact O-N 3.29Å; A178-A182 PolarHBondContact O-N 2.98Å; A178-P369 HydrophobicContact CB-CB 3.64Å; A178-P369 HydrophobicContact CB-CG 3.88Å
179	L	52.2	Low	72.5	Confident	27 Å²	27	47.1 Å²	47.1	14%	0.141	26%	0.259	C	S	.	.	H	α-helix	trans	-59.3	-37.5	-179.4	-179.6	129.5	0	0	0	112.3	E181 A182 V183 L204 T208 E275	L179-E181 VanDerWaalsContact C-N 3.27Å; L179-E181 PolarHBondContact O-N 3.35Å; L179-A182 WeakPolarHBondContact O-CB 3.45Å; L179-A182 PolarHBondContact O-N 3.44Å; L179-V183 VanDerWaalsContact O-CG2 3.27Å; L179-V183 WeakPolarHBondContact O-CG2 3.46Å; L179-V183 PolarHBondContact O-N 2.87Å; L179-L204 HydrophobicContact CD1-CD1 4.2Å; L179-L204 HydrophobicContact CD1-CD2 3.66Å; L179-L204 HydrophobicContact CD1-CG 3.8Å; L179-L204 HydrophobicContact CD2-CD2 3.24Å; L179-L204 HydrophobicContact CD2-CG 4.24Å; L179-L204 HydrophobicContact CG-CD1 3.95Å; L179-L204 HydrophobicContact CG-CD2 3.37Å; L179-L204 HydrophobicContact CG-CG 3.82Å; L179-T208 HydrophobicContact CD1-CG2 3.48Å; L179-T208 VanDerWaalsContact CD1-CG2 3.48Å; L179-E275 HydrophobicContact CB-CB 3.64Å; L179-E275 HydrophobicContact CB-CG 3.53Å; L179-E275 WeakPolarHBondContact CB-OE1 3.47Å; L179-E275 WeakPolarHBondContact CB-OE2 3.44Å; L179-E275 HydrophobicContact CD1-CB 3.52Å; L179-E275 HydrophobicContact CD1-CG 4.38Å; L179-E275 WeakPolarHBondContact CD2-OE2 3.18Å; L179-E275 HydrophobicContact CG-CB 4.11Å; L179-E275 HydrophobicContact CG-CG 4.46Å
180	K	56.9	Low	70.9	Confident	171 Å²	171	52 Å²	52	74%	0.743	28%	0.281	S	S	*	.	H	α-helix	trans	-60.3	-37.3	173.3	-68.5	-178.1	-178.6	175.3	0	112.8	A178 S184	A178-K180 PolarHBondContact O-N 3.35Å; K180-S184 PolarHBondContact O-N 3.11Å; K180-S184 PolarHBondContact O-OG 2.9Å
181	E	57.8	Low	69.3	Low	64 Å²	64	51.5 Å²	51.5	30%	0.299	29%	0.287	S	S	.	.	H	α-helix	trans	-74.3	-41	177.8	-166.7	-171.9	158.2	0	0	110.7	R175 V177 A178 L179 V183 S184 N185	R175-E181 IonicContact CZ-OE1 2.84Å; R175-E181 IonicContact NH2-OE1 3.96Å; R175-E181 PolarHBondContact NH2-OE1 2.82Å; V177-E181 HydrophobicContact CG1-CB 4.07Å; V177-E181 HydrophobicContact CG1-CG 4.34Å; A178-E181 HydrophobicContact CB-CB 4.21Å; A178-E181 CarbonylContact O-C 2.99Å; A178-E181 WeakPolarHBondContact O-CA 3.44Å; A178-E181 WeakPolarHBondContact O-CB 3.21Å; A178-E181 PolarHBondContact O-N 3.29Å; L179-E181 VanDerWaalsContact C-N 3.27Å; L179-E181 PolarHBondContact O-N 3.35Å; E181-V183 VanDerWaalsContact C-N 3.29Å; E181-V183 PolarHBondContact O-N 3.29Å; E181-S184 WeakPolarHBondContact CA-OG 3.3Å; E181-S184 PolarHBondContact O-N 3.18Å; E181-S184 VanDerWaalsContact O-N 3.16Å; E181-S184 PolarHBondContact O-OG 3.21Å; E181-N185 WeakPolarHBondContact O-CB 3.37Å; E181-N185 PolarHBondContact O-N 3.21Å; E181-N185 PolarHBondContact O-ND2 3.27Å
182	A	58.8	Low	67.6	Low	33 Å²	33	62.7 Å²	62.7	27%	0.273	33%	0.33	S	S	.	.	H	α-helix	trans	-55.9	-46.5	172	0	0	0	0	0	110.4	V177 A178 L179 N185 I186 L204	V177-A182 HydrophobicContact CG1-CB 3.98Å; A178-A182 PolarHBondContact O-N 2.98Å; L179-A182 WeakPolarHBondContact O-CB 3.45Å; L179-A182 PolarHBondContact O-N 3.44Å; A182-N185 PolarHBondContact O-N 3.29Å; A182-I186 WeakPolarHBondContact O-CG1 3.09Å; A182-I186 PolarHBondContact O-N 3.07Å; A182-L204 HydrophobicContact CB-CD1 4.21Å
183	V	54.2	Low	66.1	Low	27 Å²	27	66 Å²	66	16%	0.164	36%	0.364	C	S	.	.	H	α-helix	trans	-57.3	-52.2	172.9	172.6	0	0	0	0	111.6	L179 E181 N185 I186 E200 L204	L179-V183 VanDerWaalsContact O-CG2 3.27Å; L179-V183 WeakPolarHBondContact O-CG2 3.46Å; L179-V183 PolarHBondContact O-N 2.87Å; E181-V183 VanDerWaalsContact C-N 3.29Å; E181-V183 PolarHBondContact O-N 3.29Å; V183-N185 PolarHBondContact O-N 3.11Å; V183-I186 PolarHBondContact O-N 3.38Å; V183-E200 HydrophobicContact CG1-CB 4.02Å; V183-L204 HydrophobicContact CG2-CB 4.13Å; V183-L204 HydrophobicContact CG2-CD1 3.5Å; V183-L204 HydrophobicContact CG2-CD2 3.09Å; V183-L204 HydrophobicContact CG2-CG 3.71Å
184	S	59.6	Low	64.6	Low	64 Å²	64	67.4 Å²	67.4	45%	0.448	38%	0.379	S	S	.	.	H	α-helix	trans	-66.4	-19.3	-176.5	62.8	0	0	0	0	113.7	K180 E181 P188	K180-S184 PolarHBondContact O-N 3.11Å; K180-S184 PolarHBondContact O-OG 2.9Å; E181-S184 WeakPolarHBondContact CA-OG 3.3Å; E181-S184 PolarHBondContact O-N 3.18Å; E181-S184 VanDerWaalsContact O-N 3.16Å; E181-S184 PolarHBondContact O-OG 3.21Å; S184-P188 WeakPolarHBondContact O-CD 3.5Å; S184-P188 WeakPolarHBondContact O-CG 3.41Å
185	N	62.9	Low	63.5	Low	70 Å²	70	69.4 Å²	69.4	37%	0.374	39%	0.391	S	S	.	.	H	α-helix	trans	-88.1	-20.1	178.8	-68.7	-16.1	0	0	0	113.3	E181 A182 V183 P188 A189	E181-N185 WeakPolarHBondContact O-CB 3.37Å; E181-N185 PolarHBondContact O-N 3.21Å; E181-N185 PolarHBondContact O-ND2 3.27Å; A182-N185 PolarHBondContact O-N 3.29Å; V183-N185 PolarHBondContact O-N 3.11Å; N185-P188 WeakPolarHBondContact O-CD 3.48Å; N185-A189 VanDerWaalsContact O-CB 3.25Å; N185-A189 WeakPolarHBondContact O-CB 3.39Å; N185-A189 PolarHBondContact O-N 3.08Å
186	I	61.1	Low	62.9	Low	44 Å²	44	65.2 Å²	65.2	23%	0.226	38%	0.384	C	S	.	.	H	α-helix	trans	-60.8	-53.8	178.5	-71.7	165.7	0	0	0	110.9	A182 V183 A189 I190 E200	A182-I186 WeakPolarHBondContact O-CG1 3.09Å; A182-I186 PolarHBondContact O-N 3.07Å; V183-I186 PolarHBondContact O-N 3.38Å; I186-A189 PolarHBondContact O-N 3.29Å; I186-I190 HydrophobicContact CG2-CD1 3.71Å; I186-I190 WeakPolarHBondContact O-CG1 3.37Å; I186-I190 PolarHBondContact O-N 3.14Å; I186-I190 VanDerWaalsContact O-N 3.12Å; I186-E200 HydrophobicContact CG2-CG 4.36Å
187	N	62.1	Low	62.2	Low	25 Å²	25	73.7 Å²	73.7	13%	0.134	42%	0.421	C	S	.	.	H	α-helix	trans	-60.3	-48.6	-179.6	-104.6	-31.6	0	0	0	113.3	A189 I190 G191 V195 E200	N187-A189 VanDerWaalsContact C-N 3.32Å; N187-A189 PolarHBondContact O-N 3.49Å; N187-I190 PolarHBondContact O-N 2.57Å; N187-G191 CarbonylContact O-C 3.44Å; N187-G191 WeakPolarHBondContact O-CA 3.32Å; N187-G191 PolarHBondContact O-N 2.97Å; N187-V195 PolarHBondContact ND2-O 2.92Å; N187-V195 PolarHBondContact OD1-N 2.81Å; N187-V195 PolarHBondContact OD1-O 3.3Å; N187-E200 WeakPolarHBondContact CB-OE1 3.46Å; N187-E200 PolarHBondContact N-OE1 3.18Å; N187-E200 VanDerWaalsContact ND2-CD 3.3Å; N187-E200 PolarHBondContact ND2-OE1 3.16Å
188	P	64.8	Low	62.1	Low	74 Å²	74	75.6 Å²	75.6	48%	0.481	44%	0.437	S	S	.	.	H	α-helix	trans	-59.5	-36.9	175.3	-26.9	35.2	0	0	0	114.4	S184 N185	S184-P188 WeakPolarHBondContact O-CD 3.5Å; S184-P188 WeakPolarHBondContact O-CG 3.41Å; N185-P188 WeakPolarHBondContact O-CD 3.48Å
189	A	62.8	Low	62.4	Low	88 Å²	88	76.9 Å²	76.9	73%	0.727	44%	0.442	S	S	*	.	H	α-helix	trans	-71.6	-31.7	-179.1	0	0	0	0	0	113.3	N185 I186 N187	N185-A189 VanDerWaalsContact O-CB 3.25Å; N185-A189 WeakPolarHBondContact O-CB 3.39Å; N185-A189 PolarHBondContact O-N 3.08Å; I186-A189 PolarHBondContact O-N 3.29Å; N187-A189 VanDerWaalsContact C-N 3.32Å; N187-A189 PolarHBondContact O-N 3.49Å
190	I	61.3	Low	63	Low	113 Å²	113	76.1 Å²	76.1	58%	0.579	44%	0.438	S	S	*	.	H	α-helix	trans	-90.3	-26.6	179	-58.5	171.8	0	0	0	111.2	I186 N187 V195	I186-I190 HydrophobicContact CG2-CD1 3.71Å; I186-I190 WeakPolarHBondContact O-CG1 3.37Å; I186-I190 PolarHBondContact O-N 3.14Å; I186-I190 VanDerWaalsContact O-N 3.12Å; N187-I190 PolarHBondContact O-N 2.57Å; I190-V195 HydrophobicContact CD1-CG2 4.36Å
191	G	62.1	Low	63.4	Low	28 Å²	28	76.2 Å²	76.2	29%	0.289	43%	0.434	S	S	.	.			trans	132.2	129.8	-177.6	0	0	0	0	0	110.2	N187 G193 S194	N187-G191 CarbonylContact O-C 3.44Å; N187-G191 WeakPolarHBondContact O-CA 3.32Å; N187-G191 PolarHBondContact O-N 2.97Å; G191-G193 PolarHBondContact O-N 3.24Å; G191-G193 VanDerWaalsContact O-N 3.08Å; G191-S194 VanDerWaalsContact C-OG 3.31Å; G191-S194 WeakPolarHBondContact CA-OG 3.26Å; G191-S194 VanDerWaalsContact O-CB 3.27Å; G191-S194 WeakPolarHBondContact O-CB 3.35Å; G191-S194 PolarHBondContact O-N 3.27Å; G191-S194 PolarHBondContact O-OG 3.41Å
192	R	61.5	Low	63.9	Low	238 Å²	238	78 Å²	78	90%	0.898	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	120	-176.7	-80	-171.5	-177.5	-140.4	1.8	111
193	G	65.3	Low	64.2	Low	69 Å²	69	79.3 Å²	79.3	71%	0.711	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	5.6	178.9	0	0	0	0	0	115.3	G191 V195	G191-G193 PolarHBondContact O-N 3.24Å; G191-G193 VanDerWaalsContact O-N 3.08Å; G193-V195 VanDerWaalsContact C-N 3.3Å; G193-V195 PolarHBondContact O-N 3.03Å
194	S	63.5	Low	64.6	Low	68 Å²	68	78.6 Å²	78.6	48%	0.476	43%	0.431	S	S	.	.	S	Bend	trans	-68.4	-25.3	-177.6	-56.9	0	0	0	0	113.9	G191	G191-S194 VanDerWaalsContact C-OG 3.31Å; G191-S194 WeakPolarHBondContact CA-OG 3.26Å; G191-S194 VanDerWaalsContact O-CB 3.27Å; G191-S194 WeakPolarHBondContact O-CB 3.35Å; G191-S194 PolarHBondContact O-N 3.27Å; G191-S194 PolarHBondContact O-OG 3.41Å
195	V	68.1	Low	64.7	Low	43 Å²	43	79.8 Å²	79.8	26%	0.261	43%	0.433	S	S	.	.	S	Bend	trans	-142.7	146.2	-177.5	-128.1	0	0	0	0	112.2	N187 I190 G193 T199 E200	N187-V195 PolarHBondContact ND2-O 2.92Å; N187-V195 PolarHBondContact OD1-N 2.81Å; N187-V195 PolarHBondContact OD1-O 3.3Å; I190-V195 HydrophobicContact CD1-CG2 4.36Å; G193-V195 VanDerWaalsContact C-N 3.3Å; G193-V195 PolarHBondContact O-N 3.03Å; V195-T199 HydrophobicContact CG1-CG2 3.37Å; V195-E200 HydrophobicContact CB-CG 4.49Å
196	S	72.5	Confident	64.7	Low	57 Å²	57	77.9 Å²	77.9	40%	0.399	42%	0.42	S	S	.	.			trans	-70.6	152	175.9	70.2	0	0	0	0	111.4	S198 T199 E200	S196-S198 PolarHBondContact O-N 2.83Å; S196-S198 VanDerWaalsContact O-N 3.09Å; S196-S198 PolarHBondContact OG-OG 3.49Å; S196-T199 PolarHBondContact O-N 3.35Å; S196-T199 PolarHBondContact OG-N 3.41Å; S196-T199 PolarHBondContact OG-OG1 2.88Å; S196-E200 PolarHBondContact O-N 2.84Å
197	K	67.5	Low	64.6	Low	178 Å²	178	78.2 Å²	78.2	77%	0.774	42%	0.422	S	S	*	.	H	α-helix	trans	-53.9	-30.9	173.4	-72.9	-173	178.7	179.8	0	113.3	R201	K197-R201 WeakPolarHBondContact O-CB 3.33Å; K197-R201 PolarHBondContact O-N 3.36Å; K197-R201 VanDerWaalsContact O-N 3.14Å
198	S	67.1	Low	64.1	Low	86 Å²	86	78.2 Å²	78.2	60%	0.601	42%	0.423	S	S	*	.	H	α-helix	trans	-69	-40.1	175.6	54.9	0	0	0	0	112.2	S196 R201 Y202	S196-S198 PolarHBondContact O-N 2.83Å; S196-S198 VanDerWaalsContact O-N 3.09Å; S196-S198 PolarHBondContact OG-OG 3.49Å; S198-R201 PolarHBondContact O-N 3.33Å; S198-Y202 WeakPolarHBondContact O-CB 3.48Å; S198-Y202 PolarHBondContact O-N 3.07Å
199	T	68.2	Low	63.4	Low	47 Å²	47	77.3 Å²	77.3	29%	0.288	42%	0.419	S	S	.	.	H	α-helix	trans	-71.7	-40.8	179	-50.9	0	0	0	0	111	V195 S196 R201 Y202 W203	V195-T199 HydrophobicContact CG1-CG2 3.37Å; S196-T199 PolarHBondContact O-N 3.35Å; S196-T199 PolarHBondContact OG-N 3.41Å; S196-T199 PolarHBondContact OG-OG1 2.88Å; T199-R201 VanDerWaalsContact C-N 3.31Å; T199-R201 PolarHBondContact O-N 3.34Å; T199-Y202 WeakPolarHBondContact O-CB 3.28Å; T199-Y202 PolarHBondContact O-N 3Å; T199-W203 VanDerWaalsContact O-CD1 3.24Å; T199-W203 PolarHBondContact O-N 3.32Å
200	E	65.8	Low	63	Low	11 Å²	11	78.7 Å²	78.7	5%	0.051	42%	0.423	C	S	.	.	H	α-helix	trans	-55.8	-48.7	171.6	-65	178.2	141.8	0	0	110.9	V183 I186 N187 V195 S196 Y202 W203 L204	V183-E200 HydrophobicContact CG1-CB 4.02Å; I186-E200 HydrophobicContact CG2-CG 4.36Å; N187-E200 WeakPolarHBondContact CB-OE1 3.46Å; N187-E200 PolarHBondContact N-OE1 3.18Å; N187-E200 VanDerWaalsContact ND2-CD 3.3Å; N187-E200 PolarHBondContact ND2-OE1 3.16Å; V195-E200 HydrophobicContact CB-CG 4.49Å; S196-E200 PolarHBondContact O-N 2.84Å; E200-Y202 VanDerWaalsContact C-N 3.33Å; E200-Y202 PolarHBondContact O-N 3.35Å; E200-W203 PolarHBondContact O-N 3.2Å; E200-L204 WeakPolarHBondContact O-CB 3.33Å; E200-L204 PolarHBondContact O-N 3.27Å
201	R	63.6	Low	62.5	Low	174 Å²	174	75.4 Å²	75.4	66%	0.657	41%	0.41	S	S	*	.	H	α-helix	trans	-66.4	-33.8	-179.7	-160.6	172.4	-166.5	147.2	0.6	112.8	K197 S198 T199 N205	K197-R201 WeakPolarHBondContact O-CB 3.33Å; K197-R201 PolarHBondContact O-N 3.36Å; K197-R201 VanDerWaalsContact O-N 3.14Å; S198-R201 PolarHBondContact O-N 3.33Å; T199-R201 VanDerWaalsContact C-N 3.31Å; T199-R201 PolarHBondContact O-N 3.34Å; R201-N205 WeakPolarHBondContact O-CB 3.47Å; R201-N205 VanDerWaalsContact O-CG 3.32Å; R201-N205 PolarHBondContact O-N 3.39Å
202	Y	68.6	Low	62	Low	100 Å²	100	78.4 Å²	78.4	39%	0.392	42%	0.416	S	S	.	.	H	α-helix	trans	-62.4	-54.9	173.7	172.1	-93.4	0	0	0	111.4	S198 T199 E200 L204 N205 R206	S198-Y202 WeakPolarHBondContact O-CB 3.48Å; S198-Y202 PolarHBondContact O-N 3.07Å; T199-Y202 WeakPolarHBondContact O-CB 3.28Å; T199-Y202 PolarHBondContact O-N 3Å; E200-Y202 VanDerWaalsContact C-N 3.33Å; E200-Y202 PolarHBondContact O-N 3.35Å; Y202-L204 VanDerWaalsContact C-N 3.29Å; Y202-L204 PolarHBondContact O-N 2.94Å; Y202-N205 PolarHBondContact O-N 3.12Å; Y202-R206 WeakPolarHBondContact O-CB 3.36Å; Y202-R206 PolarHBondContact O-N 2.95Å; Y202-R206 PolarHBondContact OH-NH1 2.91Å
203	W	66.5	Low	61.6	Low	61 Å²	61	68.5 Å²	68.5	23%	0.231	38%	0.384	C	S	.	.	H	α-helix	trans	-62.6	-39.4	-179.1	-78.8	110.5	0	0	0	111.9	T199 E200 R206 L207 L214	T199-W203 VanDerWaalsContact O-CD1 3.24Å; T199-W203 PolarHBondContact O-N 3.32Å; E200-W203 PolarHBondContact O-N 3.2Å; W203-R206 WeakPolarHBondContact O-CB 3.4Å; W203-R206 PolarHBondContact O-N 2.83Å; W203-L207 WeakPolarHBondContact O-CB 3.15Å; W203-L207 VanDerWaalsContact O-CG 3.23Å; W203-L207 WeakPolarHBondContact O-CG 3.32Å; W203-L207 PolarHBondContact O-N 3.24Å; W203-L214 VanDerWaalsContact CH2-C 3.46Å; W203-L214 WeakPolarHBondContact CH2-O 3.49Å; W203-L214 WeakPolarHBondContact CZ3-O 3.28Å
204	L	62.1	Low	61.3	Low	12 Å²	12	71.4 Å²	71.4	6%	0.063	38%	0.382	C	S	.	.	H	α-helix	trans	-61.2	-51.2	175.2	-175.5	89.4	0	0	0	112.7	L179 A182 V183 E200 Y202 R206 L207 T208	L179-L204 HydrophobicContact CD1-CD1 4.2Å; L179-L204 HydrophobicContact CD1-CD2 3.66Å; L179-L204 HydrophobicContact CD1-CG 3.8Å; L179-L204 HydrophobicContact CD2-CD2 3.24Å; L179-L204 HydrophobicContact CD2-CG 4.24Å; L179-L204 HydrophobicContact CG-CD1 3.95Å; L179-L204 HydrophobicContact CG-CD2 3.37Å; L179-L204 HydrophobicContact CG-CG 3.82Å; A182-L204 HydrophobicContact CB-CD1 4.21Å; V183-L204 HydrophobicContact CG2-CB 4.13Å; V183-L204 HydrophobicContact CG2-CD1 3.5Å; V183-L204 HydrophobicContact CG2-CD2 3.09Å; V183-L204 HydrophobicContact CG2-CG 3.71Å; E200-L204 WeakPolarHBondContact O-CB 3.33Å; E200-L204 PolarHBondContact O-N 3.27Å; Y202-L204 VanDerWaalsContact C-N 3.29Å; Y202-L204 PolarHBondContact O-N 2.94Å; L204-R206 PolarHBondContact O-N 3.15Å; L204-L207 PolarHBondContact O-N 3.1Å; L204-T208 HydrophobicContact CG-CG2 4.45Å; L204-T208 WeakPolarHBondContact O-CB 3.36Å; L204-T208 WeakPolarHBondContact O-CG2 3.26Å; L204-T208 PolarHBondContact O-N 3.03Å; L204-T208 PolarHBondContact O-OG1 2.89Å
205	N	62	Low	60.9	Low	89 Å²	89	72.8 Å²	72.8	48%	0.476	38%	0.381	S	S	.	.	H	α-helix	trans	-59.6	-35.2	176.1	-78.2	-9.4	0	0	0	111.4	R201 Y202 T208 S209	R201-N205 WeakPolarHBondContact O-CB 3.47Å; R201-N205 VanDerWaalsContact O-CG 3.32Å; R201-N205 PolarHBondContact O-N 3.39Å; Y202-N205 PolarHBondContact O-N 3.12Å; N205-T208 WeakPolarHBondContact CA-OG1 3.26Å; N205-T208 PolarHBondContact O-OG1 3.03Å; N205-S209 VanDerWaalsContact O-CB 3.31Å; N205-S209 WeakPolarHBondContact O-CB 3.42Å; N205-S209 PolarHBondContact O-N 2.82Å; N205-S209 PolarHBondContact O-OG 3.27Å
206	R	62.3	Low	60.4	Low	30 Å²	30	75.7 Å²	75.7	11%	0.113	39%	0.392	C	S	.	.	H	α-helix	trans	-66.2	-47.1	176.4	-165.5	174.8	-178.1	100.1	-1.1	111.2	Y202 W203 L204 T208 S209 C211 S213 E215 S217	Y202-R206 WeakPolarHBondContact O-CB 3.36Å; Y202-R206 PolarHBondContact O-N 2.95Å; Y202-R206 PolarHBondContact OH-NH1 2.91Å; W203-R206 WeakPolarHBondContact O-CB 3.4Å; W203-R206 PolarHBondContact O-N 2.83Å; L204-R206 PolarHBondContact O-N 3.15Å; R206-T208 VanDerWaalsContact C-N 3.33Å; R206-T208 PolarHBondContact O-N 3.03Å; R206-S209 PolarHBondContact O-OG 3.15Å; R206-C211 HydrophobicContact CG-CB 4.13Å; R206-C211 WeakPolarHBondContact O-CB 3.3Å; R206-S213 PolarHBondContact NE-O 3.22Å; R206-S213 VanDerWaalsContact NE-O 3.11Å; R206-E215 VanDerWaalsContact CZ-O 3.29Å; R206-E215 PolarHBondContact NE-O 3.46Å; R206-E215 PolarHBondContact NH2-O 3.37Å; R206-S217 PolarHBondContact NH1-OG 2.84Å; R206-S217 PolarHBondContact NH2-OG 3.36Å
207	L	59.2	Low	59.6	Low	51 Å²	51	76 Å²	76	27%	0.267	39%	0.394	S	S	.	.	H	α-helix	trans	-68.4	-28.2	178.1	-69.4	167.6	0	0	0	113.3	W203 L204 S209 L214	W203-L207 WeakPolarHBondContact O-CB 3.15Å; W203-L207 VanDerWaalsContact O-CG 3.23Å; W203-L207 WeakPolarHBondContact O-CG 3.32Å; W203-L207 PolarHBondContact O-N 3.24Å; L204-L207 PolarHBondContact O-N 3.1Å; L207-S209 CarbonylContact C-O 3.56Å; L207-L214 HydrophobicContact CD2-CD2 4.31Å
208	T	52.3	Low	58.8	Low	25 Å²	25	72.7 Å²	72.7	15%	0.153	39%	0.391	C	S	.	.	H	α-helix	trans	-89.6	-24.8	178.8	65.8	0	0	0	0	113.4	L179 L204 N205 R206 S276	L179-T208 HydrophobicContact CD1-CG2 3.48Å; L179-T208 VanDerWaalsContact CD1-CG2 3.48Å; L204-T208 HydrophobicContact CG-CG2 4.45Å; L204-T208 WeakPolarHBondContact O-CB 3.36Å; L204-T208 WeakPolarHBondContact O-CG2 3.26Å; L204-T208 PolarHBondContact O-N 3.03Å; L204-T208 PolarHBondContact O-OG1 2.89Å; N205-T208 WeakPolarHBondContact CA-OG1 3.26Å; N205-T208 PolarHBondContact O-OG1 3.03Å; R206-T208 VanDerWaalsContact C-N 3.33Å; R206-T208 PolarHBondContact O-N 3.03Å; T208-S276 PolarHBondContact O-OG 3.09Å
209	S	49.3	Very low	57.9	Low	56 Å²	56	77.9 Å²	77.9	39%	0.392	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	150.3	156.3	72.1	0	0	0	0	107.7	N205 R206 L207 C211	N205-S209 VanDerWaalsContact O-CB 3.31Å; N205-S209 WeakPolarHBondContact O-CB 3.42Å; N205-S209 PolarHBondContact O-N 2.82Å; N205-S209 PolarHBondContact O-OG 3.27Å; R206-S209 PolarHBondContact O-OG 3.15Å; L207-S209 CarbonylContact C-O 3.56Å; S209-C211 PolarHBondContact O-N 2.9Å; S209-C211 WeakPolarHBondContact OG-CB 3.37Å
210	S	53.4	Low	56.9	Low	117 Å²	117	81.9 Å²	81.9	82%	0.818	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	29	-180	-44.7	0	0	0	0	114.5
211	C	51.3	Low	55.9	Low	44 Å²	44	84.1 Å²	84.1	30%	0.297	45%	0.453	S	S	.	.			trans	-94.6	94.6	177.3	-173.7	0	0	0	0	109.1	R206 S209 S213	R206-C211 HydrophobicContact CG-CB 4.13Å; R206-C211 WeakPolarHBondContact O-CB 3.3Å; S209-C211 PolarHBondContact O-N 2.9Å; S209-C211 WeakPolarHBondContact OG-CB 3.37Å; C211-S213 PolarHBondContact O-N 3.05Å; C211-S213 VanDerWaalsContact O-N 3.15Å
212	E	52.1	Low	55.1	Low	91 Å²	91	87.8 Å²	87.8	43%	0.425	47%	0.467	S	S	.	.			trans	-72.7	2.2	180	-58.3	177.8	146.8	0	0	113.8	L214 K269 L270 D271	E212-L214 PolarHBondContact O-N 3.44Å; E212-K269 VanDerWaalsContact OE2-O 3.14Å; E212-L270 VanDerWaalsContact CD-N 3.35Å; E212-L270 PolarHBondContact OE1-N 2.99Å; E212-L270 PolarHBondContact OE2-N 3.26Å; E212-D271 PolarHBondContact OE1-N 2.87Å
213	S	53.7	Low	54.3	Low	30 Å²	30	89 Å²	89	21%	0.21	48%	0.48	C	S	.	.			trans	-85.7	115.3	-171.7	178.6	0	0	0	0	113	R206 C211 E215	R206-S213 PolarHBondContact NE-O 3.22Å; R206-S213 VanDerWaalsContact NE-O 3.11Å; C211-S213 PolarHBondContact O-N 3.05Å; C211-S213 VanDerWaalsContact O-N 3.15Å; S213-E215 PolarHBondContact O-N 3.3Å; S213-E215 PolarHBondContact OG-N 3.09Å; S213-E215 PolarHBondContact OG-O 3.07Å
214	L	58	Low	53.6	Low	130 Å²	130	89 Å²	89	68%	0.681	49%	0.488	S	S	*	.			trans	-74.5	-1.9	166.2	-69.5	176.4	0	0	0	114	W203 L207 E212	W203-L214 VanDerWaalsContact CH2-C 3.46Å; W203-L214 WeakPolarHBondContact CH2-O 3.49Å; W203-L214 WeakPolarHBondContact CZ3-O 3.28Å; L207-L214 HydrophobicContact CD2-CD2 4.31Å; E212-L214 PolarHBondContact O-N 3.44Å
215	E	55.8	Low	53.5	Low	96 Å²	96	92.9 Å²	92.9	45%	0.449	53%	0.531	S	S	.	.	S	Bend	trans	-92.2	141.7	172.9	-59.9	-162.6	167	0	0	111.4	R206 S213 Y258	R206-E215 VanDerWaalsContact CZ-O 3.29Å; R206-E215 PolarHBondContact NE-O 3.46Å; R206-E215 PolarHBondContact NH2-O 3.37Å; S213-E215 PolarHBondContact O-N 3.3Å; S213-E215 PolarHBondContact OG-N 3.09Å; S213-E215 PolarHBondContact OG-O 3.07Å; E215-Y258 WeakPolarHBondContact OE2-CD1 3.3Å; E215-Y258 WeakPolarHBondContact OE2-CE1 3.49Å
216	E	58.1	Low	53.7	Low	104 Å²	104	90.3 Å²	90.3	49%	0.486	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-52.8	142	167.9	-80.7	-174.5	-177.9	0	0	109	R219	E216-R219 IonicContact OE1-NH2 2.8Å; E216-R219 IonicContact OE2-CZ 3.93Å; E216-R219 IonicContact OE2-NE 2.81Å; E216-R219 PolarHBondContact OE2-NE 3.42Å; E216-R219 IonicContact OE2-NH2 3.96Å; E216-R219 PolarHBondContact OE2-NH2 3.08Å
217	S	55.8	Low	54.3	Low	64 Å²	64	93.4 Å²	93.4	45%	0.448	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-53.1	135	167.9	-56.2	0	0	0	0	108.1	R206 R219	R206-S217 PolarHBondContact NH1-OG 2.84Å; R206-S217 PolarHBondContact NH2-OG 3.36Å; S217-R219 PolarHBondContact O-N 3.26Å
218	P	49.2	Very low	55.1	Low	109 Å²	109	93.3 Å²	93.3	71%	0.708	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-49.6	117.3	-179.2	-23.9	30.6	0	0	0	108.4	S220	P218-S220 PolarHBondContact O-N 3.02Å
219	R	49.2	Very low	56.4	Low	195 Å²	195	97 Å²	97	74%	0.736	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-53.4	135.2	166.9	-64.4	-177.2	-169.5	-169.4	1.9	104.8	E216 S217 G221	E216-R219 IonicContact OE1-NH2 2.8Å; E216-R219 IonicContact OE2-CZ 3.93Å; E216-R219 IonicContact OE2-NE 2.81Å; E216-R219 PolarHBondContact OE2-NE 3.42Å; E216-R219 IonicContact OE2-NH2 3.96Å; E216-R219 PolarHBondContact OE2-NH2 3.08Å; S217-R219 PolarHBondContact O-N 3.26Å; R219-G221 PolarHBondContact O-N 3.42Å
220	S	45.7	Very low	58	Low	131 Å²	131	97.3 Å²	97.3	92%	0.916	55%	0.549	S	S	*	.			trans	-65.1	64.1	178.1	47.9	0	0	0	0	110.6	P218	P218-S220 PolarHBondContact O-N 3.02Å
221	G	44.9	Very low	59.4	Low	58 Å²	58	91.7 Å²	91.7	60%	0.598	51%	0.51	S	S	*	.			trans	-77.9	134.2	161.4	0	0	0	0	0	106.8	R219 L223	R219-G221 PolarHBondContact O-N 3.42Å; G221-L223 PolarHBondContact O-N 3.36Å; G221-L223 VanDerWaalsContact O-N 3.12Å
222	R	47.5	Very low	60.8	Low	251 Å²	251	93.9 Å²	93.9	95%	0.947	52%	0.515	S	S	*	.			trans	-39.4	118.3	175.5	-141.2	177	-167.3	-173.1	2.3	109.8	S224	R222-S224 PolarHBondContact O-N 2.88Å; R222-S224 VanDerWaalsContact O-N 3.1Å
223	L	51.1	Low	62.3	Low	126 Å²	126	94.5 Å²	94.5	66%	0.66	52%	0.518	S	S	*	.			trans	-51	121.5	170.8	-82.2	141.8	0	0	0	107.4	G221	G221-L223 PolarHBondContact O-N 3.36Å; G221-L223 VanDerWaalsContact O-N 3.12Å
224	S	53.5	Low	63.6	Low	59 Å²	59	93.7 Å²	93.7	41%	0.413	51%	0.511	S	S	.	.			trans	-51.1	145.2	167.1	45.5	0	0	0	0	108.1	R222 F226	R222-S224 PolarHBondContact O-N 2.88Å; R222-S224 VanDerWaalsContact O-N 3.1Å; S224-F226 PolarHBondContact O-N 3.31Å
225	G	58.8	Low	64.5	Low	94 Å²	94	88.5 Å²	88.5	97%	0.969	49%	0.485	S	S	*	.	S	Bend	trans	-65.9	36.5	179.3	0	0	0	0	0	114.6
226	F	66.2	Low	65.5	Low	36 Å²	36	88.2 Å²	88.2	16%	0.158	49%	0.486	C	S	.	.			trans	-80.2	127	-178.4	-179.5	-91.1	0	0	0	109.7	S224 N228 L231 F250 I257 H260	S224-F226 PolarHBondContact O-N 3.31Å; F226-N228 PolarHBondContact O-N 2.99Å; F226-L231 HydrophobicContact CE1-CB 3.6Å; F226-L231 HydrophobicContact CE1-CD2 3.88Å; F226-L231 HydrophobicContact CE1-CG 4.24Å; F226-L231 HydrophobicContact CZ-CB 3.82Å; F226-L231 HydrophobicContact CZ-CD1 4.37Å; F226-L231 HydrophobicContact CZ-CD2 4.37Å; F226-L231 HydrophobicContact CZ-CG 4.41Å; F226-F250 HydrophobicContact CE2-CB 3.93Å; F226-F250 AromaticContact CE2-CD1 3.53Å; F226-F250 HydrophobicContact CE2-CD1 3.53Å; F226-F250 AromaticContact CE2-CD2 3.98Å; F226-F250 HydrophobicContact CE2-CD2 3.98Å; F226-F250 AromaticContact CE2-CE1 3.85Å; F226-F250 HydrophobicContact CE2-CE1 3.85Å; F226-F250 HydrophobicContact CE2-CE2 4.26Å; F226-F250 AromaticContact CE2-CG 3.58Å; F226-F250 HydrophobicContact CE2-CG 3.58Å; F226-F250 HydrophobicContact CE2-CZ 4.18Å; F226-F250 HydrophobicContact CZ-CD1 4.14Å; F226-F250 HydrophobicContact CZ-CD2 4.01Å; F226-F250 HydrophobicContact CZ-CE1 4.08Å; F226-F250 AromaticContact CZ-CE2 3.94Å; F226-F250 HydrophobicContact CZ-CE2 3.94Å; F226-F250 HydrophobicContact CZ-CG 4.08Å; F226-F250 AromaticContact CZ-CZ 3.95Å; F226-F250 HydrophobicContact CZ-CZ 3.95Å; F226-I257 HydrophobicContact CE2-CD1 4.37Å; F226-I257 HydrophobicContact CZ-CD1 4.06Å; F226-H260 HydrophobicContact CD1-CB 4.4Å; F226-H260 AromaticContact CD1-CD2 3.5Å; F226-H260 AromaticContact CD1-CE1 3.54Å; F226-H260 AromaticContact CD1-CG 3.65Å; F226-H260 AromaticContact CD1-ND1 3.66Å; F226-H260 AromaticContact CD1-NE2 3.47Å; F226-H260 WeakPolarHBondContact CD1-NE2 3.05Å; F226-H260 HydrophobicContact CE1-CB 4.24Å; F226-H260 AromaticContact CE1-CG 3.97Å; F226-H260 AromaticContact CG-NE2 3.78Å
227	D	74.3	Confident	66.6	Low	94 Å²	94	89.4 Å²	89.4	50%	0.503	50%	0.495	S	S	.	.			trans	-80.2	112.2	-177	-171.3	-8.2	0	0	0	111.2	Q229 V230 L231	D227-Q229 PolarHBondContact O-N 3.35Å; D227-Q229 WeakPolarHBondContact OD1-CB 3.34Å; D227-Q229 PolarHBondContact OD1-N 2.91Å; D227-V230 HydrophobicContact CB-CG2 3.94Å; D227-V230 PolarHBondContact O-N 3.4Å; D227-L231 PolarHBondContact O-N 3.37Å
228	N	77.3	Confident	67.3	Low	50 Å²	50	90 Å²	90	27%	0.267	49%	0.494	S	S	.	.	H	α-helix	trans	-57.9	-28.3	175.5	-78.3	-27.9	0	0	0	112.9	F226 K232 H260	F226-N228 PolarHBondContact O-N 2.99Å; N228-K232 WeakPolarHBondContact O-CB 3.32Å; N228-K232 PolarHBondContact O-N 3.29Å; N228-H260 PolarHBondContact OD1-ND1 2.59Å
229	Q	80.2	Confident	68.3	Low	103 Å²	103	89.9 Å²	89.9	48%	0.481	49%	0.492	S	S	.	.	H	α-helix	trans	-66.9	-43.7	-179.1	-164.7	70.4	7.3	0	0	110.8	D227 L231 K232 E233	D227-Q229 PolarHBondContact O-N 3.35Å; D227-Q229 WeakPolarHBondContact OD1-CB 3.34Å; D227-Q229 PolarHBondContact OD1-N 2.91Å; Q229-L231 PolarHBondContact O-N 3.3Å; Q229-K232 WeakPolarHBondContact O-CB 3.41Å; Q229-K232 PolarHBondContact O-N 3Å; Q229-E233 WeakPolarHBondContact O-CG 3.32Å; Q229-E233 PolarHBondContact O-N 2.91Å
230	V	82.4	Confident	69.2	Low	61 Å²	61	86.6 Å²	86.6	37%	0.37	49%	0.494	S	S	.	.	H	α-helix	trans	-65.8	-39.2	179.4	-174	0	0	0	0	111.2	D227 L234 F250	D227-V230 HydrophobicContact CB-CG2 3.94Å; D227-V230 PolarHBondContact O-N 3.4Å; V230-L234 WeakPolarHBondContact O-CB 3.32Å; V230-L234 PolarHBondContact O-N 2.84Å; V230-F250 HydrophobicContact CB-CE1 4.47Å; V230-F250 HydrophobicContact CB-CZ 4.49Å; V230-F250 HydrophobicContact CG1-CE1 3.74Å; V230-F250 HydrophobicContact CG1-CZ 3.82Å
231	L	82.2	Confident	70.3	Confident	0 Å²	0	83.8 Å²	83.8	0%	0	47%	0.466	C	S	.	.	H	α-helix	trans	-66.2	-42.9	174.8	-179.8	64.3	0	0	0	111.9	F226 D227 Q229 L234 V235 I246 F250 I257 H260 L261 L264	F226-L231 HydrophobicContact CE1-CB 3.6Å; F226-L231 HydrophobicContact CE1-CD2 3.88Å; F226-L231 HydrophobicContact CE1-CG 4.24Å; F226-L231 HydrophobicContact CZ-CB 3.82Å; F226-L231 HydrophobicContact CZ-CD1 4.37Å; F226-L231 HydrophobicContact CZ-CD2 4.37Å; F226-L231 HydrophobicContact CZ-CG 4.41Å; D227-L231 PolarHBondContact O-N 3.37Å; Q229-L231 PolarHBondContact O-N 3.3Å; L231-L234 PolarHBondContact O-N 3.4Å; L231-V235 HydrophobicContact CD1-CG2 4.1Å; L231-V235 HydrophobicContact CG-CG2 4.33Å; L231-V235 WeakPolarHBondContact O-CB 3.14Å; L231-V235 WeakPolarHBondContact O-CG2 3.2Å; L231-V235 PolarHBondContact O-N 2.7Å; L231-I246 HydrophobicContact CD1-CG2 3.57Å; L231-F250 HydrophobicContact CD1-CE2 4.02Å; L231-I257 HydrophobicContact CD1-CD1 4.38Å; L231-I257 HydrophobicContact CD1-CG2 4.3Å; L231-H260 HydrophobicContact CD2-CB 3.38Å; L231-L261 HydrophobicContact CD2-CD2 4.15Å; L231-L261 HydrophobicContact CD2-CG 4.2Å; L231-L261 HydrophobicContact CG-CD2 4.33Å; L231-L264 HydrophobicContact CD2-CD1 4.06Å; L231-L264 HydrophobicContact CG-CD1 4.22Å
232	K	81.3	Confident	71.8	Confident	90 Å²	90	84.6 Å²	84.6	39%	0.391	46%	0.459	S	S	.	.	H	α-helix	trans	-58.6	-49	177.1	-174.6	-179.4	177.1	-174.6	0	110.8	N228 Q229 L234 V235 D236 L264	N228-K232 WeakPolarHBondContact O-CB 3.32Å; N228-K232 PolarHBondContact O-N 3.29Å; Q229-K232 WeakPolarHBondContact O-CB 3.41Å; Q229-K232 PolarHBondContact O-N 3Å; K232-L234 VanDerWaalsContact C-N 3.34Å; K232-L234 PolarHBondContact O-N 3.19Å; K232-V235 PolarHBondContact O-N 3.28Å; K232-D236 WeakPolarHBondContact O-CB 3.48Å; K232-D236 PolarHBondContact O-N 3.46Å; K232-L264 HydrophobicContact CB-CD1 4.19Å; K232-L264 HydrophobicContact CB-CD2 4.34Å; K232-L264 HydrophobicContact CD-CD2 4.44Å
233	E	83.1	Confident	73.1	Confident	104 Å²	104	75.1 Å²	75.1	49%	0.486	43%	0.426	S	S	.	.	H	α-helix	trans	-59.8	-41.2	176.2	-73.6	174.7	-170.3	0	0	112.4	Q229 D236 L237	Q229-E233 WeakPolarHBondContact O-CG 3.32Å; Q229-E233 PolarHBondContact O-N 2.91Å; E233-D236 PolarHBondContact O-N 3.49Å; E233-L237 VanDerWaalsContact O-CB 3.29Å; E233-L237 WeakPolarHBondContact O-CB 3.43Å; E233-L237 WeakPolarHBondContact O-CD1 3.26Å; E233-L237 VanDerWaalsContact O-CG 3.25Å; E233-L237 WeakPolarHBondContact O-CG 3.49Å; E233-L237 PolarHBondContact O-N 2.95Å
234	L	80.8	Confident	74.2	Confident	12 Å²	12	70.1 Å²	70.1	6%	0.063	40%	0.404	C	S	.	.	H	α-helix	trans	-65.1	-41.1	178.9	-123.7	157.4	0	0	0	113	V230 L231 K232 N238 K241 K249 F250	V230-L234 WeakPolarHBondContact O-CB 3.32Å; V230-L234 PolarHBondContact O-N 2.84Å; L231-L234 PolarHBondContact O-N 3.4Å; K232-L234 VanDerWaalsContact C-N 3.34Å; K232-L234 PolarHBondContact O-N 3.19Å; L234-N238 PolarHBondContact O-N 3.26Å; L234-N238 VanDerWaalsContact O-N 3.07Å; L234-K241 HydrophobicContact CD2-CD 4.16Å; L234-K249 HydrophobicContact CD1-CD 3.76Å; L234-K249 HydrophobicContact CD2-CD 4.05Å; L234-K249 HydrophobicContact CG-CD 4.49Å; L234-F250 HydrophobicContact CD1-CD2 4.41Å; L234-F250 HydrophobicContact CD1-CE1 4.21Å; L234-F250 HydrophobicContact CD1-CE2 3.37Å; L234-F250 HydrophobicContact CD1-CZ 3.26Å
235	V	77.8	Confident	75.2	Confident	21 Å²	21	71.8 Å²	71.8	13%	0.127	41%	0.405	C	S	.	.	H	α-helix	trans	-71.2	-35.9	177.8	175.1	0	0	0	0	110.5	L231 K232 N238 P239 I246 L261 K266	L231-V235 HydrophobicContact CD1-CG2 4.1Å; L231-V235 HydrophobicContact CG-CG2 4.33Å; L231-V235 WeakPolarHBondContact O-CB 3.14Å; L231-V235 WeakPolarHBondContact O-CG2 3.2Å; L231-V235 PolarHBondContact O-N 2.7Å; K232-V235 PolarHBondContact O-N 3.28Å; V235-N238 CarbonylContact O-C 3.52Å; V235-P239 VanDerWaalsContact O-CA 3.32Å; V235-P239 WeakPolarHBondContact O-CA 3.39Å; V235-I246 HydrophobicContact CG2-CD1 4.2Å; V235-L261 HydrophobicContact CG2-CD2 3.69Å; V235-K266 HydrophobicContact CG1-CD 4.01Å
236	D	77	Confident	76.3	Confident	90 Å²	90	67.5 Å²	67.5	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-70.8	-37.4	176.3	-70.6	-18.4	0	0	0	111.7	K232 E233 K266	K232-D236 WeakPolarHBondContact O-CB 3.48Å; K232-D236 PolarHBondContact O-N 3.46Å; E233-D236 PolarHBondContact O-N 3.49Å; D236-K266 IonicContact OD1-NZ 2.8Å; D236-K266 PolarHBondContact OD1-NZ 2.85Å
237	L	80.5	Confident	77.1	Confident	130 Å²	130	66.2 Å²	66.2	68%	0.681	36%	0.356	S	S	*	.	H	α-helix	trans	-71.7	-35.8	177	-78.1	162.8	0	0	0	113.1	E233	E233-L237 VanDerWaalsContact O-CB 3.29Å; E233-L237 WeakPolarHBondContact O-CB 3.43Å; E233-L237 WeakPolarHBondContact O-CD1 3.26Å; E233-L237 VanDerWaalsContact O-CG 3.25Å; E233-L237 WeakPolarHBondContact O-CG 3.49Å; E233-L237 PolarHBondContact O-N 2.95Å
238	N	70.9	Confident	77.4	Confident	77 Å²	77	68.3 Å²	68.3	41%	0.412	37%	0.366	S	S	.	.			trans	-142.9	80.5	-177.5	-65.4	-77.3	0	0	0	111	L234 V235 T240 K241	L234-N238 PolarHBondContact O-N 3.26Å; L234-N238 VanDerWaalsContact O-N 3.07Å; V235-N238 CarbonylContact O-C 3.52Å; N238-T240 PolarHBondContact O-N 3.23Å; N238-K241 HydrophobicContact CB-CD 4.31Å; N238-K241 HydrophobicContact CB-CG 4Å; N238-K241 PolarHBondContact O-N 2.99Å
239	P	69.5	Low	77.7	Confident	105 Å²	105	71.8 Å²	71.8	68%	0.682	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-8.1	-176.2	24.4	-33	0	0	0	114.2	V235	V235-P239 VanDerWaalsContact O-CA 3.32Å; V235-P239 WeakPolarHBondContact O-CA 3.39Å
240	T	67.2	Low	77.7	Confident	127 Å²	127	69.2 Å²	69.2	78%	0.779	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-9	179.5	57.6	0	0	0	0	114	N238 T242	N238-T240 PolarHBondContact O-N 3.23Å; T240-T242 PolarHBondContact O-N 3.25Å
241	K	69.9	Low	77.8	Confident	72 Å²	72	72.7 Å²	72.7	31%	0.313	39%	0.388	S	S	.	.			trans	-66.4	134	-179.6	-77.2	-163.9	173.1	-163.4	0	111.6	L234 N238 E245 I246	L234-K241 HydrophobicContact CD2-CD 4.16Å; N238-K241 HydrophobicContact CB-CD 4.31Å; N238-K241 HydrophobicContact CB-CG 4Å; N238-K241 PolarHBondContact O-N 2.99Å; K241-E245 VanDerWaalsContact CA-OE2 3.3Å; K241-E245 WeakPolarHBondContact CA-OE2 3.46Å; K241-I246 HydrophobicContact CB-CD1 4.24Å; K241-I246 HydrophobicContact CB-CG1 3.95Å
242	T	76.5	Confident	77.7	Confident	74 Å²	74	74.8 Å²	74.8	45%	0.454	40%	0.4	S	S	.	.			trans	-71.7	153.6	176.2	66.7	0	0	0	0	110.6	T240 G244 E245 I246	T240-T242 PolarHBondContact O-N 3.25Å; T242-G244 PolarHBondContact O-N 3.01Å; T242-E245 PolarHBondContact N-OE2 2.93Å; T242-E245 VanDerWaalsContact N-OE2 3.16Å; T242-E245 PolarHBondContact O-N 3.3Å; T242-E245 VanDerWaalsContact O-N 3.09Å; T242-E245 VanDerWaalsContact OG1-CG 3.26Å; T242-E245 WeakPolarHBondContact OG1-CG 3.36Å; T242-E245 PolarHBondContact OG1-N 2.9Å; T242-E245 VanDerWaalsContact OG1-N 3.15Å; T242-I246 WeakPolarHBondContact O-CG1 3.37Å; T242-I246 PolarHBondContact O-N 2.87Å
243	Q	75.3	Confident	77.5	Confident	53 Å²	53	74.8 Å²	74.8	25%	0.248	41%	0.405	C	S	.	.	H	α-helix	trans	-56.1	-33.7	174.3	-66.6	174.3	-7.9	0	0	111.7	I246 A247 Q254 I257 L261	Q243-I246 PolarHBondContact O-N 3.22Å; Q243-A247 VanDerWaalsContact O-CB 3.25Å; Q243-A247 WeakPolarHBondContact O-CB 3.42Å; Q243-A247 PolarHBondContact O-N 3.26Å; Q243-Q254 HydrophobicContact CB-CG 3.84Å; Q243-I257 HydrophobicContact CB-CG2 4.47Å; Q243-L261 HydrophobicContact CG-CD1 3.98Å
244	G	73	Confident	77.3	Confident	20 Å²	20	74.6 Å²	74.6	21%	0.206	40%	0.403	C	S	.	.	H	α-helix	trans	-66.2	-43.3	174.8	0	0	0	0	0	113.2	T242 I246 A247 I248	T242-G244 PolarHBondContact O-N 3.01Å; G244-I246 VanDerWaalsContact C-N 3.32Å; G244-I246 PolarHBondContact O-N 2.8Å; G244-A247 WeakPolarHBondContact O-CB 3.49Å; G244-A247 PolarHBondContact O-N 3.5Å; G244-I248 VanDerWaalsContact O-CG1 3.31Å; G244-I248 WeakPolarHBondContact O-CG1 3.45Å; G244-I248 PolarHBondContact O-N 2.96Å
245	E	74.8	Confident	77	Confident	94 Å²	94	80.1 Å²	80.1	44%	0.439	43%	0.429	S	S	.	.	H	α-helix	trans	-63.1	-39.2	174	-74.9	164.3	-165.7	0	0	112.4	K241 T242 K249	K241-E245 VanDerWaalsContact CA-OE2 3.3Å; K241-E245 WeakPolarHBondContact CA-OE2 3.46Å; T242-E245 PolarHBondContact N-OE2 2.93Å; T242-E245 VanDerWaalsContact N-OE2 3.16Å; T242-E245 PolarHBondContact O-N 3.3Å; T242-E245 VanDerWaalsContact O-N 3.09Å; T242-E245 VanDerWaalsContact OG1-CG 3.26Å; T242-E245 WeakPolarHBondContact OG1-CG 3.36Å; T242-E245 PolarHBondContact OG1-N 2.9Å; T242-E245 VanDerWaalsContact OG1-N 3.15Å; E245-K249 WeakPolarHBondContact O-CB 3.5Å; E245-K249 PolarHBondContact O-N 2.81Å
246	I	81.8	Confident	77	Confident	5 Å²	5	80.9 Å²	80.9	3%	0.026	43%	0.434	C	S	.	.	H	α-helix	trans	-65.6	-43.1	175.3	-63.2	171.6	0	0	0	109.6	L231 V235 K241 T242 Q243 G244 I248 K249 F250 I257	L231-I246 HydrophobicContact CD1-CG2 3.57Å; V235-I246 HydrophobicContact CG2-CD1 4.2Å; K241-I246 HydrophobicContact CB-CD1 4.24Å; K241-I246 HydrophobicContact CB-CG1 3.95Å; T242-I246 WeakPolarHBondContact O-CG1 3.37Å; T242-I246 PolarHBondContact O-N 2.87Å; Q243-I246 PolarHBondContact O-N 3.22Å; G244-I246 VanDerWaalsContact C-N 3.32Å; G244-I246 PolarHBondContact O-N 2.8Å; I246-I248 PolarHBondContact O-N 2.79Å; I246-K249 PolarHBondContact O-N 2.78Å; I246-F250 HydrophobicContact CG2-CD2 3.61Å; I246-F250 HydrophobicContact CG2-CE2 3.71Å; I246-F250 VanDerWaalsContact O-CD2 3.26Å; I246-F250 WeakPolarHBondContact O-CD2 3.27Å; I246-F250 PolarHBondContact O-N 3.34Å; I246-I257 HydrophobicContact CB-CG1 4.46Å; I246-I257 HydrophobicContact CB-CG2 4.1Å; I246-I257 HydrophobicContact CG2-CB 4.47Å; I246-I257 HydrophobicContact CG2-CD1 3.69Å; I246-I257 HydrophobicContact CG2-CG1 3.91Å; I246-I257 HydrophobicContact CG2-CG2 3.69Å
247	A	83	Confident	77.1	Confident	8 Å²	8	76.6 Å²	76.6	7%	0.066	41%	0.411	C	S	.	.	H	α-helix	trans	-60.9	-44.2	178	0	0	0	0	0	112.4	Q243 G244 K249 F250 T251 V252 Q254 I257	Q243-A247 VanDerWaalsContact O-CB 3.25Å; Q243-A247 WeakPolarHBondContact O-CB 3.42Å; Q243-A247 PolarHBondContact O-N 3.26Å; G244-A247 WeakPolarHBondContact O-CB 3.49Å; G244-A247 PolarHBondContact O-N 3.5Å; A247-K249 VanDerWaalsContact C-N 3.34Å; A247-K249 PolarHBondContact O-N 2.76Å; A247-F250 PolarHBondContact O-N 3.18Å; A247-T251 PolarHBondContact O-N 3.34Å; A247-V252 WeakPolarHBondContact CB-O 3.46Å; A247-V252 PolarHBondContact O-N 3.17Å; A247-V252 VanDerWaalsContact O-N 3.11Å; A247-Q254 HydrophobicContact CB-CB 4.13Å; A247-I257 HydrophobicContact CB-CG1 4.02Å
248	I	80	Confident	76.8	Confident	139 Å²	139	73 Å²	73	71%	0.713	39%	0.388	S	S	*	.	H	α-helix	trans	-60.1	-45.3	174.1	-68.4	162.1	0	0	0	110.5	G244 I246 F250 T251	G244-I248 VanDerWaalsContact O-CG1 3.31Å; G244-I248 WeakPolarHBondContact O-CG1 3.45Å; G244-I248 PolarHBondContact O-N 2.96Å; I246-I248 PolarHBondContact O-N 2.79Å; I248-F250 VanDerWaalsContact C-N 3.3Å; I248-F250 PolarHBondContact O-N 3.27Å; I248-T251 PolarHBondContact O-N 2.99Å
249	K	84	Confident	76.9	Confident	123 Å²	123	71.1 Å²	71.1	54%	0.535	38%	0.384	S	S	.	.	H	α-helix	trans	-63.1	-35.8	-178.6	-176.7	171.2	177.3	-175.2	0	112.9	L234 E245 I246 A247	L234-K249 HydrophobicContact CD1-CD 3.76Å; L234-K249 HydrophobicContact CD2-CD 4.05Å; L234-K249 HydrophobicContact CG-CD 4.49Å; E245-K249 WeakPolarHBondContact O-CB 3.5Å; E245-K249 PolarHBondContact O-N 2.81Å; I246-K249 PolarHBondContact O-N 2.78Å; A247-K249 VanDerWaalsContact C-N 3.34Å; A247-K249 PolarHBondContact O-N 2.76Å
250	F	81.3	Confident	77.3	Confident	48 Å²	48	66.4 Å²	66.4	21%	0.211	35%	0.353	C	S	.	.	H	α-helix	trans	-95.8	-0.2	-179.3	-73.9	-69.7	0	0	0	113.9	F226 V230 L231 L234 I246 A247 I248 V252 I257	F226-F250 HydrophobicContact CE2-CB 3.93Å; F226-F250 AromaticContact CE2-CD1 3.53Å; F226-F250 HydrophobicContact CE2-CD1 3.53Å; F226-F250 AromaticContact CE2-CD2 3.98Å; F226-F250 HydrophobicContact CE2-CD2 3.98Å; F226-F250 AromaticContact CE2-CE1 3.85Å; F226-F250 HydrophobicContact CE2-CE1 3.85Å; F226-F250 HydrophobicContact CE2-CE2 4.26Å; F226-F250 AromaticContact CE2-CG 3.58Å; F226-F250 HydrophobicContact CE2-CG 3.58Å; F226-F250 HydrophobicContact CE2-CZ 4.18Å; F226-F250 HydrophobicContact CZ-CD1 4.14Å; F226-F250 HydrophobicContact CZ-CD2 4.01Å; F226-F250 HydrophobicContact CZ-CE1 4.08Å; F226-F250 AromaticContact CZ-CE2 3.94Å; F226-F250 HydrophobicContact CZ-CE2 3.94Å; F226-F250 HydrophobicContact CZ-CG 4.08Å; F226-F250 AromaticContact CZ-CZ 3.95Å; F226-F250 HydrophobicContact CZ-CZ 3.95Å; V230-F250 HydrophobicContact CB-CE1 4.47Å; V230-F250 HydrophobicContact CB-CZ 4.49Å; V230-F250 HydrophobicContact CG1-CE1 3.74Å; V230-F250 HydrophobicContact CG1-CZ 3.82Å; L231-F250 HydrophobicContact CD1-CE2 4.02Å; L234-F250 HydrophobicContact CD1-CD2 4.41Å; L234-F250 HydrophobicContact CD1-CE1 4.21Å; L234-F250 HydrophobicContact CD1-CE2 3.37Å; L234-F250 HydrophobicContact CD1-CZ 3.26Å; I246-F250 HydrophobicContact CG2-CD2 3.61Å; I246-F250 HydrophobicContact CG2-CE2 3.71Å; I246-F250 VanDerWaalsContact O-CD2 3.26Å; I246-F250 WeakPolarHBondContact O-CD2 3.27Å; I246-F250 PolarHBondContact O-N 3.34Å; A247-F250 PolarHBondContact O-N 3.18Å; I248-F250 VanDerWaalsContact C-N 3.3Å; I248-F250 PolarHBondContact O-N 3.27Å; F250-V252 HydrophobicContact CB-CG1 4.49Å; F250-V252 HydrophobicContact CB-CG2 3.84Å; F250-V252 PolarHBondContact O-N 3.26Å; F250-I257 HydrophobicContact CB-CD1 4.48Å; F250-I257 HydrophobicContact CD2-CD1 3.99Å
251	T	83.5	Confident	77.6	Confident	135 Å²	135	61 Å²	61	83%	0.828	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	38	-177.6	-33.9	0	0	0	0	112.1	A247 I248	A247-T251 PolarHBondContact O-N 3.34Å; I248-T251 PolarHBondContact O-N 2.99Å
252	V	80.2	Confident	77.6	Confident	43 Å²	43	61 Å²	61	26%	0.261	32%	0.322	S	S	.	.	S	Bend	trans	-120	164.1	177.3	-65.1	0	0	0	0	110.1	A247 F250 T256 I257	A247-V252 WeakPolarHBondContact CB-O 3.46Å; A247-V252 PolarHBondContact O-N 3.17Å; A247-V252 VanDerWaalsContact O-N 3.11Å; F250-V252 HydrophobicContact CB-CG1 4.49Å; F250-V252 HydrophobicContact CB-CG2 3.84Å; F250-V252 PolarHBondContact O-N 3.26Å; V252-T256 HydrophobicContact CB-CG2 4.23Å; V252-T256 HydrophobicContact CG1-CG2 4.45Å; V252-T256 HydrophobicContact CG2-CG2 4.4Å; V252-I257 HydrophobicContact CG2-CD1 3.48Å; V252-I257 VanDerWaalsContact CG2-CD1 3.48Å; V252-I257 HydrophobicContact CG2-CG1 3.77Å
253	N	78.1	Confident	77.4	Confident	91 Å²	91	64 Å²	64	49%	0.487	33%	0.331	S	S	.	.			trans	-65.4	143.2	171	-174.8	-21.4	0	0	0	109.6	Q255 T256 I257	N253-Q255 PolarHBondContact ND2-OE1 2.97Å; N253-Q255 PolarHBondContact O-N 3.02Å; N253-Q255 VanDerWaalsContact O-N 3.16Å; N253-Q255 PolarHBondContact OD1-N 3Å; N253-T256 WeakPolarHBondContact O-CA 3.41Å; N253-T256 VanDerWaalsContact O-CB 3.22Å; N253-T256 WeakPolarHBondContact O-CB 3.49Å; N253-T256 PolarHBondContact O-N 2.88Å; N253-T256 PolarHBondContact O-OG1 3.12Å; N253-I257 PolarHBondContact O-N 3.41Å
254	Q	78.7	Confident	77.1	Confident	99 Å²	99	64 Å²	64	46%	0.463	33%	0.332	S	S	.	.	H	α-helix	trans	-51.9	-34.6	172.6	-173.4	178.6	-18.1	0	0	112.8	Q243 A247 T256 I257 Y258	Q243-Q254 HydrophobicContact CB-CG 3.84Å; A247-Q254 HydrophobicContact CB-CB 4.13Å; Q254-T256 VanDerWaalsContact C-N 3.27Å; Q254-T256 PolarHBondContact O-N 3.44Å; Q254-I257 PolarHBondContact O-N 3.05Å; Q254-Y258 PolarHBondContact O-N 2.96Å
255	Q	74	Confident	76.6	Confident	128 Å²	128	66.2 Å²	66.2	60%	0.598	36%	0.356	S	S	*	.	H	α-helix	trans	-60	-35.4	174.4	-70.1	176.1	-19.5	0	0	112.8	N253 Y258 A259	N253-Q255 PolarHBondContact ND2-OE1 2.97Å; N253-Q255 PolarHBondContact O-N 3.02Å; N253-Q255 VanDerWaalsContact O-N 3.16Å; N253-Q255 PolarHBondContact OD1-N 3Å; Q255-Y258 PolarHBondContact O-N 3.36Å; Q255-A259 PolarHBondContact O-N 3.25Å
256	T	76.8	Confident	75.7	Confident	37 Å²	37	66.4 Å²	66.4	23%	0.227	36%	0.355	C	S	.	.	H	α-helix	trans	-64.4	-46.4	175.6	-51.5	0	0	0	0	110.2	V252 N253 Q254 Y258 A259 H260	V252-T256 HydrophobicContact CB-CG2 4.23Å; V252-T256 HydrophobicContact CG1-CG2 4.45Å; V252-T256 HydrophobicContact CG2-CG2 4.4Å; N253-T256 WeakPolarHBondContact O-CA 3.41Å; N253-T256 VanDerWaalsContact O-CB 3.22Å; N253-T256 WeakPolarHBondContact O-CB 3.49Å; N253-T256 PolarHBondContact O-N 2.88Å; N253-T256 PolarHBondContact O-OG1 3.12Å; Q254-T256 VanDerWaalsContact C-N 3.27Å; Q254-T256 PolarHBondContact O-N 3.44Å; T256-Y258 VanDerWaalsContact C-N 3.34Å; T256-Y258 PolarHBondContact O-N 3.25Å; T256-A259 PolarHBondContact O-N 3.08Å; T256-H260 PolarHBondContact O-CD2 3.32Å; T256-H260 PolarHBondContact O-N 3.47Å; T256-H260 VanDerWaalsContact O-N 3.13Å
257	I	79.5	Confident	74	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-61.1	-43.1	177.1	-60.8	-53.2	0	0	0	111.5	F226 L231 Q243 I246 A247 F250 V252 N253 Q254 A259 H260 L261	F226-I257 HydrophobicContact CE2-CD1 4.37Å; F226-I257 HydrophobicContact CZ-CD1 4.06Å; L231-I257 HydrophobicContact CD1-CD1 4.38Å; L231-I257 HydrophobicContact CD1-CG2 4.3Å; Q243-I257 HydrophobicContact CB-CG2 4.47Å; I246-I257 HydrophobicContact CB-CG1 4.46Å; I246-I257 HydrophobicContact CB-CG2 4.1Å; I246-I257 HydrophobicContact CG2-CB 4.47Å; I246-I257 HydrophobicContact CG2-CD1 3.69Å; I246-I257 HydrophobicContact CG2-CG1 3.91Å; I246-I257 HydrophobicContact CG2-CG2 3.69Å; A247-I257 HydrophobicContact CB-CG1 4.02Å; F250-I257 HydrophobicContact CB-CD1 4.48Å; F250-I257 HydrophobicContact CD2-CD1 3.99Å; V252-I257 HydrophobicContact CG2-CD1 3.48Å; V252-I257 VanDerWaalsContact CG2-CD1 3.48Å; V252-I257 HydrophobicContact CG2-CG1 3.77Å; N253-I257 PolarHBondContact O-N 3.41Å; Q254-I257 PolarHBondContact O-N 3.05Å; I257-A259 PolarHBondContact O-N 2.62Å; I257-H260 PolarHBondContact O-N 3.46Å; I257-L261 HydrophobicContact CG2-CD1 3.87Å; I257-L261 HydrophobicContact CG2-CG 4.18Å; I257-L261 WeakPolarHBondContact O-CB 3.46Å; I257-L261 WeakPolarHBondContact O-CG 3.37Å; I257-L261 PolarHBondContact O-N 3.45Å
258	Y	74.5	Confident	71.9	Confident	54 Å²	54	79.4 Å²	79.4	21%	0.212	42%	0.417	C	S	.	.	H	α-helix	trans	-59.2	-46.5	176.3	174.9	-107.9	0	0	0	112.3	E215 Q254 Q255 T256 H260 L261 N262	E215-Y258 WeakPolarHBondContact OE2-CD1 3.3Å; E215-Y258 WeakPolarHBondContact OE2-CE1 3.49Å; Q254-Y258 PolarHBondContact O-N 2.96Å; Q255-Y258 PolarHBondContact O-N 3.36Å; T256-Y258 VanDerWaalsContact C-N 3.34Å; T256-Y258 PolarHBondContact O-N 3.25Å; Y258-H260 VanDerWaalsContact C-N 3.33Å; Y258-H260 PolarHBondContact O-N 3.23Å; Y258-L261 PolarHBondContact O-N 2.72Å; Y258-N262 WeakPolarHBondContact CE1-ND2 3.43Å; Y258-N262 WeakPolarHBondContact O-CB 3.2Å; Y258-N262 PolarHBondContact O-N 3.05Å; Y258-N262 PolarHBondContact OH-ND2 2.91Å; Y258-N262 VanDerWaalsContact OH-ND2 3.12Å
259	A	74.1	Confident	69.9	Low	38 Å²	38	81.3 Å²	81.3	31%	0.314	42%	0.42	S	S	.	.	H	α-helix	trans	-59.2	-42.6	177.7	0	0	0	0	0	112.3	Q255 T256 I257 H263	Q255-A259 PolarHBondContact O-N 3.25Å; T256-A259 PolarHBondContact O-N 3.08Å; I257-A259 PolarHBondContact O-N 2.62Å; A259-H263 PolarHBondContact O-N 2.64Å; A259-H263 VanDerWaalsContact O-N 3.1Å
260	H	77	Confident	67.4	Low	7 Å²	7	82.6 Å²	82.6	3%	0.032	43%	0.432	C	S	.	.	H	α-helix	trans	-70.6	-38.1	177.1	-73.8	-77.8	0	0	0	112.6	F226 N228 L231 T256 I257 Y258 H263 L264	F226-H260 HydrophobicContact CD1-CB 4.4Å; F226-H260 AromaticContact CD1-CD2 3.5Å; F226-H260 AromaticContact CD1-CE1 3.54Å; F226-H260 AromaticContact CD1-CG 3.65Å; F226-H260 AromaticContact CD1-ND1 3.66Å; F226-H260 AromaticContact CD1-NE2 3.47Å; F226-H260 WeakPolarHBondContact CD1-NE2 3.05Å; F226-H260 HydrophobicContact CE1-CB 4.24Å; F226-H260 AromaticContact CE1-CG 3.97Å; F226-H260 AromaticContact CG-NE2 3.78Å; N228-H260 PolarHBondContact OD1-ND1 2.59Å; L231-H260 HydrophobicContact CD2-CB 3.38Å; T256-H260 PolarHBondContact O-CD2 3.32Å; T256-H260 PolarHBondContact O-N 3.47Å; T256-H260 VanDerWaalsContact O-N 3.13Å; I257-H260 PolarHBondContact O-N 3.46Å; Y258-H260 VanDerWaalsContact C-N 3.33Å; Y258-H260 PolarHBondContact O-N 3.23Å; H260-H263 PolarHBondContact O-N 2.98Å; H260-L264 WeakPolarHBondContact O-CG 3.01Å; H260-L264 PolarHBondContact O-N 2.85Å
261	L	74.2	Confident	65.1	Low	13 Å²	13	86.2 Å²	86.2	7%	0.068	45%	0.453	C	S	.	.	H	α-helix	trans	-65.7	-36.9	174.3	-74.8	176.8	0	0	0	113	L231 V235 Q243 I257 Y258 L264 G265 K266	L231-L261 HydrophobicContact CD2-CD2 4.15Å; L231-L261 HydrophobicContact CD2-CG 4.2Å; L231-L261 HydrophobicContact CG-CD2 4.33Å; V235-L261 HydrophobicContact CG2-CD2 3.69Å; Q243-L261 HydrophobicContact CG-CD1 3.98Å; I257-L261 HydrophobicContact CG2-CD1 3.87Å; I257-L261 HydrophobicContact CG2-CG 4.18Å; I257-L261 WeakPolarHBondContact O-CB 3.46Å; I257-L261 WeakPolarHBondContact O-CG 3.37Å; I257-L261 PolarHBondContact O-N 3.45Å; Y258-L261 PolarHBondContact O-N 2.72Å; L261-L264 CarbonylContact O-C 3.58Å; L261-L264 WeakPolarHBondContact O-CA 3.47Å; L261-L264 PolarHBondContact O-N 3.03Å; L261-L264 VanDerWaalsContact O-N 3.15Å; L261-G265 PolarHBondContact O-N 3.43Å; L261-K266 PolarHBondContact O-N 3.29Å
262	N	69.5	Low	62.9	Low	71 Å²	71	85.3 Å²	85.3	38%	0.38	44%	0.444	S	S	.	.	H	α-helix	trans	-64.5	-41.3	172.8	-88.5	-6.8	0	0	0	111.4	Y258 L264 G265	Y258-N262 WeakPolarHBondContact CE1-ND2 3.43Å; Y258-N262 WeakPolarHBondContact O-CB 3.2Å; Y258-N262 PolarHBondContact O-N 3.05Å; Y258-N262 PolarHBondContact OH-ND2 2.91Å; Y258-N262 VanDerWaalsContact OH-ND2 3.12Å; N262-L264 PolarHBondContact O-N 3.21Å; N262-G265 PolarHBondContact O-N 2.78Å
263	H	71.2	Confident	61.1	Low	138 Å²	138	86.8 Å²	86.8	64%	0.639	45%	0.446	S	S	*	.	H	α-helix	trans	-63.6	-25.1	173.2	-161	-55.9	0	0	0	112.4	A259 H260	A259-H263 PolarHBondContact O-N 2.64Å; A259-H263 VanDerWaalsContact O-N 3.1Å; H260-H263 PolarHBondContact O-N 2.98Å
264	L	69	Low	59.4	Low	52 Å²	52	82.8 Å²	82.8	27%	0.272	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.9	174	-67.3	170	0	0	0	113.9	L231 K232 H260 L261 N262	L231-L264 HydrophobicContact CD2-CD1 4.06Å; L231-L264 HydrophobicContact CG-CD1 4.22Å; K232-L264 HydrophobicContact CB-CD1 4.19Å; K232-L264 HydrophobicContact CB-CD2 4.34Å; K232-L264 HydrophobicContact CD-CD2 4.44Å; H260-L264 WeakPolarHBondContact O-CG 3.01Å; H260-L264 PolarHBondContact O-N 2.85Å; L261-L264 CarbonylContact O-C 3.58Å; L261-L264 WeakPolarHBondContact O-CA 3.47Å; L261-L264 PolarHBondContact O-N 3.03Å; L261-L264 VanDerWaalsContact O-N 3.15Å; N262-L264 PolarHBondContact O-N 3.21Å
265	G	63.3	Low	57.7	Low	68 Å²	68	81.9 Å²	81.9	70%	0.701	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	27	174	0	0	0	0	0	116.7	L261 N262	L261-G265 PolarHBondContact O-N 3.43Å; N262-G265 PolarHBondContact O-N 2.78Å
266	K	56.4	Low	56.5	Low	98 Å²	98	78.1 Å²	78.1	43%	0.426	41%	0.41	S	S	.	.			trans	-106.9	21.9	-165.9	-73.8	-162.8	176.1	-175.4	0	118.7	V235 D236 L261	V235-K266 HydrophobicContact CG1-CD 4.01Å; D236-K266 IonicContact OD1-NZ 2.8Å; D236-K266 PolarHBondContact OD1-NZ 2.85Å; L261-K266 PolarHBondContact O-N 3.29Å
267	V	45	Very low	55.3	Low	84 Å²	84	77.5 Å²	77.5	51%	0.509	41%	0.405	S	S	.	.			trans	-138.3	135.5	179.9	-165.9	0	0	0	0	113.6
268	K	38.9	Very low	53.9	Low	202 Å²	202	80 Å²	80	88%	0.878	42%	0.415	S	S	*	.			trans	-136.2	131.9	177.9	-101.4	-174.5	174.5	-177.4	0	111.9
269	K	38.2	Very low	53.3	Low	179 Å²	179	83 Å²	83	78%	0.778	44%	0.435	S	S	*	.			trans	-174.2	105	162.6	-101.9	174.1	-173.7	-173.7	0	111.9	E212	E212-K269 VanDerWaalsContact OE2-O 3.14Å
270	L	32.8	Very low	53.2	Low	150 Å²	150	84 Å²	84	79%	0.785	43%	0.432	S	S	*	.				84.3	84.6	105.3	-96.5	148.5	0	0	0	119	E212	E212-L270 VanDerWaalsContact CD-N 3.35Å; E212-L270 PolarHBondContact OE1-N 2.99Å; E212-L270 PolarHBondContact OE2-N 3.26Å
271	D	32.5	Very low	53.6	Low	123 Å²	123	83.7 Å²	83.7	66%	0.658	43%	0.431	S	S	*	.			trans	14.2	132.5	151.4	-63.9	-42.7	0	0	0	124	E212	E212-D271 PolarHBondContact OE1-N 2.87Å
272	N	36	Very low	54.3	Low	117 Å²	117	83.4 Å²	83.4	63%	0.626	43%	0.429	S	S	*	.			trans	-137.7	141.2	161.8	-89.8	-40.1	0	0	0	111.2
273	F	42.2	Very low	55.4	Low	73 Å²	73	81.7 Å²	81.7	32%	0.32	42%	0.42	S	S	.	.			trans	-83.5	138.5	-165.3	-129.3	-89.6	0	0	0	115.8	F156 E277 V393	F156-F273 HydrophobicContact CB-CD2 4.26Å; F156-F273 HydrophobicContact CB-CE2 3.81Å; F156-F273 HydrophobicContact CD1-CD2 4.48Å; F156-F273 AromaticContact CD1-CE2 3.43Å; F156-F273 HydrophobicContact CD1-CE2 3.43Å; F156-F273 VanDerWaalsContact CD1-CE2 3.43Å; F156-F273 AromaticContact CD1-CZ 3.53Å; F156-F273 HydrophobicContact CD1-CZ 3.53Å; F156-F273 HydrophobicContact CD2-CD2 4.46Å; F156-F273 HydrophobicContact CD2-CE2 4.07Å; F156-F273 HydrophobicContact CD2-CZ 4.38Å; F156-F273 HydrophobicContact CE1-CE1 4.34Å; F156-F273 AromaticContact CE1-CE2 3.93Å; F156-F273 HydrophobicContact CE1-CE2 3.93Å; F156-F273 AromaticContact CE1-CZ 3.52Å; F156-F273 HydrophobicContact CE1-CZ 3.52Å; F156-F273 HydrophobicContact CE2-CZ 4.37Å; F156-F273 HydrophobicContact CG-CD2 4.16Å; F156-F273 AromaticContact CG-CE2 3.49Å; F156-F273 HydrophobicContact CG-CE2 3.49Å; F156-F273 VanDerWaalsContact CG-CE2 3.49Å; F156-F273 AromaticContact CG-CZ 3.97Å; F156-F273 HydrophobicContact CG-CZ 3.97Å; F156-F273 HydrophobicContact CZ-CE1 4.38Å; F156-F273 HydrophobicContact CZ-CE2 4.43Å; F156-F273 AromaticContact CZ-CZ 3.96Å; F156-F273 HydrophobicContact CZ-CZ 3.96Å; F273-E277 WeakPolarHBondContact CA-OE2 3.43Å; F273-E277 HydrophobicContact CD1-CB 3.75Å; F273-E277 HydrophobicContact CD1-CG 4.34Å; F273-E277 WeakPolarHBondContact CD1-OE2 3.43Å; F273-E277 WeakPolarHBondContact CD2-OE2 3.5Å; F273-E277 HydrophobicContact CE1-CB 3.58Å; F273-E277 WeakPolarHBondContact CG-OE2 3.39Å; F273-E277 HydrophobicContact CZ-CB 4.33Å; F273-V393 HydrophobicContact CD2-CG2 4.02Å; F273-V393 HydrophobicContact CE1-CG1 4.41Å; F273-V393 HydrophobicContact CE1-CG2 4.32Å; F273-V393 HydrophobicContact CE2-CB 4.23Å; F273-V393 HydrophobicContact CE2-CG1 4.46Å; F273-V393 HydrophobicContact CE2-CG2 2.99Å; F273-V393 HydrophobicContact CZ-CB 3.96Å; F273-V393 HydrophobicContact CZ-CG1 3.82Å; F273-V393 HydrophobicContact CZ-CG2 3.17Å
274	G	44	Very low	56.6	Low	8 Å²	8	75.1 Å²	75.1	8%	0.082	39%	0.389	C	S	.	.			trans	-137.5	168.4	-177.8	0	0	0	0	0	115.7	S276 E277	G274-S276 PolarHBondContact O-N 2.91Å; G274-E277 WeakPolarHBondContact O-CA 3.27Å; G274-E277 WeakPolarHBondContact O-CB 3.23Å; G274-E277 WeakPolarHBondContact O-CG 3.49Å; G274-E277 PolarHBondContact O-N 3.26Å
275	E	42.7	Very low	57.9	Low	80 Å²	80	73.9 Å²	73.9	37%	0.374	39%	0.385	S	S	.	.	H	α-helix	trans	-61.9	-25.2	-176.9	-128.6	170.9	-156	0	0	114.9	L179 E277 Y278	L179-E275 HydrophobicContact CB-CB 3.64Å; L179-E275 HydrophobicContact CB-CG 3.53Å; L179-E275 WeakPolarHBondContact CB-OE1 3.47Å; L179-E275 WeakPolarHBondContact CB-OE2 3.44Å; L179-E275 HydrophobicContact CD1-CB 3.52Å; L179-E275 HydrophobicContact CD1-CG 4.38Å; L179-E275 WeakPolarHBondContact CD2-OE2 3.18Å; L179-E275 HydrophobicContact CG-CB 4.11Å; L179-E275 HydrophobicContact CG-CG 4.46Å; E275-E277 PolarHBondContact O-N 3.27Å; E275-Y278 HydrophobicContact CB-CD2 4.21Å; E275-Y278 HydrophobicContact CG-CD2 3.7Å; E275-Y278 HydrophobicContact CG-CE2 4.13Å; E275-Y278 PolarHBondContact O-N 3.04Å
276	S	48.9	Very low	59.6	Low	48 Å²	48	70.6 Å²	70.6	34%	0.336	35%	0.352	S	S	.	.	H	α-helix	trans	-57.7	-26.7	169.7	56.4	0	0	0	0	111.4	T208 G274	T208-S276 PolarHBondContact O-OG 3.09Å; G274-S276 PolarHBondContact O-N 2.91Å
277	E	50.4	Low	61.5	Low	24 Å²	24	71.9 Å²	71.9	11%	0.112	35%	0.354	C	S	.	.	H	α-helix	trans	-84.1	-22.8	-179	-49	-152.4	117.9	0	0	113.5	F273 G274 E275 N279 K280 G281 V393	F273-E277 WeakPolarHBondContact CA-OE2 3.43Å; F273-E277 HydrophobicContact CD1-CB 3.75Å; F273-E277 HydrophobicContact CD1-CG 4.34Å; F273-E277 WeakPolarHBondContact CD1-OE2 3.43Å; F273-E277 WeakPolarHBondContact CD2-OE2 3.5Å; F273-E277 HydrophobicContact CE1-CB 3.58Å; F273-E277 WeakPolarHBondContact CG-OE2 3.39Å; F273-E277 HydrophobicContact CZ-CB 4.33Å; G274-E277 WeakPolarHBondContact O-CA 3.27Å; G274-E277 WeakPolarHBondContact O-CB 3.23Å; G274-E277 WeakPolarHBondContact O-CG 3.49Å; G274-E277 PolarHBondContact O-N 3.26Å; E275-E277 PolarHBondContact O-N 3.27Å; E277-N279 PolarHBondContact O-N 3.32Å; E277-K280 HydrophobicContact CB-CD 4.2Å; E277-K280 HydrophobicContact CG-CD 4.14Å; E277-K280 WeakPolarHBondContact O-CA 3.47Å; E277-K280 VanDerWaalsContact O-CB 3.29Å; E277-K280 WeakPolarHBondContact O-CB 2.95Å; E277-K280 PolarHBondContact O-N 2.95Å; E277-K280 IonicContact OE1-NZ 2.82Å; E277-K280 PolarHBondContact OE1-NZ 3.33Å; E277-G281 PolarHBondContact O-N 3Å; E277-V393 HydrophobicContact CB-CG1 4.14Å
278	Y	51.8	Low	63.8	Low	52 Å²	52	67.9 Å²	67.9	20%	0.204	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-33.8	169.8	-69	-55.3	0	0	0	111.7	L176 V177 E275 K280 G281	L176-Y278 VanDerWaalsContact C-OH 3.3Å; L176-Y278 HydrophobicContact CB-CE1 3.88Å; L176-Y278 HydrophobicContact CD1-CE1 4.41Å; L176-Y278 HydrophobicContact CD2-CE1 4.25Å; L176-Y278 HydrophobicContact CG-CE1 4.4Å; V177-Y278 PolarHBondContact N-OH 3.32Å; V177-Y278 WeakPolarHBondContact O-CE2 3.49Å; V177-Y278 PolarHBondContact O-OH 3.24Å; E275-Y278 HydrophobicContact CB-CD2 4.21Å; E275-Y278 HydrophobicContact CG-CD2 3.7Å; E275-Y278 HydrophobicContact CG-CE2 4.13Å; E275-Y278 PolarHBondContact O-N 3.04Å; Y278-K280 VanDerWaalsContact C-N 3.26Å; Y278-G281 PolarHBondContact O-N 3.48Å
279	N	60.7	Low	66.4	Low	119 Å²	119	63.1 Å²	63.1	64%	0.636	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-17.5	173.3	-67.9	-28.5	0	0	0	112.6	E277 G281 P326	E277-N279 PolarHBondContact O-N 3.32Å; N279-G281 VanDerWaalsContact C-N 3.31Å; N279-P326 WeakPolarHBondContact O-CB 3.47Å; N279-P326 WeakPolarHBondContact O-CG 3.29Å
280	K	71.3	Confident	68.7	Low	57 Å²	57	57.3 Å²	57.3	25%	0.248	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-18.1	172.7	-61.6	177.4	-170.2	171.9	0	112.1	E277 Y278 V393 A394 C396	E277-K280 HydrophobicContact CB-CD 4.2Å; E277-K280 HydrophobicContact CG-CD 4.14Å; E277-K280 WeakPolarHBondContact O-CA 3.47Å; E277-K280 VanDerWaalsContact O-CB 3.29Å; E277-K280 WeakPolarHBondContact O-CB 2.95Å; E277-K280 PolarHBondContact O-N 2.95Å; E277-K280 IonicContact OE1-NZ 2.82Å; E277-K280 PolarHBondContact OE1-NZ 3.33Å; Y278-K280 VanDerWaalsContact C-N 3.26Å; K280-V393 HydrophobicContact CB-CG1 3.96Å; K280-V393 HydrophobicContact CD-CG1 4.24Å; K280-A394 WeakPolarHBondContact CB-O 3.47Å; K280-A394 VanDerWaalsContact O-CB 3.28Å; K280-A394 WeakPolarHBondContact O-CB 3.23Å; K280-C396 PolarHBondContact O-SG 2.74Å
281	G	86	Confident	71.1	Confident	2 Å²	2	53.4 Å²	53.4	2%	0.021	28%	0.282	C	S	.	.			trans	86.4	164.9	178.5	0	0	0	0	0	114.3	E277 Y278 N279 F324 A394	E277-G281 PolarHBondContact O-N 3Å; Y278-G281 PolarHBondContact O-N 3.48Å; N279-G281 VanDerWaalsContact C-N 3.31Å; G281-F324 CarbonylContact C-O 3.42Å; G281-F324 WeakPolarHBondContact CA-O 3.5Å; G281-A394 PolarHBondContact O-N 3.06Å
282	I	90.1	Very high	73.5	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.9	-174.2	-61.7	167.2	0	0	0	109.8	F156 L176 F324 L367 V391 M392	F156-I282 HydrophobicContact CE1-CD1 4.38Å; F156-I282 HydrophobicContact CE1-CG1 4.14Å; F156-I282 HydrophobicContact CE1-CG2 4.06Å; F156-I282 HydrophobicContact CZ-CD1 4.12Å; F156-I282 HydrophobicContact CZ-CG1 4.38Å; L176-I282 HydrophobicContact CD1-CD1 3.73Å; L176-I282 HydrophobicContact CD2-CD1 3.65Å; L176-I282 HydrophobicContact CG-CD1 4.38Å; I282-F324 HydrophobicContact CB-CB 4.25Å; I282-F324 HydrophobicContact CB-CD2 4.3Å; I282-F324 HydrophobicContact CG2-CD2 4.32Å; I282-F324 PolarHBondContact N-O 2.92Å; I282-F324 PolarHBondContact O-N 3.39Å; I282-L367 HydrophobicContact CD1-CD1 4.13Å; I282-V391 HydrophobicContact CG2-CG1 3.79Å; I282-M392 WeakPolarHBondContact CA-O 3.13Å
283	I	92.8	Very high	75.8	Confident	35 Å²	35	45 Å²	45	18%	0.179	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.3	174.7	-54.3	175.3	0	0	0	108.7	M322 F323 V391 M392 A394	I283-M322 WeakPolarHBondContact CA-O 3.39Å; I283-F323 HydrophobicContact CD1-CD1 4.23Å; I283-F323 HydrophobicContact CD1-CE1 4.13Å; I283-F323 HydrophobicContact CG1-CD1 3.98Å; I283-F323 HydrophobicContact CG1-CE1 4.28Å; I283-F323 HydrophobicContact CG2-CD1 4.23Å; I283-F323 HydrophobicContact CG2-CE1 4.05Å; I283-V391 CarbonylContact O-C 3.43Å; I283-V391 WeakPolarHBondContact O-CA 3.35Å; I283-M392 PolarHBondContact N-O 2.91Å; I283-M392 PolarHBondContact O-N 3.13Å; I283-A394 HydrophobicContact CD1-CB 3.88Å; I283-A394 HydrophobicContact CG1-CB 3.93Å
284	I	95.8	Very high	78.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	117.7	163.4	-54.4	178.5	0	0	0	106.6	I174 L296 E321 M322 F324 F374 V389 V391	I174-I284 HydrophobicContact CD1-CD1 4.18Å; I284-L296 HydrophobicContact CG2-CD1 4.34Å; I284-E321 CarbonylContact O-C 3.48Å; I284-E321 VanDerWaalsContact O-CA 3.29Å; I284-E321 WeakPolarHBondContact O-CA 3.44Å; I284-M322 HydrophobicContact CB-CB 4.22Å; I284-M322 PolarHBondContact N-O 3.35Å; I284-M322 PolarHBondContact O-N 3.26Å; I284-F324 HydrophobicContact CD1-CE2 3.81Å; I284-F324 HydrophobicContact CD1-CZ 4.44Å; I284-F324 HydrophobicContact CG1-CE2 3.99Å; I284-F374 HydrophobicContact CD1-CD1 4.07Å; I284-F374 HydrophobicContact CD1-CE1 4.24Å; I284-F374 HydrophobicContact CD1-CG 4.22Å; I284-F374 HydrophobicContact CG2-CD2 4.24Å; I284-F374 HydrophobicContact CG2-CE2 3.74Å; I284-F374 HydrophobicContact CG2-CZ 3.92Å; I284-V389 HydrophobicContact CG2-CG2 4.28Å; I284-V391 HydrophobicContact CG1-CG1 4.43Å; I284-V391 HydrophobicContact CG1-CG2 4.07Å; I284-V391 HydrophobicContact CG2-CG2 4.45Å
285	S	96.8	Very high	80.5	Confident	26 Å²	26	41.4 Å²	41.4	18%	0.182	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129	179.7	176.9	0	0	0	0	109.7	E321 V389 R390	S285-E321 PolarHBondContact OG-OE1 2.78Å; S285-V389 CarbonylContact O-C 3.48Å; S285-V389 WeakPolarHBondContact O-CA 3.32Å; S285-R390 PolarHBondContact N-O 3.1Å; S285-R390 PolarHBondContact O-N 2.87Å
286	C	97.4	Very high	83	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	135.2	173.1	-178.1	0	0	0	0	109.9	F294 L296 S319 A320 Y387 K388 V389	C286-F294 HydrophobicContact CB-CE2 3.76Å; C286-F294 HydrophobicContact CB-CZ 4.28Å; C286-F294 WeakPolarHBondContact O-CZ 3.14Å; C286-F294 WeakPolarHBondContact SG-CE2 3.23Å; C286-L296 HydrophobicContact CB-CD1 3.95Å; C286-L296 HydrophobicContact CB-CD2 3.82Å; C286-L296 HydrophobicContact CB-CG 4.03Å; C286-S319 CarbonylContact O-C 3.58Å; C286-S319 WeakPolarHBondContact O-CA 3.22Å; C286-S319 WeakPolarHBondContact O-CB 3.24Å; C286-A320 PolarHBondContact N-O 3.07Å; C286-A320 PolarHBondContact O-N 3.01Å; C286-Y387 VanDerWaalsContact SG-CD2 3.52Å; C286-K388 CarbonylContact C-O 3.58Å; C286-K388 VanDerWaalsContact CA-O 3.3Å; C286-K388 WeakPolarHBondContact CA-O 3.3Å; C286-V389 HydrophobicContact CB-CB 4.36Å; C286-V389 HydrophobicContact CB-CG2 4.19Å
287	R	96.6	Very high	85.2	Confident	125 Å²	125	35.3 Å²	35.3	47%	0.472	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	134.1	-174.7	-176	173	-178.7	180	-0	111.7	F317 T318 Y387 K388	R287-F317 HydrophobicContact CG-CB 4.15Å; R287-F317 HydrophobicContact CG-CD2 3.7Å; R287-F317 HydrophobicContact CG-CE2 4.41Å; R287-F317 HydrophobicContact CG-CG 4.18Å; R287-T318 CarbonylContact C-O 3.54Å; R287-T318 WeakPolarHBondContact CA-O 3.43Å; R287-Y387 CarbonylContact O-C 3.58Å; R287-Y387 VanDerWaalsContact O-CA 3.27Å; R287-Y387 WeakPolarHBondContact O-CA 3.5Å; R287-K388 PolarHBondContact N-O 3.46Å; R287-K388 PolarHBondContact O-N 3.38Å
288	S	94.3	Very high	87.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	124.7	173.4	178.2	0	0	0	0	111	S290 F317 T318 K386	S288-S290 VanDerWaalsContact C-N 3.31Å; S288-S290 PolarHBondContact OG-N 3.16Å; S288-S290 PolarHBondContact OG-OG 3.45Å; S288-F317 CarbonylContact O-C 3.54Å; S288-F317 VanDerWaalsContact O-CA 3.26Å; S288-F317 WeakPolarHBondContact O-CA 3.5Å; S288-F317 VanDerWaalsContact O-CB 3.26Å; S288-F317 WeakPolarHBondContact O-CB 3.47Å; S288-T318 WeakPolarHBondContact CB-OG1 3.37Å; S288-T318 PolarHBondContact N-O 2.96Å; S288-T318 PolarHBondContact O-N 3.46Å; S288-K386 WeakPolarHBondContact CA-O 3.29Å; S288-K386 VanDerWaalsContact CB-O 3.23Å; S288-K386 WeakPolarHBondContact CB-O 3.35Å; S288-K386 PolarHBondContact OG-O 2.89Å
289	S	92.1	Very high	89.4	Confident	102 Å²	102	31.8 Å²	31.8	71%	0.713	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-16.9	174	53.3	0	0	0	0	112.8	M291	S289-M291 PolarHBondContact O-N 3.42Å
290	S	86.6	Confident	90.9	Very high	56 Å²	56	28.4 Å²	28.4	39%	0.392	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	8.3	176.5	51.8	0	0	0	0	113.6	S288 S292	S288-S290 VanDerWaalsContact C-N 3.31Å; S288-S290 PolarHBondContact OG-N 3.16Å; S288-S290 PolarHBondContact OG-OG 3.45Å; S290-S292 PolarHBondContact O-N 3.46Å; S290-S292 VanDerWaalsContact O-N 3.16Å; S290-S292 PolarHBondContact OG-OG 2.81Å
291	M	84.3	Confident	91.8	Very high	68 Å²	68	34.5 Å²	34.5	34%	0.335	17%	0.171	S	C	.	.			trans	58.9	26.2	178.5	-61.4	-79.6	-86.8	0	0	113.5	S289 K313 H314 R316 F317 T318	S289-M291 PolarHBondContact O-N 3.42Å; M291-K313 HydrophobicContact CE-CD 4.15Å; M291-K313 HydrophobicContact CE-CG 3.72Å; M291-H314 VanDerWaalsContact CE-O 3.23Å; M291-H314 WeakPolarHBondContact CE-O 3.34Å; M291-R316 VanDerWaalsContact SD-C 3.52Å; M291-F317 WeakPolarHBondContact SD-CA 3.44Å; M291-F317 PolarHBondContact SD-N 2.98Å; M291-T318 HydrophobicContact CB-CG2 4.46Å; M291-T318 HydrophobicContact SD-CG2 4.47Å
292	S	83.4	Confident	91.9	Very high	5 Å²	5	39.6 Å²	39.6	4%	0.035	20%	0.199	C	C	.	.			trans	-75.2	145.6	-177.6	-58.1	0	0	0	0	111.3	S290 F294 T318 N380	S290-S292 PolarHBondContact O-N 3.46Å; S290-S292 VanDerWaalsContact O-N 3.16Å; S290-S292 PolarHBondContact OG-OG 2.81Å; S292-F294 WeakPolarHBondContact O-CD1 3.13Å; S292-T318 PolarHBondContact N-OG1 2.92Å; S292-T318 WeakPolarHBondContact O-CB 3.44Å; S292-T318 PolarHBondContact O-OG1 3Å; S292-N380 WeakPolarHBondContact CB-ND2 3.27Å
293	K	84.6	Confident	91.8	Very high	60 Å²	60	39.5 Å²	39.5	26%	0.261	20%	0.199	S	C	.	.			trans	-86.6	128	174.6	-168.3	-172.7	-178.1	-152.8	0	110.2	E310 S311 D379 N380 I385	K293-E310 IonicContact NZ-OE2 2.81Å; K293-S311 WeakPolarHBondContact CA-OG 3.4Å; K293-D379 WeakPolarHBondContact CD-OD2 3.49Å; K293-D379 VanDerWaalsContact CE-OD2 3.23Å; K293-D379 WeakPolarHBondContact CE-OD2 3.47Å; K293-D379 HydrophobicContact CG-CB 4.46Å; K293-D379 IonicContact NZ-OD2 3.77Å; K293-D379 PolarHBondContact NZ-OD2 3.48Å; K293-D379 PolarHBondContact O-N 3.4Å; K293-N380 PolarHBondContact N-OD1 3.15Å; K293-N380 PolarHBondContact O-OD1 3.01Å; K293-I385 WeakPolarHBondContact O-CD1 3.21Å
294	F	90.5	Very high	91.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.			trans	-143.8	171.5	178.8	59.1	-89.4	0	0	0	111.3	C286 S292 S311 A320 V376 Y377 I385	C286-F294 HydrophobicContact CB-CE2 3.76Å; C286-F294 HydrophobicContact CB-CZ 4.28Å; C286-F294 WeakPolarHBondContact O-CZ 3.14Å; C286-F294 WeakPolarHBondContact SG-CE2 3.23Å; S292-F294 WeakPolarHBondContact O-CD1 3.13Å; F294-S311 PolarHBondContact N-OG 2.83Å; F294-S311 WeakPolarHBondContact O-CB 3.14Å; F294-S311 PolarHBondContact O-N 3.25Å; F294-S311 PolarHBondContact O-OG 2.61Å; F294-A320 HydrophobicContact CD2-CB 4.36Å; F294-A320 HydrophobicContact CE2-CB 3.65Å; F294-A320 HydrophobicContact CZ-CB 4.32Å; F294-V376 HydrophobicContact CB-CG1 4.36Å; F294-V376 HydrophobicContact CD2-CG1 4.17Å; F294-V376 HydrophobicContact CG-CG1 4.47Å; F294-Y377 VanDerWaalsContact CA-O 3.31Å; F294-Y377 WeakPolarHBondContact CA-O 3.49Å; F294-Y377 WeakPolarHBondContact CB-O 3.43Å; F294-I385 HydrophobicContact CB-CD1 3.65Å; F294-I385 HydrophobicContact CB-CG2 4.47Å; F294-I385 HydrophobicContact CD1-CG2 4.3Å
295	K	92.9	Very high	91.4	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.017	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	138.1	172.8	-56.1	-174.7	-170.5	-159.7	0	110.1	T126 I128 V297 I308 R309 E310 Y377 D379	T126-K295 PolarHBondContact O-NZ 3.46Å; T126-K295 VanDerWaalsContact OG1-CE 3.29Å; T126-K295 WeakPolarHBondContact OG1-CE 3.45Å; T126-K295 PolarHBondContact OG1-NZ 3.42Å; I128-K295 HydrophobicContact CD1-CD 4.19Å; K295-V297 HydrophobicContact CB-CG2 4.3Å; K295-I308 HydrophobicContact CB-CG2 4.19Å; K295-I308 HydrophobicContact CD-CG2 3.99Å; K295-I308 HydrophobicContact CG-CG2 4.44Å; K295-R309 CarbonylContact C-O 3.55Å; K295-R309 VanDerWaalsContact CA-O 3.3Å; K295-R309 WeakPolarHBondContact CA-O 3.46Å; K295-E310 HydrophobicContact CD-CG 4.17Å; K295-E310 VanDerWaalsContact CE-OE1 3.31Å; K295-E310 WeakPolarHBondContact CE-OE1 2.95Å; K295-E310 HydrophobicContact CG-CG 4.17Å; K295-E310 IonicContact NZ-OE1 3.08Å; K295-E310 PolarHBondContact NZ-OE1 3.3Å; K295-Y377 PolarHBondContact N-O 3.37Å; K295-Y377 PolarHBondContact O-N 2.8Å; K295-D379 VanDerWaalsContact CE-CG 3.42Å; K295-D379 WeakPolarHBondContact CE-OD2 3.22Å; K295-D379 HydrophobicContact CG-CB 4.2Å; K295-D379 IonicContact NZ-OD2 3.27Å
296	L	95.6	Very high	91.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	130.7	159	-74.4	173.3	0	0	0	108.1	I284 C286 I308 R309 A320 M322 F374 C375 V376	I284-L296 HydrophobicContact CG2-CD1 4.34Å; C286-L296 HydrophobicContact CB-CD1 3.95Å; C286-L296 HydrophobicContact CB-CD2 3.82Å; C286-L296 HydrophobicContact CB-CG 4.03Å; L296-I308 CarbonylContact O-C 3.6Å; L296-I308 WeakPolarHBondContact O-CA 3.32Å; L296-R309 HydrophobicContact CB-CB 4.27Å; L296-R309 PolarHBondContact N-O 3.15Å; L296-R309 PolarHBondContact O-N 2.89Å; L296-A320 HydrophobicContact CD1-CB 3.96Å; L296-A320 VanDerWaalsContact CD1-O 3.3Å; L296-A320 WeakPolarHBondContact CD1-O 3.31Å; L296-A320 HydrophobicContact CG-CB 4.13Å; L296-M322 HydrophobicContact CB-CE 3.56Å; L296-M322 HydrophobicContact CB-CG 4.32Å; L296-M322 HydrophobicContact CB-SD 4.11Å; L296-M322 HydrophobicContact CD1-CG 4.31Å; L296-M322 WeakPolarHBondContact O-CE 3.34Å; L296-F374 HydrophobicContact CD2-CD2 4.19Å; L296-F374 HydrophobicContact CD2-CE2 4.23Å; L296-C375 WeakPolarHBondContact CA-O 3.34Å; L296-V376 HydrophobicContact CD2-CG2 3.76Å
297	V	95.8	Very high	90.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.9	179.3	-171.7	0	0	0	0	108.7	I128 K295 F299 V305 L307 I308 F374 C375	I128-V297 HydrophobicContact CD1-CG2 3.67Å; I128-V297 HydrophobicContact CG1-CG2 4.07Å; K295-V297 HydrophobicContact CB-CG2 4.3Å; V297-F299 HydrophobicContact CB-CE2 4.24Å; V297-F299 HydrophobicContact CB-CZ 4.1Å; V297-F299 HydrophobicContact CG1-CE1 3.86Å; V297-F299 HydrophobicContact CG1-CE2 4.05Å; V297-F299 HydrophobicContact CG1-CZ 3.61Å; V297-V305 HydrophobicContact CG1-CB 4.46Å; V297-V305 HydrophobicContact CG1-CG1 3.91Å; V297-V305 HydrophobicContact CG1-CG2 3.91Å; V297-L307 CarbonylContact C-O 3.47Å; V297-L307 WeakPolarHBondContact CA-O 3.37Å; V297-I308 HydrophobicContact CG1-CG1 4.29Å; V297-I308 HydrophobicContact CG2-CG1 4.43Å; V297-F374 CarbonylContact O-C 3.51Å; V297-F374 WeakPolarHBondContact O-CA 3.31Å; V297-F374 VanDerWaalsContact O-CB 3.29Å; V297-F374 WeakPolarHBondContact O-CB 3.3Å; V297-C375 PolarHBondContact N-O 2.93Å; V297-C375 PolarHBondContact O-N 3.28Å
298	L	95.7	Very high	90.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	135.6	173.2	-178	73.4	0	0	0	108.6	R306 L307 M322 F324 L367 F374	L298-R306 HydrophobicContact CD2-CB 4.38Å; L298-R306 HydrophobicContact CD2-CG 4.36Å; L298-R306 HydrophobicContact CG-CB 4.46Å; L298-R306 PolarHBondContact O-N 3.28Å; L298-L307 HydrophobicContact CB-CB 3.92Å; L298-L307 HydrophobicContact CD2-CB 4.21Å; L298-L307 PolarHBondContact N-O 3.06Å; L298-L307 PolarHBondContact O-N 3.33Å; L298-M322 HydrophobicContact CB-CE 3.96Å; L298-M322 HydrophobicContact CB-SD 4.06Å; L298-F324 HydrophobicContact CD1-CZ 4.48Å; L298-F324 HydrophobicContact CD2-CE1 3.72Å; L298-F324 HydrophobicContact CD2-CZ 3.79Å; L298-L367 HydrophobicContact CD2-CD2 4.22Å; L298-F374 HydrophobicContact CD1-CB 4.12Å
299	F	94.8	Very high	90.4	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.009	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	150.2	176.7	-56.3	-86	0	0	0	111	L133 A136 F171 V297 G303 N304 V305 L373 C375	L133-F299 HydrophobicContact CD2-CE1 4.2Å; A136-F299 HydrophobicContact CB-CD1 3.61Å; A136-F299 HydrophobicContact CB-CD2 4.3Å; A136-F299 HydrophobicContact CB-CE1 3.38Å; A136-F299 HydrophobicContact CB-CE2 4.11Å; A136-F299 HydrophobicContact CB-CG 4.07Å; A136-F299 HydrophobicContact CB-CZ 3.66Å; F171-F299 HydrophobicContact CD1-CE2 4.27Å; F171-F299 AromaticContact CE1-CE2 3.86Å; F171-F299 HydrophobicContact CE1-CE2 3.86Å; F171-F299 HydrophobicContact CE1-CZ 4.05Å; V297-F299 HydrophobicContact CB-CE2 4.24Å; V297-F299 HydrophobicContact CB-CZ 4.1Å; V297-F299 HydrophobicContact CG1-CE1 3.86Å; V297-F299 HydrophobicContact CG1-CE2 4.05Å; V297-F299 HydrophobicContact CG1-CZ 3.61Å; F299-G303 WeakPolarHBondContact CD1-O 3.2Å; F299-N304 CarbonylContact C-O 3.52Å; F299-N304 VanDerWaalsContact CA-O 3.22Å; F299-N304 WeakPolarHBondContact CA-O 3.35Å; F299-V305 HydrophobicContact CD1-CG2 4.36Å; F299-V305 HydrophobicContact CE1-CG2 4.04Å; F299-L373 HydrophobicContact CB-CB 4.45Å; F299-L373 HydrophobicContact CB-CD2 4.46Å; F299-L373 HydrophobicContact CD2-CB 4.5Å; F299-L373 HydrophobicContact CD2-CD2 4.07Å; F299-L373 HydrophobicContact CD2-CG 4.02Å; F299-L373 HydrophobicContact CG-CD2 4.4Å; F299-L373 PolarHBondContact N-O 2.87Å; F299-C375 HydrophobicContact CE2-CB 4.09Å
300	D	91.6	Very high	90.2	Very high	48 Å²	48	46.9 Å²	46.9	26%	0.257	23%	0.227	S	C	.	.			trans	-83.7	-173.4	169	68.4	18	0	0	0	111.9	D302 G303 N304 R306	D300-D302 PolarHBondContact O-N 3.28Å; D300-D302 WeakPolarHBondContact OD1-CA 3.46Å; D300-D302 PolarHBondContact OD1-N 3.37Å; D300-G303 PolarHBondContact O-N 3.04Å; D300-G303 PolarHBondContact OD1-N 2.69Å; D300-G303 VanDerWaalsContact OD1-N 3.11Å; D300-N304 PolarHBondContact N-O 3.05Å; D300-N304 PolarHBondContact OD1-N 2.91Å; D300-N304 WeakPolarHBondContact OD2-CB 3.37Å; D300-R306 HydrophobicContact CB-CB 4.28Å
301	R	89.9	Confident	90.4	Very high	185 Å²	185	45 Å²	45	70%	0.698	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-9.8	-178.5	-67	-177.2	177.1	177	-1.8	114.1	V140	V140-R301 WeakPolarHBondContact CG1-O 3.3Å
302	D	88.3	Confident	90.5	Very high	110 Å²	110	44 Å²	44	59%	0.588	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.2	3.8	178.1	-59.5	-44.1	0	0	0	111.3	D300 N304	D300-D302 PolarHBondContact O-N 3.28Å; D300-D302 WeakPolarHBondContact OD1-CA 3.46Å; D300-D302 PolarHBondContact OD1-N 3.37Å; D302-N304 VanDerWaalsContact C-N 3.31Å; D302-N304 WeakPolarHBondContact CB-ND2 3.17Å
303	G	87.5	Confident	90.6	Very high	4 Å²	4	51.2 Å²	51.2	4%	0.041	25%	0.247	C	C	.	.	S	Bend	trans	79.6	8.1	-177.5	0	0	0	0	0	114.3	F299 D300	F299-G303 WeakPolarHBondContact CD1-O 3.2Å; D300-G303 PolarHBondContact O-N 3.04Å; D300-G303 PolarHBondContact OD1-N 2.69Å; D300-G303 VanDerWaalsContact OD1-N 3.11Å
304	N	89.7	Confident	90.8	Very high	91 Å²	91	52.2 Å²	52.2	49%	0.487	25%	0.252	S	S	.	.			trans	-81.2	154.2	176.4	-54	-62.1	0	0	0	110.8	F299 D300 D302 R306	F299-N304 CarbonylContact C-O 3.52Å; F299-N304 VanDerWaalsContact CA-O 3.22Å; F299-N304 WeakPolarHBondContact CA-O 3.35Å; D300-N304 PolarHBondContact N-O 3.05Å; D300-N304 PolarHBondContact OD1-N 2.91Å; D300-N304 WeakPolarHBondContact OD2-CB 3.37Å; D302-N304 VanDerWaalsContact C-N 3.31Å; D302-N304 WeakPolarHBondContact CB-ND2 3.17Å; N304-R306 PolarHBondContact O-N 3.29Å
305	V	91.4	Very high	90.6	Very high	56 Å²	56	61.8 Å²	61.8	34%	0.339	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	118.7	176	176.2	0	0	0	0	110	L133 V297 F299 I308	L133-V305 HydrophobicContact CD2-CG2 3.48Å; L133-V305 VanDerWaalsContact CD2-CG2 3.48Å; V297-V305 HydrophobicContact CG1-CB 4.46Å; V297-V305 HydrophobicContact CG1-CG1 3.91Å; V297-V305 HydrophobicContact CG1-CG2 3.91Å; F299-V305 HydrophobicContact CD1-CG2 4.36Å; F299-V305 HydrophobicContact CE1-CG2 4.04Å; V305-I308 HydrophobicContact CG1-CD1 3.82Å; V305-I308 HydrophobicContact CG1-CG1 3.54Å
306	R	90.6	Very high	90.5	Very high	100 Å²	100	71 Å²	71	38%	0.377	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-39.9	177.4	-172.5	175.5	-177.8	-175.2	2.4	112.8	L298 D300 N304 I365	L298-R306 HydrophobicContact CD2-CB 4.38Å; L298-R306 HydrophobicContact CD2-CG 4.36Å; L298-R306 HydrophobicContact CG-CB 4.46Å; L298-R306 PolarHBondContact O-N 3.28Å; D300-R306 HydrophobicContact CB-CB 4.28Å; N304-R306 PolarHBondContact O-N 3.29Å; R306-I365 HydrophobicContact CG-CD1 4.47Å
307	L	91.1	Very high	90.4	Very high	25 Å²	25	73 Å²	73	13%	0.131	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	137.7	-177.4	-173	66.5	0	0	0	110.5	V297 L298 M322 F324 I365	V297-L307 CarbonylContact C-O 3.47Å; V297-L307 WeakPolarHBondContact CA-O 3.37Å; L298-L307 HydrophobicContact CB-CB 3.92Å; L298-L307 HydrophobicContact CD2-CB 4.21Å; L298-L307 PolarHBondContact N-O 3.06Å; L298-L307 PolarHBondContact O-N 3.33Å; L307-M322 HydrophobicContact CB-CE 4.31Å; L307-M322 HydrophobicContact CD2-CB 4.34Å; L307-M322 HydrophobicContact CD2-CE 4.23Å; L307-M322 HydrophobicContact CD2-CG 3.98Å; L307-M322 HydrophobicContact CD2-SD 4.24Å; L307-M322 HydrophobicContact CG-CE 4.19Å; L307-M322 WeakPolarHBondContact O-CE 3.31Å; L307-F324 HydrophobicContact CD2-CE1 4.21Å; L307-F324 HydrophobicContact CD2-CZ 4.36Å; L307-I365 HydrophobicContact CD1-CD1 4.36Å
308	I	90.9	Very high	90.3	Very high	64 Å²	64	73.3 Å²	73.3	33%	0.328	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	137.8	170	-60.7	178.3	0	0	0	109.1	I128 K295 L296 V297 V305	I128-I308 HydrophobicContact CG1-CD1 4.26Å; K295-I308 HydrophobicContact CB-CG2 4.19Å; K295-I308 HydrophobicContact CD-CG2 3.99Å; K295-I308 HydrophobicContact CG-CG2 4.44Å; L296-I308 CarbonylContact O-C 3.6Å; L296-I308 WeakPolarHBondContact O-CA 3.32Å; V297-I308 HydrophobicContact CG1-CG1 4.29Å; V297-I308 HydrophobicContact CG2-CG1 4.43Å; V305-I308 HydrophobicContact CG1-CD1 3.82Å; V305-I308 HydrophobicContact CG1-CG1 3.54Å
309	R	90.9	Very high	90.3	Very high	32 Å²	32	73.5 Å²	73.5	12%	0.121	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	116.3	168.9	-71.1	-74.5	-176.6	-96.7	6.9	109.4	K295 L296 A320 E321 M322 D362	K295-R309 CarbonylContact C-O 3.55Å; K295-R309 VanDerWaalsContact CA-O 3.3Å; K295-R309 WeakPolarHBondContact CA-O 3.46Å; L296-R309 HydrophobicContact CB-CB 4.27Å; L296-R309 PolarHBondContact N-O 3.15Å; L296-R309 PolarHBondContact O-N 2.89Å; R309-A320 HydrophobicContact CB-CB 4.39Å; R309-E321 WeakPolarHBondContact CD-O 3.49Å; R309-E321 VanDerWaalsContact CG-O 3.28Å; R309-E321 WeakPolarHBondContact CG-O 3.49Å; R309-M322 HydrophobicContact CB-CE 4.44Å; R309-M322 HydrophobicContact CB-CG 4.25Å; R309-M322 HydrophobicContact CG-CE 4.32Å; R309-M322 HydrophobicContact CG-CG 3.66Å; R309-D362 IonicContact CZ-OD1 3.11Å; R309-D362 IonicContact CZ-OD2 3.69Å; R309-D362 VanDerWaalsContact NH2-CG 3.25Å; R309-D362 IonicContact NH2-OD1 2.87Å; R309-D362 PolarHBondContact NH2-OD1 2.77Å; R309-D362 IonicContact NH2-OD2 2.61Å; R309-D362 PolarHBondContact NH2-OD2 2.89Å
310	E	88.4	Confident	90.3	Very high	74 Å²	74	73.5 Å²	73.5	35%	0.346	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	147.3	175.1	-53.5	-157.9	163.5	0	0	110.5	K293 K295 A312	K293-E310 IonicContact NZ-OE2 2.81Å; K295-E310 HydrophobicContact CD-CG 4.17Å; K295-E310 VanDerWaalsContact CE-OE1 3.31Å; K295-E310 WeakPolarHBondContact CE-OE1 2.95Å; K295-E310 HydrophobicContact CG-CG 4.17Å; K295-E310 IonicContact NZ-OE1 3.08Å; K295-E310 PolarHBondContact NZ-OE1 3.3Å; E310-A312 PolarHBondContact O-N 2.87Å
311	S	91.2	Very high	90.4	Very high	17 Å²	17	73.8 Å²	73.8	12%	0.119	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-69.8	127.8	176.8	65.3	0	0	0	0	111.7	K293 F294 S319	K293-S311 WeakPolarHBondContact CA-OG 3.4Å; F294-S311 PolarHBondContact N-OG 2.83Å; F294-S311 WeakPolarHBondContact O-CB 3.14Å; F294-S311 PolarHBondContact O-N 3.25Å; F294-S311 PolarHBondContact O-OG 2.61Å; S311-S319 CarbonylContact C-O 3.56Å; S311-S319 WeakPolarHBondContact CA-O 3.5Å
312	A	86.6	Confident	90.7	Very high	47 Å²	47	65 Å²	65	39%	0.388	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	151.8	169	0	0	0	0	0	111	E310 T318 S319	E310-A312 PolarHBondContact O-N 2.87Å; A312-T318 CarbonylContact O-C 3.56Å; A312-T318 WeakPolarHBondContact O-CA 3.19Å; A312-T318 WeakPolarHBondContact O-CB 3.48Å; A312-S319 PolarHBondContact N-O 3.45Å; A312-S319 PolarHBondContact O-N 3.27Å
313	K	85.6	Confident	90.9	Very high	157 Å²	157	62.9 Å²	62.9	68%	0.683	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	123.1	178	-172.3	-178.6	-178	-178.2	0	110.2	M291 T318	M291-K313 HydrophobicContact CE-CD 4.15Å; M291-K313 HydrophobicContact CE-CG 3.72Å; K313-T318 HydrophobicContact CB-CG2 4.29Å; K313-T318 HydrophobicContact CG-CG2 4.39Å
314	H	87.4	Confident	91.2	Very high	80 Å²	80	63 Å²	63	37%	0.37	29%	0.293	S	S	.	.			trans	-109.4	177.7	170.9	-57.3	-78.7	0	0	0	110.6	M291 R316 F317 S319	M291-H314 VanDerWaalsContact CE-O 3.23Å; M291-H314 WeakPolarHBondContact CE-O 3.34Å; H314-R316 PolarHBondContact O-N 3.27Å; H314-R316 VanDerWaalsContact O-N 3.1Å; H314-F317 CarbonylContact C-O 3.46Å; H314-F317 WeakPolarHBondContact CA-O 3.31Å; H314-F317 HydrophobicContact CB-CD1 4.11Å; H314-F317 HydrophobicContact CB-CD2 4.19Å; H314-F317 HydrophobicContact CB-CE1 3.85Å; H314-F317 HydrophobicContact CB-CE2 3.95Å; H314-F317 HydrophobicContact CB-CG 4.3Å; H314-F317 HydrophobicContact CB-CZ 3.79Å; H314-F317 WeakPolarHBondContact CB-O 3.21Å; H314-F317 AromaticContact CD2-CD2 3.74Å; H314-F317 AromaticContact CD2-CE2 3.28Å; H314-F317 WeakPolarHBondContact CD2-CE2 2.91Å; H314-F317 AromaticContact CD2-CZ 3.84Å; H314-F317 AromaticContact CG-CE2 3.72Å; H314-F317 AromaticContact CG-CZ 3.79Å; H314-F317 PolarHBondContact N-O 3.5Å; H314-S319 PolarHBondContact CD2-OG 3.29Å; H314-S319 PolarHBondContact NE2-OG 2.8Å; H314-S319 VanDerWaalsContact NE2-OG 3.1Å
315	K	87	Confident	91.2	Very high	201 Å²	201	59.4 Å²	59.4	87%	0.874	27%	0.273	S	S	*	.	S	Bend	trans	-54.1	-34.6	-175.5	-171.7	176.8	-179.3	175.2	0	114.6
316	R	91	Very high	90.8	Very high	198 Å²	198	59.6 Å²	59.6	75%	0.747	28%	0.276	S	S	*	.	S	Bend	trans	-135.9	2.3	-171.8	-63.9	-170.2	-70.3	179.7	-2.8	114.6	M291 H314	M291-R316 VanDerWaalsContact SD-C 3.52Å; H314-R316 PolarHBondContact O-N 3.27Å; H314-R316 VanDerWaalsContact O-N 3.1Å
317	F	93.6	Very high	90.6	Very high	43 Å²	43	56.4 Å²	56.4	19%	0.189	27%	0.265	C	S	.	.			trans	-160	162.8	-177.9	60.8	-83.1	0	0	0	109.9	R287 S288 M291 H314	R287-F317 HydrophobicContact CG-CB 4.15Å; R287-F317 HydrophobicContact CG-CD2 3.7Å; R287-F317 HydrophobicContact CG-CE2 4.41Å; R287-F317 HydrophobicContact CG-CG 4.18Å; S288-F317 CarbonylContact O-C 3.54Å; S288-F317 VanDerWaalsContact O-CA 3.26Å; S288-F317 WeakPolarHBondContact O-CA 3.5Å; S288-F317 VanDerWaalsContact O-CB 3.26Å; S288-F317 WeakPolarHBondContact O-CB 3.47Å; M291-F317 WeakPolarHBondContact SD-CA 3.44Å; M291-F317 PolarHBondContact SD-N 2.98Å; H314-F317 CarbonylContact C-O 3.46Å; H314-F317 WeakPolarHBondContact CA-O 3.31Å; H314-F317 HydrophobicContact CB-CD1 4.11Å; H314-F317 HydrophobicContact CB-CD2 4.19Å; H314-F317 HydrophobicContact CB-CE1 3.85Å; H314-F317 HydrophobicContact CB-CE2 3.95Å; H314-F317 HydrophobicContact CB-CG 4.3Å; H314-F317 HydrophobicContact CB-CZ 3.79Å; H314-F317 WeakPolarHBondContact CB-O 3.21Å; H314-F317 AromaticContact CD2-CD2 3.74Å; H314-F317 AromaticContact CD2-CE2 3.28Å; H314-F317 WeakPolarHBondContact CD2-CE2 2.91Å; H314-F317 AromaticContact CD2-CZ 3.84Å; H314-F317 AromaticContact CG-CE2 3.72Å; H314-F317 AromaticContact CG-CZ 3.79Å; H314-F317 PolarHBondContact N-O 3.5Å
318	T	92.6	Very high	90.6	Very high	6 Å²	6	59.5 Å²	59.5	4%	0.037	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	146.6	162.4	46.3	0	0	0	0	109.3	R287 S288 M291 S292 A312 K313	R287-T318 CarbonylContact C-O 3.54Å; R287-T318 WeakPolarHBondContact CA-O 3.43Å; S288-T318 WeakPolarHBondContact CB-OG1 3.37Å; S288-T318 PolarHBondContact N-O 2.96Å; S288-T318 PolarHBondContact O-N 3.46Å; M291-T318 HydrophobicContact CB-CG2 4.46Å; M291-T318 HydrophobicContact SD-CG2 4.47Å; S292-T318 PolarHBondContact N-OG1 2.92Å; S292-T318 WeakPolarHBondContact O-CB 3.44Å; S292-T318 PolarHBondContact O-OG1 3Å; A312-T318 CarbonylContact O-C 3.56Å; A312-T318 WeakPolarHBondContact O-CA 3.19Å; A312-T318 WeakPolarHBondContact O-CB 3.48Å; K313-T318 HydrophobicContact CB-CG2 4.29Å; K313-T318 HydrophobicContact CG-CG2 4.39Å
319	S	95.3	Very high	90.6	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	154.2	174.9	61.9	0	0	0	0	112.5	C286 S311 A312 H314 E321	C286-S319 CarbonylContact O-C 3.58Å; C286-S319 WeakPolarHBondContact O-CA 3.22Å; C286-S319 WeakPolarHBondContact O-CB 3.24Å; S311-S319 CarbonylContact C-O 3.56Å; S311-S319 WeakPolarHBondContact CA-O 3.5Å; A312-S319 PolarHBondContact N-O 3.45Å; A312-S319 PolarHBondContact O-N 3.27Å; H314-S319 PolarHBondContact CD2-OG 3.29Å; H314-S319 PolarHBondContact NE2-OG 2.8Å; H314-S319 VanDerWaalsContact NE2-OG 3.1Å; S319-E321 VanDerWaalsContact CB-OE1 3.31Å; S319-E321 WeakPolarHBondContact CB-OE1 3.29Å; S319-E321 PolarHBondContact OG-OE1 2.8Å
320	A	94.8	Very high	90.6	Very high	2 Å²	2	58 Å²	58	2%	0.017	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	141.3	168.6	0	0	0	0	0	108.8	C286 F294 L296 R309	C286-A320 PolarHBondContact N-O 3.07Å; C286-A320 PolarHBondContact O-N 3.01Å; F294-A320 HydrophobicContact CD2-CB 4.36Å; F294-A320 HydrophobicContact CE2-CB 3.65Å; F294-A320 HydrophobicContact CZ-CB 4.32Å; L296-A320 HydrophobicContact CD1-CB 3.96Å; L296-A320 VanDerWaalsContact CD1-O 3.3Å; L296-A320 WeakPolarHBondContact CD1-O 3.31Å; L296-A320 HydrophobicContact CG-CB 4.13Å; R309-A320 HydrophobicContact CB-CB 4.39Å
321	E	95.6	Very high	90.5	Very high	54 Å²	54	59.4 Å²	59.4	25%	0.252	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	135.3	-179.4	-69.9	74.9	-161.9	0	0	110.5	I284 S285 R309 S319 F323	I284-E321 CarbonylContact O-C 3.48Å; I284-E321 VanDerWaalsContact O-CA 3.29Å; I284-E321 WeakPolarHBondContact O-CA 3.44Å; S285-E321 PolarHBondContact OG-OE1 2.78Å; R309-E321 WeakPolarHBondContact CD-O 3.49Å; R309-E321 VanDerWaalsContact CG-O 3.28Å; R309-E321 WeakPolarHBondContact CG-O 3.49Å; S319-E321 VanDerWaalsContact CB-OE1 3.31Å; S319-E321 WeakPolarHBondContact CB-OE1 3.29Å; S319-E321 PolarHBondContact OG-OE1 2.8Å; E321-F323 HydrophobicContact CB-CD2 4.21Å; E321-F323 HydrophobicContact CB-CE1 4.3Å; E321-F323 HydrophobicContact CB-CE2 3.48Å; E321-F323 VanDerWaalsContact CB-CE2 3.48Å; E321-F323 HydrophobicContact CB-CZ 3.53Å; E321-F323 HydrophobicContact CG-CE2 4.4Å; E321-F323 HydrophobicContact CG-CZ 4.02Å
322	M	95.1	Very high	90.1	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	121.5	164.7	-67.2	174.8	164.8	0	0	108.8	I283 I284 L296 L298 L307 R309 F324	I283-M322 WeakPolarHBondContact CA-O 3.39Å; I284-M322 HydrophobicContact CB-CB 4.22Å; I284-M322 PolarHBondContact N-O 3.35Å; I284-M322 PolarHBondContact O-N 3.26Å; L296-M322 HydrophobicContact CB-CE 3.56Å; L296-M322 HydrophobicContact CB-CG 4.32Å; L296-M322 HydrophobicContact CB-SD 4.11Å; L296-M322 HydrophobicContact CD1-CG 4.31Å; L296-M322 WeakPolarHBondContact O-CE 3.34Å; L298-M322 HydrophobicContact CB-CE 3.96Å; L298-M322 HydrophobicContact CB-SD 4.06Å; L307-M322 HydrophobicContact CB-CE 4.31Å; L307-M322 HydrophobicContact CD2-CB 4.34Å; L307-M322 HydrophobicContact CD2-CE 4.23Å; L307-M322 HydrophobicContact CD2-CG 3.98Å; L307-M322 HydrophobicContact CD2-SD 4.24Å; L307-M322 HydrophobicContact CG-CE 4.19Å; L307-M322 WeakPolarHBondContact O-CE 3.31Å; R309-M322 HydrophobicContact CB-CE 4.44Å; R309-M322 HydrophobicContact CB-CG 4.25Å; R309-M322 HydrophobicContact CG-CE 4.32Å; R309-M322 HydrophobicContact CG-CG 3.66Å; M322-F324 HydrophobicContact CB-CE2 3.63Å; M322-F324 HydrophobicContact CB-CZ 3.79Å; M322-F324 HydrophobicContact CG-CZ 4.49Å; M322-F324 HydrophobicContact SD-CZ 4.19Å
323	F	93.3	Very high	89.3	Confident	66 Å²	66	63.2 Å²	63.2	29%	0.289	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.7	178.8	-63.3	-76.3	0	0	0	109.2	I283 E321 L325 L329	I283-F323 HydrophobicContact CD1-CD1 4.23Å; I283-F323 HydrophobicContact CD1-CE1 4.13Å; I283-F323 HydrophobicContact CG1-CD1 3.98Å; I283-F323 HydrophobicContact CG1-CE1 4.28Å; I283-F323 HydrophobicContact CG2-CD1 4.23Å; I283-F323 HydrophobicContact CG2-CE1 4.05Å; E321-F323 HydrophobicContact CB-CD2 4.21Å; E321-F323 HydrophobicContact CB-CE1 4.3Å; E321-F323 HydrophobicContact CB-CE2 3.48Å; E321-F323 VanDerWaalsContact CB-CE2 3.48Å; E321-F323 HydrophobicContact CB-CZ 3.53Å; E321-F323 HydrophobicContact CG-CE2 4.4Å; E321-F323 HydrophobicContact CG-CZ 4.02Å; F323-L325 HydrophobicContact CB-CD1 3.99Å; F323-L325 HydrophobicContact CB-CG 4.01Å; F323-L325 HydrophobicContact CD1-CD1 4.19Å; F323-L325 HydrophobicContact CG-CD1 4.38Å; F323-L329 HydrophobicContact CB-CD1 3.84Å; F323-L329 HydrophobicContact CD1-CD1 4.39Å; F323-L329 HydrophobicContact CD2-CD1 3.84Å; F323-L329 HydrophobicContact CG-CD1 3.77Å
324	F	92.3	Very high	88	Confident	7 Å²	7	63.9 Å²	63.9	3%	0.031	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	73.2	173.7	-53.4	-79.7	0	0	0	107.7	G281 I282 I284 L298 L307 M322 I365 L367	G281-F324 CarbonylContact C-O 3.42Å; G281-F324 WeakPolarHBondContact CA-O 3.5Å; I282-F324 HydrophobicContact CB-CB 4.25Å; I282-F324 HydrophobicContact CB-CD2 4.3Å; I282-F324 HydrophobicContact CG2-CD2 4.32Å; I282-F324 PolarHBondContact N-O 2.92Å; I282-F324 PolarHBondContact O-N 3.39Å; I284-F324 HydrophobicContact CD1-CE2 3.81Å; I284-F324 HydrophobicContact CD1-CZ 4.44Å; I284-F324 HydrophobicContact CG1-CE2 3.99Å; L298-F324 HydrophobicContact CD1-CZ 4.48Å; L298-F324 HydrophobicContact CD2-CE1 3.72Å; L298-F324 HydrophobicContact CD2-CZ 3.79Å; L307-F324 HydrophobicContact CD2-CE1 4.21Å; L307-F324 HydrophobicContact CD2-CZ 4.36Å; M322-F324 HydrophobicContact CB-CE2 3.63Å; M322-F324 HydrophobicContact CB-CZ 3.79Å; M322-F324 HydrophobicContact CG-CZ 4.49Å; M322-F324 HydrophobicContact SD-CZ 4.19Å; F324-I365 WeakPolarHBondContact CA-O 3.06Å; F324-I365 WeakPolarHBondContact CB-O 3.23Å; F324-I365 HydrophobicContact CD1-CB 4.29Å; F324-I365 WeakPolarHBondContact CD1-O 3.5Å; F324-L367 HydrophobicContact CB-CD1 4.34Å; F324-L367 HydrophobicContact CB-CG 4.15Å; F324-L367 HydrophobicContact CD1-CD1 4.07Å; F324-L367 HydrophobicContact CD1-CD2 3.81Å; F324-L367 HydrophobicContact CD1-CG 3.6Å; F324-L367 HydrophobicContact CD2-CD1 3.64Å; F324-L367 HydrophobicContact CD2-CG 4.11Å; F324-L367 HydrophobicContact CE1-CD1 4.27Å; F324-L367 HydrophobicContact CE1-CD2 3.69Å; F324-L367 HydrophobicContact CE1-CG 3.96Å; F324-L367 HydrophobicContact CE2-CD1 3.86Å; F324-L367 HydrophobicContact CE2-CG 4.42Å; F324-L367 HydrophobicContact CG-CD1 3.75Å; F324-L367 HydrophobicContact CG-CD2 4.34Å; F324-L367 HydrophobicContact CG-CG 3.68Å; F324-L367 HydrophobicContact CZ-CD1 4.17Å; F324-L367 HydrophobicContact CZ-CD2 4.13Å; F324-L367 HydrophobicContact CZ-CG 4.35Å
325	L	89.9	Confident	86.5	Confident	15 Å²	15	64.5 Å²	64.5	8%	0.079	30%	0.303	C	S	.	.			trans	-100.3	159.5	-169.5	-61.2	176.4	0	0	0	111.8	F323 F327 L329 C364 A394	F323-L325 HydrophobicContact CB-CD1 3.99Å; F323-L325 HydrophobicContact CB-CG 4.01Å; F323-L325 HydrophobicContact CD1-CD1 4.19Å; F323-L325 HydrophobicContact CG-CD1 4.38Å; L325-F327 HydrophobicContact CB-CE1 4.47Å; L325-F327 WeakPolarHBondContact CB-O 3.08Å; L325-F327 HydrophobicContact CD1-CE2 3.92Å; L325-F327 HydrophobicContact CD1-CZ 3.88Å; L325-F327 PolarHBondContact O-N 2.94Å; L325-L329 HydrophobicContact CD1-CD1 3.74Å; L325-L329 HydrophobicContact CD1-CD2 4.18Å; L325-L329 HydrophobicContact CD1-CG 4.02Å; L325-C364 HydrophobicContact CB-CB 4.4Å; L325-A394 HydrophobicContact CD2-CB 3.36Å
326	P	83.4	Confident	85	Confident	61 Å²	61	59 Å²	59	40%	0.396	28%	0.279	S	S	.	.	S	Bend	trans	-74.9	-1.5	174.3	33.1	-38.4	0	0	0	113.6	N279	N279-P326 WeakPolarHBondContact O-CB 3.47Å; N279-P326 WeakPolarHBondContact O-CG 3.29Å
327	F	87.7	Confident	83.2	Confident	33 Å²	33	51.7 Å²	51.7	15%	0.145	26%	0.258	C	S	.	.	S	Bend	trans	-135.4	156.9	176.7	57	-93.5	0	0	0	109.9	L325 L329 C364 C396 V401	L325-F327 HydrophobicContact CB-CE1 4.47Å; L325-F327 WeakPolarHBondContact CB-O 3.08Å; L325-F327 HydrophobicContact CD1-CE2 3.92Å; L325-F327 HydrophobicContact CD1-CZ 3.88Å; L325-F327 PolarHBondContact O-N 2.94Å; F327-L329 HydrophobicContact CD2-CD2 4.24Å; F327-L329 HydrophobicContact CE2-CD2 3.69Å; F327-C364 WeakPolarHBondContact O-CB 3.16Å; F327-C364 PolarHBondContact O-SG 3.09Å; F327-C364 VanDerWaalsContact O-SG 3.42Å; F327-C396 HydrophobicContact CE1-CB 4.34Å; F327-C396 VanDerWaalsContact CE1-SG 3.56Å; F327-V401 HydrophobicContact CE1-CG1 3.78Å; F327-V401 HydrophobicContact CE2-CG1 4.21Å; F327-V401 HydrophobicContact CZ-CG1 3.48Å; F327-V401 VanDerWaalsContact CZ-CG1 3.48Å; F327-V401 HydrophobicContact CZ-CG2 4.25Å
328	D	89.8	Confident	81.1	Confident	90 Å²	90	53.5 Å²	53.5	48%	0.481	27%	0.269	S	S	.	.			trans	-80.3	152.8	178	-63.8	-32.6	0	0	0	111.4	Q363 C364	D328-Q363 WeakPolarHBondContact OD1-CA 3.28Å; D328-Q363 WeakPolarHBondContact OD1-CG 3.27Å; D328-C364 PolarHBondContact OD1-N 2.78Å
329	L	91.1	Very high	79.3	Confident	24 Å²	24	59.7 Å²	59.7	13%	0.126	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	169.4	176.2	-69	176.5	0	0	0	109.9	F323 L325 F327 D362 I404	F323-L329 HydrophobicContact CB-CD1 3.84Å; F323-L329 HydrophobicContact CD1-CD1 4.39Å; F323-L329 HydrophobicContact CD2-CD1 3.84Å; F323-L329 HydrophobicContact CG-CD1 3.77Å; L325-L329 HydrophobicContact CD1-CD1 3.74Å; L325-L329 HydrophobicContact CD1-CD2 4.18Å; L325-L329 HydrophobicContact CD1-CG 4.02Å; F327-L329 HydrophobicContact CD2-CD2 4.24Å; F327-L329 HydrophobicContact CE2-CD2 3.69Å; L329-D362 PolarHBondContact N-O 2.96Å; L329-D362 WeakPolarHBondContact O-CA 3.31Å; L329-D362 WeakPolarHBondContact O-CB 3.25Å; L329-D362 PolarHBondContact O-N 3.04Å; L329-I404 HydrophobicContact CD2-CG2 4.18Å
330	M	91.8	Very high	77.4	Confident	41 Å²	41	60.2 Å²	60.2	20%	0.202	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.8	166.4	-59.4	-64.8	-73.3	0	0	110.1	F359 P361 E408	M330-F359 HydrophobicContact CB-CD2 3.98Å; M330-F359 HydrophobicContact CB-CE1 4.3Å; M330-F359 HydrophobicContact CB-CE2 3.24Å; M330-F359 HydrophobicContact CB-CZ 3.43Å; M330-F359 VanDerWaalsContact CB-CZ 3.43Å; M330-F359 HydrophobicContact CE-CD1 3.62Å; M330-F359 HydrophobicContact CE-CD2 4.5Å; M330-F359 HydrophobicContact CE-CE1 3.3Å; M330-F359 HydrophobicContact CE-CE2 4.28Å; M330-F359 HydrophobicContact CE-CG 4.23Å; M330-F359 HydrophobicContact CE-CZ 3.68Å; M330-F359 HydrophobicContact CG-CE1 4.12Å; M330-F359 HydrophobicContact CG-CE2 3.89Å; M330-F359 HydrophobicContact CG-CZ 3.49Å; M330-F359 VanDerWaalsContact CG-CZ 3.49Å; M330-F359 HydrophobicContact SD-CZ 4.45Å; M330-P361 HydrophobicContact CE-CG 4.28Å; M330-P361 HydrophobicContact SD-CB 4.27Å; M330-P361 HydrophobicContact SD-CG 4.24Å; M330-E408 HydrophobicContact CB-CB 4.42Å; M330-E408 HydrophobicContact CB-CG 3.95Å; M330-E408 HydrophobicContact CG-CB 3.84Å; M330-E408 HydrophobicContact CG-CG 3.91Å; M330-E408 PolarHBondContact N-OE1 2.9Å; M330-E408 PolarHBondContact N-OE2 3.16Å
331	R	86.1	Confident	75.4	Confident	102 Å²	102	62 Å²	62	39%	0.385	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	131.4	171.4	-171.5	-178.9	-58.9	168.4	15.8	109.1	T333 F359 E360 D362	R331-T333 HydrophobicContact CG-CG2 4.21Å; R331-F359 CarbonylContact O-C 3.53Å; R331-F359 VanDerWaalsContact O-CA 3.32Å; R331-F359 WeakPolarHBondContact O-CA 3.28Å; R331-E360 PolarHBondContact N-O 3.05Å; R331-E360 PolarHBondContact O-N 3.47Å; R331-D362 HydrophobicContact CB-CB 3.93Å; R331-D362 IonicContact CZ-OD1 2.64Å; R331-D362 IonicContact CZ-OD2 3.63Å; R331-D362 VanDerWaalsContact CZ-OD2 3.3Å; R331-D362 IonicContact NE-OD1 3.71Å; R331-D362 IonicContact NE-OD2 2.59Å; R331-D362 PolarHBondContact NE-OD2 2.9Å; R331-D362 IonicContact NH2-OD1 2.57Å; R331-D362 PolarHBondContact NH2-OD1 2.83Å; R331-D362 IonicContact NH2-OD2 3.14Å; R331-D362 PolarHBondContact NH2-OD2 2.59Å
332	V	82.6	Confident	73.4	Confident	95 Å²	95	66.7 Å²	66.7	58%	0.576	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	113.4	165.3	-177.6	0	0	0	0	107.2	F359	V332-F359 HydrophobicContact CG2-CD2 3.7Å; V332-F359 HydrophobicContact CG2-CE2 4.2Å
333	T	69.8	Low	71.4	Confident	50 Å²	50	68.4 Å²	68.4	31%	0.307	34%	0.335	S	S	.	.			trans	-91	122.1	166	52.1	0	0	0	0	108.6	R331 F335 G358	R331-T333 HydrophobicContact CG-CG2 4.21Å; T333-F335 PolarHBondContact O-N 3.4Å; T333-G358 PolarHBondContact N-O 2.87Å; T333-G358 WeakPolarHBondContact OG1-CA 2.96Å; T333-G358 PolarHBondContact OG1-O 2.8Å; T333-G358 VanDerWaalsContact OG1-O 3.09Å
334	E	57.5	Low	69.4	Low	170 Å²	170	68.4 Å²	68.4	79%	0.794	34%	0.34	S	S	*	.			trans	-70	5.3	176.2	-66.1	-175.7	168	0	0	112.7
335	F	56.3	Low	67.2	Low	94 Å²	94	72.1 Å²	72.1	41%	0.412	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-90.5	120.9	-177.6	-56.1	-66	0	0	0	109	P123 T333 S337	P123-F335 HydrophobicContact CB-CD1 3.98Å; P123-F335 HydrophobicContact CB-CE1 3.87Å; P123-F335 HydrophobicContact CB-CG 4.49Å; P123-F335 HydrophobicContact CB-CZ 4.3Å; P123-F335 HydrophobicContact CG-CB 4.48Å; P123-F335 HydrophobicContact CG-CD1 3.82Å; P123-F335 HydrophobicContact CG-CE1 4.24Å; P123-F335 HydrophobicContact CG-CG 4.07Å; T333-F335 PolarHBondContact O-N 3.4Å; F335-S337 PolarHBondContact O-N 2.69Å
336	F	55.2	Low	65.5	Low	84 Å²	84	73.8 Å²	73.8	37%	0.368	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-61.1	125.4	159.6	-68.4	-68.8	0	0	0	108.9	F340 I351 H354	F336-F340 HydrophobicContact CB-CB 3.86Å; F336-F340 HydrophobicContact CB-CD1 3.18Å; F336-F340 HydrophobicContact CB-CD2 4.36Å; F336-F340 HydrophobicContact CB-CE1 3.62Å; F336-F340 HydrophobicContact CB-CG 3.55Å; F336-F340 HydrophobicContact CB-CZ 4.36Å; F336-F340 HydrophobicContact CD1-CB 4.29Å; F336-F340 AromaticContact CD1-CD1 3.68Å; F336-F340 HydrophobicContact CD1-CD1 3.68Å; F336-F340 AromaticContact CD1-CD2 3.46Å; F336-F340 HydrophobicContact CD1-CD2 3.46Å; F336-F340 VanDerWaalsContact CD1-CD2 3.46Å; F336-F340 AromaticContact CD1-CE1 3.59Å; F336-F340 HydrophobicContact CD1-CE1 3.59Å; F336-F340 AromaticContact CD1-CE2 3.4Å; F336-F340 HydrophobicContact CD1-CE2 3.4Å; F336-F340 VanDerWaalsContact CD1-CE2 3.4Å; F336-F340 AromaticContact CD1-CG 3.54Å; F336-F340 HydrophobicContact CD1-CG 3.54Å; F336-F340 AromaticContact CD1-CZ 3.42Å; F336-F340 HydrophobicContact CD1-CZ 3.42Å; F336-F340 VanDerWaalsContact CD1-CZ 3.42Å; F336-F340 HydrophobicContact CD2-CD1 4.21Å; F336-F340 AromaticContact CD2-CE1 3.71Å; F336-F340 HydrophobicContact CD2-CE1 3.71Å; F336-F340 HydrophobicContact CD2-CZ 4.01Å; F336-F340 HydrophobicContact CE1-CD2 4.03Å; F336-F340 HydrophobicContact CE1-CE1 4.16Å; F336-F340 AromaticContact CE1-CE2 3.55Å; F336-F340 HydrophobicContact CE1-CE2 3.55Å; F336-F340 HydrophobicContact CE1-CG 4.5Å; F336-F340 AromaticContact CE1-CZ 3.56Å; F336-F340 HydrophobicContact CE1-CZ 3.56Å; F336-F340 HydrophobicContact CE2-CE1 4.27Å; F336-F340 HydrophobicContact CE2-CZ 4.13Å; F336-F340 HydrophobicContact CG-CB 4.48Å; F336-F340 AromaticContact CG-CD1 3.43Å; F336-F340 HydrophobicContact CG-CD1 3.43Å; F336-F340 VanDerWaalsContact CG-CD1 3.43Å; F336-F340 HydrophobicContact CG-CD2 4.12Å; F336-F340 AromaticContact CG-CE1 3.34Å; F336-F340 HydrophobicContact CG-CE1 3.34Å; F336-F340 HydrophobicContact CG-CE2 4.08Å; F336-F340 AromaticContact CG-CG 3.76Å; F336-F340 HydrophobicContact CG-CG 3.76Å; F336-F340 AromaticContact CG-CZ 3.66Å; F336-F340 HydrophobicContact CG-CZ 3.66Å; F336-F340 HydrophobicContact CZ-CE1 4.47Å; F336-F340 HydrophobicContact CZ-CE2 4.32Å; F336-F340 AromaticContact CZ-CZ 3.93Å; F336-F340 HydrophobicContact CZ-CZ 3.93Å; F336-I351 HydrophobicContact CE1-CD1 4.32Å; F336-I351 HydrophobicContact CE1-CG1 4.15Å; F336-I351 HydrophobicContact CZ-CD1 3.93Å; F336-I351 HydrophobicContact CZ-CG1 4.2Å; F336-H354 HydrophobicContact CD1-CB 4.37Å; F336-H354 HydrophobicContact CE1-CB 4.41Å
337	S	52.7	Low	64.3	Low	46 Å²	46	79.6 Å²	79.6	32%	0.322	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-58.3	155.7	176.8	66.6	0	0	0	0	110.5	F335 K339 F340 L341	F335-S337 PolarHBondContact O-N 2.69Å; S337-K339 PolarHBondContact O-N 3.5Å; S337-K339 WeakPolarHBondContact OG-CB 3.42Å; S337-K339 PolarHBondContact OG-N 3.39Å; S337-F340 WeakPolarHBondContact O-CA 3.3Å; S337-F340 WeakPolarHBondContact O-CB 3.24Å; S337-F340 PolarHBondContact O-N 2.78Å; S337-F340 PolarHBondContact OG-N 2.93Å; S337-F340 VanDerWaalsContact OG-N 3.15Å; S337-L341 PolarHBondContact O-N 2.74Å
338	L	50.2	Low	63.4	Low	80 Å²	80	81.1 Å²	81.1	42%	0.419	40%	0.402	S	S	.	.	H	α-helix	trans	-57.1	-23.4	169.2	-76.5	160.8	0	0	0	111.8	D55 L341 K342	D55-L338 WeakPolarHBondContact OD2-CD1 3.33Å; L338-L341 HydrophobicContact CD2-CD1 4.05Å; L338-L341 PolarHBondContact O-N 2.68Å; L338-K342 PolarHBondContact O-N 2.8Å
339	K	55.6	Low	62.8	Low	136 Å²	136	77.8 Å²	77.8	59%	0.591	38%	0.384	S	S	*	.	H	α-helix	trans	-63.3	-41.7	171.8	-161.9	-176.1	-179.7	-171.2	0	111.4	S337 L341 K342 E343	S337-K339 PolarHBondContact O-N 3.5Å; S337-K339 WeakPolarHBondContact OG-CB 3.42Å; S337-K339 PolarHBondContact OG-N 3.39Å; K339-L341 PolarHBondContact O-N 3.32Å; K339-K342 PolarHBondContact O-N 2.78Å; K339-E343 WeakPolarHBondContact CE-OE1 3.31Å; K339-E343 WeakPolarHBondContact CG-OE1 3.31Å; K339-E343 WeakPolarHBondContact O-CB 3.3Å; K339-E343 WeakPolarHBondContact O-CG 3.34Å; K339-E343 PolarHBondContact O-N 3.07Å
340	F	54.4	Low	62.3	Low	14 Å²	14	78.1 Å²	78.1	6%	0.061	39%	0.388	C	S	.	.	H	α-helix	trans	-57.7	-46.3	168.7	167.5	-92.9	0	0	0	112	F336 S337 K342 E343 V344 I351 H354	F336-F340 HydrophobicContact CB-CB 3.86Å; F336-F340 HydrophobicContact CB-CD1 3.18Å; F336-F340 HydrophobicContact CB-CD2 4.36Å; F336-F340 HydrophobicContact CB-CE1 3.62Å; F336-F340 HydrophobicContact CB-CG 3.55Å; F336-F340 HydrophobicContact CB-CZ 4.36Å; F336-F340 HydrophobicContact CD1-CB 4.29Å; F336-F340 AromaticContact CD1-CD1 3.68Å; F336-F340 HydrophobicContact CD1-CD1 3.68Å; F336-F340 AromaticContact CD1-CD2 3.46Å; F336-F340 HydrophobicContact CD1-CD2 3.46Å; F336-F340 VanDerWaalsContact CD1-CD2 3.46Å; F336-F340 AromaticContact CD1-CE1 3.59Å; F336-F340 HydrophobicContact CD1-CE1 3.59Å; F336-F340 AromaticContact CD1-CE2 3.4Å; F336-F340 HydrophobicContact CD1-CE2 3.4Å; F336-F340 VanDerWaalsContact CD1-CE2 3.4Å; F336-F340 AromaticContact CD1-CG 3.54Å; F336-F340 HydrophobicContact CD1-CG 3.54Å; F336-F340 AromaticContact CD1-CZ 3.42Å; F336-F340 HydrophobicContact CD1-CZ 3.42Å; F336-F340 VanDerWaalsContact CD1-CZ 3.42Å; F336-F340 HydrophobicContact CD2-CD1 4.21Å; F336-F340 AromaticContact CD2-CE1 3.71Å; F336-F340 HydrophobicContact CD2-CE1 3.71Å; F336-F340 HydrophobicContact CD2-CZ 4.01Å; F336-F340 HydrophobicContact CE1-CD2 4.03Å; F336-F340 HydrophobicContact CE1-CE1 4.16Å; F336-F340 AromaticContact CE1-CE2 3.55Å; F336-F340 HydrophobicContact CE1-CE2 3.55Å; F336-F340 HydrophobicContact CE1-CG 4.5Å; F336-F340 AromaticContact CE1-CZ 3.56Å; F336-F340 HydrophobicContact CE1-CZ 3.56Å; F336-F340 HydrophobicContact CE2-CE1 4.27Å; F336-F340 HydrophobicContact CE2-CZ 4.13Å; F336-F340 HydrophobicContact CG-CB 4.48Å; F336-F340 AromaticContact CG-CD1 3.43Å; F336-F340 HydrophobicContact CG-CD1 3.43Å; F336-F340 VanDerWaalsContact CG-CD1 3.43Å; F336-F340 HydrophobicContact CG-CD2 4.12Å; F336-F340 AromaticContact CG-CE1 3.34Å; F336-F340 HydrophobicContact CG-CE1 3.34Å; F336-F340 HydrophobicContact CG-CE2 4.08Å; F336-F340 AromaticContact CG-CG 3.76Å; F336-F340 HydrophobicContact CG-CG 3.76Å; F336-F340 AromaticContact CG-CZ 3.66Å; F336-F340 HydrophobicContact CG-CZ 3.66Å; F336-F340 HydrophobicContact CZ-CE1 4.47Å; F336-F340 HydrophobicContact CZ-CE2 4.32Å; F336-F340 AromaticContact CZ-CZ 3.93Å; F336-F340 HydrophobicContact CZ-CZ 3.93Å; S337-F340 WeakPolarHBondContact O-CA 3.3Å; S337-F340 WeakPolarHBondContact O-CB 3.24Å; S337-F340 PolarHBondContact O-N 2.78Å; S337-F340 PolarHBondContact OG-N 2.93Å; S337-F340 VanDerWaalsContact OG-N 3.15Å; F340-K342 PolarHBondContact O-N 2.88Å; F340-E343 PolarHBondContact O-N 2.82Å; F340-E343 VanDerWaalsContact O-N 3.11Å; F340-V344 HydrophobicContact CD1-CG2 3.94Å; F340-V344 HydrophobicContact CD2-CG2 3.52Å; F340-V344 HydrophobicContact CE1-CG2 3.78Å; F340-V344 HydrophobicContact CE2-CG2 3.29Å; F340-V344 HydrophobicContact CG-CG2 3.89Å; F340-V344 HydrophobicContact CZ-CG2 3.48Å; F340-V344 VanDerWaalsContact CZ-CG2 3.48Å; F340-V344 WeakPolarHBondContact O-CB 3.37Å; F340-V344 WeakPolarHBondContact O-CG2 3.13Å; F340-V344 PolarHBondContact O-N 2.81Å; F340-I351 HydrophobicContact CE2-CB 4.38Å; F340-I351 HydrophobicContact CE2-CD1 4.09Å; F340-I351 HydrophobicContact CE2-CG1 3.75Å; F340-I351 HydrophobicContact CZ-CD1 3.73Å; F340-I351 HydrophobicContact CZ-CG1 3.94Å; F340-H354 HydrophobicContact CD2-CB 3.47Å; F340-H354 VanDerWaalsContact CD2-CB 3.47Å; F340-H354 AromaticContact CD2-CD2 3.56Å; F340-H354 AromaticContact CD2-CG 3.41Å; F340-H354 VanDerWaalsContact CD2-CG 3.41Å; F340-H354 AromaticContact CD2-ND1 3.96Å; F340-H354 HydrophobicContact CE2-CB 3.91Å; F340-H354 HydrophobicContact CG-CB 4.49Å
341	L	53.4	Low	61.4	Low	41 Å²	41	80.2 Å²	80.2	22%	0.215	40%	0.399	C	S	.	.	H	α-helix	trans	-63.1	-30.8	179	-71.9	171.1	0	0	0	112.7	I50 I122 S337 L338 K339	I50-L341 HydrophobicContact CD1-CD2 4.12Å; I122-L341 HydrophobicContact CG1-CD1 4.34Å; S337-L341 PolarHBondContact O-N 2.74Å; L338-L341 HydrophobicContact CD2-CD1 4.05Å; L338-L341 PolarHBondContact O-N 2.68Å; K339-L341 PolarHBondContact O-N 3.32Å
342	K	53.7	Low	61.2	Low	151 Å²	151	80.4 Å²	80.4	66%	0.657	40%	0.404	S	S	*	.	H	α-helix	trans	-72.3	-40.7	171.8	-71.3	-177.3	179.1	-174.3	0	112.5	L338 K339 F340	L338-K342 PolarHBondContact O-N 2.8Å; K339-K342 PolarHBondContact O-N 2.78Å; F340-K342 PolarHBondContact O-N 2.88Å
343	E	53.2	Low	61.4	Low	37 Å²	37	77.1 Å²	77.1	17%	0.173	38%	0.383	C	S	.	.	H	α-helix	trans	-80	-21	-177	-71.8	-177.5	-151.7	0	0	113.7	K339 F340 S346 H354 K422	K339-E343 WeakPolarHBondContact CE-OE1 3.31Å; K339-E343 WeakPolarHBondContact CG-OE1 3.31Å; K339-E343 WeakPolarHBondContact O-CB 3.3Å; K339-E343 WeakPolarHBondContact O-CG 3.34Å; K339-E343 PolarHBondContact O-N 3.07Å; F340-E343 PolarHBondContact O-N 2.82Å; F340-E343 VanDerWaalsContact O-N 3.11Å; E343-S346 PolarHBondContact O-OG 3.24Å; E343-H354 IonicContact OE2-CE1 2.73Å; E343-H354 PolarHBondContact OE2-CE1 3.15Å; E343-H354 IonicContact OE2-NE2 2.96Å; E343-H354 PolarHBondContact OE2-NE2 2.83Å; E343-K422 IonicContact OE2-NZ 3.07Å; E343-K422 PolarHBondContact OE2-NZ 3.27Å
344	V	50.9	Low	61.8	Low	65 Å²	65	75 Å²	75	39%	0.394	37%	0.369	S	S	.	.	H	α-helix	trans	-82.6	-23.6	175.3	171.9	0	0	0	0	112.3	F340	F340-V344 HydrophobicContact CD1-CG2 3.94Å; F340-V344 HydrophobicContact CD2-CG2 3.52Å; F340-V344 HydrophobicContact CE1-CG2 3.78Å; F340-V344 HydrophobicContact CE2-CG2 3.29Å; F340-V344 HydrophobicContact CG-CG2 3.89Å; F340-V344 HydrophobicContact CZ-CG2 3.48Å; F340-V344 VanDerWaalsContact CZ-CG2 3.48Å; F340-V344 WeakPolarHBondContact O-CB 3.37Å; F340-V344 WeakPolarHBondContact O-CG2 3.13Å; F340-V344 PolarHBondContact O-N 2.81Å
345	E	46.2	Very low	62.9	Low	86 Å²	86	72.4 Å²	72.4	40%	0.402	36%	0.36	S	S	.	.	H	α-helix	trans	-78.3	-25	172	-82.4	-170.7	175.2	0	0	113.3	I50 R56 E347	I50-E345 WeakPolarHBondContact CG2-OE1 3.14Å; R56-E345 IonicContact CZ-OE2 2.81Å; R56-E345 IonicContact NH1-OE1 2.77Å; R56-E345 PolarHBondContact NH1-OE1 3.1Å; R56-E345 IonicContact NH1-OE2 2.72Å; R56-E345 PolarHBondContact NH1-OE2 2.88Å; R56-E345 IonicContact NH2-OE2 2.99Å; R56-E345 PolarHBondContact NH2-OE2 2.83Å; E345-E347 PolarHBondContact O-N 2.98Å
346	S	53.7	Low	64.4	Low	50 Å²	50	69.3 Å²	69.3	35%	0.35	35%	0.348	S	S	.	.	S	Bend	trans	-76.9	106.7	155.5	51.8	0	0	0	0	106.3	E343 D348	E343-S346 PolarHBondContact O-OG 3.24Å; S346-D348 PolarHBondContact O-N 2.72Å
347	E	57.9	Low	65.6	Low	182 Å²	182	67.6 Å²	67.6	85%	0.85	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	21.5	-176.7	-67.5	-177.8	153.8	0	0	115.1	E345	E345-E347 PolarHBondContact O-N 2.98Å
348	D	70.3	Confident	66.8	Low	66 Å²	66	65.9 Å²	65.9	35%	0.353	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-27.7	-165.9	-61.1	-42.9	0	0	0	114.6	S346 M426 K429	S346-D348 PolarHBondContact O-N 2.72Å; D348-M426 HydrophobicContact CB-CE 3.62Å; D348-K429 WeakPolarHBondContact O-CD 3.18Å; D348-K429 WeakPolarHBondContact O-CE 3.5Å; D348-K429 IonicContact OD1-NZ 2.68Å; D348-K429 PolarHBondContact OD1-NZ 3.42Å
349	V	75.8	Confident	68.6	Low	19 Å²	19	62.3 Å²	62.3	12%	0.115	31%	0.313	C	S	.	.	S	Bend	trans	-105.8	118.3	-175.8	-173	0	0	0	0	111.3	F353 K422 M426	V349-F353 HydrophobicContact CG1-CB 4.1Å; V349-F353 HydrophobicContact CG1-CD2 4.06Å; V349-F353 HydrophobicContact CG1-CG 4.45Å; V349-K422 HydrophobicContact CG1-CD 4.44Å; V349-M426 HydrophobicContact CB-SD 4.42Å; V349-M426 HydrophobicContact CG2-CE 3.76Å; V349-M426 HydrophobicContact CG2-SD 3.79Å
350	P	80.7	Confident	70.1	Confident	31 Å²	31	61.3 Å²	61.3	20%	0.201	31%	0.31	C	S	.	.			trans	-59.5	138.8	174.8	-24.8	31.5	0	0	0	113.8	Q352 F353 Y425	P350-Q352 PolarHBondContact O-N 3.25Å; P350-F353 HydrophobicContact CB-CD2 4.02Å; P350-F353 HydrophobicContact CB-CE2 4.25Å; P350-F353 HydrophobicContact CG-CD2 4.09Å; P350-F353 HydrophobicContact CG-CE2 3.95Å; P350-F353 PolarHBondContact O-N 2.93Å; P350-Y425 HydrophobicContact CG-CD1 4.23Å; P350-Y425 HydrophobicContact CG-CE1 3.36Å; P350-Y425 HydrophobicContact CG-CE2 4.34Å; P350-Y425 VanDerWaalsContact CG-CZ 3.43Å; P350-Y425 VanDerWaalsContact CG-OH 3.32Å; P350-Y425 WeakPolarHBondContact CG-OH 3.22Å
351	I	72.7	Confident	71.8	Confident	85 Å²	85	65.8 Å²	65.8	44%	0.436	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-52.7	-28.2	179.2	-175.9	156.3	0	0	0	113.8	F336 F340 F353 H354	F336-I351 HydrophobicContact CE1-CD1 4.32Å; F336-I351 HydrophobicContact CE1-CG1 4.15Å; F336-I351 HydrophobicContact CZ-CD1 3.93Å; F336-I351 HydrophobicContact CZ-CG1 4.2Å; F340-I351 HydrophobicContact CE2-CB 4.38Å; F340-I351 HydrophobicContact CE2-CD1 4.09Å; F340-I351 HydrophobicContact CE2-CG1 3.75Å; F340-I351 HydrophobicContact CZ-CD1 3.73Å; F340-I351 HydrophobicContact CZ-CG1 3.94Å; I351-F353 PolarHBondContact O-N 2.9Å; I351-H354 WeakPolarHBondContact O-CB 3.49Å; I351-H354 PolarHBondContact O-N 3.44Å
352	Q	83.1	Confident	73.3	Confident	106 Å²	106	64.9 Å²	64.9	50%	0.495	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-58.8	-35.9	180	-64.2	81.7	-8.1	0	0	111.5	P350 H354 L355 M418	P350-Q352 PolarHBondContact O-N 3.25Å; Q352-H354 PolarHBondContact O-N 3.3Å; Q352-L355 HydrophobicContact CB-CD1 4.32Å; Q352-L355 WeakPolarHBondContact O-CG 3.29Å; Q352-L355 PolarHBondContact O-N 3.49Å; Q352-M418 WeakPolarHBondContact O-CE 3.26Å
353	F	86.3	Confident	74.8	Confident	27 Å²	27	64.9 Å²	64.9	12%	0.118	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-64.8	-11.5	178.2	-71.5	-66.2	0	0	0	113.9	V349 P350 I351 M418 F421 K422 Y425	V349-F353 HydrophobicContact CG1-CB 4.1Å; V349-F353 HydrophobicContact CG1-CD2 4.06Å; V349-F353 HydrophobicContact CG1-CG 4.45Å; P350-F353 HydrophobicContact CB-CD2 4.02Å; P350-F353 HydrophobicContact CB-CE2 4.25Å; P350-F353 HydrophobicContact CG-CD2 4.09Å; P350-F353 HydrophobicContact CG-CE2 3.95Å; P350-F353 PolarHBondContact O-N 2.93Å; I351-F353 PolarHBondContact O-N 2.9Å; F353-M418 WeakPolarHBondContact CD1-O 3.38Å; F353-F421 HydrophobicContact CE1-CB 4.49Å; F353-F421 AromaticContact CE1-CD1 3.65Å; F353-F421 HydrophobicContact CE1-CD1 3.65Å; F353-F421 HydrophobicContact CE1-CE1 4.31Å; F353-F421 HydrophobicContact CE1-CG 4.42Å; F353-F421 AromaticContact CZ-CD1 3.73Å; F353-F421 HydrophobicContact CZ-CD1 3.73Å; F353-F421 AromaticContact CZ-CE1 3.95Å; F353-F421 HydrophobicContact CZ-CE1 3.95Å; F353-K422 HydrophobicContact CB-CD 4.31Å; F353-K422 HydrophobicContact CB-CG 4.49Å; F353-K422 HydrophobicContact CD1-CB 3.61Å; F353-K422 HydrophobicContact CD1-CG 4.06Å; F353-K422 HydrophobicContact CD2-CG 4.38Å; F353-K422 HydrophobicContact CE1-CB 3.7Å; F353-K422 HydrophobicContact CE1-CG 4.37Å; F353-K422 HydrophobicContact CG-CB 4.14Å; F353-K422 HydrophobicContact CG-CD 4.4Å; F353-K422 HydrophobicContact CG-CG 4.06Å; F353-K422 HydrophobicContact CZ-CB 4.3Å; F353-Y425 AromaticContact CE2-CD1 3.7Å; F353-Y425 HydrophobicContact CE2-CD1 3.7Å; F353-Y425 HydrophobicContact CE2-CD2 4.38Å; F353-Y425 HydrophobicContact CE2-CE1 4.24Å; F353-Y425 AromaticContact CE2-CG 3.79Å; F353-Y425 HydrophobicContact CE2-CG 3.79Å; F353-Y425 HydrophobicContact CZ-CD1 4.19Å; F353-Y425 HydrophobicContact CZ-CD2 4.38Å; F353-Y425 AromaticContact CZ-CG 3.83Å; F353-Y425 HydrophobicContact CZ-CG 3.83Å
354	H	78	Confident	76.4	Confident	5 Å²	5	64 Å²	64	2%	0.023	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-107.8	0.8	-177.6	-64.2	-78.6	0	0	0	114.2	F336 F340 E343 I351 Q352 L356 D357	F336-H354 HydrophobicContact CD1-CB 4.37Å; F336-H354 HydrophobicContact CE1-CB 4.41Å; F340-H354 HydrophobicContact CD2-CB 3.47Å; F340-H354 VanDerWaalsContact CD2-CB 3.47Å; F340-H354 AromaticContact CD2-CD2 3.56Å; F340-H354 AromaticContact CD2-CG 3.41Å; F340-H354 VanDerWaalsContact CD2-CG 3.41Å; F340-H354 AromaticContact CD2-ND1 3.96Å; F340-H354 HydrophobicContact CE2-CB 3.91Å; F340-H354 HydrophobicContact CG-CB 4.49Å; E343-H354 IonicContact OE2-CE1 2.73Å; E343-H354 PolarHBondContact OE2-CE1 3.15Å; E343-H354 IonicContact OE2-NE2 2.96Å; E343-H354 PolarHBondContact OE2-NE2 2.83Å; I351-H354 WeakPolarHBondContact O-CB 3.49Å; I351-H354 PolarHBondContact O-N 3.44Å; Q352-H354 PolarHBondContact O-N 3.3Å; H354-L356 PolarHBondContact O-N 2.97Å; H354-L356 VanDerWaalsContact O-N 3.14Å; H354-D357 IonicContact CE1-OD2 2.68Å; H354-D357 IonicContact CG-OD2 3.86Å; H354-D357 IonicContact ND1-OD1 3.43Å; H354-D357 IonicContact ND1-OD2 3.11Å; H354-D357 PolarHBondContact ND1-OD2 3.04Å; H354-D357 WeakPolarHBondContact O-CB 3.4Å; H354-D357 PolarHBondContact O-N 2.88Å
355	L	80.9	Confident	78	Confident	115 Å²	115	63 Å²	63	60%	0.602	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-28	-177.5	-72	169.9	0	0	0	113.6	Q352	Q352-L355 HydrophobicContact CB-CD1 4.32Å; Q352-L355 WeakPolarHBondContact O-CG 3.29Å; Q352-L355 PolarHBondContact O-N 3.49Å
356	L	87.1	Confident	79.7	Confident	30 Å²	30	65.4 Å²	65.4	16%	0.157	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	12.4	-177	-59.8	177.4	0	0	0	113	H354 G358 F359 L411 K415 M418	H354-L356 PolarHBondContact O-N 2.97Å; H354-L356 VanDerWaalsContact O-N 3.14Å; L356-G358 VanDerWaalsContact C-N 3.27Å; L356-G358 PolarHBondContact O-N 2.75Å; L356-F359 HydrophobicContact CB-CB 4.25Å; L356-F359 HydrophobicContact CD2-CB 4.42Å; L356-F359 VanDerWaalsContact O-CB 3.32Å; L356-F359 WeakPolarHBondContact O-CB 3.48Å; L356-F359 PolarHBondContact O-N 2.77Å; L356-F359 VanDerWaalsContact O-N 3.09Å; L356-L411 HydrophobicContact CD2-CD2 4.11Å; L356-K415 HydrophobicContact CB-CB 4.18Å; L356-K415 HydrophobicContact CB-CD 4.3Å; L356-K415 HydrophobicContact CB-CG 4.06Å; L356-K415 HydrophobicContact CD1-CB 3.91Å; L356-K415 WeakPolarHBondContact O-CE 3.38Å; L356-K415 PolarHBondContact O-NZ 2.86Å; L356-K415 VanDerWaalsContact O-NZ 3.08Å; L356-M418 HydrophobicContact CD1-SD 4.37Å
357	D	79.8	Confident	81.1	Confident	48 Å²	48	63.9 Å²	63.9	26%	0.257	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-45.8	178.3	-84.4	3.8	0	0	0	110.7	H354 F359 K415	H354-D357 IonicContact CE1-OD2 2.68Å; H354-D357 IonicContact CG-OD2 3.86Å; H354-D357 IonicContact ND1-OD1 3.43Å; H354-D357 IonicContact ND1-OD2 3.11Å; H354-D357 PolarHBondContact ND1-OD2 3.04Å; H354-D357 WeakPolarHBondContact O-CB 3.4Å; H354-D357 PolarHBondContact O-N 2.88Å; D357-F359 PolarHBondContact O-N 2.99Å; D357-K415 PolarHBondContact O-NZ 2.95Å
358	G	77.9	Confident	82.2	Confident	9 Å²	9	60.2 Å²	60.2	9%	0.093	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	3.1	179.2	0	0	0	0	0	115.7	T333 L356 E360	T333-G358 PolarHBondContact N-O 2.87Å; T333-G358 WeakPolarHBondContact OG1-CA 2.96Å; T333-G358 PolarHBondContact OG1-O 2.8Å; T333-G358 VanDerWaalsContact OG1-O 3.09Å; L356-G358 VanDerWaalsContact C-N 3.27Å; L356-G358 PolarHBondContact O-N 2.75Å; G358-E360 PolarHBondContact O-N 2.84Å
359	F	89.3	Confident	82.6	Confident	5 Å²	5	59.2 Å²	59.2	2%	0.022	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	99.9	178.8	-173.3	-114.2	0	0	0	110.5	M330 R331 V332 L356 D357 E408 L411 S412 K415	M330-F359 HydrophobicContact CB-CD2 3.98Å; M330-F359 HydrophobicContact CB-CE1 4.3Å; M330-F359 HydrophobicContact CB-CE2 3.24Å; M330-F359 HydrophobicContact CB-CZ 3.43Å; M330-F359 VanDerWaalsContact CB-CZ 3.43Å; M330-F359 HydrophobicContact CE-CD1 3.62Å; M330-F359 HydrophobicContact CE-CD2 4.5Å; M330-F359 HydrophobicContact CE-CE1 3.3Å; M330-F359 HydrophobicContact CE-CE2 4.28Å; M330-F359 HydrophobicContact CE-CG 4.23Å; M330-F359 HydrophobicContact CE-CZ 3.68Å; M330-F359 HydrophobicContact CG-CE1 4.12Å; M330-F359 HydrophobicContact CG-CE2 3.89Å; M330-F359 HydrophobicContact CG-CZ 3.49Å; M330-F359 VanDerWaalsContact CG-CZ 3.49Å; M330-F359 HydrophobicContact SD-CZ 4.45Å; R331-F359 CarbonylContact O-C 3.53Å; R331-F359 VanDerWaalsContact O-CA 3.32Å; R331-F359 WeakPolarHBondContact O-CA 3.28Å; V332-F359 HydrophobicContact CG2-CD2 3.7Å; V332-F359 HydrophobicContact CG2-CE2 4.2Å; L356-F359 HydrophobicContact CB-CB 4.25Å; L356-F359 HydrophobicContact CD2-CB 4.42Å; L356-F359 VanDerWaalsContact O-CB 3.32Å; L356-F359 WeakPolarHBondContact O-CB 3.48Å; L356-F359 PolarHBondContact O-N 2.77Å; L356-F359 VanDerWaalsContact O-N 3.09Å; D357-F359 PolarHBondContact O-N 2.99Å; F359-E408 HydrophobicContact CZ-CB 4.27Å; F359-E408 HydrophobicContact CZ-CG 4.38Å; F359-L411 HydrophobicContact CD1-CB 4.35Å; F359-L411 HydrophobicContact CE1-CB 3.67Å; F359-L411 HydrophobicContact CE2-CB 4.17Å; F359-L411 HydrophobicContact CE2-CD1 3.96Å; F359-L411 HydrophobicContact CZ-CB 3.56Å; F359-L411 HydrophobicContact CZ-CD1 4.1Å; F359-S412 WeakPolarHBondContact CE1-OG 3.43Å; F359-K415 HydrophobicContact CD1-CD 4.42Å; F359-K415 PolarHBondContact O-NZ 3.46Å
360	E	87.5	Confident	82.9	Confident	115 Å²	115	59.5 Å²	59.5	54%	0.537	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.8	-171.1	-64.1	-174	155.5	0	0	111.9	R331 G358 D362	R331-E360 PolarHBondContact N-O 3.05Å; R331-E360 PolarHBondContact O-N 3.47Å; G358-E360 PolarHBondContact O-N 2.84Å; E360-D362 PolarHBondContact O-N 3.01Å
361	P	88.3	Confident	83.3	Confident	109 Å²	109	62.7 Å²	62.7	71%	0.708	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	132.8	173.1	-21.9	32.9	0	0	0	112.1	M330	M330-P361 HydrophobicContact CE-CG 4.28Å; M330-P361 HydrophobicContact SD-CB 4.27Å; M330-P361 HydrophobicContact SD-CG 4.24Å
362	D	86.8	Confident	84.3	Confident	22 Å²	22	59.5 Å²	59.5	12%	0.118	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	92.7	177	-162.6	-2.5	0	0	0	109.1	R309 L329 R331 E360 C364	R309-D362 IonicContact CZ-OD1 3.11Å; R309-D362 IonicContact CZ-OD2 3.69Å; R309-D362 VanDerWaalsContact NH2-CG 3.25Å; R309-D362 IonicContact NH2-OD1 2.87Å; R309-D362 PolarHBondContact NH2-OD1 2.77Å; R309-D362 IonicContact NH2-OD2 2.61Å; R309-D362 PolarHBondContact NH2-OD2 2.89Å; L329-D362 PolarHBondContact N-O 2.96Å; L329-D362 WeakPolarHBondContact O-CA 3.31Å; L329-D362 WeakPolarHBondContact O-CB 3.25Å; L329-D362 PolarHBondContact O-N 3.04Å; R331-D362 HydrophobicContact CB-CB 3.93Å; R331-D362 IonicContact CZ-OD1 2.64Å; R331-D362 IonicContact CZ-OD2 3.63Å; R331-D362 VanDerWaalsContact CZ-OD2 3.3Å; R331-D362 IonicContact NE-OD1 3.71Å; R331-D362 IonicContact NE-OD2 2.59Å; R331-D362 PolarHBondContact NE-OD2 2.9Å; R331-D362 IonicContact NH2-OD1 2.57Å; R331-D362 PolarHBondContact NH2-OD1 2.83Å; R331-D362 IonicContact NH2-OD2 3.14Å; R331-D362 PolarHBondContact NH2-OD2 2.59Å; E360-D362 PolarHBondContact O-N 3.01Å; D362-C364 PolarHBondContact O-N 3.06Å
363	Q	84.7	Confident	84.9	Confident	151 Å²	151	55 Å²	55	71%	0.706	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-63.6	119.5	-177	-168.5	177.1	21.6	0	0	110.5	D328 I365	D328-Q363 WeakPolarHBondContact OD1-CA 3.28Å; D328-Q363 WeakPolarHBondContact OD1-CG 3.27Å; Q363-I365 PolarHBondContact O-N 2.93Å
364	C	85.9	Confident	85.5	Confident	17 Å²	17	53.7 Å²	53.7	12%	0.115	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-75.4	126.1	-178.8	-81.8	0	0	0	0	110.4	L325 F327 D328 D362	L325-C364 HydrophobicContact CB-CB 4.4Å; F327-C364 WeakPolarHBondContact O-CB 3.16Å; F327-C364 PolarHBondContact O-SG 3.09Å; F327-C364 VanDerWaalsContact O-SG 3.42Å; D328-C364 PolarHBondContact OD1-N 2.78Å; D362-C364 PolarHBondContact O-N 3.06Å
365	I	85.4	Confident	86.4	Confident	45 Å²	45	53.4 Å²	53.4	23%	0.231	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-79.2	138	178.3	-59	173.9	0	0	0	108.9	R306 L307 F324 Q363	R306-I365 HydrophobicContact CG-CD1 4.47Å; L307-I365 HydrophobicContact CD1-CD1 4.36Å; F324-I365 WeakPolarHBondContact CA-O 3.06Å; F324-I365 WeakPolarHBondContact CB-O 3.23Å; F324-I365 HydrophobicContact CD1-CB 4.29Å; F324-I365 WeakPolarHBondContact CD1-O 3.5Å; Q363-I365 PolarHBondContact O-N 2.93Å
366	K	80.5	Confident	87.1	Confident	137 Å²	137	48 Å²	48	60%	0.596	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-86.5	124.3	168.6	-66.5	-174	179.6	-177.1	0	110.7
367	L	84.5	Confident	87.5	Confident	18 Å²	18	46.5 Å²	46.5	9%	0.094	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-77.1	128.8	169.4	-63.8	179.7	0	0	0	109.5	I174 L176 I282 L298 F324	I174-L367 HydrophobicContact CD1-CD1 4.07Å; L176-L367 HydrophobicContact CD1-CB 3.45Å; L176-L367 VanDerWaalsContact CD1-CB 3.45Å; L176-L367 HydrophobicContact CD1-CD1 4.05Å; L176-L367 HydrophobicContact CD1-CG 4.39Å; I282-L367 HydrophobicContact CD1-CD1 4.13Å; L298-L367 HydrophobicContact CD2-CD2 4.22Å; F324-L367 HydrophobicContact CB-CD1 4.34Å; F324-L367 HydrophobicContact CB-CG 4.15Å; F324-L367 HydrophobicContact CD1-CD1 4.07Å; F324-L367 HydrophobicContact CD1-CD2 3.81Å; F324-L367 HydrophobicContact CD1-CG 3.6Å; F324-L367 HydrophobicContact CD2-CD1 3.64Å; F324-L367 HydrophobicContact CD2-CG 4.11Å; F324-L367 HydrophobicContact CE1-CD1 4.27Å; F324-L367 HydrophobicContact CE1-CD2 3.69Å; F324-L367 HydrophobicContact CE1-CG 3.96Å; F324-L367 HydrophobicContact CE2-CD1 3.86Å; F324-L367 HydrophobicContact CE2-CG 4.42Å; F324-L367 HydrophobicContact CG-CD1 3.75Å; F324-L367 HydrophobicContact CG-CD2 4.34Å; F324-L367 HydrophobicContact CG-CG 3.68Å; F324-L367 HydrophobicContact CZ-CD1 4.17Å; F324-L367 HydrophobicContact CZ-CD2 4.13Å; F324-L367 HydrophobicContact CZ-CG 4.35Å
368	Q	81.6	Confident	87.9	Confident	105 Å²	105	44.2 Å²	44.2	49%	0.491	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-82.2	156.4	175.9	-64	-58.1	-43.3	0	0	110.3	G370 H372	Q368-G370 PolarHBondContact O-N 3.18Å; Q368-H372 PolarHBondContact O-CE1 3.03Å; Q368-H372 PolarHBondContact O-NE2 3.18Å
369	P	78.2	Confident	87.8	Confident	45 Å²	45	44 Å²	44	29%	0.292	23%	0.227	S	C	.	.	S	Bend	trans	-52.9	143.6	166.4	-25.3	35	0	0	0	111.9	L176 A178	L176-P369 CarbonylContact O-C 3.59Å; L176-P369 WeakPolarHBondContact O-CA 3.47Å; A178-P369 HydrophobicContact CB-CB 3.64Å; A178-P369 HydrophobicContact CB-CG 3.88Å
370	G	82.3	Confident	86.9	Confident	24 Å²	24	45 Å²	45	25%	0.247	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	130.7	-176	-174.7	0	0	0	0	0	112.6	L176 Q368	L176-G370 PolarHBondContact N-O 2.87Å; L176-G370 PolarHBondContact O-N 3.23Å; Q368-G370 PolarHBondContact O-N 3.18Å
371	E	89	Confident	85.6	Confident	99 Å²	99	42.8 Å²	42.8	46%	0.463	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	136.8	172.9	-166.5	174	94.5	0	0	110	R173 I174	R173-E371 HydrophobicContact CB-CG 4.17Å; R173-E371 VanDerWaalsContact CD-CD 3.5Å; R173-E371 WeakPolarHBondContact CD-OE1 3.43Å; R173-E371 HydrophobicContact CG-CG 4.07Å; R173-E371 IonicContact CZ-OE1 3.3Å; R173-E371 IonicContact NE-OE1 2.74Å; R173-E371 PolarHBondContact NE-OE1 3.43Å; R173-E371 VanDerWaalsContact NE-OE1 3.15Å; R173-E371 IonicContact NH1-OE1 2.95Å; R173-E371 PolarHBondContact NH1-OE1 3.36Å; R173-E371 IonicContact NH1-OE2 3.74Å; R173-E371 IonicContact NH2-OE1 2.75Å; I174-E371 CarbonylContact O-C 3.55Å; I174-E371 WeakPolarHBondContact O-CA 3.26Å
372	H	92.9	Very high	84.1	Confident	17 Å²	17	43.9 Å²	43.9	8%	0.079	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	137	173.4	-58.4	-93.9	0	0	0	109.7	R173 I174 Q368	R173-H372 WeakPolarHBondContact CA-O 3.46Å; I174-H372 HydrophobicContact CD1-CB 4.25Å; I174-H372 HydrophobicContact CG1-CB 3.78Å; I174-H372 PolarHBondContact N-O 3Å; I174-H372 PolarHBondContact O-N 3.49Å; Q368-H372 PolarHBondContact O-CE1 3.03Å; Q368-H372 PolarHBondContact O-NE2 3.18Å
373	L	96.3	Very high	83.3	Confident	11 Å²	11	48.9 Å²	48.9	6%	0.058	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.5	176.8	-175.6	71	0	0	0	109.7	A136 I139 V140 V151 F171 R173 F299	A136-L373 HydrophobicContact CB-CD2 4.44Å; I139-L373 HydrophobicContact CB-CD2 4.01Å; I139-L373 HydrophobicContact CG2-CD1 3.72Å; I139-L373 HydrophobicContact CG2-CD2 3.78Å; I139-L373 HydrophobicContact CG2-CG 4.41Å; V140-L373 HydrophobicContact CG2-CD2 3.78Å; V151-L373 HydrophobicContact CG1-CD1 4.02Å; F171-L373 HydrophobicContact CB-CD1 4.29Å; F171-L373 HydrophobicContact CD1-CD1 4.23Å; F171-L373 HydrophobicContact CD1-CD2 4.28Å; F171-L373 HydrophobicContact CD1-CG 4.34Å; R173-L373 HydrophobicContact CG-CD1 4.11Å; F299-L373 HydrophobicContact CB-CB 4.45Å; F299-L373 HydrophobicContact CB-CD2 4.46Å; F299-L373 HydrophobicContact CD2-CB 4.5Å; F299-L373 HydrophobicContact CD2-CD2 4.07Å; F299-L373 HydrophobicContact CD2-CG 4.02Å; F299-L373 HydrophobicContact CG-CD2 4.4Å; F299-L373 PolarHBondContact N-O 2.87Å
374	F	97.3	Very high	83.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	165.6	168	77.3	-82.7	0	0	0	110.3	L154 Y172 I174 I284 L296 V297 L298 V389 V391	L154-F374 HydrophobicContact CD2-CZ 4.45Å; Y172-F374 AromaticContact CD2-CE2 3.9Å; Y172-F374 HydrophobicContact CD2-CE2 3.9Å; Y172-F374 HydrophobicContact CD2-CZ 4.05Å; Y172-F374 HydrophobicContact CG-CE1 4.19Å; Y172-F374 HydrophobicContact CG-CE2 4.08Å; Y172-F374 AromaticContact CG-CZ 3.74Å; Y172-F374 HydrophobicContact CG-CZ 3.74Å; Y172-F374 PolarHBondContact N-O 2.85Å; Y172-F374 PolarHBondContact O-N 3.44Å; I174-F374 HydrophobicContact CG2-CE1 3.98Å; I284-F374 HydrophobicContact CD1-CD1 4.07Å; I284-F374 HydrophobicContact CD1-CE1 4.24Å; I284-F374 HydrophobicContact CD1-CG 4.22Å; I284-F374 HydrophobicContact CG2-CD2 4.24Å; I284-F374 HydrophobicContact CG2-CE2 3.74Å; I284-F374 HydrophobicContact CG2-CZ 3.92Å; L296-F374 HydrophobicContact CD2-CD2 4.19Å; L296-F374 HydrophobicContact CD2-CE2 4.23Å; V297-F374 CarbonylContact O-C 3.51Å; V297-F374 WeakPolarHBondContact O-CA 3.31Å; V297-F374 VanDerWaalsContact O-CB 3.29Å; V297-F374 WeakPolarHBondContact O-CB 3.3Å; L298-F374 HydrophobicContact CD1-CB 4.12Å; F374-V389 HydrophobicContact CE2-CG2 3.91Å; F374-V389 HydrophobicContact CZ-CG2 4.08Å; F374-V391 HydrophobicContact CE1-CG2 4.44Å; F374-V391 HydrophobicContact CZ-CG2 4.47Å
375	C	97.1	Very high	83.4	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	159.1	173.7	76.8	0	0	0	0	112.6	A169 K170 F171 L296 V297 F299	A169-C375 HydrophobicContact CB-CB 4.09Å; K170-C375 WeakPolarHBondContact O-CA 3.25Å; K170-C375 WeakPolarHBondContact O-CB 3.38Å; F171-C375 HydrophobicContact CD1-CB 3.66Å; F171-C375 HydrophobicContact CE1-CB 3.89Å; F171-C375 HydrophobicContact CG-CB 4.06Å; F171-C375 HydrophobicContact CZ-CB 4.48Å; L296-C375 WeakPolarHBondContact CA-O 3.34Å; V297-C375 PolarHBondContact N-O 2.93Å; V297-C375 PolarHBondContact O-N 3.28Å; F299-C375 HydrophobicContact CE2-CB 4.09Å
376	V	96.8	Very high	83.8	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	113.1	162.6	-178.1	0	0	0	0	107.1	A169 K170 Y172 F294 L296 Y387	A169-V376 WeakPolarHBondContact CA-O 3.44Å; K170-V376 PolarHBondContact N-O 3.46Å; K170-V376 VanDerWaalsContact N-O 3.13Å; K170-V376 PolarHBondContact O-N 2.89Å; Y172-V376 HydrophobicContact CE2-CG2 4.07Å; F294-V376 HydrophobicContact CB-CG1 4.36Å; F294-V376 HydrophobicContact CD2-CG1 4.17Å; F294-V376 HydrophobicContact CG-CG1 4.47Å; L296-V376 HydrophobicContact CD2-CG2 3.76Å; V376-Y387 HydrophobicContact CB-CE1 4.06Å; V376-Y387 HydrophobicContact CB-CE2 4.01Å; V376-Y387 HydrophobicContact CG1-CD1 3.87Å; V376-Y387 HydrophobicContact CG1-CD2 4.24Å; V376-Y387 HydrophobicContact CG1-CE1 3.78Å; V376-Y387 HydrophobicContact CG1-CE2 4.18Å; V376-Y387 HydrophobicContact CG1-CG 4.11Å; V376-Y387 HydrophobicContact CG2-CD2 4.06Å; V376-Y387 HydrophobicContact CG2-CE2 3.6Å
377	Y	94.4	Very high	84.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.8	178.9	178.6	-103.3	0	0	0	111.4	I128 V132 Q167 D168 A169 F294 K295 D379	I128-Y377 HydrophobicContact CD1-CD1 3.43Å; I128-Y377 VanDerWaalsContact CD1-CD1 3.43Å; I128-Y377 HydrophobicContact CD1-CD2 4.14Å; I128-Y377 HydrophobicContact CD1-CE1 3.88Å; I128-Y377 HydrophobicContact CD1-CG 3.56Å; I128-Y377 HydrophobicContact CG2-CD2 4.37Å; I128-Y377 HydrophobicContact CG2-CE2 4.39Å; V132-Y377 HydrophobicContact CG1-CD2 4.32Å; V132-Y377 HydrophobicContact CG2-CD2 4.22Å; V132-Y377 HydrophobicContact CG2-CE2 3.93Å; Q167-Y377 PolarHBondContact OE1-OH 2.9Å; D168-Y377 WeakPolarHBondContact O-CA 3.49Å; D168-Y377 VanDerWaalsContact O-CD2 3.32Å; D168-Y377 WeakPolarHBondContact O-CD2 3.36Å; A169-Y377 HydrophobicContact CB-CD2 4.28Å; F294-Y377 VanDerWaalsContact CA-O 3.31Å; F294-Y377 WeakPolarHBondContact CA-O 3.49Å; F294-Y377 WeakPolarHBondContact CB-O 3.43Å; K295-Y377 PolarHBondContact N-O 3.37Å; K295-Y377 PolarHBondContact O-N 2.8Å; Y377-D379 HydrophobicContact CD1-CB 4.16Å; Y377-D379 HydrophobicContact CE1-CB 4.26Å; Y377-D379 PolarHBondContact O-N 3.36Å
378	G	89.6	Confident	85.2	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.219	C	C	.	.			trans	-73.2	82.1	178	0	0	0	0	0	113.3	Q167 D168 N380	Q167-G378 VanDerWaalsContact CA-O 3.26Å; Q167-G378 WeakPolarHBondContact CA-O 3.25Å; Q167-G378 PolarHBondContact N-O 3.16Å; D168-G378 PolarHBondContact O-N 3.04Å; G378-N380 PolarHBondContact O-N 3.01Å
379	D	75.5	Confident	85.9	Confident	4 Å²	4	41 Å²	41	2%	0.021	20%	0.195	C	C	.	.			trans	-76.8	13.1	-178.8	-165.1	36.8	0	0	0	114.7	T126 K293 K295 Y377	T126-D379 WeakPolarHBondContact CB-OD1 3.34Å; T126-D379 WeakPolarHBondContact CG2-OD1 3.47Å; T126-D379 PolarHBondContact OG1-OD1 3.48Å; T126-D379 PolarHBondContact OG1-OD2 3.19Å; K293-D379 WeakPolarHBondContact CD-OD2 3.49Å; K293-D379 VanDerWaalsContact CE-OD2 3.23Å; K293-D379 WeakPolarHBondContact CE-OD2 3.47Å; K293-D379 HydrophobicContact CG-CB 4.46Å; K293-D379 IonicContact NZ-OD2 3.77Å; K293-D379 PolarHBondContact NZ-OD2 3.48Å; K293-D379 PolarHBondContact O-N 3.4Å; K295-D379 VanDerWaalsContact CE-CG 3.42Å; K295-D379 WeakPolarHBondContact CE-OD2 3.22Å; K295-D379 HydrophobicContact CG-CB 4.2Å; K295-D379 IonicContact NZ-OD2 3.27Å; Y377-D379 HydrophobicContact CD1-CB 4.16Å; Y377-D379 HydrophobicContact CE1-CB 4.26Å; Y377-D379 PolarHBondContact O-N 3.36Å
380	N	69.5	Low	86.7	Confident	25 Å²	25	43 Å²	43	13%	0.134	20%	0.197	C	C	.	.			trans	-86.6	146	172.7	-77.7	-17.1	0	0	0	110.7	R166 Q167 S292 K293 G378 Q383 I385	R166-N380 WeakPolarHBondContact CB-O 3.47Å; Q167-N380 PolarHBondContact NE2-O 3.43Å; S292-N380 WeakPolarHBondContact CB-ND2 3.27Å; K293-N380 PolarHBondContact N-OD1 3.15Å; K293-N380 PolarHBondContact O-OD1 3.01Å; G378-N380 PolarHBondContact O-N 3.01Å; N380-Q383 WeakPolarHBondContact CB-O 3.3Å; N380-Q383 PolarHBondContact ND2-O 3.45Å; N380-Q383 VanDerWaalsContact ND2-O 3.12Å; N380-I385 HydrophobicContact CB-CD1 4.37Å; N380-I385 HydrophobicContact CB-CG1 4.39Å
381	W	60.4	Low	87.1	Confident	70 Å²	70	41.8 Å²	41.8	27%	0.265	19%	0.185	S	C	.	.	S	Bend	trans	-92	-28.7	175.7	-68.3	96.4	0	0	0	113.5	R111 T126 R166 Q167	R111-W381 HydrophobicContact CB-CD2 4.42Å; R111-W381 HydrophobicContact CB-CE3 4.33Å; R111-W381 VanDerWaalsContact CD-CE3 3.45Å; R111-W381 HydrophobicContact CG-CD2 4Å; R111-W381 HydrophobicContact CG-CE3 3.46Å; R111-W381 VanDerWaalsContact CG-CE3 3.46Å; R111-W381 HydrophobicContact CG-CH2 3.9Å; R111-W381 HydrophobicContact CG-CZ2 4.4Å; R111-W381 HydrophobicContact CG-CZ3 3.42Å; R111-W381 VanDerWaalsContact CG-CZ3 3.42Å; T126-W381 HydrophobicContact CG2-CZ2 4.17Å; R166-W381 WeakPolarHBondContact CD-O 3.26Å; Q167-W381 HydrophobicContact CG-CE3 4.15Å; Q167-W381 HydrophobicContact CG-CZ3 4.27Å
382	F	56.8	Low	87.1	Confident	131 Å²	131	40 Å²	40	58%	0.575	18%	0.177	S	C	*	.	S	Bend	trans	-115.6	-22.5	-168.2	-57.7	-69.3	0	0	0	114.1	L101	L101-F382 HydrophobicContact CD1-CE1 4.23Å
383	Q	70.5	Confident	86.7	Confident	127 Å²	127	41 Å²	41	59%	0.593	19%	0.185	S	C	*	.	S	Bend	trans	-136.9	136.8	-169.4	-65.8	-179.1	5.6	0	0	111.2	N380	N380-Q383 WeakPolarHBondContact CB-O 3.3Å; N380-Q383 PolarHBondContact ND2-O 3.45Å; N380-Q383 VanDerWaalsContact ND2-O 3.12Å
384	D	84.6	Confident	86.3	Confident	44 Å²	44	40.8 Å²	40.8	24%	0.235	18%	0.184	C	C	.	.			trans	-64.9	158.1	169.5	-63	-1.7	0	0	0	110.9	R163 V164 R166	R163-D384 HydrophobicContact CG-CB 4.17Å; R163-D384 IonicContact CZ-OD2 3.15Å; R163-D384 IonicContact NE-OD2 3.6Å; R163-D384 PolarHBondContact NE-OD2 3.17Å; R163-D384 IonicContact NH2-OD2 3Å; R163-D384 PolarHBondContact NH2-OD2 3.42Å; V164-D384 WeakPolarHBondContact O-CA 3.46Å; V164-D384 WeakPolarHBondContact O-CB 3.26Å; R166-D384 PolarHBondContact N-OD1 2.89Å
385	I	89	Confident	85.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125.9	-173.5	-52.7	-164.9	0	0	0	108.6	R163 V164 K293 F294 N380 Y387	R163-I385 CarbonylContact C-O 3.48Å; R163-I385 WeakPolarHBondContact CA-O 3.42Å; V164-I385 HydrophobicContact CG1-CB 3.77Å; V164-I385 HydrophobicContact CG1-CG1 4.3Å; V164-I385 PolarHBondContact N-O 3.18Å; V164-I385 PolarHBondContact O-N 3.29Å; K293-I385 WeakPolarHBondContact O-CD1 3.21Å; F294-I385 HydrophobicContact CB-CD1 3.65Å; F294-I385 HydrophobicContact CB-CG2 4.47Å; F294-I385 HydrophobicContact CD1-CG2 4.3Å; N380-I385 HydrophobicContact CB-CD1 4.37Å; N380-I385 HydrophobicContact CB-CG1 4.39Å; I385-Y387 HydrophobicContact CG2-CD1 4.07Å
386	K	93.6	Very high	85.1	Confident	130 Å²	130	46.3 Å²	46.3	57%	0.565	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100	125.7	165.9	-64.7	-178.3	-178.1	179.4	0	108.8	E162 S288	E162-K386 WeakPolarHBondContact O-CA 3.31Å; S288-K386 WeakPolarHBondContact CA-O 3.29Å; S288-K386 VanDerWaalsContact CB-O 3.23Å; S288-K386 WeakPolarHBondContact CB-O 3.35Å; S288-K386 PolarHBondContact OG-O 2.89Å
387	Y	95.9	Very high	84.4	Confident	8 Å²	8	53.5 Å²	53.5	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	165.6	-176	65.5	-90.9	0	0	0	112.2	S161 E162 V164 K170 Y172 C286 R287 V376 I385 V389	S161-Y387 WeakPolarHBondContact CA-O 3.2Å; E162-Y387 HydrophobicContact CB-CE1 4.18Å; E162-Y387 HydrophobicContact CB-CE2 3.94Å; E162-Y387 PolarHBondContact N-O 3.13Å; E162-Y387 PolarHBondContact O-N 3.33Å; V164-Y387 HydrophobicContact CB-CE1 4.03Å; V164-Y387 HydrophobicContact CG1-CD1 4.25Å; V164-Y387 HydrophobicContact CG1-CE1 3.82Å; K170-Y387 WeakPolarHBondContact CB-OH 3.21Å; Y172-Y387 HydrophobicContact CE2-CE2 4.25Å; Y172-Y387 WeakPolarHBondContact CE2-OH 3.48Å; Y172-Y387 VanDerWaalsContact OH-CE2 3.29Å; Y172-Y387 WeakPolarHBondContact OH-CE2 3.2Å; Y172-Y387 PolarHBondContact OH-OH 3.33Å; C286-Y387 VanDerWaalsContact SG-CD2 3.52Å; R287-Y387 CarbonylContact O-C 3.58Å; R287-Y387 VanDerWaalsContact O-CA 3.27Å; R287-Y387 WeakPolarHBondContact O-CA 3.5Å; V376-Y387 HydrophobicContact CB-CE1 4.06Å; V376-Y387 HydrophobicContact CB-CE2 4.01Å; V376-Y387 HydrophobicContact CG1-CD1 3.87Å; V376-Y387 HydrophobicContact CG1-CD2 4.24Å; V376-Y387 HydrophobicContact CG1-CE1 3.78Å; V376-Y387 HydrophobicContact CG1-CE2 4.18Å; V376-Y387 HydrophobicContact CG1-CG 4.11Å; V376-Y387 HydrophobicContact CG2-CD2 4.06Å; V376-Y387 HydrophobicContact CG2-CE2 3.6Å; I385-Y387 HydrophobicContact CG2-CD1 4.07Å; Y387-V389 HydrophobicContact CD2-CB 4.2Å; Y387-V389 HydrophobicContact CD2-CG1 4.44Å; Y387-V389 HydrophobicContact CE2-CB 4.14Å; Y387-V389 HydrophobicContact CE2-CG1 3.97Å
388	K	97	Very high	84.1	Confident	125 Å²	125	55.7 Å²	55.7	54%	0.543	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.3	167.9	-61.2	-167.7	173.7	-172.6	0	108.8	V159 S160 S161 C286 R287	V159-K388 HydrophobicContact CG1-CB 4.13Å; V159-K388 HydrophobicContact CG1-CD 4.34Å; S160-K388 CarbonylContact O-C 3.56Å; S160-K388 VanDerWaalsContact O-CA 3.24Å; S160-K388 WeakPolarHBondContact O-CA 3.39Å; S161-K388 WeakPolarHBondContact OG-CE 3.47Å; S161-K388 WeakPolarHBondContact OG-CG 3.43Å; C286-K388 CarbonylContact C-O 3.58Å; C286-K388 VanDerWaalsContact CA-O 3.3Å; C286-K388 WeakPolarHBondContact CA-O 3.3Å; R287-K388 PolarHBondContact N-O 3.46Å; R287-K388 PolarHBondContact O-N 3.38Å
389	V	97.2	Very high	84.2	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	142.7	177.8	66.4	0	0	0	0	110.4	L154 S160 Y172 I284 S285 C286 F374 Y387	L154-V389 HydrophobicContact CD2-CG1 4.17Å; L154-V389 HydrophobicContact CD2-CG2 4.4Å; S160-V389 PolarHBondContact N-O 2.64Å; S160-V389 PolarHBondContact O-N 3.5Å; Y172-V389 HydrophobicContact CD1-CG1 4.33Å; Y172-V389 HydrophobicContact CE1-CG1 3.7Å; Y172-V389 HydrophobicContact CE2-CG1 4.06Å; I284-V389 HydrophobicContact CG2-CG2 4.28Å; S285-V389 CarbonylContact O-C 3.48Å; S285-V389 WeakPolarHBondContact O-CA 3.32Å; C286-V389 HydrophobicContact CB-CB 4.36Å; C286-V389 HydrophobicContact CB-CG2 4.19Å; F374-V389 HydrophobicContact CE2-CG2 3.91Å; F374-V389 HydrophobicContact CZ-CG2 4.08Å; Y387-V389 HydrophobicContact CD2-CB 4.2Å; Y387-V389 HydrophobicContact CD2-CG1 4.44Å; Y387-V389 HydrophobicContact CE2-CB 4.14Å; Y387-V389 HydrophobicContact CE2-CG1 3.97Å
390	R	95.1	Very high	85	Confident	87 Å²	87	63.1 Å²	63.1	33%	0.328	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	151.8	176.5	69.1	-176.6	-55.3	-161.2	0.5	111.5	G157 E158 V159 S285 M392	G157-R390 PolarHBondContact O-NH2 3.2Å; E158-R390 WeakPolarHBondContact O-CA 3.14Å; E158-R390 VanDerWaalsContact O-CB 3.22Å; E158-R390 WeakPolarHBondContact O-CB 3.37Å; V159-R390 HydrophobicContact CG2-CB 4.11Å; S285-R390 PolarHBondContact N-O 3.1Å; S285-R390 PolarHBondContact O-N 2.87Å; R390-M392 VanDerWaalsContact CD-SD 3.6Å; R390-M392 HydrophobicContact CG-CG 4.1Å; R390-M392 HydrophobicContact CG-SD 4.06Å; R390-M392 PolarHBondContact NE-SD 2.89Å; R390-M392 PolarHBondContact NH1-SD 3.25Å
391	V	90.7	Very high	86	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.3	172	-177.4	0	0	0	0	108.4	L154 F156 G157 I174 I282 I283 I284 F374	L154-V391 HydrophobicContact CD2-CG2 3.76Å; L154-V391 HydrophobicContact CG-CG2 4.41Å; F156-V391 HydrophobicContact CD1-CG1 3.83Å; F156-V391 HydrophobicContact CE1-CG1 3.59Å; F156-V391 HydrophobicContact CZ-CG1 4.11Å; G157-V391 PolarHBondContact N-O 2.67Å; I174-V391 HydrophobicContact CG2-CB 4.33Å; I174-V391 HydrophobicContact CG2-CG1 4.31Å; I174-V391 HydrophobicContact CG2-CG2 3.54Å; I282-V391 HydrophobicContact CG2-CG1 3.79Å; I283-V391 CarbonylContact O-C 3.43Å; I283-V391 WeakPolarHBondContact O-CA 3.35Å; I284-V391 HydrophobicContact CG1-CG1 4.43Å; I284-V391 HydrophobicContact CG1-CG2 4.07Å; I284-V391 HydrophobicContact CG2-CG2 4.45Å; F374-V391 HydrophobicContact CE1-CG2 4.44Å; F374-V391 HydrophobicContact CZ-CG2 4.47Å
392	M	88.5	Confident	87.5	Confident	60 Å²	60	64 Å²	64	30%	0.296	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	155.4	-172.7	-59.6	175.3	65.7	0	0	111.4	I282 I283 R390	I282-M392 WeakPolarHBondContact CA-O 3.13Å; I283-M392 PolarHBondContact N-O 2.91Å; I283-M392 PolarHBondContact O-N 3.13Å; R390-M392 VanDerWaalsContact CD-SD 3.6Å; R390-M392 HydrophobicContact CG-CG 4.1Å; R390-M392 HydrophobicContact CG-SD 4.06Å; R390-M392 PolarHBondContact NE-SD 2.89Å; R390-M392 PolarHBondContact NH1-SD 3.25Å
393	V	84.9	Confident	89.4	Confident	40 Å²	40	62 Å²	62	24%	0.242	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	134.5	163.8	-149.8	0	0	0	0	107.8	F273 E277 K280	F273-V393 HydrophobicContact CD2-CG2 4.02Å; F273-V393 HydrophobicContact CE1-CG1 4.41Å; F273-V393 HydrophobicContact CE1-CG2 4.32Å; F273-V393 HydrophobicContact CE2-CB 4.23Å; F273-V393 HydrophobicContact CE2-CG1 4.46Å; F273-V393 HydrophobicContact CE2-CG2 2.99Å; F273-V393 HydrophobicContact CZ-CB 3.96Å; F273-V393 HydrophobicContact CZ-CG1 3.82Å; F273-V393 HydrophobicContact CZ-CG2 3.17Å; E277-V393 HydrophobicContact CB-CG1 4.14Å; K280-V393 HydrophobicContact CB-CG1 3.96Å; K280-V393 HydrophobicContact CD-CG1 4.24Å
394	A	87.2	Confident	90.5	Very high	5 Å²	5	59.1 Å²	59.1	4%	0.041	32%	0.323	C	S	.	.			trans	-73.1	134.2	170.2	0	0	0	0	0	110.3	K280 G281 I283 L325 C396	K280-A394 WeakPolarHBondContact CB-O 3.47Å; K280-A394 VanDerWaalsContact O-CB 3.28Å; K280-A394 WeakPolarHBondContact O-CB 3.23Å; G281-A394 PolarHBondContact O-N 3.06Å; I283-A394 HydrophobicContact CD1-CB 3.88Å; I283-A394 HydrophobicContact CG1-CB 3.93Å; L325-A394 HydrophobicContact CD2-CB 3.36Å; A394-C396 VanDerWaalsContact C-N 3.33Å; A394-C396 PolarHBondContact O-N 2.81Å
395	S	85.5	Confident	90.8	Very high	95 Å²	95	62.3 Å²	62.3	66%	0.664	33%	0.332	S	S	*	.			trans	-86.4	75.7	170.1	-54	0	0	0	0	109.4	D397 S398	S395-D397 PolarHBondContact O-N 3.21Å; S395-D397 VanDerWaalsContact O-N 3.15Å; S395-S398 WeakPolarHBondContact O-CB 3.23Å; S395-S398 PolarHBondContact O-N 2.77Å
396	C	84	Confident	91.1	Very high	21 Å²	21	66 Å²	66	14%	0.142	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.4	-176.5	-80.2	0	0	0	0	114.6	K280 F327 A394 S398 V401	K280-C396 PolarHBondContact O-SG 2.74Å; F327-C396 HydrophobicContact CE1-CB 4.34Å; F327-C396 VanDerWaalsContact CE1-SG 3.56Å; A394-C396 VanDerWaalsContact C-N 3.33Å; A394-C396 PolarHBondContact O-N 2.81Å; C396-S398 VanDerWaalsContact C-N 3.28Å; C396-V401 WeakPolarHBondContact O-CG2 3.47Å
397	D	82	Confident	91.3	Very high	152 Å²	152	63 Å²	63	81%	0.813	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	1.1	177.2	-51.7	-38.9	0	0	0	112.8	S395	S395-D397 PolarHBondContact O-N 3.21Å; S395-D397 VanDerWaalsContact O-N 3.15Å
398	S	87.6	Confident	91.3	Very high	46 Å²	46	64.3 Å²	64.3	32%	0.322	35%	0.351	S	S	.	.	S	Bend	trans	-63.2	139.5	177.8	176.8	0	0	0	0	111	S395 C396 A400 V401	S395-S398 WeakPolarHBondContact O-CB 3.23Å; S395-S398 PolarHBondContact O-N 2.77Å; C396-S398 VanDerWaalsContact C-N 3.28Å; S398-A400 PolarHBondContact O-N 3Å; S398-A400 PolarHBondContact OG-N 3.13Å; S398-V401 WeakPolarHBondContact O-CB 3.41Å; S398-V401 PolarHBondContact O-N 3.19Å
399	P	92.3	Very high	91.1	Very high	107 Å²	107	61.3 Å²	61.3	70%	0.695	35%	0.349	S	S	*	.	H	α-helix	trans	-52.9	-26.8	172	-26.2	34.2	0	0	0	113.5	V401 Q402 V403	P399-V401 VanDerWaalsContact C-N 3.26Å; P399-V401 PolarHBondContact O-N 2.99Å; P399-Q402 PolarHBondContact O-N 2.77Å; P399-V403 PolarHBondContact O-N 3.24Å
400	A	92.9	Very high	91.1	Very high	53 Å²	53	67.3 Å²	67.3	44%	0.438	38%	0.375	S	S	.	.	H	α-helix	trans	-60.2	-34.5	175.9	0	0	0	0	0	112.8	S398 Q402 V403 I404	S398-A400 PolarHBondContact O-N 3Å; S398-A400 PolarHBondContact OG-N 3.13Å; A400-Q402 VanDerWaalsContact C-N 3.33Å; A400-Q402 PolarHBondContact O-N 3.37Å; A400-V403 PolarHBondContact O-N 2.91Å; A400-I404 VanDerWaalsContact O-CG1 3.26Å; A400-I404 WeakPolarHBondContact O-CG1 3.42Å; A400-I404 PolarHBondContact O-N 3.32Å
401	V	90.7	Very high	91.1	Very high	17 Å²	17	65.8 Å²	65.8	10%	0.103	37%	0.373	C	S	.	.	H	α-helix	trans	-66.1	-38.5	179.2	174.4	0	0	0	0	111.1	F327 C396 S398 P399 I404 R405	F327-V401 HydrophobicContact CE1-CG1 3.78Å; F327-V401 HydrophobicContact CE2-CG1 4.21Å; F327-V401 HydrophobicContact CZ-CG1 3.48Å; F327-V401 VanDerWaalsContact CZ-CG1 3.48Å; F327-V401 HydrophobicContact CZ-CG2 4.25Å; C396-V401 WeakPolarHBondContact O-CG2 3.47Å; S398-V401 WeakPolarHBondContact O-CB 3.41Å; S398-V401 PolarHBondContact O-N 3.19Å; P399-V401 VanDerWaalsContact C-N 3.26Å; P399-V401 PolarHBondContact O-N 2.99Å; V401-I404 PolarHBondContact O-N 3.3Å; V401-R405 WeakPolarHBondContact O-CG 3.1Å; V401-R405 PolarHBondContact O-N 2.72Å
402	Q	91.3	Very high	91.3	Very high	95 Å²	95	67.5 Å²	67.5	44%	0.444	39%	0.386	S	S	.	.	H	α-helix	trans	-65.1	-43.7	175.2	-170.1	59.1	41.3	0	0	111	P399 A400 I404 R405 D406	P399-Q402 PolarHBondContact O-N 2.77Å; A400-Q402 VanDerWaalsContact C-N 3.33Å; A400-Q402 PolarHBondContact O-N 3.37Å; Q402-I404 VanDerWaalsContact C-N 3.32Å; Q402-I404 PolarHBondContact O-N 3.41Å; Q402-R405 PolarHBondContact O-N 2.66Å; Q402-D406 PolarHBondContact NE2-OD1 2.84Å; Q402-D406 WeakPolarHBondContact O-CB 3.5Å; Q402-D406 PolarHBondContact O-N 3Å
403	V	96.5	Very high	91.6	Very high	89 Å²	89	69.6 Å²	69.6	54%	0.539	39%	0.394	S	S	.	.	H	α-helix	trans	-60	-42.1	175.8	176.6	0	0	0	0	111.6	P399 A400 T407	P399-V403 PolarHBondContact O-N 3.24Å; A400-V403 PolarHBondContact O-N 2.91Å; V403-T407 VanDerWaalsContact O-CB 3.25Å; V403-T407 WeakPolarHBondContact O-CB 3.11Å; V403-T407 PolarHBondContact O-N 3.22Å; V403-T407 PolarHBondContact O-OG1 3.11Å
404	I	93.5	Very high	92.1	Very high	68 Å²	68	73.6 Å²	73.6	35%	0.349	41%	0.406	S	S	.	.	H	α-helix	trans	-59.4	-53.2	176.1	-69.8	164.4	0	0	0	109.7	L329 A400 V401 Q402 D406 T407 E408	L329-I404 HydrophobicContact CD2-CG2 4.18Å; A400-I404 VanDerWaalsContact O-CG1 3.26Å; A400-I404 WeakPolarHBondContact O-CG1 3.42Å; A400-I404 PolarHBondContact O-N 3.32Å; V401-I404 PolarHBondContact O-N 3.3Å; Q402-I404 VanDerWaalsContact C-N 3.32Å; Q402-I404 PolarHBondContact O-N 3.41Å; I404-D406 PolarHBondContact O-N 2.84Å; I404-T407 PolarHBondContact O-N 3.16Å; I404-E408 HydrophobicContact CG2-CG 4.22Å; I404-E408 WeakPolarHBondContact O-CB 3.45Å; I404-E408 WeakPolarHBondContact O-CG 3.35Å; I404-E408 PolarHBondContact O-N 2.84Å
405	R	92.4	Very high	92.4	Very high	110 Å²	110	76.7 Å²	76.7	42%	0.415	42%	0.419	S	S	.	.	H	α-helix	trans	-58	-47	-179.8	-72	176.3	179.9	175.1	1.6	112.5	V401 Q402 T407 E408 A409	V401-R405 WeakPolarHBondContact O-CG 3.1Å; V401-R405 PolarHBondContact O-N 2.72Å; Q402-R405 PolarHBondContact O-N 2.66Å; R405-T407 VanDerWaalsContact C-N 3.31Å; R405-T407 PolarHBondContact O-N 2.84Å; R405-E408 PolarHBondContact O-N 3.22Å; R405-A409 VanDerWaalsContact O-CB 3.27Å; R405-A409 WeakPolarHBondContact O-CB 3.16Å; R405-A409 PolarHBondContact O-N 2.81Å
406	D	95.4	Very high	92.8	Very high	78 Å²	78	78.4 Å²	78.4	42%	0.417	42%	0.416	S	S	.	.	H	α-helix	trans	-64.3	-38.1	180	-66.2	-17	0	0	0	111.5	Q402 I404 K410	Q402-D406 PolarHBondContact NE2-OD1 2.84Å; Q402-D406 WeakPolarHBondContact O-CB 3.5Å; Q402-D406 PolarHBondContact O-N 3Å; I404-D406 PolarHBondContact O-N 2.84Å; D406-K410 WeakPolarHBondContact O-CG 3.29Å; D406-K410 PolarHBondContact O-N 2.88Å; D406-K410 VanDerWaalsContact O-N 3.16Å
407	T	96.7	Very high	93.3	Very high	68 Å²	68	81.5 Å²	81.5	42%	0.417	43%	0.429	S	S	.	.	H	α-helix	trans	-71.8	-46.5	179.4	-56.4	0	0	0	0	111.4	V403 I404 R405 A409 K410 L411	V403-T407 VanDerWaalsContact O-CB 3.25Å; V403-T407 WeakPolarHBondContact O-CB 3.11Å; V403-T407 PolarHBondContact O-N 3.22Å; V403-T407 PolarHBondContact O-OG1 3.11Å; I404-T407 PolarHBondContact O-N 3.16Å; R405-T407 VanDerWaalsContact C-N 3.31Å; R405-T407 PolarHBondContact O-N 2.84Å; T407-A409 VanDerWaalsContact C-N 3.31Å; T407-A409 PolarHBondContact O-N 3.44Å; T407-K410 PolarHBondContact O-N 3.18Å; T407-L411 HydrophobicContact CG2-CD1 4.17Å; T407-L411 HydrophobicContact CG2-CG 4.5Å; T407-L411 WeakPolarHBondContact O-CG 3.05Å; T407-L411 PolarHBondContact O-N 3.5Å
408	E	95.3	Very high	93.8	Very high	35 Å²	35	76.8 Å²	76.8	16%	0.164	40%	0.402	C	S	.	.	H	α-helix	trans	-63.9	-36.4	178.1	-73.1	-176.9	164.9	0	0	111.9	M330 F359 I404 R405 L411 S412	M330-E408 HydrophobicContact CB-CB 4.42Å; M330-E408 HydrophobicContact CB-CG 3.95Å; M330-E408 HydrophobicContact CG-CB 3.84Å; M330-E408 HydrophobicContact CG-CG 3.91Å; M330-E408 PolarHBondContact N-OE1 2.9Å; M330-E408 PolarHBondContact N-OE2 3.16Å; F359-E408 HydrophobicContact CZ-CB 4.27Å; F359-E408 HydrophobicContact CZ-CG 4.38Å; I404-E408 HydrophobicContact CG2-CG 4.22Å; I404-E408 WeakPolarHBondContact O-CB 3.45Å; I404-E408 WeakPolarHBondContact O-CG 3.35Å; I404-E408 PolarHBondContact O-N 2.84Å; R405-E408 PolarHBondContact O-N 3.22Å; E408-L411 PolarHBondContact O-N 2.81Å; E408-S412 WeakPolarHBondContact O-CB 3.42Å; E408-S412 PolarHBondContact O-N 3.46Å; E408-S412 PolarHBondContact O-OG 3.44Å
409	A	94.2	Very high	93.8	Very high	61 Å²	61	77.3 Å²	77.3	50%	0.504	41%	0.409	S	S	.	.	H	α-helix	trans	-63.1	-45.8	172.9	0	0	0	0	0	111.9	R405 T407 S412 Q413	R405-A409 VanDerWaalsContact O-CB 3.27Å; R405-A409 WeakPolarHBondContact O-CB 3.16Å; R405-A409 PolarHBondContact O-N 2.81Å; T407-A409 VanDerWaalsContact C-N 3.31Å; T407-A409 PolarHBondContact O-N 3.44Å; A409-S412 WeakPolarHBondContact O-CB 3.21Å; A409-S412 PolarHBondContact O-N 3.03Å; A409-Q413 PolarHBondContact O-N 2.83Å
410	K	96.5	Very high	93.7	Very high	127 Å²	127	79 Å²	79	55%	0.552	41%	0.408	S	S	*	.	H	α-helix	trans	-62.7	-42.9	175.2	-74.5	175.3	-177.6	178.7	0	112.6	D406 T407 S412 Q413 Y414	D406-K410 WeakPolarHBondContact O-CG 3.29Å; D406-K410 PolarHBondContact O-N 2.88Å; D406-K410 VanDerWaalsContact O-N 3.16Å; T407-K410 PolarHBondContact O-N 3.18Å; K410-S412 VanDerWaalsContact C-N 3.31Å; K410-S412 PolarHBondContact O-N 3.35Å; K410-Q413 WeakPolarHBondContact O-CB 3.43Å; K410-Q413 PolarHBondContact O-N 3.12Å; K410-Y414 WeakPolarHBondContact O-CD2 3.34Å; K410-Y414 PolarHBondContact O-N 3.15Å
411	L	95.8	Very high	93.8	Very high	54 Å²	54	82.4 Å²	82.4	28%	0.283	41%	0.413	S	S	.	.	H	α-helix	trans	-63.7	-38.3	176.6	-72.2	172.8	0	0	0	111.7	L356 F359 T407 E408 Q413 Y414 K415	L356-L411 HydrophobicContact CD2-CD2 4.11Å; F359-L411 HydrophobicContact CD1-CB 4.35Å; F359-L411 HydrophobicContact CE1-CB 3.67Å; F359-L411 HydrophobicContact CE2-CB 4.17Å; F359-L411 HydrophobicContact CE2-CD1 3.96Å; F359-L411 HydrophobicContact CZ-CB 3.56Å; F359-L411 HydrophobicContact CZ-CD1 4.1Å; T407-L411 HydrophobicContact CG2-CD1 4.17Å; T407-L411 HydrophobicContact CG2-CG 4.5Å; T407-L411 WeakPolarHBondContact O-CG 3.05Å; T407-L411 PolarHBondContact O-N 3.5Å; E408-L411 PolarHBondContact O-N 2.81Å; L411-Q413 VanDerWaalsContact C-N 3.34Å; L411-Y414 PolarHBondContact O-N 3.34Å; L411-K415 WeakPolarHBondContact O-CB 3.22Å; L411-K415 PolarHBondContact O-N 2.91Å
412	S	93.7	Very high	93.9	Very high	37 Å²	37	83.6 Å²	83.6	26%	0.259	42%	0.417	S	S	.	.	H	α-helix	trans	-62.7	-42.1	174.4	-60.2	0	0	0	0	111.6	F359 E408 A409 K410 K415 Q416	F359-S412 WeakPolarHBondContact CE1-OG 3.43Å; E408-S412 WeakPolarHBondContact O-CB 3.42Å; E408-S412 PolarHBondContact O-N 3.46Å; E408-S412 PolarHBondContact O-OG 3.44Å; A409-S412 WeakPolarHBondContact O-CB 3.21Å; A409-S412 PolarHBondContact O-N 3.03Å; K410-S412 VanDerWaalsContact C-N 3.31Å; K410-S412 PolarHBondContact O-N 3.35Å; S412-K415 PolarHBondContact O-N 3.32Å; S412-Q416 WeakPolarHBondContact O-CG 3.43Å; S412-Q416 PolarHBondContact O-N 3.27Å
413	Q	95.8	Very high	93.7	Very high	103 Å²	103	84.7 Å²	84.7	48%	0.481	43%	0.426	S	S	.	.	H	α-helix	trans	-61.3	-50.2	173.6	-179.7	-178	-4.7	0	0	111.2	A409 K410 L411 K415 Q416 E417	A409-Q413 PolarHBondContact O-N 2.83Å; K410-Q413 WeakPolarHBondContact O-CB 3.43Å; K410-Q413 PolarHBondContact O-N 3.12Å; L411-Q413 VanDerWaalsContact C-N 3.34Å; Q413-K415 VanDerWaalsContact C-N 3.3Å; Q413-K415 PolarHBondContact O-N 3.3Å; Q413-Q416 WeakPolarHBondContact O-CB 3.46Å; Q413-Q416 PolarHBondContact O-N 3.22Å; Q413-Q416 VanDerWaalsContact O-N 3.08Å; Q413-E417 HydrophobicContact CG-CG 4.4Å; Q413-E417 WeakPolarHBondContact CG-OE1 3.22Å; Q413-E417 PolarHBondContact NE2-OE1 3.3Å; Q413-E417 PolarHBondContact O-N 3.35Å
414	Y	95.6	Very high	93.5	Very high	125 Å²	125	83.2 Å²	83.2	49%	0.49	42%	0.423	S	S	.	.	H	α-helix	trans	-60.3	-37.9	177.9	-71.1	-42.9	0	0	0	112.8	K410 L411 Q416 E417 M418	K410-Y414 WeakPolarHBondContact O-CD2 3.34Å; K410-Y414 PolarHBondContact O-N 3.15Å; L411-Y414 PolarHBondContact O-N 3.34Å; Y414-Q416 VanDerWaalsContact C-N 3.27Å; Y414-Q416 PolarHBondContact O-N 3.05Å; Y414-E417 PolarHBondContact O-N 3.1Å; Y414-M418 VanDerWaalsContact O-CB 3.26Å; Y414-M418 WeakPolarHBondContact O-CB 3.39Å; Y414-M418 WeakPolarHBondContact O-CG 3.38Å; Y414-M418 PolarHBondContact O-N 3.41Å
415	K	93.2	Very high	93.5	Very high	70 Å²	70	83.9 Å²	83.9	30%	0.304	42%	0.422	S	S	.	.	H	α-helix	trans	-57.9	-41.6	175.1	-171.6	174.7	-174.4	169.9	0	111.7	L356 D357 F359 L411 S412 Q413 A419	L356-K415 HydrophobicContact CB-CB 4.18Å; L356-K415 HydrophobicContact CB-CD 4.3Å; L356-K415 HydrophobicContact CB-CG 4.06Å; L356-K415 HydrophobicContact CD1-CB 3.91Å; L356-K415 WeakPolarHBondContact O-CE 3.38Å; L356-K415 PolarHBondContact O-NZ 2.86Å; L356-K415 VanDerWaalsContact O-NZ 3.08Å; D357-K415 PolarHBondContact O-NZ 2.95Å; F359-K415 HydrophobicContact CD1-CD 4.42Å; F359-K415 PolarHBondContact O-NZ 3.46Å; L411-K415 WeakPolarHBondContact O-CB 3.22Å; L411-K415 PolarHBondContact O-N 2.91Å; S412-K415 PolarHBondContact O-N 3.32Å; Q413-K415 VanDerWaalsContact C-N 3.3Å; Q413-K415 PolarHBondContact O-N 3.3Å; K415-A419 WeakPolarHBondContact O-CB 3.49Å; K415-A419 PolarHBondContact O-N 3.13Å
416	Q	92.6	Very high	93.4	Very high	131 Å²	131	81.2 Å²	81.2	61%	0.612	42%	0.415	S	S	*	.	H	α-helix	trans	-70.7	-46.6	177.9	-66.2	176.1	6.1	0	0	112	S412 Q413 Y414 M418 A419 Q420	S412-Q416 WeakPolarHBondContact O-CG 3.43Å; S412-Q416 PolarHBondContact O-N 3.27Å; Q413-Q416 WeakPolarHBondContact O-CB 3.46Å; Q413-Q416 PolarHBondContact O-N 3.22Å; Q413-Q416 VanDerWaalsContact O-N 3.08Å; Y414-Q416 VanDerWaalsContact C-N 3.27Å; Y414-Q416 PolarHBondContact O-N 3.05Å; Q416-M418 PolarHBondContact O-N 2.98Å; Q416-A419 PolarHBondContact O-N 3.24Å; Q416-Q420 WeakPolarHBondContact O-CG 3.41Å; Q416-Q420 PolarHBondContact O-N 2.64Å; Q416-Q420 VanDerWaalsContact O-N 3.11Å
417	E	94.8	Very high	93.2	Very high	86 Å²	86	83.3 Å²	83.3	40%	0.402	42%	0.423	S	S	.	.	H	α-helix	trans	-62.3	-42	178.4	-70.6	176.9	-176.1	0	0	111.8	Q413 Y414 A419 Q420 F421	Q413-E417 HydrophobicContact CG-CG 4.4Å; Q413-E417 WeakPolarHBondContact CG-OE1 3.22Å; Q413-E417 PolarHBondContact NE2-OE1 3.3Å; Q413-E417 PolarHBondContact O-N 3.35Å; Y414-E417 PolarHBondContact O-N 3.1Å; E417-A419 PolarHBondContact O-N 3.12Å; E417-Q420 PolarHBondContact O-N 3.25Å; E417-F421 WeakPolarHBondContact O-CB 3.09Å; E417-F421 PolarHBondContact O-N 3.48Å
418	M	92.9	Very high	93	Very high	52 Å²	52	82.7 Å²	82.7	26%	0.256	43%	0.425	S	S	.	.	H	α-helix	trans	-66.1	-36.5	176.9	-71.3	-176.3	75.2	0	0	112.4	Q352 F353 L356 Y414 Q416 F421 K422	Q352-M418 WeakPolarHBondContact O-CE 3.26Å; F353-M418 WeakPolarHBondContact CD1-O 3.38Å; L356-M418 HydrophobicContact CD1-SD 4.37Å; Y414-M418 VanDerWaalsContact O-CB 3.26Å; Y414-M418 WeakPolarHBondContact O-CB 3.39Å; Y414-M418 WeakPolarHBondContact O-CG 3.38Å; Y414-M418 PolarHBondContact O-N 3.41Å; Q416-M418 PolarHBondContact O-N 2.98Å; M418-F421 PolarHBondContact O-N 2.92Å; M418-K422 WeakPolarHBondContact O-CB 3.16Å; M418-K422 PolarHBondContact O-N 2.8Å
419	A	88.3	Confident	92.8	Very high	57 Å²	57	83.1 Å²	83.1	47%	0.471	43%	0.426	S	S	.	.	H	α-helix	trans	-63.8	-43.4	174.6	0	0	0	0	0	111.6	K415 Q416 E417 K422	K415-A419 WeakPolarHBondContact O-CB 3.49Å; K415-A419 PolarHBondContact O-N 3.13Å; Q416-A419 PolarHBondContact O-N 3.24Å; E417-A419 PolarHBondContact O-N 3.12Å; A419-K422 WeakPolarHBondContact O-CB 3.42Å; A419-K422 PolarHBondContact O-N 2.97Å
420	Q	90.6	Very high	92.6	Very high	142 Å²	142	86.3 Å²	86.3	66%	0.664	43%	0.429	S	S	*	.	H	α-helix	trans	-66.5	-41.1	175.4	-66.8	173.4	10.8	0	0	112	Q416 E417 K422	Q416-Q420 WeakPolarHBondContact O-CG 3.41Å; Q416-Q420 PolarHBondContact O-N 2.64Å; Q416-Q420 VanDerWaalsContact O-N 3.11Å; E417-Q420 PolarHBondContact O-N 3.25Å; Q420-K422 VanDerWaalsContact C-N 3.32Å; Q420-K422 PolarHBondContact O-N 2.93Å
421	F	94.7	Very high	92.5	Very high	125 Å²	125	85.5 Å²	85.5	55%	0.548	43%	0.427	S	S	.	.	H	α-helix	trans	-67.8	-31.3	178.6	-178.8	-120.8	0	0	0	112.5	F353 E417 M418 D423 A424 Y425	F353-F421 HydrophobicContact CE1-CB 4.49Å; F353-F421 AromaticContact CE1-CD1 3.65Å; F353-F421 HydrophobicContact CE1-CD1 3.65Å; F353-F421 HydrophobicContact CE1-CE1 4.31Å; F353-F421 HydrophobicContact CE1-CG 4.42Å; F353-F421 AromaticContact CZ-CD1 3.73Å; F353-F421 HydrophobicContact CZ-CD1 3.73Å; F353-F421 AromaticContact CZ-CE1 3.95Å; F353-F421 HydrophobicContact CZ-CE1 3.95Å; E417-F421 WeakPolarHBondContact O-CB 3.09Å; E417-F421 PolarHBondContact O-N 3.48Å; M418-F421 PolarHBondContact O-N 2.92Å; F421-D423 VanDerWaalsContact C-N 3.32Å; F421-D423 PolarHBondContact O-N 3.06Å; F421-A424 PolarHBondContact O-N 2.81Å; F421-Y425 HydrophobicContact CZ-CD2 4.49Å; F421-Y425 WeakPolarHBondContact O-CB 3.42Å; F421-Y425 PolarHBondContact O-N 3.04Å
422	K	91.1	Very high	92.4	Very high	43 Å²	43	88.8 Å²	88.8	19%	0.187	44%	0.439	C	S	.	.	H	α-helix	trans	-54	-48.9	176.2	-176.8	-179.9	175.1	169	0	111.2	E343 V349 F353 M418 A419 Q420 A424 Y425 M426	E343-K422 IonicContact OE2-NZ 3.07Å; E343-K422 PolarHBondContact OE2-NZ 3.27Å; V349-K422 HydrophobicContact CG1-CD 4.44Å; F353-K422 HydrophobicContact CB-CD 4.31Å; F353-K422 HydrophobicContact CB-CG 4.49Å; F353-K422 HydrophobicContact CD1-CB 3.61Å; F353-K422 HydrophobicContact CD1-CG 4.06Å; F353-K422 HydrophobicContact CD2-CG 4.38Å; F353-K422 HydrophobicContact CE1-CB 3.7Å; F353-K422 HydrophobicContact CE1-CG 4.37Å; F353-K422 HydrophobicContact CG-CB 4.14Å; F353-K422 HydrophobicContact CG-CD 4.4Å; F353-K422 HydrophobicContact CG-CG 4.06Å; F353-K422 HydrophobicContact CZ-CB 4.3Å; M418-K422 WeakPolarHBondContact O-CB 3.16Å; M418-K422 PolarHBondContact O-N 2.8Å; A419-K422 WeakPolarHBondContact O-CB 3.42Å; A419-K422 PolarHBondContact O-N 2.97Å; Q420-K422 VanDerWaalsContact C-N 3.32Å; Q420-K422 PolarHBondContact O-N 2.93Å; K422-A424 PolarHBondContact O-N 2.99Å; K422-Y425 PolarHBondContact O-N 2.99Å; K422-M426 HydrophobicContact CG-CG 4.34Å; K422-M426 VanDerWaalsContact O-CG 3.22Å; K422-M426 WeakPolarHBondContact O-CG 3.45Å; K422-M426 PolarHBondContact O-N 2.88Å
423	D	87.8	Confident	92.2	Very high	117 Å²	117	91.2 Å²	91.2	63%	0.626	45%	0.446	S	S	*	.	H	α-helix	trans	-62.9	-43.8	-178	-65.6	-26	0	0	0	111.6	F421 M426 M427	F421-D423 VanDerWaalsContact C-N 3.32Å; F421-D423 PolarHBondContact O-N 3.06Å; D423-M426 PolarHBondContact O-N 3.46Å; D423-M427 WeakPolarHBondContact O-CB 3.29Å; D423-M427 PolarHBondContact O-N 2.8Å
424	A	92.5	Very high	92.2	Very high	58 Å²	58	90.8 Å²	90.8	48%	0.479	45%	0.445	S	S	.	.	H	α-helix	trans	-63.9	-42	176	0	0	0	0	0	112.3	F421 K422 M427 A428	F421-A424 PolarHBondContact O-N 2.81Å; K422-A424 PolarHBondContact O-N 2.99Å; A424-M427 PolarHBondContact O-N 3.22Å; A424-A428 WeakPolarHBondContact O-CB 3.49Å; A424-A428 PolarHBondContact O-N 3.38Å
425	Y	93.4	Very high	92.2	Very high	83 Å²	83	87.5 Å²	87.5	33%	0.325	44%	0.443	S	S	.	.	H	α-helix	trans	-61.3	-48.3	176.4	176	-87	0	0	0	111.5	P350 F353 F421 K422 M427 A428 K429	P350-Y425 HydrophobicContact CG-CD1 4.23Å; P350-Y425 HydrophobicContact CG-CE1 3.36Å; P350-Y425 HydrophobicContact CG-CE2 4.34Å; P350-Y425 VanDerWaalsContact CG-CZ 3.43Å; P350-Y425 VanDerWaalsContact CG-OH 3.32Å; P350-Y425 WeakPolarHBondContact CG-OH 3.22Å; F353-Y425 AromaticContact CE2-CD1 3.7Å; F353-Y425 HydrophobicContact CE2-CD1 3.7Å; F353-Y425 HydrophobicContact CE2-CD2 4.38Å; F353-Y425 HydrophobicContact CE2-CE1 4.24Å; F353-Y425 AromaticContact CE2-CG 3.79Å; F353-Y425 HydrophobicContact CE2-CG 3.79Å; F353-Y425 HydrophobicContact CZ-CD1 4.19Å; F353-Y425 HydrophobicContact CZ-CD2 4.38Å; F353-Y425 AromaticContact CZ-CG 3.83Å; F353-Y425 HydrophobicContact CZ-CG 3.83Å; F421-Y425 HydrophobicContact CZ-CD2 4.49Å; F421-Y425 WeakPolarHBondContact O-CB 3.42Å; F421-Y425 PolarHBondContact O-N 3.04Å; K422-Y425 PolarHBondContact O-N 2.99Å; Y425-M427 VanDerWaalsContact C-N 3.32Å; Y425-M427 PolarHBondContact O-N 3.22Å; Y425-A428 PolarHBondContact O-N 3.4Å; Y425-K429 HydrophobicContact CE1-CD 4.3Å; Y425-K429 WeakPolarHBondContact O-CB 3.45Å; Y425-K429 PolarHBondContact O-N 3.11Å
426	M	89.4	Confident	92.1	Very high	54 Å²	54	87.1 Å²	87.1	27%	0.266	44%	0.444	S	S	.	.	H	α-helix	trans	-63.3	-39	-179.8	-66.8	-59.8	-68	0	0	111.8	D348 V349 K422 D423 K429 K430	D348-M426 HydrophobicContact CB-CE 3.62Å; V349-M426 HydrophobicContact CB-SD 4.42Å; V349-M426 HydrophobicContact CG2-CE 3.76Å; V349-M426 HydrophobicContact CG2-SD 3.79Å; K422-M426 HydrophobicContact CG-CG 4.34Å; K422-M426 VanDerWaalsContact O-CG 3.22Å; K422-M426 WeakPolarHBondContact O-CG 3.45Å; K422-M426 PolarHBondContact O-N 2.88Å; D423-M426 PolarHBondContact O-N 3.46Å; M426-K429 PolarHBondContact O-N 3.23Å; M426-K430 WeakPolarHBondContact O-CB 3.39Å; M426-K430 PolarHBondContact O-N 3.34Å
427	M	91.4	Very high	92.1	Very high	122 Å²	122	83.4 Å²	83.4	60%	0.601	44%	0.436	S	S	*	.	H	α-helix	trans	-63.8	-44.2	174.5	-174.1	175.2	-178.3	0	0	111.9	D423 A424 Y425 K430 Q431	D423-M427 WeakPolarHBondContact O-CB 3.29Å; D423-M427 PolarHBondContact O-N 2.8Å; A424-M427 PolarHBondContact O-N 3.22Å; Y425-M427 VanDerWaalsContact C-N 3.32Å; Y425-M427 PolarHBondContact O-N 3.22Å; M427-K430 PolarHBondContact O-N 2.89Å; M427-Q431 WeakPolarHBondContact O-CG 3.42Å; M427-Q431 PolarHBondContact O-N 2.89Å
428	A	94	Very high	92.1	Very high	55 Å²	55	85.4 Å²	85.4	46%	0.455	44%	0.443	S	S	.	.	H	α-helix	trans	-65.6	-41.6	177.3	0	0	0	0	0	112.3	A424 Y425 Q431 F432	A424-A428 WeakPolarHBondContact O-CB 3.49Å; A424-A428 PolarHBondContact O-N 3.38Å; Y425-A428 PolarHBondContact O-N 3.4Å; A428-Q431 PolarHBondContact O-N 3.17Å; A428-F432 WeakPolarHBondContact O-CB 3.22Å; A428-F432 PolarHBondContact O-N 2.69Å
429	K	89.8	Confident	92.1	Very high	43 Å²	43	87.3 Å²	87.3	19%	0.187	45%	0.454	C	S	.	.	H	α-helix	trans	-57.3	-50.4	174.5	-174.2	-175.5	-172.3	-88.7	0	110.7	D348 Y425 M426 Q431 F432 E433	D348-K429 WeakPolarHBondContact O-CD 3.18Å; D348-K429 WeakPolarHBondContact O-CE 3.5Å; D348-K429 IonicContact OD1-NZ 2.68Å; D348-K429 PolarHBondContact OD1-NZ 3.42Å; Y425-K429 HydrophobicContact CE1-CD 4.3Å; Y425-K429 WeakPolarHBondContact O-CB 3.45Å; Y425-K429 PolarHBondContact O-N 3.11Å; M426-K429 PolarHBondContact O-N 3.23Å; K429-Q431 PolarHBondContact O-N 2.77Å; K429-F432 WeakPolarHBondContact O-CB 3.2Å; K429-F432 PolarHBondContact O-N 3.15Å; K429-F432 VanDerWaalsContact O-N 3.15Å; K429-E433 WeakPolarHBondContact CE-OE1 3.38Å; K429-E433 IonicContact NZ-OE1 3.99Å; K429-E433 PolarHBondContact NZ-OE1 2.96Å; K429-E433 WeakPolarHBondContact O-CG 2.95Å; K429-E433 PolarHBondContact O-N 3.2Å
430	K	90.8	Very high	92.2	Very high	128 Å²	128	90.1 Å²	90.1	56%	0.557	46%	0.457	S	S	*	.	H	α-helix	trans	-58	-46	177.6	-178.1	-179.5	175.6	-177.9	0	112.2	M426 M427 F432 E433 E434	M426-K430 WeakPolarHBondContact O-CB 3.39Å; M426-K430 PolarHBondContact O-N 3.34Å; M427-K430 PolarHBondContact O-N 2.89Å; K430-F432 VanDerWaalsContact C-N 3.3Å; K430-F432 PolarHBondContact O-N 2.83Å; K430-E433 PolarHBondContact O-N 3.25Å; K430-E434 WeakPolarHBondContact CE-OE1 3.23Å; K430-E434 WeakPolarHBondContact O-CG 2.94Å; K430-E434 PolarHBondContact O-N 3.29Å
431	Q	94.7	Very high	92.5	Very high	111 Å²	111	89.7 Å²	89.7	52%	0.519	45%	0.451	S	S	.	.	H	α-helix	trans	-62.5	-38.3	177.5	-74.3	-180	-3.7	0	0	112.5	M427 A428 K429 A435	M427-Q431 WeakPolarHBondContact O-CG 3.42Å; M427-Q431 PolarHBondContact O-N 2.89Å; A428-Q431 PolarHBondContact O-N 3.17Å; K429-Q431 PolarHBondContact O-N 2.77Å; Q431-A435 WeakPolarHBondContact O-CB 3.42Å; Q431-A435 PolarHBondContact O-N 2.91Å
432	F	94	Very high	92.5	Very high	123 Å²	123	90.8 Å²	90.8	54%	0.539	45%	0.452	S	S	.	.	H	α-helix	trans	-66.2	-43.9	176.3	179	-107.9	0	0	0	111.9	A428 K429 K430 A435 I436	A428-F432 WeakPolarHBondContact O-CB 3.22Å; A428-F432 PolarHBondContact O-N 2.69Å; K429-F432 WeakPolarHBondContact O-CB 3.2Å; K429-F432 PolarHBondContact O-N 3.15Å; K429-F432 VanDerWaalsContact O-N 3.15Å; K430-F432 VanDerWaalsContact C-N 3.3Å; K430-F432 PolarHBondContact O-N 2.83Å; F432-A435 WeakPolarHBondContact O-CB 3.17Å; F432-A435 PolarHBondContact O-N 3.26Å; F432-A435 VanDerWaalsContact O-N 3.16Å; F432-I436 HydrophobicContact CD1-CD1 3.82Å; F432-I436 HydrophobicContact CE1-CD1 3.27Å; F432-I436 HydrophobicContact CE1-CG1 4.27Å; F432-I436 HydrophobicContact CE2-CD1 4.24Å; F432-I436 HydrophobicContact CE2-CG1 4.47Å; F432-I436 HydrophobicContact CZ-CD1 3.52Å; F432-I436 HydrophobicContact CZ-CG1 4.21Å; F432-I436 WeakPolarHBondContact O-CG1 3.11Å; F432-I436 PolarHBondContact O-N 2.92Å
433	E	89.8	Confident	92.5	Very high	87 Å²	87	90.7 Å²	90.7	41%	0.407	46%	0.455	S	S	.	.	H	α-helix	trans	-61.4	-43	174.6	-71.7	169.6	173.6	0	0	111.9	K429 K430 A435 I436 A437	K429-E433 WeakPolarHBondContact CE-OE1 3.38Å; K429-E433 IonicContact NZ-OE1 3.99Å; K429-E433 PolarHBondContact NZ-OE1 2.96Å; K429-E433 WeakPolarHBondContact O-CG 2.95Å; K429-E433 PolarHBondContact O-N 3.2Å; K430-E433 PolarHBondContact O-N 3.25Å; E433-A435 VanDerWaalsContact C-N 3.3Å; E433-A435 PolarHBondContact O-N 3.15Å; E433-I436 PolarHBondContact O-N 3.27Å; E433-A437 WeakPolarHBondContact O-CB 3.31Å; E433-A437 PolarHBondContact O-N 3.43Å
434	E	94.5	Very high	92.6	Very high	95 Å²	95	89.8 Å²	89.8	44%	0.444	45%	0.45	S	S	.	.	H	α-helix	trans	-61.8	-36.5	173.6	-73.7	175.9	-171	0	0	112.3	K430 K438	K430-E434 WeakPolarHBondContact CE-OE1 3.23Å; K430-E434 WeakPolarHBondContact O-CG 2.94Å; K430-E434 PolarHBondContact O-N 3.29Å; E434-K438 WeakPolarHBondContact O-CG 3.48Å; E434-K438 PolarHBondContact O-N 3.34Å; E434-K438 VanDerWaalsContact O-N 3.1Å
435	A	95.3	Very high	92.7	Very high	55 Å²	55	90.9 Å²	90.9	46%	0.455	45%	0.446	S	S	.	.	H	α-helix	trans	-69.5	-41.2	176.1	0	0	0	0	0	112.1	Q431 F432 E433 K438 L439	Q431-A435 WeakPolarHBondContact O-CB 3.42Å; Q431-A435 PolarHBondContact O-N 2.91Å; F432-A435 WeakPolarHBondContact O-CB 3.17Å; F432-A435 PolarHBondContact O-N 3.26Å; F432-A435 VanDerWaalsContact O-N 3.16Å; E433-A435 VanDerWaalsContact C-N 3.3Å; E433-A435 PolarHBondContact O-N 3.15Å; A435-K438 PolarHBondContact O-N 2.64Å; A435-L439 PolarHBondContact O-N 2.61Å
436	I	91.7	Very high	92.7	Very high	62 Å²	62	91 Å²	91	32%	0.318	45%	0.454	S	S	.	.	H	α-helix	trans	-61.4	-49.1	173.5	-71.7	176	0	0	0	110.3	F432 E433 K438 L439 E440	F432-I436 HydrophobicContact CD1-CD1 3.82Å; F432-I436 HydrophobicContact CE1-CD1 3.27Å; F432-I436 HydrophobicContact CE1-CG1 4.27Å; F432-I436 HydrophobicContact CE2-CD1 4.24Å; F432-I436 HydrophobicContact CE2-CG1 4.47Å; F432-I436 HydrophobicContact CZ-CD1 3.52Å; F432-I436 HydrophobicContact CZ-CG1 4.21Å; F432-I436 WeakPolarHBondContact O-CG1 3.11Å; F432-I436 PolarHBondContact O-N 2.92Å; E433-I436 PolarHBondContact O-N 3.27Å; I436-K438 VanDerWaalsContact C-N 3.27Å; I436-K438 PolarHBondContact O-N 2.99Å; I436-L439 WeakPolarHBondContact O-CA 3.29Å; I436-L439 WeakPolarHBondContact O-CB 3.37Å; I436-L439 PolarHBondContact O-N 3.03Å; I436-E440 HydrophobicContact CG2-CG 4.35Å; I436-E440 WeakPolarHBondContact O-CG 3.19Å; I436-E440 PolarHBondContact O-N 3.22Å
437	A	92.9	Very high	92.9	Very high	54 Å²	54	90 Å²	90	45%	0.446	45%	0.451	S	S	.	.	H	α-helix	trans	-58.9	-39	179.5	0	0	0	0	0	112.1	E433 Y441	E433-A437 WeakPolarHBondContact O-CB 3.31Å; E433-A437 PolarHBondContact O-N 3.43Å; A437-Y441 WeakPolarHBondContact O-CB 3.41Å; A437-Y441 PolarHBondContact O-N 2.95Å
438	K	95.4	Very high	93	Very high	127 Å²	127	87.6 Å²	87.6	55%	0.552	44%	0.441	S	S	*	.	H	α-helix	trans	-65.1	-41.9	172.9	-76.3	173.4	-176.8	170.4	0	112.4	E434 A435 I436 Y441 Y442	E434-K438 WeakPolarHBondContact O-CG 3.48Å; E434-K438 PolarHBondContact O-N 3.34Å; E434-K438 VanDerWaalsContact O-N 3.1Å; A435-K438 PolarHBondContact O-N 2.64Å; I436-K438 VanDerWaalsContact C-N 3.27Å; I436-K438 PolarHBondContact O-N 2.99Å; K438-Y441 WeakPolarHBondContact O-CB 3.41Å; K438-Y441 PolarHBondContact O-N 3.18Å; K438-Y442 WeakPolarHBondContact O-CD2 3.49Å; K438-Y442 PolarHBondContact O-N 2.87Å
439	L	91.9	Very high	93	Very high	93 Å²	93	88.7 Å²	88.7	49%	0.487	44%	0.444	S	S	.	.	H	α-helix	trans	-63.5	-42.8	177.3	-179.3	62.7	0	0	0	111.4	A435 I436 Y442 T443 L500	A435-L439 PolarHBondContact O-N 2.61Å; I436-L439 WeakPolarHBondContact O-CA 3.29Å; I436-L439 WeakPolarHBondContact O-CB 3.37Å; I436-L439 PolarHBondContact O-N 3.03Å; L439-Y442 PolarHBondContact O-N 3.41Å; L439-T443 VanDerWaalsContact O-CB 3.32Å; L439-T443 WeakPolarHBondContact O-CB 3.43Å; L439-T443 PolarHBondContact O-N 3.15Å; L439-T443 PolarHBondContact O-OG1 3.08Å; L439-L500 HydrophobicContact CD2-CD1 4.41Å
440	E	91.3	Very high	93.2	Very high	116 Å²	116	88.9 Å²	88.9	54%	0.542	45%	0.447	S	S	.	.	H	α-helix	trans	-62	-44.5	174.6	-71.7	-178.4	171.3	0	0	111.7	I436 T443 N444	I436-E440 HydrophobicContact CG2-CG 4.35Å; I436-E440 WeakPolarHBondContact O-CG 3.19Å; I436-E440 PolarHBondContact O-N 3.22Å; E440-T443 PolarHBondContact O-N 2.91Å; E440-N444 WeakPolarHBondContact O-CB 3.45Å; E440-N444 PolarHBondContact O-N 3.38Å; E440-N444 PolarHBondContact O-ND2 2.99Å
441	Y	95.2	Very high	93.3	Very high	133 Å²	133	88.8 Å²	88.8	52%	0.522	45%	0.447	S	S	.	.	H	α-helix	trans	-55.4	-54.3	173.7	172	-95.3	0	0	0	111.6	A437 K438 T443 N444 E445	A437-Y441 WeakPolarHBondContact O-CB 3.41Å; A437-Y441 PolarHBondContact O-N 2.95Å; K438-Y441 WeakPolarHBondContact O-CB 3.41Å; K438-Y441 PolarHBondContact O-N 3.18Å; Y441-T443 VanDerWaalsContact C-N 3.29Å; Y441-T443 PolarHBondContact O-N 3.26Å; Y441-N444 PolarHBondContact O-N 3.04Å; Y441-E445 HydrophobicContact CD1-CG 4.37Å; Y441-E445 HydrophobicContact CD2-CG 4.34Å; Y441-E445 HydrophobicContact CE1-CG 3.91Å; Y441-E445 HydrophobicContact CE2-CG 3.89Å; Y441-E445 WeakPolarHBondContact O-CG 3.39Å; Y441-E445 PolarHBondContact O-N 3.3Å
442	Y	95.7	Very high	93.3	Very high	147 Å²	147	88.7 Å²	88.7	58%	0.576	45%	0.45	S	S	*	.	H	α-helix	trans	-62.6	-37	179	-73.5	-57.1	0	0	0	112.4	K438 L439 N444 E445 V446	K438-Y442 WeakPolarHBondContact O-CD2 3.49Å; K438-Y442 PolarHBondContact O-N 2.87Å; L439-Y442 PolarHBondContact O-N 3.41Å; Y442-N444 VanDerWaalsContact C-N 3.35Å; Y442-N444 PolarHBondContact O-N 3.3Å; Y442-E445 PolarHBondContact O-N 3.27Å; Y442-V446 VanDerWaalsContact O-CB 3.3Å; Y442-V446 WeakPolarHBondContact O-CB 3.44Å; Y442-V446 WeakPolarHBondContact O-CG2 3.36Å; Y442-V446 PolarHBondContact O-N 2.87Å
443	T	90.5	Very high	93.4	Very high	42 Å²	42	89.2 Å²	89.2	26%	0.258	45%	0.448	S	S	.	.	H	α-helix	trans	-61.9	-44.4	177.1	-60.2	0	0	0	0	111	L439 E440 Y441 T447 L493	L439-T443 VanDerWaalsContact O-CB 3.32Å; L439-T443 WeakPolarHBondContact O-CB 3.43Å; L439-T443 PolarHBondContact O-N 3.15Å; L439-T443 PolarHBondContact O-OG1 3.08Å; E440-T443 PolarHBondContact O-N 2.91Å; Y441-T443 VanDerWaalsContact C-N 3.29Å; Y441-T443 PolarHBondContact O-N 3.26Å; T443-T447 VanDerWaalsContact O-CB 3.23Å; T443-T447 WeakPolarHBondContact O-CB 3.5Å; T443-T447 PolarHBondContact O-N 2.84Å; T443-T447 PolarHBondContact O-OG1 3.33Å; T443-L493 HydrophobicContact CG2-CD1 4.19Å; T443-L493 HydrophobicContact CG2-CD2 4.08Å; T443-L493 HydrophobicContact CG2-CG 4.27Å
444	N	89.8	Confident	93.6	Very high	97 Å²	97	88.4 Å²	88.4	52%	0.519	45%	0.445	S	S	.	.	H	α-helix	trans	-66	-47.7	177.3	-72.3	-30.6	0	0	0	111.7	E440 Y441 Y442 T447 N448	E440-N444 WeakPolarHBondContact O-CB 3.45Å; E440-N444 PolarHBondContact O-N 3.38Å; E440-N444 PolarHBondContact O-ND2 2.99Å; Y441-N444 PolarHBondContact O-N 3.04Å; Y442-N444 VanDerWaalsContact C-N 3.35Å; Y442-N444 PolarHBondContact O-N 3.3Å; N444-T447 PolarHBondContact O-N 2.85Å; N444-N448 WeakPolarHBondContact O-CB 3.44Å; N444-N448 PolarHBondContact O-N 2.58Å; N444-N448 PolarHBondContact O-ND2 3.49Å
445	E	95.7	Very high	93.6	Very high	82 Å²	82	90.1 Å²	90.1	38%	0.383	45%	0.45	S	S	.	.	H	α-helix	trans	-60.6	-49.2	178.8	-74.2	-58.4	108.5	0	0	111.9	Y441 Y442 T447 N448 C449	Y441-E445 HydrophobicContact CD1-CG 4.37Å; Y441-E445 HydrophobicContact CD2-CG 4.34Å; Y441-E445 HydrophobicContact CE1-CG 3.91Å; Y441-E445 HydrophobicContact CE2-CG 3.89Å; Y441-E445 WeakPolarHBondContact O-CG 3.39Å; Y441-E445 PolarHBondContact O-N 3.3Å; Y442-E445 PolarHBondContact O-N 3.27Å; E445-T447 VanDerWaalsContact C-N 3.34Å; E445-T447 PolarHBondContact O-N 2.68Å; E445-N448 PolarHBondContact O-N 2.91Å; E445-C449 WeakPolarHBondContact O-CB 3.47Å; E445-C449 PolarHBondContact O-N 3Å; E445-C449 PolarHBondContact O-SG 2.87Å; E445-C449 VanDerWaalsContact O-SG 3.32Å
446	V	94	Very high	93.5	Very high	84 Å²	84	90.1 Å²	90.1	51%	0.509	45%	0.451	S	S	.	.	H	α-helix	trans	-61.7	-43.4	177.9	171.1	0	0	0	0	110.9	Y442 N448 C449 L450	Y442-V446 VanDerWaalsContact O-CB 3.3Å; Y442-V446 WeakPolarHBondContact O-CB 3.44Å; Y442-V446 WeakPolarHBondContact O-CG2 3.36Å; Y442-V446 PolarHBondContact O-N 2.87Å; V446-N448 VanDerWaalsContact C-N 3.34Å; V446-N448 PolarHBondContact O-N 3.11Å; V446-C449 PolarHBondContact O-N 2.9Å; V446-L450 HydrophobicContact CG1-CD1 3.94Å; V446-L450 HydrophobicContact CG1-CG 4.39Å; V446-L450 WeakPolarHBondContact O-CB 3.34Å; V446-L450 VanDerWaalsContact O-CG 3.28Å; V446-L450 WeakPolarHBondContact O-CG 3.46Å; V446-L450 PolarHBondContact O-N 3.3Å
447	T	92.2	Very high	93.6	Very high	33 Å²	33	93.2 Å²	93.2	20%	0.202	46%	0.459	C	S	.	.	H	α-helix	trans	-62.3	-42	177.6	-60.5	0	0	0	0	111.6	T443 N444 E445 L450 K451	T443-T447 VanDerWaalsContact O-CB 3.23Å; T443-T447 WeakPolarHBondContact O-CB 3.5Å; T443-T447 PolarHBondContact O-N 2.84Å; T443-T447 PolarHBondContact O-OG1 3.33Å; N444-T447 PolarHBondContact O-N 2.85Å; E445-T447 VanDerWaalsContact C-N 3.34Å; E445-T447 PolarHBondContact O-N 2.68Å; T447-L450 PolarHBondContact O-N 3.01Å; T447-K451 HydrophobicContact CG2-CD 4.35Å; T447-K451 WeakPolarHBondContact O-CG 3.16Å; T447-K451 PolarHBondContact O-N 3.42Å
448	N	93.2	Very high	93.6	Very high	73 Å²	73	95.2 Å²	95.2	39%	0.39	47%	0.466	S	S	.	.	H	α-helix	trans	-67	-44.2	177.3	-72.4	-21.8	0	0	0	111.5	N444 E445 V446 L450 K451 N452	N444-N448 WeakPolarHBondContact O-CB 3.44Å; N444-N448 PolarHBondContact O-N 2.58Å; N444-N448 PolarHBondContact O-ND2 3.49Å; E445-N448 PolarHBondContact O-N 2.91Å; V446-N448 VanDerWaalsContact C-N 3.34Å; V446-N448 PolarHBondContact O-N 3.11Å; N448-L450 VanDerWaalsContact C-N 3.34Å; N448-L450 PolarHBondContact O-N 3.39Å; N448-K451 PolarHBondContact O-N 3.02Å; N448-N452 WeakPolarHBondContact O-CB 3.36Å; N448-N452 VanDerWaalsContact O-CG 3.24Å; N448-N452 PolarHBondContact O-N 2.9Å; N448-N452 PolarHBondContact O-ND2 2.77Å
449	C	94.8	Very high	93.6	Very high	77 Å²	77	93.2 Å²	93.2	52%	0.52	46%	0.461	S	S	.	.	H	α-helix	trans	-58.8	-43.8	174.5	-73	0	0	0	0	112	E445 V446 N452 R453	E445-C449 WeakPolarHBondContact O-CB 3.47Å; E445-C449 PolarHBondContact O-N 3Å; E445-C449 PolarHBondContact O-SG 2.87Å; E445-C449 VanDerWaalsContact O-SG 3.32Å; V446-C449 PolarHBondContact O-N 2.9Å; C449-N452 PolarHBondContact O-N 3.17Å; C449-R453 VanDerWaalsContact O-CB 3.25Å; C449-R453 WeakPolarHBondContact O-CB 3.2Å; C449-R453 PolarHBondContact O-N 3.27Å
450	L	93.4	Very high	93.7	Very high	47 Å²	47	95.2 Å²	95.2	25%	0.246	47%	0.466	C	S	.	.	H	α-helix	trans	-63.7	-46.1	177.5	-72.9	171.2	0	0	0	111.9	V446 T447 N448 R453 E454 F489	V446-L450 HydrophobicContact CG1-CD1 3.94Å; V446-L450 HydrophobicContact CG1-CG 4.39Å; V446-L450 WeakPolarHBondContact O-CB 3.34Å; V446-L450 VanDerWaalsContact O-CG 3.28Å; V446-L450 WeakPolarHBondContact O-CG 3.46Å; V446-L450 PolarHBondContact O-N 3.3Å; T447-L450 PolarHBondContact O-N 3.01Å; N448-L450 VanDerWaalsContact C-N 3.34Å; N448-L450 PolarHBondContact O-N 3.39Å; L450-R453 WeakPolarHBondContact O-CB 3.48Å; L450-R453 PolarHBondContact O-N 2.97Å; L450-E454 WeakPolarHBondContact O-CG 3.3Å; L450-E454 PolarHBondContact O-N 3.03Å; L450-F489 HydrophobicContact CD1-CD1 4Å; L450-F489 HydrophobicContact CD1-CE1 3.5Å; L450-F489 HydrophobicContact CD1-CZ 4Å; L450-F489 HydrophobicContact CD2-CZ 4.42Å
451	K	93.1	Very high	93.7	Very high	126 Å²	126	95.2 Å²	95.2	55%	0.548	47%	0.468	S	S	.	.	H	α-helix	trans	-60.1	-45.9	175.2	-74.5	174.2	-177.7	171	0	112.3	T447 N448 R453 E454 K455	T447-K451 HydrophobicContact CG2-CD 4.35Å; T447-K451 WeakPolarHBondContact O-CG 3.16Å; T447-K451 PolarHBondContact O-N 3.42Å; N448-K451 PolarHBondContact O-N 3.02Å; K451-R453 VanDerWaalsContact C-N 3.32Å; K451-R453 PolarHBondContact O-N 2.64Å; K451-E454 PolarHBondContact O-N 3.14Å; K451-K455 WeakPolarHBondContact O-CB 3.41Å; K451-K455 PolarHBondContact O-N 3.16Å
452	N	95.3	Very high	93.4	Very high	109 Å²	109	92.3 Å²	92.3	58%	0.583	47%	0.468	S	S	*	.	H	α-helix	trans	-63.3	-40.4	178.3	-73.3	-15.5	0	0	0	111.4	N448 C449 K455 A456	N448-N452 WeakPolarHBondContact O-CB 3.36Å; N448-N452 VanDerWaalsContact O-CG 3.24Å; N448-N452 PolarHBondContact O-N 2.9Å; N448-N452 PolarHBondContact O-ND2 2.77Å; C449-N452 PolarHBondContact O-N 3.17Å; N452-K455 PolarHBondContact O-N 2.82Å; N452-A456 WeakPolarHBondContact O-CB 3.41Å; N452-A456 PolarHBondContact O-N 3.13Å
453	R	96.8	Very high	93.2	Very high	135 Å²	135	88 Å²	88	51%	0.509	46%	0.463	S	S	.	.	H	α-helix	trans	-61.8	-50.3	174.6	177.3	178.8	167.7	-86	-3.5	111.3	C449 L450 K451 K455 A456 Y457	C449-R453 VanDerWaalsContact O-CB 3.25Å; C449-R453 WeakPolarHBondContact O-CB 3.2Å; C449-R453 PolarHBondContact O-N 3.27Å; L450-R453 WeakPolarHBondContact O-CB 3.48Å; L450-R453 PolarHBondContact O-N 2.97Å; K451-R453 VanDerWaalsContact C-N 3.32Å; K451-R453 PolarHBondContact O-N 2.64Å; R453-K455 VanDerWaalsContact C-N 3.32Å; R453-K455 PolarHBondContact O-N 3.29Å; R453-A456 PolarHBondContact O-N 2.91Å; R453-Y457 HydrophobicContact CG-CD2 3.94Å; R453-Y457 HydrophobicContact CG-CE2 3.71Å; R453-Y457 VanDerWaalsContact O-CD2 3.24Å; R453-Y457 WeakPolarHBondContact O-CD2 3.28Å; R453-Y457 PolarHBondContact O-N 3.24Å
454	E	93.7	Very high	93.2	Very high	70 Å²	70	88.2 Å²	88.2	33%	0.327	47%	0.466	S	S	.	.	H	α-helix	trans	-57.5	-44.9	177.6	-75.1	-179.9	176.7	0	0	111.8	L450 K451 Y457 V458	L450-E454 WeakPolarHBondContact O-CG 3.3Å; L450-E454 PolarHBondContact O-N 3.03Å; K451-E454 PolarHBondContact O-N 3.14Å; E454-Y457 PolarHBondContact O-N 2.77Å; E454-V458 WeakPolarHBondContact O-CG2 3.04Å; E454-V458 PolarHBondContact O-N 3.37Å; E454-V458 VanDerWaalsContact O-N 3.15Å
455	K	93.8	Very high	93.1	Very high	130 Å²	130	85.2 Å²	85.2	57%	0.565	46%	0.458	S	S	*	.	H	α-helix	trans	-59.6	-47.2	174.4	-175.3	-176.9	174.7	-175	0	112	K451 N452 R453 Y457 V458 D459	K451-K455 WeakPolarHBondContact O-CB 3.41Å; K451-K455 PolarHBondContact O-N 3.16Å; N452-K455 PolarHBondContact O-N 2.82Å; R453-K455 VanDerWaalsContact C-N 3.32Å; R453-K455 PolarHBondContact O-N 3.29Å; K455-Y457 VanDerWaalsContact C-N 3.27Å; K455-Y457 PolarHBondContact O-N 3.31Å; K455-V458 WeakPolarHBondContact O-CB 3.4Å; K455-V458 PolarHBondContact O-N 2.81Å; K455-D459 PolarHBondContact O-N 3.26Å
456	A	94.4	Very high	92.6	Very high	56 Å²	56	87.6 Å²	87.6	46%	0.463	47%	0.469	S	S	.	.	H	α-helix	trans	-60	-36.1	179.2	0	0	0	0	0	112.6	N452 R453 F460	N452-A456 WeakPolarHBondContact O-CB 3.41Å; N452-A456 PolarHBondContact O-N 3.13Å; R453-A456 PolarHBondContact O-N 2.91Å; A456-F460 WeakPolarHBondContact O-CB 3.25Å; A456-F460 PolarHBondContact O-N 3.26Å
457	Y	93.8	Very high	92.1	Very high	127 Å²	127	90.4 Å²	90.4	50%	0.498	47%	0.474	S	S	.	.	H	α-helix	trans	-66	-41.9	172.9	-84.7	-77.4	0	0	0	112.4	R453 E454 K455 F460 I461	R453-Y457 HydrophobicContact CG-CD2 3.94Å; R453-Y457 HydrophobicContact CG-CE2 3.71Å; R453-Y457 VanDerWaalsContact O-CD2 3.24Å; R453-Y457 WeakPolarHBondContact O-CD2 3.28Å; R453-Y457 PolarHBondContact O-N 3.24Å; E454-Y457 PolarHBondContact O-N 2.77Å; K455-Y457 VanDerWaalsContact C-N 3.27Å; K455-Y457 PolarHBondContact O-N 3.31Å; Y457-F460 PolarHBondContact O-N 3.29Å; Y457-I461 WeakPolarHBondContact O-CB 3.38Å; Y457-I461 WeakPolarHBondContact O-CD1 3.36Å; Y457-I461 VanDerWaalsContact O-CG1 3.23Å; Y457-I461 WeakPolarHBondContact O-CG1 3.37Å; Y457-I461 PolarHBondContact O-N 2.93Å
458	V	92.5	Very high	91.7	Very high	96 Å²	96	94.7 Å²	94.7	58%	0.582	49%	0.488	S	S	*	.	H	α-helix	trans	-62.9	-47.4	175.7	173.7	0	0	0	0	110.8	E454 K455 F460 I461 S462	E454-V458 WeakPolarHBondContact O-CG2 3.04Å; E454-V458 PolarHBondContact O-N 3.37Å; E454-V458 VanDerWaalsContact O-N 3.15Å; K455-V458 WeakPolarHBondContact O-CB 3.4Å; K455-V458 PolarHBondContact O-N 2.81Å; V458-F460 VanDerWaalsContact C-N 3.34Å; V458-F460 PolarHBondContact O-N 3.21Å; V458-I461 PolarHBondContact O-N 3.26Å; V458-S462 WeakPolarHBondContact O-CB 3.37Å; V458-S462 PolarHBondContact O-N 3.4Å
459	D	93.7	Very high	90.6	Very high	85 Å²	85	95.2 Å²	95.2	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-42.1	178.3	-66	-15.4	0	0	0	110.8	K455 S462 A463	K455-D459 PolarHBondContact O-N 3.26Å; D459-S462 PolarHBondContact O-N 2.96Å; D459-A463 WeakPolarHBondContact O-CB 3.37Å; D459-A463 PolarHBondContact O-N 3.31Å
460	F	94.2	Very high	89.4	Confident	134 Å²	134	96.3 Å²	96.3	59%	0.588	51%	0.505	S	S	*	.	H	α-helix	trans	-62.5	-44.4	175.9	174.3	-105.4	0	0	0	112.8	A456 Y457 V458 S464	A456-F460 WeakPolarHBondContact O-CB 3.25Å; A456-F460 PolarHBondContact O-N 3.26Å; Y457-F460 PolarHBondContact O-N 3.29Å; V458-F460 VanDerWaalsContact C-N 3.34Å; V458-F460 PolarHBondContact O-N 3.21Å; F460-S464 VanDerWaalsContact O-CB 3.23Å; F460-S464 WeakPolarHBondContact O-CB 3.42Å; F460-S464 PolarHBondContact O-N 2.85Å; F460-S464 PolarHBondContact O-OG 3.38Å
461	I	91.5	Very high	88.1	Confident	116 Å²	116	100.1 Å²	100.1	60%	0.595	53%	0.525	S	S	*	.	H	α-helix	trans	-63.4	-44.7	175.7	-69.7	165.5	0	0	0	110.1	Y457 V458 S464 G465	Y457-I461 WeakPolarHBondContact O-CB 3.38Å; Y457-I461 WeakPolarHBondContact O-CD1 3.36Å; Y457-I461 VanDerWaalsContact O-CG1 3.23Å; Y457-I461 WeakPolarHBondContact O-CG1 3.37Å; Y457-I461 PolarHBondContact O-N 2.93Å; V458-I461 PolarHBondContact O-N 3.26Å; I461-S464 PolarHBondContact O-N 3.16Å; I461-G465 PolarHBondContact O-N 2.91Å
462	S	89.7	Confident	86.3	Confident	73 Å²	73	101 Å²	101	51%	0.51	54%	0.536	S	S	.	.	H	α-helix	trans	-59	-54	178	-171.5	0	0	0	0	111.4	V458 D459 S464 G465 E466	V458-S462 WeakPolarHBondContact O-CB 3.37Å; V458-S462 PolarHBondContact O-N 3.4Å; D459-S462 PolarHBondContact O-N 2.96Å; S462-S464 VanDerWaalsContact C-N 3.31Å; S462-S464 PolarHBondContact O-N 2.89Å; S462-G465 WeakPolarHBondContact O-CA 3.47Å; S462-G465 PolarHBondContact O-N 3Å; S462-E466 PolarHBondContact O-N 3.25Å
463	A	91.8	Very high	84	Confident	56 Å²	56	101.2 Å²	101.2	46%	0.463	54%	0.541	S	S	.	.	H	α-helix	trans	-61.3	-38.2	179.3	0	0	0	0	0	112.3	D459 G465 E466	D459-A463 WeakPolarHBondContact O-CB 3.37Å; D459-A463 PolarHBondContact O-N 3.31Å; A463-G465 PolarHBondContact O-N 3.22Å; A463-E466 PolarHBondContact O-N 2.92Å
464	S	90.7	Very high	81.5	Confident	47 Å²	47	101.8 Å²	101.8	33%	0.329	55%	0.554	S	S	.	*	H	α-helix	trans	-66.2	-28.1	175.7	-62.6	0	0	0	0	112.9	F460 I461 S462 K467	F460-S464 VanDerWaalsContact O-CB 3.23Å; F460-S464 WeakPolarHBondContact O-CB 3.42Å; F460-S464 PolarHBondContact O-N 2.85Å; F460-S464 PolarHBondContact O-OG 3.38Å; I461-S464 PolarHBondContact O-N 3.16Å; S462-S464 VanDerWaalsContact C-N 3.31Å; S462-S464 PolarHBondContact O-N 2.89Å; S464-K467 WeakPolarHBondContact O-CE 3.34Å; S464-K467 WeakPolarHBondContact O-CG 3.27Å
465	G	88	Confident	79.2	Confident	34 Å²	34	104.3 Å²	104.3	35%	0.351	58%	0.58	S	S	.	*	H	α-helix	trans	-80.8	-22.4	178.1	0	0	0	0	0	114.5	I461 S462 A463 K467 Y468 S469	I461-G465 PolarHBondContact O-N 2.91Å; S462-G465 WeakPolarHBondContact O-CA 3.47Å; S462-G465 PolarHBondContact O-N 3Å; A463-G465 PolarHBondContact O-N 3.22Å; G465-K467 VanDerWaalsContact C-N 3.29Å; G465-K467 PolarHBondContact O-N 2.77Å; G465-Y468 WeakPolarHBondContact O-CA 3.27Å; G465-Y468 PolarHBondContact O-N 3.44Å; G465-S469 PolarHBondContact O-N 3.43Å
466	E	84	Confident	76.5	Confident	131 Å²	131	104.5 Å²	104.5	61%	0.612	59%	0.592	S	S	*	*	H	α-helix	trans	-55.7	-39.3	-174.4	-75.8	178.2	-177.9	0	0	113.4	S462 A463 Y468 S469	S462-E466 PolarHBondContact O-N 3.25Å; A463-E466 PolarHBondContact O-N 2.92Å; E466-Y468 PolarHBondContact O-N 3.42Å; E466-Y468 VanDerWaalsContact O-N 3.13Å; E466-S469 VanDerWaalsContact O-CB 3.27Å; E466-S469 WeakPolarHBondContact O-CB 3.45Å; E466-S469 PolarHBondContact O-N 3.14Å; E466-S469 VanDerWaalsContact O-N 3.08Å; E466-S469 PolarHBondContact O-OG 2.97Å
467	K	83.5	Confident	73.8	Confident	144 Å²	144	106.9 Å²	106.9	63%	0.626	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-14.3	176.2	56.8	170.6	162.5	157.5	0	114.6	S464 G465	S464-K467 WeakPolarHBondContact O-CE 3.34Å; S464-K467 WeakPolarHBondContact O-CG 3.27Å; G465-K467 VanDerWaalsContact C-N 3.29Å; G465-K467 PolarHBondContact O-N 2.77Å
468	Y	84	Confident	71.2	Confident	122 Å²	122	110.4 Å²	110.4	48%	0.478	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.1	3.9	178.1	-54.2	-68.8	0	0	0	112.6	G465 E466 S470 L471	G465-Y468 WeakPolarHBondContact O-CA 3.27Å; G465-Y468 PolarHBondContact O-N 3.44Å; E466-Y468 PolarHBondContact O-N 3.42Å; E466-Y468 VanDerWaalsContact O-N 3.13Å; Y468-S470 PolarHBondContact O-N 2.93Å; Y468-S470 VanDerWaalsContact O-N 3.16Å; Y468-L471 HydrophobicContact CD1-CD1 3.86Å; Y468-L471 WeakPolarHBondContact O-CB 3.47Å; Y468-L471 PolarHBondContact O-N 3.19Å
469	S	70.9	Confident	68.5	Low	85 Å²	85	115.5 Å²	115.5	59%	0.594	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-57.5	-30.6	-177.8	55.7	0	0	0	0	113.6	G465 E466 L471	G465-S469 PolarHBondContact O-N 3.43Å; E466-S469 VanDerWaalsContact O-CB 3.27Å; E466-S469 WeakPolarHBondContact O-CB 3.45Å; E466-S469 PolarHBondContact O-N 3.14Å; E466-S469 VanDerWaalsContact O-N 3.08Å; E466-S469 PolarHBondContact O-OG 2.97Å; S469-L471 VanDerWaalsContact C-N 3.3Å; S469-L471 PolarHBondContact O-N 3.32Å
470	S	68.6	Low	65.7	Low	99 Å²	99	120.3 Å²	120.3	69%	0.692	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-75.1	-12.2	177	57.1	0	0	0	0	114.8	Y468	Y468-S470 PolarHBondContact O-N 2.93Å; Y468-S470 VanDerWaalsContact O-N 3.16Å
471	L	65.3	Low	62.8	Low	127 Å²	127	125.4 Å²	125.4	67%	0.665	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-90.6	-14.3	179	-69.4	160.2	0	0	0	112.8	Y468 S469 V473	Y468-L471 HydrophobicContact CD1-CD1 3.86Å; Y468-L471 WeakPolarHBondContact O-CB 3.47Å; Y468-L471 PolarHBondContact O-N 3.19Å; S469-L471 VanDerWaalsContact C-N 3.3Å; S469-L471 PolarHBondContact O-N 3.32Å; L471-V473 VanDerWaalsContact C-N 3.32Å; L471-V473 PolarHBondContact O-N 2.8Å; L471-V473 VanDerWaalsContact O-N 3.17Å
472	N	56.2	Low	60.2	Low	145 Å²	145	127.5 Å²	127.5	78%	0.775	69%	0.688	S	S	*	*			trans	-90.7	68.4	179.2	-75.9	-25	0	0	0	110.6
473	V	47.9	Very low	57.9	Low	113 Å²	113	131.6 Å²	131.6	69%	0.685	70%	0.704	S	S	*	*			trans	-94.9	125.6	158.9	-174.4	0	0	0	0	106	L471	L471-V473 VanDerWaalsContact C-N 3.32Å; L471-V473 PolarHBondContact O-N 2.8Å; L471-V473 VanDerWaalsContact O-N 3.17Å
474	D	44.1	Very low	55.6	Low	147 Å²	147	136.1 Å²	136.1	79%	0.786	72%	0.721	S	S	*	*			trans	79.8	93.1	176	-56.1	-30.7	0	0	0	118.6
475	S	45.7	Very low	53.5	Low	124 Å²	124	137.1 Å²	137.1	87%	0.867	73%	0.732	S	S	*	*				-171.1	108.2	122	38.4	0	0	0	0	111.4
476	T	36.9	Very low	51.4	Low	133 Å²	133	137.7 Å²	137.7	82%	0.816	74%	0.738	S	S	*	*			trans	-58.3	140.1	166.4	-21.7	0	0	0	0	110.2
477	S	37.3	Very low	49.7	Very low	106 Å²	106	133.6 Å²	133.6	74%	0.741	73%	0.731	S	S	*	*			trans	87.8	82.3	157.8	-38.6	0	0	0	0	118.4
478	Q	39.2	Very low	48.2	Very low	202 Å²	202	132.5 Å²	132.5	94%	0.944	73%	0.731	S	S	*	*			trans	-151.8	81.9	142.8	-112.5	172.8	16	0	0	110.9
479	K	35.1	Very low	46.7	Very low	202 Å²	202	131.4 Å²	131.4	88%	0.878	73%	0.728	S	S	*	*			trans	-73	134.5	165	-106.1	174.8	177.1	174.5	0	108.7
480	Q	35.4	Very low	45.9	Very low	187 Å²	187	134.5 Å²	134.5	87%	0.874	73%	0.731	S	S	*	*			trans	72.4	80.4	162	-64.4	175.3	-22.2	0	0	117.6
481	R	32.7	Very low	45.3	Very low	241 Å²	241	131.9 Å²	131.9	91%	0.909	72%	0.72	S	S	*	*			trans	-154	81.6	149.9	-111.9	178.3	177.9	171.8	-0.5	109.5
482	N	36.9	Very low	44.9	Very low	160 Å²	160	130.2 Å²	130.2	86%	0.856	71%	0.711	S	S	*	*			trans	-165.2	83.3	162.5	-99.2	-13.5	0	0	0	108.7
483	N	42.4	Very low	44.7	Very low	159 Å²	159	126.5 Å²	126.5	85%	0.85	69%	0.69	S	S	*	*			trans	-151.3	17.5	166.7	-95.6	-15.4	0	0	0	112.9
484	N	43.7	Very low	45	Very low	151 Å²	151	126 Å²	126	81%	0.807	68%	0.684	S	S	*	*			trans	-102.9	-3.6	-174.5	-98	10.6	0	0	0	115.9
485	A	45.3	Very low	45.6	Very low	67 Å²	67	122.6 Å²	122.6	55%	0.554	67%	0.671	S	S	*	*	H	α-helix	trans	-74	-33.9	174.3	0	0	0	0	0	112.2	G487	A485-G487 VanDerWaalsContact C-N 3.28Å; A485-G487 PolarHBondContact O-N 3.39Å
486	G	44.8	Very low	45.9	Very low	47 Å²	47	124 Å²	124	49%	0.485	66%	0.662	S	S	.	*	H	α-helix	trans	-74.3	-9	178.7	0	0	0	0	0	115.5	K490	G486-K490 WeakPolarHBondContact O-CB 2.92Å
487	G	47.9	Very low	46.7	Very low	45 Å²	45	121.1 Å²	121.1	46%	0.464	65%	0.645	S	S	.	*	H	α-helix	trans	-80	-35.5	-176.9	0	0	0	0	0	114.3	A485 G491	A485-G487 VanDerWaalsContact C-N 3.28Å; A485-G487 PolarHBondContact O-N 3.39Å; G487-G491 PolarHBondContact O-N 3.28Å
488	I	52.2	Low	47	Very low	121 Å²	121	118.6 Å²	118.6	62%	0.621	64%	0.636	S	S	*	*	H	α-helix	trans	-71.3	-43.7	-176.3	-62.2	172.4	0	0	0	110.4	G491 I492	I488-G491 PolarHBondContact O-N 3.4Å; I488-I492 HydrophobicContact CG2-CD1 4.4Å; I488-I492 PolarHBondContact O-N 3.07Å
489	F	52.5	Low	47.3	Very low	98 Å²	98	113.5 Å²	113.5	43%	0.43	62%	0.622	S	S	.	*	H	α-helix	trans	-68.3	-36.4	177.3	-84.6	-78.6	0	0	0	112.9	L450 G491 I492 L493	L450-F489 HydrophobicContact CD1-CD1 4Å; L450-F489 HydrophobicContact CD1-CE1 3.5Å; L450-F489 HydrophobicContact CD1-CZ 4Å; L450-F489 HydrophobicContact CD2-CZ 4.42Å; F489-G491 VanDerWaalsContact C-N 3.31Å; F489-G491 PolarHBondContact O-N 3.12Å; F489-I492 PolarHBondContact O-N 2.6Å; F489-L493 PolarHBondContact O-N 2.86Å; F489-L493 VanDerWaalsContact O-N 3.07Å
490	K	53.4	Low	47.8	Very low	150 Å²	150	109.3 Å²	109.3	65%	0.652	61%	0.609	S	S	*	*	H	α-helix	trans	-66.9	-32.2	177.5	-154.3	175.6	-172.4	-178.5	0	112.3	G486 N494	G486-K490 WeakPolarHBondContact O-CB 2.92Å; K490-N494 WeakPolarHBondContact O-CB 3.21Å; K490-N494 VanDerWaalsContact O-CG 3.28Å; K490-N494 PolarHBondContact O-N 3.17Å
491	G	56.1	Low	48	Very low	44 Å²	44	105.7 Å²	105.7	45%	0.454	60%	0.604	S	S	.	*	H	α-helix	trans	-68.3	-42.7	174.6	0	0	0	0	0	113.6	G487 I488 F489 S495	G487-G491 PolarHBondContact O-N 3.28Å; I488-G491 PolarHBondContact O-N 3.4Å; F489-G491 VanDerWaalsContact C-N 3.31Å; F489-G491 PolarHBondContact O-N 3.12Å; G491-S495 PolarHBondContact O-N 3.2Å
492	I	56.8	Low	48.2	Very low	93 Å²	93	96.7 Å²	96.7	48%	0.477	59%	0.587	S	S	.	*	H	α-helix	trans	-69.8	-42.5	179.4	-63.2	169.9	0	0	0	110.6	I488 F489 N494 S495 F496	I488-I492 HydrophobicContact CG2-CD1 4.4Å; I488-I492 PolarHBondContact O-N 3.07Å; F489-I492 PolarHBondContact O-N 2.6Å; I492-N494 PolarHBondContact O-N 3.39Å; I492-S495 PolarHBondContact O-N 2.89Å; I492-S495 PolarHBondContact O-OG 3.38Å; I492-F496 HydrophobicContact CG2-CD2 4.4Å; I492-F496 PolarHBondContact O-N 3.44Å
493	L	51.5	Low	48	Very low	66 Å²	66	102.6 Å²	102.6	35%	0.346	60%	0.604	S	S	.	*	H	α-helix	trans	-64.7	-39.3	179.8	-134.7	106.9	0	0	0	112.5	T443 F489 S495 F496 T497	T443-L493 HydrophobicContact CG2-CD1 4.19Å; T443-L493 HydrophobicContact CG2-CD2 4.08Å; T443-L493 HydrophobicContact CG2-CG 4.27Å; F489-L493 PolarHBondContact O-N 2.86Å; F489-L493 VanDerWaalsContact O-N 3.07Å; L493-S495 VanDerWaalsContact C-N 3.34Å; L493-F496 PolarHBondContact O-N 2.98Å; L493-T497 WeakPolarHBondContact O-CG2 3.07Å; L493-T497 PolarHBondContact O-N 2.66Å; L493-T497 VanDerWaalsContact O-N 3.08Å; L493-T497 PolarHBondContact O-OG1 3.08Å
494	N	55.4	Low	48.2	Very low	102 Å²	102	99.8 Å²	99.8	55%	0.545	59%	0.592	S	S	.	*	H	α-helix	trans	-68.8	-30.9	176.5	-77.1	-0.5	0	0	0	112.5	K490 I492 G498	K490-N494 WeakPolarHBondContact O-CB 3.21Å; K490-N494 VanDerWaalsContact O-CG 3.28Å; K490-N494 PolarHBondContact O-N 3.17Å; I492-N494 PolarHBondContact O-N 3.39Å; N494-G498 PolarHBondContact O-N 2.99Å
495	S	57.5	Low	48.5	Very low	76 Å²	76	97.1 Å²	97.1	53%	0.531	58%	0.581	S	S	.	*	H	α-helix	trans	-71.3	-29.5	174.9	66.6	0	0	0	0	113.8	G491 I492 L493	G491-S495 PolarHBondContact O-N 3.2Å; I492-S495 PolarHBondContact O-N 2.89Å; I492-S495 PolarHBondContact O-OG 3.38Å; L493-S495 VanDerWaalsContact C-N 3.34Å
496	F	51.8	Low	48.7	Very low	153 Å²	153	98.7 Å²	98.7	67%	0.671	58%	0.582	S	S	*	*	H	α-helix	trans	-83	-40.1	178.1	-97.3	-88.6	0	0	0	112.6	I492 L493	I492-F496 HydrophobicContact CG2-CD2 4.4Å; I492-F496 PolarHBondContact O-N 3.44Å; L493-F496 PolarHBondContact O-N 2.98Å
497	T	52.1	Low	48.9	Very low	74 Å²	74	101.8 Å²	101.8	45%	0.454	59%	0.588	S	S	.	*	H	α-helix	trans	-79.5	-35.4	-178.8	51.7	0	0	0	0	112.8	L493 S499 L500	L493-T497 WeakPolarHBondContact O-CG2 3.07Å; L493-T497 PolarHBondContact O-N 2.66Å; L493-T497 VanDerWaalsContact O-N 3.08Å; L493-T497 PolarHBondContact O-OG1 3.08Å; T497-S499 PolarHBondContact O-N 2.78Å; T497-L500 PolarHBondContact O-N 3.09Å
498	G	44.9	Very low	48.9	Very low	53 Å²	53	105.3 Å²	105.3	55%	0.546	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.9	-16.5	178.1	0	0	0	0	0	114.9	N494	N494-G498 PolarHBondContact O-N 2.99Å
499	S	45.7	Very low	48.7	Very low	94 Å²	94	104.3 Å²	104.3	66%	0.657	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-13.7	176.3	-175.3	0	0	0	0	113.6	T497	T497-S499 PolarHBondContact O-N 2.78Å
500	L	44.3	Very low	48.5	Very low	115 Å²	115	104.7 Å²	104.7	60%	0.602	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-18.2	-176.4	-84.7	154.5	0	0	0	113.1	L439 T497	L439-L500 HydrophobicContact CD2-CD1 4.41Å; T497-L500 PolarHBondContact O-N 3.09Å
501	S	40.7	Very low	48.1	Very low	110 Å²	110	101.2 Å²	101.2	77%	0.769	60%	0.602	S	S	*	*	S	Bend	trans	-92.1	10.5	177.4	97.4	0	0	0	0	114.4
502	G	35.4	Very low	47.4	Very low	53 Å²	53	106 Å²	106	55%	0.546	62%	0.615	S	S	.	*			trans	-136.2	71.5	-175.5	0	0	0	0	0	112.1
503	K	32.8	Very low	46.6	Very low	283 Å²	283	107.2 Å²	107.2	100%	1.23	63%	0.627	S	S	*	*			trans	-168.2	0	156.7	-107.8	169.3	-167.5	-176.8	0	111.6

Retrieved 503 of 503 residues in 95 ms (Link to these results)

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