A0A3Q0KP13_SCHMA Loading...

Lipid scramblase CLPTM1L

Scramblase that mediates the translocation of glucosaminylphosphatidylinositol (alpha-D-GlcN-(1-6)-(1,2-diacyl-sn-glycero-3-phospho)-1D-myo-inositol, GlcN-PI) across the endoplasmic reticulum (ER) membrane, from the cytosolic leaflet to the luminal leaflet of the ER membrane, where it participates in the biosynthesis of glycosylphosphatidylinositol (GPI). GPI is a lipid glycoconjugate involved in post-translational modification of proteins. Can also translocate 1,2-diacyl-sn-glycero-3-phospho-(1D-myo-inositol) (phosphatidylinositol or PI), as well as several other phospholipids (1,2-diacyl-sn-glycero-3-phosphocholine, 1,2-diacyl-sn-glycero-3-phosphoethanolamine), and N-acetylglucosaminylphosphatidylinositol (GlcNAc-PI) in vitro.

AlphaFold DB , UniProt , Accession A0A3Q0KP13, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 527 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	50.4	Low	77.7	Confident	238 Å²	238	130.5 Å²	130.5	100%	1.172	65%	0.648	S	S	*	*				0	95	0	-155.1	178.3	-161	0	0	107.4	K3	M1-K3 PolarHBondContact O-N 3.47Å
2	F	57	Low	78	Confident	173 Å²	173	126.2 Å²	126.2	76%	0.759	64%	0.64	S	S	*	*			trans	-61.6	111.9	176.4	-88.8	-92	0	0	0	107.5	F4	F2-F4 PolarHBondContact O-N 3.44Å
3	K	73.7	Confident	78.7	Confident	156 Å²	156	125.2 Å²	125.2	68%	0.678	64%	0.636	S	S	*	*			trans	-58.5	130	177.9	-71.9	-178	177.7	178	0	107.1	M1 S5 H6	M1-K3 PolarHBondContact O-N 3.47Å; K3-S5 PolarHBondContact O-N 3.46Å; K3-H6 PolarHBondContact O-N 3.42Å
4	F	79.8	Confident	79.4	Confident	162 Å²	162	119.2 Å²	119.2	71%	0.711	62%	0.622	S	S	*	*	H	α-helix	trans	-42.4	-33.5	177.2	179.1	-100.5	0	0	0	113.3	F2 H6 I7 L8	F2-F4 PolarHBondContact O-N 3.44Å; F4-H6 VanDerWaalsContact C-N 3.34Å; F4-H6 PolarHBondContact O-N 3.41Å; F4-I7 PolarHBondContact O-N 3.39Å; F4-L8 PolarHBondContact O-N 3.13Å
5	S	81.7	Confident	80	Confident	75 Å²	75	122.2 Å²	122.2	52%	0.524	62%	0.623	S	S	.	*	H	α-helix	trans	-53.4	-38.9	171.9	171.3	0	0	0	0	114.9	K3 L9	K3-S5 PolarHBondContact O-N 3.46Å; S5-L9 WeakPolarHBondContact O-CB 3.38Å; S5-L9 PolarHBondContact O-N 3.41Å
6	H	83.7	Confident	80.2	Confident	109 Å²	109	123.3 Å²	123.3	51%	0.505	62%	0.623	S	S	.	*	H	α-helix	trans	-73.5	-37.2	-180	-65.8	-7.1	0	0	0	112.4	K3 F4 L9 A10	K3-H6 PolarHBondContact O-N 3.42Å; F4-H6 VanDerWaalsContact C-N 3.34Å; F4-H6 PolarHBondContact O-N 3.41Å; H6-L9 PolarHBondContact O-N 3.48Å; H6-A10 WeakPolarHBondContact O-CB 3.17Å; H6-A10 PolarHBondContact O-N 3.04Å
7	I	84.8	Confident	80.5	Confident	84 Å²	84	120.4 Å²	120.4	43%	0.431	62%	0.615	S	S	.	*	H	α-helix	trans	-65.3	-46.4	174.7	-64.8	172.7	0	0	0	109.3	F4 L9 A10 F11	F4-I7 PolarHBondContact O-N 3.39Å; I7-L9 VanDerWaalsContact C-N 3.3Å; I7-L9 PolarHBondContact O-N 3.42Å; I7-A10 PolarHBondContact O-N 2.99Å; I7-F11 HydrophobicContact CG2-CD2 3.63Å; I7-F11 HydrophobicContact CG2-CE2 3.62Å; I7-F11 WeakPolarHBondContact O-CD2 3.34Å; I7-F11 PolarHBondContact O-N 3.06Å
8	L	84.1	Confident	81	Confident	106 Å²	106	121.2 Å²	121.2	56%	0.555	61%	0.614	S	S	*	*	H	α-helix	trans	-59.6	-41.2	176.9	-170.4	71.6	0	0	0	112	F4 F11 S12	F4-L8 PolarHBondContact O-N 3.13Å; L8-F11 PolarHBondContact O-N 3.47Å; L8-S12 WeakPolarHBondContact O-CB 3.39Å; L8-S12 PolarHBondContact O-N 3.46Å
9	L	84.9	Confident	81.1	Confident	119 Å²	119	117.3 Å²	117.3	62%	0.623	60%	0.597	S	S	*	*	H	α-helix	trans	-64.6	-42.9	176.7	-168.1	117.8	0	0	0	111.8	S5 H6 I7 S12 L13	S5-L9 WeakPolarHBondContact O-CB 3.38Å; S5-L9 PolarHBondContact O-N 3.41Å; H6-L9 PolarHBondContact O-N 3.48Å; I7-L9 VanDerWaalsContact C-N 3.3Å; I7-L9 PolarHBondContact O-N 3.42Å; L9-S12 PolarHBondContact O-N 2.9Å; L9-L13 WeakPolarHBondContact O-CB 3.42Å; L9-L13 PolarHBondContact O-N 3.31Å
10	A	86.1	Confident	81	Confident	61 Å²	61	114 Å²	114	50%	0.504	58%	0.584	S	S	.	*	H	α-helix	trans	-64.2	-42.6	176.7	0	0	0	0	0	112.3	H6 I7 L13 G14	H6-A10 WeakPolarHBondContact O-CB 3.17Å; H6-A10 PolarHBondContact O-N 3.04Å; I7-A10 PolarHBondContact O-N 2.99Å; A10-L13 PolarHBondContact O-N 3.35Å; A10-G14 PolarHBondContact O-N 3.03Å
11	F	88.8	Confident	81.1	Confident	153 Å²	153	116.3 Å²	116.3	67%	0.671	59%	0.586	S	S	*	*	H	α-helix	trans	-63.5	-43.1	174	-88	-74.2	0	0	0	112.1	I7 L8 L13 G14 Y15	I7-F11 HydrophobicContact CG2-CD2 3.63Å; I7-F11 HydrophobicContact CG2-CE2 3.62Å; I7-F11 WeakPolarHBondContact O-CD2 3.34Å; I7-F11 PolarHBondContact O-N 3.06Å; L8-F11 PolarHBondContact O-N 3.47Å; F11-L13 VanDerWaalsContact C-N 3.32Å; F11-L13 PolarHBondContact O-N 3.36Å; F11-G14 PolarHBondContact O-N 3.48Å; F11-Y15 WeakPolarHBondContact O-CB 3.32Å; F11-Y15 PolarHBondContact O-N 2.96Å
12	S	81.4	Confident	82.6	Confident	78 Å²	78	106.8 Å²	106.8	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-62.1	-40.7	176.5	-175	0	0	0	0	111.9	L8 L9 F16	L8-S12 WeakPolarHBondContact O-CB 3.39Å; L8-S12 PolarHBondContact O-N 3.46Å; L9-S12 PolarHBondContact O-N 2.9Å; S12-F16 WeakPolarHBondContact O-CB 3.43Å; S12-F16 PolarHBondContact O-N 3.38Å
13	L	86.4	Confident	83.6	Confident	113 Å²	113	103 Å²	103	59%	0.592	53%	0.53	S	S	*	.	H	α-helix	trans	-67.3	-45.3	177.6	-161.3	98.8	0	0	0	111.1	L9 A10 F11 Y15 F16 C17	L9-L13 WeakPolarHBondContact O-CB 3.42Å; L9-L13 PolarHBondContact O-N 3.31Å; A10-L13 PolarHBondContact O-N 3.35Å; F11-L13 VanDerWaalsContact C-N 3.32Å; F11-L13 PolarHBondContact O-N 3.36Å; L13-Y15 VanDerWaalsContact C-N 3.33Å; L13-Y15 PolarHBondContact O-N 3.29Å; L13-F16 PolarHBondContact O-N 3.13Å; L13-C17 PolarHBondContact O-N 3.44Å; L13-C17 PolarHBondContact O-SG 2.9Å; L13-C17 VanDerWaalsContact O-SG 3.39Å
14	G	89.5	Confident	83.9	Confident	42 Å²	42	101 Å²	101	43%	0.433	52%	0.522	S	S	.	.	H	α-helix	trans	-60	-42.1	176.2	0	0	0	0	0	112.5	A10 F11 C17 F18	A10-G14 PolarHBondContact O-N 3.03Å; F11-G14 PolarHBondContact O-N 3.48Å; G14-C17 PolarHBondContact O-N 2.96Å; G14-F18 WeakPolarHBondContact O-CB 3.49Å; G14-F18 PolarHBondContact O-N 2.69Å
15	Y	88.4	Confident	83.9	Confident	164 Å²	164	97.3 Å²	97.3	64%	0.643	51%	0.507	S	S	*	.	H	α-helix	trans	-63	-45.1	174.2	-178.4	-103	0	0	0	112	F11 L13 C17 F18 V19	F11-Y15 WeakPolarHBondContact O-CB 3.32Å; F11-Y15 PolarHBondContact O-N 2.96Å; L13-Y15 VanDerWaalsContact C-N 3.33Å; L13-Y15 PolarHBondContact O-N 3.29Å; Y15-C17 PolarHBondContact O-N 3.37Å; Y15-F18 PolarHBondContact O-N 3.14Å; Y15-V19 HydrophobicContact CD1-CG2 4.12Å; Y15-V19 HydrophobicContact CD2-CG2 4.37Å; Y15-V19 HydrophobicContact CE1-CG2 3.68Å; Y15-V19 HydrophobicContact CE2-CG2 3.96Å; Y15-V19 HydrophobicContact CG-CG2 4.45Å; Y15-V19 WeakPolarHBondContact O-CG2 3.49Å; Y15-V19 PolarHBondContact O-N 3.2Å
16	F	82.7	Confident	83.7	Confident	140 Å²	140	95 Å²	95	61%	0.614	49%	0.489	S	S	*	.	H	α-helix	trans	-60.2	-42.9	177.4	-177.7	-94.9	0	0	0	112.6	S12 L13 V19 S20	S12-F16 WeakPolarHBondContact O-CB 3.43Å; S12-F16 PolarHBondContact O-N 3.38Å; L13-F16 PolarHBondContact O-N 3.13Å; F16-V19 PolarHBondContact O-N 3.05Å; F16-S20 VanDerWaalsContact O-CB 3.32Å; F16-S20 WeakPolarHBondContact O-CB 3.32Å; F16-S20 PolarHBondContact O-N 3.28Å; F16-S20 PolarHBondContact O-OG 3.32Å
17	C	85.7	Confident	83.5	Confident	74 Å²	74	92.7 Å²	92.7	50%	0.5	48%	0.478	S	S	.	.	H	α-helix	trans	-63.4	-42.7	175.1	-68.8	0	0	0	0	111.9	L13 G14 Y15 S20 W21	L13-C17 PolarHBondContact O-N 3.44Å; L13-C17 PolarHBondContact O-SG 2.9Å; L13-C17 VanDerWaalsContact O-SG 3.39Å; G14-C17 PolarHBondContact O-N 2.96Å; Y15-C17 PolarHBondContact O-N 3.37Å; C17-S20 PolarHBondContact O-N 3.2Å; C17-W21 WeakPolarHBondContact O-CB 3.45Å; C17-W21 PolarHBondContact O-N 2.95Å
18	F	88.3	Confident	83.2	Confident	135 Å²	135	91.7 Å²	91.7	59%	0.592	48%	0.478	S	S	*	.	H	α-helix	trans	-62.7	-43.8	176.4	175.8	-99.9	0	0	0	112.4	G14 Y15 W21 S22	G14-F18 WeakPolarHBondContact O-CB 3.49Å; G14-F18 PolarHBondContact O-N 2.69Å; Y15-F18 PolarHBondContact O-N 3.14Å; F18-W21 PolarHBondContact O-N 3.48Å; F18-S22 WeakPolarHBondContact O-CB 3.35Å; F18-S22 PolarHBondContact O-N 2.84Å; F18-S22 PolarHBondContact O-OG 2.94Å
19	V	83.8	Confident	82.8	Confident	47 Å²	47	88 Å²	88	29%	0.285	46%	0.461	S	S	.	.	H	α-helix	trans	-65.4	-42.4	177.6	172	0	0	0	0	110.9	Y15 F16 S22 L23	Y15-V19 HydrophobicContact CD1-CG2 4.12Å; Y15-V19 HydrophobicContact CD2-CG2 4.37Å; Y15-V19 HydrophobicContact CE1-CG2 3.68Å; Y15-V19 HydrophobicContact CE2-CG2 3.96Å; Y15-V19 HydrophobicContact CG-CG2 4.45Å; Y15-V19 WeakPolarHBondContact O-CG2 3.49Å; Y15-V19 PolarHBondContact O-N 3.2Å; F16-V19 PolarHBondContact O-N 3.05Å; V19-S22 PolarHBondContact O-N 3.17Å; V19-L23 HydrophobicContact CG1-CD1 4.02Å; V19-L23 HydrophobicContact CG1-CG 4.49Å; V19-L23 WeakPolarHBondContact O-CB 3.49Å; V19-L23 WeakPolarHBondContact O-CG 3.25Å; V19-L23 PolarHBondContact O-N 3.08Å
20	S	79	Confident	82.3	Confident	50 Å²	50	87.1 Å²	87.1	35%	0.35	46%	0.464	S	S	.	.	H	α-helix	trans	-64.6	-40.5	177.4	-66.5	0	0	0	0	112	F16 C17 F24	F16-S20 VanDerWaalsContact O-CB 3.32Å; F16-S20 WeakPolarHBondContact O-CB 3.32Å; F16-S20 PolarHBondContact O-N 3.28Å; F16-S20 PolarHBondContact O-OG 3.32Å; C17-S20 PolarHBondContact O-N 3.2Å; S20-F24 WeakPolarHBondContact O-CB 3.12Å; S20-F24 PolarHBondContact O-N 3.47Å
21	W	83.3	Confident	82	Confident	163 Å²	163	88.3 Å²	88.3	62%	0.617	46%	0.462	S	S	*	.	H	α-helix	trans	-64.3	-45.4	173.5	-178.3	-95.5	0	0	0	112	C17 F18 L23 F24 E25	C17-W21 WeakPolarHBondContact O-CB 3.45Å; C17-W21 PolarHBondContact O-N 2.95Å; F18-W21 PolarHBondContact O-N 3.48Å; W21-L23 VanDerWaalsContact C-N 3.33Å; W21-L23 PolarHBondContact O-N 3.48Å; W21-F24 WeakPolarHBondContact O-CB 3.36Å; W21-F24 PolarHBondContact O-N 2.98Å; W21-F24 VanDerWaalsContact O-N 3.15Å; W21-E25 PolarHBondContact O-N 2.96Å
22	S	80.6	Confident	81.6	Confident	39 Å²	39	82.6 Å²	82.6	27%	0.273	44%	0.441	S	S	.	.	H	α-helix	trans	-61.5	-42.2	177.8	-57.9	0	0	0	0	111.5	F18 V19 E25 V26	F18-S22 WeakPolarHBondContact O-CB 3.35Å; F18-S22 PolarHBondContact O-N 2.84Å; F18-S22 PolarHBondContact O-OG 2.94Å; V19-S22 PolarHBondContact O-N 3.17Å; S22-E25 PolarHBondContact O-N 3.02Å; S22-V26 WeakPolarHBondContact O-CG2 3.28Å; S22-V26 PolarHBondContact O-N 3.29Å; S22-V26 VanDerWaalsContact O-N 3.1Å
23	L	79	Confident	81.3	Confident	93 Å²	93	88.5 Å²	88.5	49%	0.487	46%	0.457	S	S	.	.	H	α-helix	trans	-62.6	-44.8	173.4	-77.3	168.8	0	0	0	111.2	V19 W21 E25 V26 F27	V19-L23 HydrophobicContact CG1-CD1 4.02Å; V19-L23 HydrophobicContact CG1-CG 4.49Å; V19-L23 WeakPolarHBondContact O-CB 3.49Å; V19-L23 WeakPolarHBondContact O-CG 3.25Å; V19-L23 PolarHBondContact O-N 3.08Å; W21-L23 VanDerWaalsContact C-N 3.33Å; W21-L23 PolarHBondContact O-N 3.48Å; L23-E25 VanDerWaalsContact C-N 3.3Å; L23-E25 PolarHBondContact O-N 3.24Å; L23-V26 WeakPolarHBondContact O-CB 3.29Å; L23-V26 PolarHBondContact O-N 3.19Å; L23-V26 VanDerWaalsContact O-N 3.14Å; L23-F27 WeakPolarHBondContact O-CD2 3.43Å; L23-F27 PolarHBondContact O-N 3.42Å; L23-F27 VanDerWaalsContact O-N 3.13Å
24	F	80	Confident	80.4	Confident	114 Å²	114	85.2 Å²	85.2	50%	0.5	45%	0.45	S	S	.	.	H	α-helix	trans	-58.3	-42.8	176.9	178.6	-100	0	0	0	112	S20 W21 V26 F27 S28	S20-F24 WeakPolarHBondContact O-CB 3.12Å; S20-F24 PolarHBondContact O-N 3.47Å; W21-F24 WeakPolarHBondContact O-CB 3.36Å; W21-F24 PolarHBondContact O-N 2.98Å; W21-F24 VanDerWaalsContact O-N 3.15Å; F24-V26 VanDerWaalsContact C-N 3.31Å; F24-V26 PolarHBondContact O-N 2.95Å; F24-F27 PolarHBondContact O-N 3.26Å; F24-S28 PolarHBondContact O-N 3.14Å
25	E	79.9	Confident	79.1	Confident	85 Å²	85	89.9 Å²	89.9	40%	0.397	47%	0.473	S	S	.	.	H	α-helix	trans	-66.4	-31	177.7	-170.2	174.8	-177.8	0	0	113	W21 S22 L23 P29 R228	W21-E25 PolarHBondContact O-N 2.96Å; S22-E25 PolarHBondContact O-N 3.02Å; L23-E25 VanDerWaalsContact C-N 3.3Å; L23-E25 PolarHBondContact O-N 3.24Å; E25-P29 WeakPolarHBondContact O-CA 3.38Å; E25-R228 PolarHBondContact O-NH1 3.41Å
26	V	76.9	Confident	78	Confident	26 Å²	26	87.3 Å²	87.3	16%	0.158	48%	0.479	C	S	.	.	H	α-helix	trans	-64.1	-46	171.8	170.6	0	0	0	0	111	S22 L23 F24 R228 M232	S22-V26 WeakPolarHBondContact O-CG2 3.28Å; S22-V26 PolarHBondContact O-N 3.29Å; S22-V26 VanDerWaalsContact O-N 3.1Å; L23-V26 WeakPolarHBondContact O-CB 3.29Å; L23-V26 PolarHBondContact O-N 3.19Å; L23-V26 VanDerWaalsContact O-N 3.14Å; F24-V26 VanDerWaalsContact C-N 3.31Å; F24-V26 PolarHBondContact O-N 2.95Å; V26-R228 HydrophobicContact CG1-CB 4.28Å; V26-M232 HydrophobicContact CG1-CE 3.7Å; V26-M232 HydrophobicContact CG2-CE 4.46Å
27	F	79.9	Confident	77.6	Confident	61 Å²	61	82.1 Å²	82.1	27%	0.268	47%	0.465	S	S	.	.	H	α-helix	trans	-79.1	-33	-176.6	-78.5	-86.9	0	0	0	114.1	L23 F24 L229	L23-F27 WeakPolarHBondContact O-CD2 3.43Å; L23-F27 PolarHBondContact O-N 3.42Å; L23-F27 VanDerWaalsContact O-N 3.13Å; F24-F27 PolarHBondContact O-N 3.26Å; F27-L229 HydrophobicContact CZ-CD2 4.25Å
28	S	77.6	Confident	77.5	Confident	62 Å²	62	80.3 Å²	80.3	43%	0.434	45%	0.453	S	S	.	.	S	Bend	trans	-131.3	71.9	-176.4	-60.4	0	0	0	0	110.4	F24 S30	F24-S28 PolarHBondContact O-N 3.14Å; S28-S30 PolarHBondContact O-N 3.23Å
29	P	76.1	Confident	77.3	Confident	29 Å²	29	75.3 Å²	75.3	19%	0.188	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-62.8	139.7	177.4	26.6	-33.5	0	0	0	110.2	E25 V163 I224	E25-P29 WeakPolarHBondContact O-CA 3.38Å; P29-V163 HydrophobicContact CG-CG1 4.23Å; P29-I224 HydrophobicContact CG-CG1 3.98Å; P29-I224 HydrophobicContact CG-CG2 3.78Å
30	S	75.6	Confident	77.4	Confident	100 Å²	100	76.9 Å²	76.9	70%	0.699	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-69	133.5	174	63.6	0	0	0	0	110.3	S28 C32	S28-S30 PolarHBondContact O-N 3.23Å; S30-C32 PolarHBondContact O-N 2.7Å
31	N	78.6	Confident	77.8	Confident	87 Å²	87	76.1 Å²	76.1	47%	0.465	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-65.3	134.8	174.1	-78.8	-25.6	0	0	0	109.8	K33 S164	N31-K33 PolarHBondContact O-N 3.48Å; N31-K33 VanDerWaalsContact O-N 3.13Å; N31-S164 WeakPolarHBondContact CB-OG 3.21Å
32	C	80	Confident	77.9	Confident	32 Å²	32	70.1 Å²	70.1	22%	0.216	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-58.7	116.6	173.3	-175.6	0	0	0	0	109.7	S30 C38 S164	S30-C32 PolarHBondContact O-N 2.7Å; C32-C38 HydrophobicContact CB-CB 3.74Å; C32-C38 WeakPolarHBondContact CB-SG 3.13Å; C32-C38 VanDerWaalsContact SG-CA 3.57Å; C32-C38 WeakPolarHBondContact SG-CB 3.49Å; C32-C38 CovalentContact SG-SG 2.04Å; C32-C38 PolarHBondContact SG-SG 2.9Å; C32-S164 VanDerWaalsContact CB-O 3.3Å; C32-S164 WeakPolarHBondContact CB-O 3.49Å; C32-S164 PolarHBondContact N-O 2.93Å; C32-S164 PolarHBondContact N-OG 3.47Å; C32-S164 VanDerWaalsContact N-OG 3.12Å; C32-S164 PolarHBondContact O-OG 2.95Å
33	K	75.3	Confident	78.2	Confident	202 Å²	202	68.8 Å²	68.8	88%	0.878	41%	0.413	S	S	*	.			trans	-110.2	100.2	175.2	-67.7	179.7	-176.4	179.2	0	108.2	N31	N31-K33 PolarHBondContact O-N 3.48Å; N31-K33 VanDerWaalsContact O-N 3.13Å
34	G	67.5	Low	78.6	Confident	44 Å²	44	71.2 Å²	71.2	45%	0.454	42%	0.419	S	S	.	.	S	Bend	trans	176.3	151.6	175.1	0	0	0	0	0	113.5	S36 C38	G34-S36 VanDerWaalsContact C-N 3.33Å; G34-C38 PolarHBondContact O-SG 3.26Å
35	P	63.4	Low	78.8	Confident	141 Å²	141	67.6 Å²	67.6	92%	0.916	41%	0.407	S	S	*	.	S	Bend	trans	-73.6	-20.8	179.3	28	-32.9	0	0	0	113.6
36	S	64.2	Low	79.1	Confident	110 Å²	110	68.9 Å²	68.9	77%	0.769	42%	0.417	S	S	*	.	S	Bend	trans	-116.3	99.3	-172	43	0	0	0	0	112.1	G34	G34-S36 VanDerWaalsContact C-N 3.33Å
37	G	75.3	Confident	79.5	Confident	31 Å²	31	70.6 Å²	70.6	32%	0.32	43%	0.426	S	S	.	.	S	Bend	trans	99.5	20.9	162.5	0	0	0	0	0	117.3	R167	G37-R167 WeakPolarHBondContact O-CB 3.31Å; G37-R167 PolarHBondContact O-N 3.42Å
38	C	83.3	Confident	79.8	Confident	36 Å²	36	72 Å²	72	24%	0.243	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	135.4	168.3	-56.6	0	0	0	0	111	C32 G34 F165	C32-C38 HydrophobicContact CB-CB 3.74Å; C32-C38 WeakPolarHBondContact CB-SG 3.13Å; C32-C38 VanDerWaalsContact SG-CA 3.57Å; C32-C38 WeakPolarHBondContact SG-CB 3.49Å; C32-C38 CovalentContact SG-SG 2.04Å; C32-C38 PolarHBondContact SG-SG 2.9Å; G34-C38 PolarHBondContact O-SG 3.26Å; C38-F165 CarbonylContact C-O 3.56Å; C38-F165 WeakPolarHBondContact CA-O 3.3Å
39	I	84.7	Confident	80.2	Confident	30 Å²	30	69.3 Å²	69.3	15%	0.154	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	112.9	171.4	-51.9	178.1	0	0	0	107.4	S164 F165 R167 V170 L180 Y185	I39-S164 WeakPolarHBondContact O-CA 3.45Å; I39-F165 PolarHBondContact N-O 2.7Å; I39-F165 PolarHBondContact O-N 2.95Å; I39-F165 VanDerWaalsContact O-N 3.13Å; I39-R167 HydrophobicContact CD1-CB 4.32Å; I39-R167 HydrophobicContact CD1-CG 4.43Å; I39-R167 HydrophobicContact CG1-CB 4.2Å; I39-V170 HydrophobicContact CD1-CG2 4.13Å; I39-L180 HydrophobicContact CD1-CD2 4.47Å; I39-L180 HydrophobicContact CG2-CD2 3.53Å; I39-Y185 HydrophobicContact CG2-CD1 3.87Å; I39-Y185 HydrophobicContact CG2-CG 4.41Å
40	T	85.9	Confident	80.7	Confident	79 Å²	79	71.2 Å²	71.2	49%	0.485	42%	0.419	S	S	.	.			trans	-94.8	149.9	-178.7	52	0	0	0	0	111.9	G184 Y185	T40-G184 CarbonylContact O-C 3.56Å; T40-G184 WeakPolarHBondContact O-CA 3.5Å; T40-Y185 VanDerWaalsContact C-CD1 3.44Å; T40-Y185 WeakPolarHBondContact O-CD1 3.32Å; T40-Y185 PolarHBondContact O-N 2.84Å
41	P	87.5	Confident	81.1	Confident	35 Å²	35	66.5 Å²	66.5	23%	0.227	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-70	132	175.8	19.4	-21.1	0	0	0	110.9	W43 P162 Y185	P41-W43 PolarHBondContact O-N 2.87Å; P41-P162 HydrophobicContact CB-CB 3.94Å; P41-P162 HydrophobicContact CG-CB 3.44Å; P41-P162 VanDerWaalsContact CG-CB 3.44Å; P41-Y185 HydrophobicContact CB-CD1 4.29Å; P41-Y185 HydrophobicContact CB-CE1 3.59Å; P41-Y185 HydrophobicContact CB-CE2 4.4Å; P41-Y185 HydrophobicContact CG-CE1 4.09Å; P41-Y185 VanDerWaalsContact N-CE1 3.27Å
42	G	84.8	Confident	81.3	Confident	36 Å²	36	64.7 Å²	64.7	37%	0.371	37%	0.374	S	S	.	.	S	Bend	trans	-86.6	14	173.9	0	0	0	0	0	114.2	K183 Y185	G42-K183 WeakPolarHBondContact CA-O 3.49Å; G42-Y185 PolarHBondContact N-O 2.83Å
43	W	87.6	Confident	81.4	Confident	12 Å²	12	63.1 Å²	63.1	5%	0.045	36%	0.364	C	S	.	.			trans	-140	157.2	-172.8	57.4	-84	0	0	0	110.9	P41 D47 I73 L159 P162 Y185 P187	P41-W43 PolarHBondContact O-N 2.87Å; W43-D47 VanDerWaalsContact CA-OD2 3.31Å; W43-D47 WeakPolarHBondContact CA-OD2 3.13Å; W43-I73 HydrophobicContact CD2-CD1 4.42Å; W43-I73 HydrophobicContact CE3-CD1 3.66Å; W43-I73 HydrophobicContact CZ3-CD1 4.19Å; W43-I73 HydrophobicContact CZ3-CG2 4.24Å; W43-L159 HydrophobicContact CH2-CB 4.36Å; W43-L159 HydrophobicContact CH2-CD2 4.46Å; W43-L159 HydrophobicContact CH2-CG 4.14Å; W43-L159 WeakPolarHBondContact CH2-O 2.88Å; W43-L159 HydrophobicContact CZ2-CB 4.47Å; W43-L159 HydrophobicContact CZ2-CD2 4.1Å; W43-L159 HydrophobicContact CZ2-CG 4.25Å; W43-L159 WeakPolarHBondContact CZ3-O 3.32Å; W43-P162 HydrophobicContact CH2-CB 4.49Å; W43-Y185 HydrophobicContact CZ2-CE2 4.3Å; W43-Y185 AromaticContact NE1-CD2 3.97Å; W43-Y185 AromaticContact NE1-CE2 3.47Å; W43-Y185 AromaticContact NE1-CZ 3.96Å; W43-P187 HydrophobicContact CB-CG 3.85Å; W43-P187 HydrophobicContact CD2-CB 4.19Å; W43-P187 HydrophobicContact CD2-CG 3.92Å; W43-P187 HydrophobicContact CG-CB 4.29Å; W43-P187 HydrophobicContact CG-CG 3.57Å
44	K	86.5	Confident	81.5	Confident	143 Å²	143	55.2 Å²	55.2	62%	0.622	33%	0.33	S	S	*	.			trans	-116.6	154.9	175.3	-62.7	179	-178.5	178.3	0	110.6	D46 D47	K44-D46 PolarHBondContact O-N 3.47Å; K44-D46 VanDerWaalsContact O-N 3.14Å; K44-D47 PolarHBondContact N-OD2 3.1Å; K44-D47 WeakPolarHBondContact O-CB 3.35Å; K44-D47 PolarHBondContact O-N 3.13Å
45	P	84.2	Confident	81.7	Confident	38 Å²	38	54 Å²	54	25%	0.247	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.8	179	-26.5	35	0	0	0	115.1	I73 N74 P162	P45-I73 WeakPolarHBondContact O-CB 3.47Å; P45-N74 HydrophobicContact CB-CB 4.44Å; P45-N74 WeakPolarHBondContact O-CB 3.41Å; P45-N74 PolarHBondContact O-N 3.46Å; P45-P162 HydrophobicContact CG-CG 4.32Å
46	D	85.4	Confident	82	Confident	112 Å²	112	47.9 Å²	47.9	60%	0.599	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	1.3	-179.3	-59.3	-45	0	0	0	113.3	K44	K44-D46 PolarHBondContact O-N 3.47Å; K44-D46 VanDerWaalsContact O-N 3.14Å
47	D	85.9	Confident	81.9	Confident	63 Å²	63	47.8 Å²	47.8	34%	0.337	26%	0.257	S	S	.	.			trans	-67.4	142.7	177.6	-71	-12.2	0	0	0	110.9	W43 K44 I73	W43-D47 VanDerWaalsContact CA-OD2 3.31Å; W43-D47 WeakPolarHBondContact CA-OD2 3.13Å; K44-D47 PolarHBondContact N-OD2 3.1Å; K44-D47 WeakPolarHBondContact O-CB 3.35Å; K44-D47 PolarHBondContact O-N 3.13Å; D47-I73 HydrophobicContact CB-CD1 4.47Å; D47-I73 PolarHBondContact O-N 2.95Å
48	E	86.4	Confident	81	Confident	90 Å²	90	49.1 Å²	49.1	42%	0.421	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	130.2	176.3	-71.3	178.6	-179.1	0	0	111.1	F71 K72	E48-F71 CarbonylContact C-O 3.5Å; E48-F71 WeakPolarHBondContact CA-O 3.45Å; E48-K72 HydrophobicContact CG-CG 3.65Å; E48-K72 WeakPolarHBondContact OE1-CE 3.46Å; E48-K72 IonicContact OE1-NZ 3.98Å
49	L	86.8	Confident	79.6	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.026	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	149.4	175.2	-61.5	-175.2	0	0	0	110	T70 F71 I73 I109 V158 P187	L49-T70 CarbonylContact O-C 3.48Å; L49-T70 WeakPolarHBondContact O-CA 3.39Å; L49-F71 HydrophobicContact CB-CD1 4.33Å; L49-F71 HydrophobicContact CB-CE1 3.7Å; L49-F71 HydrophobicContact CB-CE2 4.2Å; L49-F71 HydrophobicContact CB-CZ 3.63Å; L49-F71 HydrophobicContact CD1-CE2 4.28Å; L49-F71 HydrophobicContact CD1-CZ 3.92Å; L49-F71 HydrophobicContact CG-CZ 4.34Å; L49-F71 PolarHBondContact N-O 3.37Å; L49-F71 WeakPolarHBondContact O-CD1 3.48Å; L49-F71 PolarHBondContact O-N 2.9Å; L49-I73 HydrophobicContact CD1-CD1 3.83Å; L49-I73 HydrophobicContact CD1-CG1 3.61Å; L49-I73 HydrophobicContact CG-CD1 4.08Å; L49-I73 HydrophobicContact CG-CG1 3.88Å; L49-I109 HydrophobicContact CD1-CD1 4.02Å; L49-I109 HydrophobicContact CD2-CD1 3.66Å; L49-I109 HydrophobicContact CG-CD1 4.42Å; L49-V158 HydrophobicContact CD1-CG1 4.48Å; L49-P187 HydrophobicContact CD1-CB 4.35Å; L49-P187 HydrophobicContact CD1-CG 4.22Å; L49-P187 HydrophobicContact CD2-CG 4.38Å
50	K	85.9	Confident	77.9	Confident	69 Å²	69	54.1 Å²	54.1	30%	0.3	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	132.1	174.8	-75	171.7	-176.2	171.4	0	109.1	E69 T70 L102	K50-E69 CarbonylContact C-O 3.57Å; K50-E69 WeakPolarHBondContact CA-O 3.18Å; K50-T70 HydrophobicContact CD-CG2 4.34Å; K50-T70 HydrophobicContact CG-CG2 3.56Å; K50-L102 HydrophobicContact CB-CB 4.36Å; K50-L102 PolarHBondContact N-O 3.36Å; K50-L102 PolarHBondContact O-N 2.93Å
51	I	84.7	Confident	76	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.1	172.4	-162.4	152.4	0	0	0	108.9	T68 E69 F71 L99 L101 L217 I219	I51-T68 VanDerWaalsContact O-CA 3.24Å; I51-T68 WeakPolarHBondContact O-CA 3.37Å; I51-E69 HydrophobicContact CG2-CB 3.83Å; I51-E69 PolarHBondContact N-O 2.93Å; I51-E69 PolarHBondContact O-N 3.41Å; I51-F71 HydrophobicContact CB-CE1 4.18Å; I51-L99 HydrophobicContact CD1-CD1 3.66Å; I51-L99 HydrophobicContact CD1-CD2 4.25Å; I51-L99 HydrophobicContact CD1-CG 4.2Å; I51-L99 HydrophobicContact CG1-CD1 3.57Å; I51-L99 HydrophobicContact CG1-CG 4.19Å; I51-L101 HydrophobicContact CD1-CD1 3.48Å; I51-L101 VanDerWaalsContact CD1-CD1 3.48Å; I51-L101 HydrophobicContact CD1-CG 4.29Å; I51-L101 HydrophobicContact CG1-CD1 3.78Å; I51-L101 HydrophobicContact CG1-CG 4.42Å; I51-L217 HydrophobicContact CD1-CD1 4.38Å; I51-L217 HydrophobicContact CD1-CD2 4.13Å; I51-L217 HydrophobicContact CG2-CD2 4.23Å; I51-I219 HydrophobicContact CB-CD1 4.33Å; I51-I219 HydrophobicContact CD1-CD1 3.42Å; I51-I219 VanDerWaalsContact CD1-CD1 3.42Å; I51-I219 HydrophobicContact CD1-CG1 4.06Å; I51-I219 HydrophobicContact CG2-CD1 4.16Å
52	H	83.1	Confident	73.8	Confident	49 Å²	49	61.4 Å²	61.4	23%	0.227	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	112.3	175.3	-76.6	-138.3	0	0	0	107.4	T67 T68 R100 L102	H52-T67 WeakPolarHBondContact CA-O 3.32Å; H52-T68 VanDerWaalsContact CD2-CG2 3.48Å; H52-T68 WeakPolarHBondContact CD2-CG2 3.23Å; H52-T68 PolarHBondContact CD2-OG1 3.21Å; H52-T68 VanDerWaalsContact CD2-OG1 3.28Å; H52-T68 PolarHBondContact CE1-OG1 3.49Å; H52-T68 PolarHBondContact ND1-OG1 3.01Å; H52-T68 WeakPolarHBondContact NE2-CG2 3.49Å; H52-T68 PolarHBondContact NE2-OG1 3.19Å; H52-R100 HydrophobicContact CB-CB 4.24Å; H52-R100 PolarHBondContact N-O 3.3Å; H52-R100 PolarHBondContact O-N 3.24Å; H52-L102 HydrophobicContact CB-CD1 3.96Å; H52-L102 VanDerWaalsContact CD2-CD1 3.44Å; H52-L102 WeakPolarHBondContact CD2-CD1 3.34Å
53	L	80.3	Confident	72	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.1	174.6	-177.3	64.8	0	0	0	108.7	F55 S66 T67 Y81 A97 L99 F114	L53-F55 HydrophobicContact CD2-CE1 4.44Å; L53-F55 HydrophobicContact CD2-CE2 3.88Å; L53-F55 HydrophobicContact CD2-CZ 3.58Å; L53-F55 HydrophobicContact CG-CE2 4.05Å; L53-F55 HydrophobicContact CG-CZ 4.03Å; L53-S66 WeakPolarHBondContact O-CA 3.25Å; L53-T67 PolarHBondContact N-O 2.94Å; L53-T67 PolarHBondContact O-N 3.06Å; L53-Y81 HydrophobicContact CD2-CD2 4.37Å; L53-Y81 HydrophobicContact CD2-CE2 4.34Å; L53-A97 HydrophobicContact CD1-CB 4.22Å; L53-L99 HydrophobicContact CB-CD1 4.24Å; L53-L99 HydrophobicContact CD1-CB 4.45Å; L53-L99 HydrophobicContact CD1-CD1 3.76Å; L53-F114 HydrophobicContact CD1-CZ 4.16Å
54	Q	77.6	Confident	70.3	Confident	36 Å²	36	63.7 Å²	63.7	17%	0.168	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.6	-179.8	-64.8	-177.5	-23	0	0	109.8	A97 R98	Q54-A97 CarbonylContact O-C 3.42Å; Q54-A97 WeakPolarHBondContact O-CA 3.47Å; Q54-R98 HydrophobicContact CB-CB 4.44Å; Q54-R98 PolarHBondContact N-O 2.92Å; Q54-R98 PolarHBondContact O-N 3.38Å
55	F	73.1	Confident	69.1	Low	19 Å²	19	61.1 Å²	61.1	8%	0.083	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	128.2	174.4	-61.8	-83.2	0	0	0	110	L53 A64 I65 C83 A97 L116 M215	L53-F55 HydrophobicContact CD2-CE1 4.44Å; L53-F55 HydrophobicContact CD2-CE2 3.88Å; L53-F55 HydrophobicContact CD2-CZ 3.58Å; L53-F55 HydrophobicContact CG-CE2 4.05Å; L53-F55 HydrophobicContact CG-CZ 4.03Å; F55-A64 WeakPolarHBondContact O-CA 3.4Å; F55-A64 WeakPolarHBondContact O-CB 3.47Å; F55-I65 HydrophobicContact CD2-CB 4Å; F55-I65 HydrophobicContact CD2-CG2 4.44Å; F55-I65 WeakPolarHBondContact CD2-O 3.33Å; F55-I65 PolarHBondContact N-O 3.15Å; F55-C83 WeakPolarHBondContact CZ-SG 3.35Å; F55-A97 HydrophobicContact CD1-CB 4.15Å; F55-A97 HydrophobicContact CE1-CB 4.31Å; F55-L116 HydrophobicContact CD1-CD1 3.64Å; F55-L116 HydrophobicContact CE1-CD1 3.69Å; F55-M215 HydrophobicContact CE1-CE 3.75Å; F55-M215 HydrophobicContact CE1-SD 4.11Å; F55-M215 HydrophobicContact CZ-CE 4.33Å; F55-M215 HydrophobicContact CZ-SD 4.17Å
56	I	68.6	Low	68.1	Low	11 Å²	11	62.3 Å²	62.3	6%	0.056	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.7	-175.7	-55.3	169.4	0	0	0	108.1	F61 T96 R98	I56-F61 HydrophobicContact CD1-CE1 4.49Å; I56-T96 PolarHBondContact N-O 3.46Å; I56-T96 PolarHBondContact O-N 3.29Å; I56-T96 PolarHBondContact O-OG1 3.29Å; I56-R98 HydrophobicContact CD1-CB 3.97Å
57	K	62.6	Low	67.3	Low	108 Å²	108	58.5 Å²	58.5	47%	0.47	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.9	-179.5	-175.5	-179.5	179.5	-177.1	0	109.5	G59 D60 D86	K57-G59 VanDerWaalsContact C-N 3.25Å; K57-G59 PolarHBondContact O-N 2.93Å; K57-D60 PolarHBondContact O-N 3.36Å; K57-D86 IonicContact NZ-OD2 3.71Å; K57-D86 PolarHBondContact NZ-OD2 2.82Å
58	G	57	Low	66.9	Low	60 Å²	60	58.7 Å²	58.7	62%	0.619	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	24.6	170.4	0	0	0	0	0	115.6	D60	G58-D60 PolarHBondContact O-N 3Å
59	G	53.8	Low	66.7	Low	57 Å²	57	56.5 Å²	56.5	59%	0.588	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	-19.2	-178.4	0	0	0	0	0	115	K57	K57-G59 VanDerWaalsContact C-N 3.25Å; K57-G59 PolarHBondContact O-N 2.93Å
60	D	47.8	Very low	66.6	Low	114 Å²	114	59.8 Å²	59.8	61%	0.61	36%	0.362	S	S	*	.	B	Isolated β-bridge	trans	-90	128.1	177.9	-83	-26.8	0	0	0	111.9	K57 G58 V62	K57-D60 PolarHBondContact O-N 3.36Å; G58-D60 PolarHBondContact O-N 3Å; D60-V62 HydrophobicContact CB-CG2 4.2Å; D60-V62 PolarHBondContact O-N 3.3Å
61	F	45.5	Very low	66.6	Low	128 Å²	128	57 Å²	57	56%	0.561	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-66	-2.7	179.6	-78.3	-86.1	0	0	0	114.3	I56 G63 A64	I56-F61 HydrophobicContact CD1-CE1 4.49Å; F61-G63 PolarHBondContact O-N 3.38Å; F61-G63 VanDerWaalsContact O-N 3.11Å; F61-A64 WeakPolarHBondContact O-CB 3.42Å; F61-A64 PolarHBondContact O-N 3.37Å
62	V	41.3	Very low	66.7	Low	138 Å²	138	61.4 Å²	61.4	84%	0.836	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-69.6	-15.9	-160.8	-177.2	0	0	0	0	113.5	D60	D60-V62 HydrophobicContact CB-CG2 4.2Å; D60-V62 PolarHBondContact O-N 3.3Å
63	G	48.4	Very low	66.7	Low	60 Å²	60	59.2 Å²	59.2	62%	0.619	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-112.8	14	177.3	0	0	0	0	0	115.6	F61 I65	F61-G63 PolarHBondContact O-N 3.38Å; F61-G63 VanDerWaalsContact O-N 3.11Å; G63-I65 PolarHBondContact O-N 3.4Å
64	A	52.5	Low	67	Low	37 Å²	37	61.8 Å²	61.8	31%	0.306	37%	0.373	S	S	.	.			trans	-69.5	104.2	-167.3	0	0	0	0	0	113.7	F55 F61 S66	F55-A64 WeakPolarHBondContact O-CA 3.4Å; F55-A64 WeakPolarHBondContact O-CB 3.47Å; F61-A64 WeakPolarHBondContact O-CB 3.42Å; F61-A64 PolarHBondContact O-N 3.37Å; A64-S66 PolarHBondContact O-N 3.35Å; A64-S66 VanDerWaalsContact O-N 3.12Å
65	I	59.7	Low	67.3	Low	89 Å²	89	65 Å²	65	46%	0.456	40%	0.396	S	S	.	.			trans	-68.3	107.2	160.4	-58.5	169.8	0	0	0	105.9	F55 G63	F55-I65 HydrophobicContact CD2-CB 4Å; F55-I65 HydrophobicContact CD2-CG2 4.44Å; F55-I65 WeakPolarHBondContact CD2-O 3.33Å; F55-I65 PolarHBondContact N-O 3.15Å; G63-I65 PolarHBondContact O-N 3.4Å
66	S	64.4	Low	67.9	Low	62 Å²	62	64.6 Å²	64.6	43%	0.434	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	122	174.1	-176.2	0	0	0	0	108.4	L53 A64	L53-S66 WeakPolarHBondContact O-CA 3.25Å; A64-S66 PolarHBondContact O-N 3.35Å; A64-S66 VanDerWaalsContact O-N 3.12Å
67	T	68.5	Low	68.8	Low	33 Å²	33	65.9 Å²	65.9	20%	0.202	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	134.2	173.5	-47.7	0	0	0	0	110.5	H52 L53 E69 Y81	H52-T67 WeakPolarHBondContact CA-O 3.32Å; L53-T67 PolarHBondContact N-O 2.94Å; L53-T67 PolarHBondContact O-N 3.06Å; T67-E69 HydrophobicContact CG2-CG 4.32Å; T67-Y81 HydrophobicContact CG2-CE1 3.63Å
68	T	77.4	Confident	69.9	Low	67 Å²	67	65.6 Å²	65.6	41%	0.411	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.5	175.7	-62.5	0	0	0	0	109.1	I51 H52	I51-T68 VanDerWaalsContact O-CA 3.24Å; I51-T68 WeakPolarHBondContact O-CA 3.37Å; H52-T68 VanDerWaalsContact CD2-CG2 3.48Å; H52-T68 WeakPolarHBondContact CD2-CG2 3.23Å; H52-T68 PolarHBondContact CD2-OG1 3.21Å; H52-T68 VanDerWaalsContact CD2-OG1 3.28Å; H52-T68 PolarHBondContact CE1-OG1 3.49Å; H52-T68 PolarHBondContact ND1-OG1 3.01Å; H52-T68 WeakPolarHBondContact NE2-CG2 3.49Å; H52-T68 PolarHBondContact NE2-OG1 3.19Å
69	E	82	Confident	71.2	Confident	43 Å²	43	66.7 Å²	66.7	20%	0.201	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	148.3	173.6	-64.9	-75.2	-171.4	0	0	109.5	K50 I51 T67 L77 K79 Y81	K50-E69 CarbonylContact C-O 3.57Å; K50-E69 WeakPolarHBondContact CA-O 3.18Å; I51-E69 HydrophobicContact CG2-CB 3.83Å; I51-E69 PolarHBondContact N-O 2.93Å; I51-E69 PolarHBondContact O-N 3.41Å; T67-E69 HydrophobicContact CG2-CG 4.32Å; E69-L77 HydrophobicContact CB-CD2 3.74Å; E69-L77 HydrophobicContact CG-CD2 4.37Å; E69-K79 IonicContact OE1-NZ 2.74Å; E69-K79 PolarHBondContact OE1-NZ 3.35Å; E69-Y81 VanDerWaalsContact CG-OH 3.25Å; E69-Y81 WeakPolarHBondContact CG-OH 3.43Å
70	T	84.1	Confident	72.6	Confident	75 Å²	75	70.2 Å²	70.2	46%	0.46	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.6	174.4	46	0	0	0	0	110.2	L49 K50	L49-T70 CarbonylContact O-C 3.48Å; L49-T70 WeakPolarHBondContact O-CA 3.39Å; K50-T70 HydrophobicContact CD-CG2 4.34Å; K50-T70 HydrophobicContact CG-CG2 3.56Å
71	F	86.9	Confident	73.9	Confident	9 Å²	9	65.8 Å²	65.8	4%	0.039	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	156.2	177.2	71.1	-82.9	0	0	0	111.6	E48 L49 I51 L77 L101 V158 I219	E48-F71 CarbonylContact C-O 3.5Å; E48-F71 WeakPolarHBondContact CA-O 3.45Å; L49-F71 HydrophobicContact CB-CD1 4.33Å; L49-F71 HydrophobicContact CB-CE1 3.7Å; L49-F71 HydrophobicContact CB-CE2 4.2Å; L49-F71 HydrophobicContact CB-CZ 3.63Å; L49-F71 HydrophobicContact CD1-CE2 4.28Å; L49-F71 HydrophobicContact CD1-CZ 3.92Å; L49-F71 HydrophobicContact CG-CZ 4.34Å; L49-F71 PolarHBondContact N-O 3.37Å; L49-F71 WeakPolarHBondContact O-CD1 3.48Å; L49-F71 PolarHBondContact O-N 2.9Å; I51-F71 HydrophobicContact CB-CE1 4.18Å; F71-L77 HydrophobicContact CB-CB 3.67Å; F71-L77 HydrophobicContact CB-CD2 4.23Å; F71-L77 HydrophobicContact CB-CG 4.42Å; F71-L77 HydrophobicContact CG-CB 4.26Å; F71-L101 HydrophobicContact CZ-CD2 4.02Å; F71-V158 HydrophobicContact CE2-CG2 4.28Å; F71-V158 HydrophobicContact CZ-CG2 4.31Å; F71-I219 HydrophobicContact CD1-CD1 3.49Å; F71-I219 VanDerWaalsContact CD1-CD1 3.49Å; F71-I219 HydrophobicContact CD2-CD1 4.29Å; F71-I219 HydrophobicContact CD2-CG2 4.02Å; F71-I219 HydrophobicContact CE1-CD1 3.49Å; F71-I219 VanDerWaalsContact CE1-CD1 3.49Å; F71-I219 HydrophobicContact CE1-CG2 4.49Å; F71-I219 HydrophobicContact CE2-CD1 4.3Å; F71-I219 HydrophobicContact CE2-CG2 3.59Å; F71-I219 HydrophobicContact CG-CD1 3.91Å; F71-I219 HydrophobicContact CZ-CD1 3.92Å; F71-I219 HydrophobicContact CZ-CG2 3.84Å
72	K	86.7	Confident	75	Confident	95 Å²	95	64.3 Å²	64.3	41%	0.413	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	139.3	171.9	-67.7	179.7	-179.8	-177.9	0	110.1	E48 N74 T75 G76	E48-K72 HydrophobicContact CG-CG 3.65Å; E48-K72 WeakPolarHBondContact OE1-CE 3.46Å; E48-K72 IonicContact OE1-NZ 3.98Å; K72-N74 VanDerWaalsContact C-N 3.28Å; K72-N74 PolarHBondContact O-N 3.4Å; K72-T75 PolarHBondContact O-N 3.47Å; K72-T75 PolarHBondContact O-OG1 3.23Å; K72-G76 PolarHBondContact O-N 3.27Å
73	I	83.4	Confident	76	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.01	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-42.4	-176.7	-62.8	169.8	0	0	0	111.1	W43 P45 D47 L49 T75 V158 P187 P221	W43-I73 HydrophobicContact CD2-CD1 4.42Å; W43-I73 HydrophobicContact CE3-CD1 3.66Å; W43-I73 HydrophobicContact CZ3-CD1 4.19Å; W43-I73 HydrophobicContact CZ3-CG2 4.24Å; P45-I73 WeakPolarHBondContact O-CB 3.47Å; D47-I73 HydrophobicContact CB-CD1 4.47Å; D47-I73 PolarHBondContact O-N 2.95Å; L49-I73 HydrophobicContact CD1-CD1 3.83Å; L49-I73 HydrophobicContact CD1-CG1 3.61Å; L49-I73 HydrophobicContact CG-CD1 4.08Å; L49-I73 HydrophobicContact CG-CG1 3.88Å; I73-T75 PolarHBondContact O-N 3.27Å; I73-V158 HydrophobicContact CG1-CG1 4.41Å; I73-V158 HydrophobicContact CG2-CG1 3.92Å; I73-P187 HydrophobicContact CD1-CB 4.41Å; I73-P187 HydrophobicContact CD1-CG 4.11Å; I73-P221 WeakPolarHBondContact O-CB 3.48Å
74	N	85.3	Confident	76.5	Confident	54 Å²	54	60.8 Å²	60.8	29%	0.289	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-29.5	-176.1	-167	24.7	0	0	0	114.6	P45 K72 R160	P45-N74 HydrophobicContact CB-CB 4.44Å; P45-N74 WeakPolarHBondContact O-CB 3.41Å; P45-N74 PolarHBondContact O-N 3.46Å; K72-N74 VanDerWaalsContact C-N 3.28Å; K72-N74 PolarHBondContact O-N 3.4Å; N74-R160 PolarHBondContact OD1-NE 3.46Å; N74-R160 PolarHBondContact OD1-NH2 3.27Å
75	T	84	Confident	76.8	Confident	105 Å²	105	59.3 Å²	59.3	64%	0.644	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-26.9	-177	57.2	0	0	0	0	112.9	K72 I73	K72-T75 PolarHBondContact O-N 3.47Å; K72-T75 PolarHBondContact O-OG1 3.23Å; I73-T75 PolarHBondContact O-N 3.27Å
76	G	85.6	Confident	76.5	Confident	10 Å²	10	59 Å²	59	10%	0.103	32%	0.318	C	S	.	.			trans	69.1	-166.6	-167.9	0	0	0	0	0	112.4	K72 I219	K72-G76 PolarHBondContact O-N 3.27Å; G76-I219 CarbonylContact C-O 3.55Å; G76-I219 WeakPolarHBondContact CA-O 3.43Å
77	L	87.7	Confident	75.7	Confident	38 Å²	38	57.9 Å²	57.9	20%	0.199	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	136.1	-179.9	176.5	70	0	0	0	109.7	E69 F71 I219	E69-L77 HydrophobicContact CB-CD2 3.74Å; E69-L77 HydrophobicContact CG-CD2 4.37Å; F71-L77 HydrophobicContact CB-CB 3.67Å; F71-L77 HydrophobicContact CB-CD2 4.23Å; F71-L77 HydrophobicContact CB-CG 4.42Å; F71-L77 HydrophobicContact CG-CB 4.26Å; L77-I219 HydrophobicContact CB-CB 4.25Å; L77-I219 HydrophobicContact CB-CD1 4Å; L77-I219 HydrophobicContact CB-CG1 4.28Å; L77-I219 HydrophobicContact CD2-CD1 4.11Å; L77-I219 PolarHBondContact N-O 3.48Å; L77-I219 PolarHBondContact O-N 3.3Å
78	V	87.2	Confident	74.8	Confident	101 Å²	101	60.7 Å²	60.7	61%	0.612	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.8	168.3	-177.5	0	0	0	0	108.2	I216 L217	V78-I216 HydrophobicContact CG1-CG2 3.76Å; V78-L217 WeakPolarHBondContact CA-O 3.26Å
79	K	83.9	Confident	73.5	Confident	84 Å²	84	58.8 Å²	58.8	37%	0.365	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137	-179.5	-168.9	66.5	179.7	-113.2	0	111.1	E69 Y81 I216 L217	E69-K79 IonicContact OE1-NZ 2.74Å; E69-K79 PolarHBondContact OE1-NZ 3.35Å; K79-Y81 HydrophobicContact CB-CE2 3.92Å; K79-Y81 HydrophobicContact CG-CD2 4.5Å; K79-Y81 HydrophobicContact CG-CE1 4.27Å; K79-Y81 HydrophobicContact CG-CE2 3.82Å; K79-I216 CarbonylContact O-C 3.58Å; K79-I216 WeakPolarHBondContact O-CA 3.43Å; K79-L217 PolarHBondContact N-O 3.15Å; K79-L217 PolarHBondContact O-N 3.32Å
80	K	82.1	Confident	71.8	Confident	131 Å²	131	60.4 Å²	60.4	57%	0.57	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.3	175.2	-57.5	-166.8	175.6	-171.9	0	110.4	I216	K80-I216 HydrophobicContact CG-CD1 4.47Å; K80-I216 HydrophobicContact CG-CG1 4.14Å
81	Y	74.6	Confident	70.1	Confident	21 Å²	21	60.4 Å²	60.4	8%	0.082	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.9	176.3	-65	-79.2	0	0	0	108.9	L53 T67 E69 K79 M215 L217	L53-Y81 HydrophobicContact CD2-CD2 4.37Å; L53-Y81 HydrophobicContact CD2-CE2 4.34Å; T67-Y81 HydrophobicContact CG2-CE1 3.63Å; E69-Y81 VanDerWaalsContact CG-OH 3.25Å; E69-Y81 WeakPolarHBondContact CG-OH 3.43Å; K79-Y81 HydrophobicContact CB-CE2 3.92Å; K79-Y81 HydrophobicContact CG-CD2 4.5Å; K79-Y81 HydrophobicContact CG-CE1 4.27Å; K79-Y81 HydrophobicContact CG-CE2 3.82Å; Y81-M215 PolarHBondContact N-O 2.94Å; Y81-M215 PolarHBondContact O-N 2.83Å; Y81-L217 HydrophobicContact CD2-CB 4.13Å; Y81-L217 HydrophobicContact CE2-CB 3.73Å; Y81-L217 HydrophobicContact CE2-CD2 3.89Å
82	N	68.6	Low	68.2	Low	97 Å²	97	66.8 Å²	66.8	52%	0.519	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	107	174.1	-68.7	-8.2	0	0	0	107.8
83	C	64	Low	66.4	Low	9 Å²	9	63.9 Å²	63.9	6%	0.061	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	129.7	178.7	-62.6	0	0	0	0	109.1	F55 V85 W150 R212 L213	F55-C83 WeakPolarHBondContact CZ-SG 3.35Å; C83-V85 HydrophobicContact CB-CG2 4.28Å; C83-W150 HydrophobicContact CB-CH2 4.19Å; C83-W150 HydrophobicContact CB-CZ2 4Å; C83-R212 WeakPolarHBondContact O-CA 3.38Å; C83-L213 PolarHBondContact N-O 3Å; C83-L213 PolarHBondContact O-N 2.86Å
84	I	59.1	Low	65.2	Low	114 Å²	114	66.7 Å²	66.7	59%	0.585	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	117.7	168	-58.2	172.8	0	0	0	106.1	R212	I84-R212 HydrophobicContact CG1-CG 4.27Å
85	V	58	Low	64.3	Low	6 Å²	6	65.6 Å²	65.6	4%	0.036	37%	0.369	C	S	.	.			trans	-112.2	116.8	-178.9	-177.3	0	0	0	0	107.8	C83 V87 L89 W150 R211 L213	C83-V85 HydrophobicContact CB-CG2 4.28Å; V85-V87 PolarHBondContact O-N 3.01Å; V85-L89 HydrophobicContact CG1-CD2 3.7Å; V85-W150 HydrophobicContact CG1-CZ3 4.43Å; V85-W150 HydrophobicContact CG2-CE3 4.35Å; V85-W150 HydrophobicContact CG2-CH2 3.52Å; V85-W150 HydrophobicContact CG2-CZ2 4.11Å; V85-W150 HydrophobicContact CG2-CZ3 3.67Å; V85-R211 PolarHBondContact N-O 3.33Å; V85-L213 HydrophobicContact CB-CD1 4.17Å; V85-L213 HydrophobicContact CG1-CD1 4.4Å; V85-L213 HydrophobicContact CG2-CB 4.13Å; V85-L213 HydrophobicContact CG2-CD1 3.99Å; V85-L213 HydrophobicContact CG2-CG 4.37Å
86	D	52.4	Low	63.7	Low	83 Å²	83	62.8 Å²	62.8	44%	0.444	35%	0.352	S	S	.	.			trans	-74.2	109.6	176.2	-72	-37.3	0	0	0	109.5	K57	K57-D86 IonicContact NZ-OD2 3.71Å; K57-D86 PolarHBondContact NZ-OD2 2.82Å
87	V	48.7	Very low	63.2	Low	39 Å²	39	62.3 Å²	62.3	24%	0.236	35%	0.347	C	S	.	.	S	Bend	trans	-86.3	137.1	171.9	-174.6	0	0	0	0	107.7	V85	V85-V87 PolarHBondContact O-N 3.01Å
88	P	48.3	Very low	62.9	Low	92 Å²	92	62.8 Å²	62.8	60%	0.597	35%	0.346	S	S	*	.			cis	-82.4	131.5	20.8	30.9	-33.6	0	0	0	114.9	T90	P88-T90 HydrophobicContact CB-CG2 4.27Å; P88-T90 PolarHBondContact O-N 3.23Å; P88-T90 PolarHBondContact O-OG1 3.36Å
89	L	50.9	Low	62.6	Low	26 Å²	26	58 Å²	58	14%	0.136	32%	0.317	C	S	.	.			trans	-68.3	73.4	167.3	-67.6	160.8	0	0	0	108.6	V85 L117 Y119 V204	V85-L89 HydrophobicContact CG1-CD2 3.7Å; L89-L117 HydrophobicContact CB-CD2 4.01Å; L89-L117 HydrophobicContact CD1-CD1 4.25Å; L89-L117 HydrophobicContact CD2-CD1 3.92Å; L89-L117 HydrophobicContact CD2-CD2 3.95Å; L89-L117 HydrophobicContact CD2-CG 4.47Å; L89-L117 HydrophobicContact CG-CD1 4.47Å; L89-Y119 PolarHBondContact O-OH 3.49Å; L89-V204 HydrophobicContact CD1-CB 4.22Å; L89-V204 HydrophobicContact CD1-CG1 3.86Å; L89-V204 HydrophobicContact CD1-CG2 4.42Å
90	T	45.5	Very low	62.7	Low	77 Å²	77	57.7 Å²	57.7	47%	0.472	31%	0.314	S	S	.	.			trans	-90	149.1	171.3	40.3	0	0	0	0	108.3	P88 D92 S93	P88-T90 HydrophobicContact CB-CG2 4.27Å; P88-T90 PolarHBondContact O-N 3.23Å; P88-T90 PolarHBondContact O-OG1 3.36Å; T90-D92 PolarHBondContact O-N 3.35Å; T90-S93 PolarHBondContact O-N 3.26Å; T90-S93 VanDerWaalsContact O-N 3.12Å; T90-S93 PolarHBondContact O-OG 3.29Å
91	S	49	Very low	62.7	Low	75 Å²	75	51.5 Å²	51.5	52%	0.524	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-25.6	-175.7	52.5	0	0	0	0	114.5	V94	S91-V94 WeakPolarHBondContact O-CG2 3.33Å
92	D	46.4	Very low	63.3	Low	143 Å²	143	51.7 Å²	51.7	77%	0.765	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-12.8	-169.2	-61.7	-2.5	0	0	0	113.1	T90 V94	T90-D92 PolarHBondContact O-N 3.35Å; D92-V94 VanDerWaalsContact C-N 3.31Å; D92-V94 PolarHBondContact O-N 3.46Å
93	S	50.1	Low	63.9	Low	35 Å²	35	47.9 Å²	47.9	25%	0.245	27%	0.269	C	S	.	.			trans	-95.2	50.6	173.5	63.2	0	0	0	0	111.4	T90 V95	T90-S93 PolarHBondContact O-N 3.26Å; T90-S93 VanDerWaalsContact O-N 3.12Å; T90-S93 PolarHBondContact O-OG 3.29Å; S93-V95 PolarHBondContact O-N 3.17Å
94	V	57.4	Low	64.5	Low	61 Å²	61	52.3 Å²	52.3	37%	0.37	29%	0.292	S	S	.	.			trans	-60.1	97.7	-179.3	-169.1	0	0	0	0	109.4	S91 D92 T96	S91-V94 WeakPolarHBondContact O-CG2 3.33Å; D92-V94 VanDerWaalsContact C-N 3.31Å; D92-V94 PolarHBondContact O-N 3.46Å; V94-T96 HydrophobicContact CB-CG2 4.4Å; V94-T96 HydrophobicContact CG1-CG2 3.62Å; V94-T96 PolarHBondContact O-N 3.32Å
95	V	66	Low	65.2	Low	30 Å²	30	52.6 Å²	52.6	18%	0.182	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	103.9	167.8	-172.5	0	0	0	0	105.6	S93 L116	S93-V95 PolarHBondContact O-N 3.17Å; V95-L116 HydrophobicContact CB-CD1 4.43Å; V95-L116 HydrophobicContact CG1-CD1 3.77Å; V95-L116 PolarHBondContact O-N 2.94Å; V95-L116 VanDerWaalsContact O-N 3.11Å
96	T	72.4	Confident	66.1	Low	46 Å²	46	54.5 Å²	54.5	28%	0.282	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	143.1	175.4	53.2	0	0	0	0	108.5	I56 V94 F114	I56-T96 PolarHBondContact N-O 3.46Å; I56-T96 PolarHBondContact O-N 3.29Å; I56-T96 PolarHBondContact O-OG1 3.29Å; V94-T96 HydrophobicContact CB-CG2 4.4Å; V94-T96 HydrophobicContact CG1-CG2 3.62Å; V94-T96 PolarHBondContact O-N 3.32Å; T96-F114 CarbonylContact C-O 3.59Å; T96-F114 WeakPolarHBondContact CA-O 3.35Å
97	A	75.1	Confident	67.4	Low	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.5	171.1	0	0	0	0	0	109	L53 Q54 F55 D113 F114 L116	L53-A97 HydrophobicContact CD1-CB 4.22Å; Q54-A97 CarbonylContact O-C 3.42Å; Q54-A97 WeakPolarHBondContact O-CA 3.47Å; F55-A97 HydrophobicContact CD1-CB 4.15Å; F55-A97 HydrophobicContact CE1-CB 4.31Å; A97-D113 WeakPolarHBondContact O-CA 3.34Å; A97-F114 HydrophobicContact CB-CD2 4Å; A97-F114 HydrophobicContact CB-CE1 4.46Å; A97-F114 HydrophobicContact CB-CE2 3.37Å; A97-F114 HydrophobicContact CB-CZ 3.61Å; A97-F114 PolarHBondContact N-O 3.49Å; A97-F114 WeakPolarHBondContact O-CD1 3.22Å; A97-F114 WeakPolarHBondContact O-CE1 3.36Å; A97-F114 PolarHBondContact O-N 3.29Å; A97-L116 HydrophobicContact CB-CD1 4.1Å; A97-L116 HydrophobicContact CB-CD2 3.79Å; A97-L116 HydrophobicContact CB-CG 4.01Å
98	R	80.8	Confident	69	Low	48 Å²	48	54.6 Å²	54.6	18%	0.181	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.1	174	174.7	168.9	-67.7	154.5	1.2	108.4	Q54 I56 R100 D113	Q54-R98 HydrophobicContact CB-CB 4.44Å; Q54-R98 PolarHBondContact N-O 2.92Å; Q54-R98 PolarHBondContact O-N 3.38Å; I56-R98 HydrophobicContact CD1-CB 3.97Å; R98-R100 HydrophobicContact CG-CG 4.31Å; R98-D113 WeakPolarHBondContact CB-OD1 3.05Å; R98-D113 WeakPolarHBondContact CD-OD1 3.27Å; R98-D113 WeakPolarHBondContact CG-OD1 3.39Å; R98-D113 IonicContact CZ-OD1 3.65Å; R98-D113 IonicContact CZ-OD2 3.45Å; R98-D113 IonicContact NE-OD1 2.75Å; R98-D113 PolarHBondContact NE-OD1 3.23Å; R98-D113 IonicContact NE-OD2 3.33Å; R98-D113 PolarHBondContact NE-OD2 3.45Å; R98-D113 IonicContact NH2-OD1 3.7Å; R98-D113 IonicContact NH2-OD2 2.73Å; R98-D113 PolarHBondContact NH2-OD2 2.97Å
99	L	82.3	Confident	70.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.9	175.3	-172.4	82.1	0	0	0	109.7	I51 L53 L101 S111 N112 F114 V156 V191 L217	I51-L99 HydrophobicContact CD1-CD1 3.66Å; I51-L99 HydrophobicContact CD1-CD2 4.25Å; I51-L99 HydrophobicContact CD1-CG 4.2Å; I51-L99 HydrophobicContact CG1-CD1 3.57Å; I51-L99 HydrophobicContact CG1-CG 4.19Å; L53-L99 HydrophobicContact CB-CD1 4.24Å; L53-L99 HydrophobicContact CD1-CB 4.45Å; L53-L99 HydrophobicContact CD1-CD1 3.76Å; L99-L101 HydrophobicContact CD2-CD1 3.96Å; L99-L101 HydrophobicContact CG-CD1 4.18Å; L99-S111 WeakPolarHBondContact O-CA 3.43Å; L99-N112 PolarHBondContact N-O 3.12Å; L99-N112 PolarHBondContact O-N 3.01Å; L99-F114 HydrophobicContact CB-CE1 3.58Å; L99-F114 HydrophobicContact CB-CZ 4.08Å; L99-V156 HydrophobicContact CD2-CG1 4.37Å; L99-V156 HydrophobicContact CD2-CG2 3.44Å; L99-V156 VanDerWaalsContact CD2-CG2 3.44Å; L99-V191 HydrophobicContact CD2-CG1 4.2Å; L99-V191 HydrophobicContact CD2-CG2 4.06Å; L99-L217 HydrophobicContact CD1-CD1 4.4Å
100	R	84.5	Confident	72	Confident	79 Å²	79	49.8 Å²	49.8	30%	0.298	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122.3	172.6	-70.3	177.6	175.7	162.1	-0.7	109.9	H52 R98 L102 S110 S111	H52-R100 HydrophobicContact CB-CB 4.24Å; H52-R100 PolarHBondContact N-O 3.3Å; H52-R100 PolarHBondContact O-N 3.24Å; R98-R100 HydrophobicContact CG-CG 4.31Å; R100-L102 HydrophobicContact CB-CD1 4Å; R100-S110 WeakPolarHBondContact CA-O 3.45Å; R100-S111 PolarHBondContact NE-OG 3.23Å
101	L	83.5	Confident	73.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.9	165.1	-96.1	76.1	0	0	0	108.8	I51 F71 L99 I109 S110 V156 V158 T189	I51-L101 HydrophobicContact CD1-CD1 3.48Å; I51-L101 VanDerWaalsContact CD1-CD1 3.48Å; I51-L101 HydrophobicContact CD1-CG 4.29Å; I51-L101 HydrophobicContact CG1-CD1 3.78Å; I51-L101 HydrophobicContact CG1-CG 4.42Å; F71-L101 HydrophobicContact CZ-CD2 4.02Å; L99-L101 HydrophobicContact CD2-CD1 3.96Å; L99-L101 HydrophobicContact CG-CD1 4.18Å; L101-I109 HydrophobicContact CB-CB 4.17Å; L101-I109 HydrophobicContact CB-CD1 4.49Å; L101-I109 WeakPolarHBondContact O-CB 3.32Å; L101-I109 PolarHBondContact O-N 3.4Å; L101-S110 PolarHBondContact N-O 3.21Å; L101-V156 HydrophobicContact CD1-CG1 4.16Å; L101-V158 HydrophobicContact CD2-CG2 4.17Å; L101-T189 HydrophobicContact CD2-CG2 3.61Å
102	L	86	Confident	75.5	Confident	25 Å²	25	47.4 Å²	47.4	13%	0.131	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	142.9	177.9	-57	96.2	0	0	0	109.9	K50 H52 R100 S107 I108	K50-L102 HydrophobicContact CB-CB 4.36Å; K50-L102 PolarHBondContact N-O 3.36Å; K50-L102 PolarHBondContact O-N 2.93Å; H52-L102 HydrophobicContact CB-CD1 3.96Å; H52-L102 VanDerWaalsContact CD2-CD1 3.44Å; H52-L102 WeakPolarHBondContact CD2-CD1 3.34Å; R100-L102 HydrophobicContact CB-CD1 4Å; L102-S107 WeakPolarHBondContact CA-O 3.49Å; L102-I108 HydrophobicContact CD2-CG1 4.24Å
103	T	81.3	Confident	77.2	Confident	17 Å²	17	45 Å²	45	10%	0.104	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	162.3	163.2	55.4	0	0	0	0	110.8	T105 G106 S107 I109 L186	T103-T105 PolarHBondContact O-N 3.27Å; T103-T105 VanDerWaalsContact O-N 3.15Å; T103-T105 PolarHBondContact OG1-OG1 2.86Å; T103-T105 VanDerWaalsContact OG1-OG1 3.09Å; T103-G106 PolarHBondContact O-N 3.13Å; T103-G106 PolarHBondContact OG1-N 3.49Å; T103-S107 VanDerWaalsContact CG2-OG 3.27Å; T103-S107 WeakPolarHBondContact CG2-OG 3.24Å; T103-S107 PolarHBondContact N-O 3.37Å; T103-S107 WeakPolarHBondContact OG1-CA 3.29Å; T103-S107 WeakPolarHBondContact OG1-CB 3.5Å; T103-S107 PolarHBondContact OG1-N 2.72Å; T103-S107 PolarHBondContact OG1-O 3.08Å; T103-S107 VanDerWaalsContact OG1-O 3.04Å; T103-S107 PolarHBondContact OG1-OG 2.93Å; T103-I109 HydrophobicContact CG2-CD1 3.77Å; T103-I109 HydrophobicContact CG2-CG1 3.77Å; T103-L186 HydrophobicContact CG2-CD2 3.89Å
104	N	76.5	Confident	78.6	Confident	103 Å²	103	44.1 Å²	44.1	55%	0.551	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-28.1	173.1	-164.4	17.8	0	0	0	112.9	G106	N104-G106 PolarHBondContact O-N 3.43Å
105	T	74.4	Confident	79.6	Confident	120 Å²	120	43.1 Å²	43.1	74%	0.736	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	0.8	175.3	61.5	0	0	0	0	114	T103	T103-T105 PolarHBondContact O-N 3.27Å; T103-T105 VanDerWaalsContact O-N 3.15Å; T103-T105 PolarHBondContact OG1-OG1 2.86Å; T103-T105 VanDerWaalsContact OG1-OG1 3.09Å
106	G	76.5	Confident	80	Confident	45 Å²	45	41.7 Å²	41.7	46%	0.464	24%	0.241	S	C	.	.	S	Bend	trans	83.9	2.4	179	0	0	0	0	0	115.4	T103 N104	T103-G106 PolarHBondContact O-N 3.13Å; T103-G106 PolarHBondContact OG1-N 3.49Å; N104-G106 PolarHBondContact O-N 3.43Å
107	S	80.4	Confident	80.2	Confident	40 Å²	40	40.4 Å²	40.4	28%	0.28	23%	0.232	S	C	.	.			trans	-70.8	132.4	172.3	70.5	0	0	0	0	110.5	L102 T103	L102-S107 WeakPolarHBondContact CA-O 3.49Å; T103-S107 VanDerWaalsContact CG2-OG 3.27Å; T103-S107 WeakPolarHBondContact CG2-OG 3.24Å; T103-S107 PolarHBondContact N-O 3.37Å; T103-S107 WeakPolarHBondContact OG1-CA 3.29Å; T103-S107 WeakPolarHBondContact OG1-CB 3.5Å; T103-S107 PolarHBondContact OG1-N 2.72Å; T103-S107 PolarHBondContact OG1-O 3.08Å; T103-S107 VanDerWaalsContact OG1-O 3.04Å; T103-S107 PolarHBondContact OG1-OG 2.93Å
108	I	82.3	Confident	80.1	Confident	84 Å²	84	42.2 Å²	42.2	43%	0.431	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	123.5	-179.1	-58	171.3	0	0	0	108.3	L102 Q179	L102-I108 HydrophobicContact CD2-CG1 4.24Å; I108-Q179 PolarHBondContact O-OE1 3.21Å
109	I	79.5	Confident	79.7	Confident	6 Å²	6	44.1 Å²	44.1	3%	0.031	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-45.7	178.6	-60.5	169.5	0	0	0	110.2	L49 L101 T103 Q179 L186 P187 T189	L49-I109 HydrophobicContact CD1-CD1 4.02Å; L49-I109 HydrophobicContact CD2-CD1 3.66Å; L49-I109 HydrophobicContact CG-CD1 4.42Å; L101-I109 HydrophobicContact CB-CB 4.17Å; L101-I109 HydrophobicContact CB-CD1 4.49Å; L101-I109 WeakPolarHBondContact O-CB 3.32Å; L101-I109 PolarHBondContact O-N 3.4Å; T103-I109 HydrophobicContact CG2-CD1 3.77Å; T103-I109 HydrophobicContact CG2-CG1 3.77Å; I109-Q179 VanDerWaalsContact O-CD 3.28Å; I109-Q179 PolarHBondContact O-OE1 3.04Å; I109-Q179 VanDerWaalsContact O-OE1 3.05Å; I109-L186 HydrophobicContact CG1-CB 4.48Å; I109-L186 HydrophobicContact CG1-CD1 4.4Å; I109-L186 HydrophobicContact CG2-CB 4.36Å; I109-P187 HydrophobicContact CD1-CG 4.07Å; I109-P187 WeakPolarHBondContact CG2-O 3.41Å; I109-T189 HydrophobicContact CG2-CG2 4.02Å
110	S	82.1	Confident	79.1	Confident	12 Å²	12	45.7 Å²	45.7	8%	0.084	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	146.3	176.5	57.8	0	0	0	0	109.8	R100 L101 T189	R100-S110 WeakPolarHBondContact CA-O 3.45Å; L101-S110 PolarHBondContact N-O 3.21Å; S110-T189 WeakPolarHBondContact CB-OG1 3.29Å; S110-T189 PolarHBondContact OG-OG1 3.4Å
111	S	85	Confident	78.2	Confident	56 Å²	56	46.2 Å²	46.2	39%	0.392	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	108.9	173.2	-175.3	0	0	0	0	106.7	L99 R100	L99-S111 WeakPolarHBondContact O-CA 3.43Å; R100-S111 PolarHBondContact NE-OG 3.23Å
112	N	83	Confident	77.2	Confident	46 Å²	46	48.6 Å²	48.6	25%	0.246	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.7	-178.6	-61.6	-54.7	0	0	0	109.5	L99	L99-N112 PolarHBondContact N-O 3.12Å; L99-N112 PolarHBondContact O-N 3.01Å
113	D	81.7	Confident	76	Confident	92 Å²	92	51.8 Å²	51.8	49%	0.492	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.5	174.9	-64.6	-9.4	0	0	0	108.3	A97 R98	A97-D113 WeakPolarHBondContact O-CA 3.34Å; R98-D113 WeakPolarHBondContact CB-OD1 3.05Å; R98-D113 WeakPolarHBondContact CD-OD1 3.27Å; R98-D113 WeakPolarHBondContact CG-OD1 3.39Å; R98-D113 IonicContact CZ-OD1 3.65Å; R98-D113 IonicContact CZ-OD2 3.45Å; R98-D113 IonicContact NE-OD1 2.75Å; R98-D113 PolarHBondContact NE-OD1 3.23Å; R98-D113 IonicContact NE-OD2 3.33Å; R98-D113 PolarHBondContact NE-OD2 3.45Å; R98-D113 IonicContact NH2-OD1 3.7Å; R98-D113 IonicContact NH2-OD2 2.73Å; R98-D113 PolarHBondContact NH2-OD2 2.97Å
114	F	80.9	Confident	74.7	Confident	16 Å²	16	59.4 Å²	59.4	7%	0.07	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	152.8	-179.7	47.2	-86.2	0	0	0	111.9	L53 T96 A97 L99 L116 L151 L154 P193	L53-F114 HydrophobicContact CD1-CZ 4.16Å; T96-F114 CarbonylContact C-O 3.59Å; T96-F114 WeakPolarHBondContact CA-O 3.35Å; A97-F114 HydrophobicContact CB-CD2 4Å; A97-F114 HydrophobicContact CB-CE1 4.46Å; A97-F114 HydrophobicContact CB-CE2 3.37Å; A97-F114 HydrophobicContact CB-CZ 3.61Å; A97-F114 PolarHBondContact N-O 3.49Å; A97-F114 WeakPolarHBondContact O-CD1 3.22Å; A97-F114 WeakPolarHBondContact O-CE1 3.36Å; A97-F114 PolarHBondContact O-N 3.29Å; L99-F114 HydrophobicContact CB-CE1 3.58Å; L99-F114 HydrophobicContact CB-CZ 4.08Å; F114-L116 HydrophobicContact CD2-CD2 3.87Å; F114-L116 HydrophobicContact CE2-CD2 3.71Å; F114-L151 HydrophobicContact CD2-CD2 4.26Å; F114-L151 HydrophobicContact CE2-CD2 4.34Å; F114-L154 HydrophobicContact CD2-CD1 4.49Å; F114-L154 HydrophobicContact CE1-CD2 4.13Å; F114-L154 HydrophobicContact CE2-CD1 4.03Å; F114-L154 HydrophobicContact CE2-CD2 3.62Å; F114-L154 HydrophobicContact CE2-CG 4.44Å; F114-L154 HydrophobicContact CZ-CD1 4.11Å; F114-L154 HydrophobicContact CZ-CD2 3.26Å; F114-L154 HydrophobicContact CZ-CG 4.35Å; F114-P193 HydrophobicContact CB-CG 3.71Å; F114-P193 HydrophobicContact CD1-CG 4.28Å; F114-P193 HydrophobicContact CD2-CG 3.89Å; F114-P193 HydrophobicContact CG-CG 3.7Å
115	S	78.3	Confident	73.7	Confident	40 Å²	40	60.1 Å²	60.1	28%	0.28	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	136.9	172.4	-172.8	0	0	0	0	110.2	L117	S115-L117 PolarHBondContact OG-N 3.3Å; S115-L117 PolarHBondContact OG-O 3.25Å
116	L	74.4	Confident	72.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.331	C	S	.	.	S	Bend	trans	-87.1	-13.9	174.2	-61.4	-177.3	0	0	0	113.5	F55 V95 A97 F114 W150 L151 M215	F55-L116 HydrophobicContact CD1-CD1 3.64Å; F55-L116 HydrophobicContact CE1-CD1 3.69Å; V95-L116 HydrophobicContact CB-CD1 4.43Å; V95-L116 HydrophobicContact CG1-CD1 3.77Å; V95-L116 PolarHBondContact O-N 2.94Å; V95-L116 VanDerWaalsContact O-N 3.11Å; A97-L116 HydrophobicContact CB-CD1 4.1Å; A97-L116 HydrophobicContact CB-CD2 3.79Å; A97-L116 HydrophobicContact CB-CG 4.01Å; F114-L116 HydrophobicContact CD2-CD2 3.87Å; F114-L116 HydrophobicContact CE2-CD2 3.71Å; L116-W150 HydrophobicContact CB-CE3 4.14Å; L116-W150 HydrophobicContact CB-CH2 3.98Å; L116-W150 HydrophobicContact CB-CZ3 3.59Å; L116-W150 HydrophobicContact CD1-CH2 3.66Å; L116-W150 HydrophobicContact CD1-CZ2 4.47Å; L116-W150 HydrophobicContact CD1-CZ3 4.06Å; L116-W150 HydrophobicContact CG-CH2 4.43Å; L116-W150 HydrophobicContact CG-CZ3 4.49Å; L116-L151 HydrophobicContact CD2-CB 4.38Å; L116-L151 HydrophobicContact CD2-CD2 3.98Å; L116-L151 PolarHBondContact O-N 2.93Å; L116-M215 HydrophobicContact CD1-CE 3.59Å; L116-M215 HydrophobicContact CD2-CE 3.33Å; L116-M215 HydrophobicContact CD2-SD 4.41Å; L116-M215 HydrophobicContact CG-CE 4.02Å
117	L	75.4	Confident	71.8	Confident	20 Å²	20	60.3 Å²	60.3	11%	0.105	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.5	177.8	-171.6	69.8	0	0	0	108.8	L89 S115 Y119 P148	L89-L117 HydrophobicContact CB-CD2 4.01Å; L89-L117 HydrophobicContact CD1-CD1 4.25Å; L89-L117 HydrophobicContact CD2-CD1 3.92Å; L89-L117 HydrophobicContact CD2-CD2 3.95Å; L89-L117 HydrophobicContact CD2-CG 4.47Å; L89-L117 HydrophobicContact CG-CD1 4.47Å; S115-L117 PolarHBondContact OG-N 3.3Å; S115-L117 PolarHBondContact OG-O 3.25Å; L117-Y119 HydrophobicContact CD2-CE2 4.3Å; L117-P148 HydrophobicContact CD1-CB 3.95Å
118	T	74	Confident	70.9	Confident	38 Å²	38	61.5 Å²	61.5	23%	0.233	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	158.2	170.7	-166.5	0	0	0	0	109.5	K120 F149 W201	T118-K120 HydrophobicContact CG2-CD 4.34Å; T118-K120 HydrophobicContact CG2-CG 4.06Å; T118-F149 HydrophobicContact CG2-CB 4.03Å; T118-F149 PolarHBondContact N-O 2.93Å; T118-F149 PolarHBondContact O-N 3.37Å; T118-W201 HydrophobicContact CG2-CD2 3.91Å; T118-W201 HydrophobicContact CG2-CE3 3.44Å; T118-W201 VanDerWaalsContact CG2-CE3 3.44Å; T118-W201 HydrophobicContact CG2-CH2 3.68Å; T118-W201 HydrophobicContact CG2-CZ2 4.11Å; T118-W201 HydrophobicContact CG2-CZ3 3.32Å
119	Y	71.6	Confident	70.1	Confident	88 Å²	88	58.9 Å²	58.9	35%	0.345	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.9	178.3	-72.7	-88.5	0	0	0	109.4	L89 L117 A147 P148	L89-Y119 PolarHBondContact O-OH 3.49Å; L117-Y119 HydrophobicContact CD2-CE2 4.3Å; Y119-A147 VanDerWaalsContact CA-O 3.31Å; Y119-A147 WeakPolarHBondContact CA-O 3.48Å; Y119-P148 HydrophobicContact CD1-CB 4.25Å; Y119-P148 HydrophobicContact CE1-CB 3.86Å
120	K	70	Confident	69	Low	33 Å²	33	64.2 Å²	64.2	14%	0.143	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	167.7	180	-57.9	-173.3	175.9	-161.6	0	110.8	T118 A122 L146 A147 F149 D251	T118-K120 HydrophobicContact CG2-CD 4.34Å; T118-K120 HydrophobicContact CG2-CG 4.06Å; K120-A122 PolarHBondContact O-N 2.89Å; K120-L146 CarbonylContact O-C 3.56Å; K120-L146 WeakPolarHBondContact O-CA 3.46Å; K120-A147 PolarHBondContact N-O 3.27Å; K120-A147 PolarHBondContact O-N 3.17Å; K120-F149 HydrophobicContact CB-CD2 3.63Å; K120-F149 HydrophobicContact CB-CE2 3.67Å; K120-F149 HydrophobicContact CB-CG 4.29Å; K120-F149 HydrophobicContact CB-CZ 4.35Å; K120-F149 HydrophobicContact CD-CG 4.46Å; K120-F149 HydrophobicContact CG-CD2 4.19Å; K120-F149 HydrophobicContact CG-CG 4.42Å; K120-D251 IonicContact NZ-OD2 3.33Å; K120-D251 PolarHBondContact NZ-OD2 3.02Å
121	E	66.5	Low	68	Low	90 Å²	90	68.7 Å²	68.7	42%	0.421	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	131.4	173.4	-65.7	-179	173.4	0	0	110.5	K248	E121-K248 IonicContact OE2-NZ 3.26Å; E121-K248 PolarHBondContact OE2-NZ 3.43Å
122	A	62.5	Low	66.4	Low	49 Å²	49	68.2 Å²	68.2	41%	0.405	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-61.6	146.4	179.6	0	0	0	0	0	112.9	K120 A147	K120-A122 PolarHBondContact O-N 2.89Å; A122-A147 HydrophobicContact CB-CB 3.95Å
123	T	59.1	Low	64.6	Low	93 Å²	93	72.1 Å²	72.1	57%	0.571	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-75.4	130.2	179.2	-42.8	0	0	0	0	110.2	T125 E203	T123-T125 PolarHBondContact O-N 3.39Å; T123-E203 WeakPolarHBondContact CB-OE2 3.27Å; T123-E203 PolarHBondContact N-OE2 2.95Å; T123-E203 PolarHBondContact OG1-OE2 2.7Å
124	R	55.2	Low	62.8	Low	176 Å²	176	70.7 Å²	70.7	66%	0.664	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-72.6	123.4	179.2	-66.8	-176.1	179.6	-166.9	-7.2	111
125	T	55	Low	60.6	Low	119 Å²	119	74 Å²	74	73%	0.73	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-91.8	146.7	179.4	53.2	0	0	0	0	112.4	T123	T123-T125 PolarHBondContact O-N 3.39Å
126	T	50.4	Low	59	Low	91 Å²	91	77 Å²	77	56%	0.558	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-102.9	144.6	170.8	49.2	0	0	0	0	109.5	R401	T126-R401 HydrophobicContact CG2-CG 3.95Å
127	F	59.6	Low	57.1	Low	77 Å²	77	83.3 Å²	83.3	34%	0.338	48%	0.48	S	S	.	.	B	Isolated β-bridge	trans	-137.9	160.4	-178.4	54.2	-91.6	0	0	0	111.7	L129 S132 H400 R401	F127-L129 HydrophobicContact CE2-CD2 4.19Å; F127-S132 VanDerWaalsContact CD2-OG 3.27Å; F127-S132 WeakPolarHBondContact CD2-OG 3.48Å; F127-H400 PolarHBondContact O-N 2.88Å; F127-R401 WeakPolarHBondContact CE1-O 3.43Å; F127-R401 WeakPolarHBondContact CZ-O 3.31Å
128	N	63.1	Low	55.4	Low	66 Å²	66	87.4 Å²	87.4	35%	0.353	50%	0.502	S	S	.	.			trans	-81.9	123.7	170.5	-87.8	-16.8	0	0	0	109.2	M130 T131 S132 P399	N128-M130 PolarHBondContact O-N 2.91Å; N128-T131 WeakPolarHBondContact CB-OG1 3.16Å; N128-T131 PolarHBondContact O-N 2.94Å; N128-S132 WeakPolarHBondContact O-CB 3.46Å; N128-S132 PolarHBondContact O-N 3.19Å; N128-S132 PolarHBondContact O-OG 3.42Å; N128-P399 WeakPolarHBondContact OD1-CA 3.31Å; N128-P399 WeakPolarHBondContact OD1-CB 3.33Å
129	L	64.5	Low	53.9	Low	29 Å²	29	89.5 Å²	89.5	15%	0.152	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-31.8	-177.1	-75.7	163.5	0	0	0	113.1	F127 L395 H400 W403 W406	F127-L129 HydrophobicContact CE2-CD2 4.19Å; L129-L395 HydrophobicContact CD1-CD1 4.42Å; L129-H400 HydrophobicContact CD1-CB 3.64Å; L129-H400 HydrophobicContact CG-CB 4.19Å; L129-W403 HydrophobicContact CD1-CD2 4.48Å; L129-W403 HydrophobicContact CD2-CD2 4.45Å; L129-W403 HydrophobicContact CD2-CG 4.26Å; L129-W406 HydrophobicContact CD1-CB 4.09Å
130	M	57.5	Low	52.4	Low	117 Å²	117	91.7 Å²	91.7	58%	0.576	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-30.3	-174.9	-69.7	-70.9	-72.2	0	0	114.3	N128 F396	N128-M130 PolarHBondContact O-N 2.91Å; M130-F396 HydrophobicContact CE-CE1 4.45Å
131	T	59.8	Low	50.9	Low	107 Å²	107	98.3 Å²	98.3	66%	0.656	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-13.4	-174.9	55.6	0	0	0	0	113.2	N128 S133	N128-T131 WeakPolarHBondContact CB-OG1 3.16Å; N128-T131 PolarHBondContact O-N 2.94Å; T131-S133 PolarHBondContact O-N 3.39Å
132	S	51.2	Low	49.7	Very low	45 Å²	45	98 Å²	98	32%	0.315	57%	0.569	S	S	.	*			trans	-88.7	87.8	177.8	56.6	0	0	0	0	110.9	F127 N128 G134	F127-S132 VanDerWaalsContact CD2-OG 3.27Å; F127-S132 WeakPolarHBondContact CD2-OG 3.48Å; N128-S132 WeakPolarHBondContact O-CB 3.46Å; N128-S132 PolarHBondContact O-N 3.19Å; N128-S132 PolarHBondContact O-OG 3.42Å; S132-G134 PolarHBondContact O-N 3.34Å; S132-G134 VanDerWaalsContact O-N 3.1Å
133	S	45.1	Very low	48.6	Very low	128 Å²	128	103 Å²	103	90%	0.895	58%	0.583	S	S	*	*			trans	-68.3	6.8	160.5	-35.6	0	0	0	0	112.6	T131 S135	T131-S133 PolarHBondContact O-N 3.39Å; S133-S135 PolarHBondContact O-N 3.18Å
134	G	44.6	Very low	48.2	Very low	62 Å²	62	101.2 Å²	101.2	64%	0.639	58%	0.583	S	S	*	*	S	Bend	trans	-92.7	88.5	-178.6	0	0	0	0	0	111.9	S132	S132-G134 PolarHBondContact O-N 3.34Å; S132-G134 VanDerWaalsContact O-N 3.1Å
135	S	35.9	Very low	48.3	Very low	86 Å²	86	98 Å²	98	60%	0.601	58%	0.579	S	S	*	*			trans	33.3	103.2	153.6	-149.5	0	0	0	0	118.1	S133 N137	S133-S135 PolarHBondContact O-N 3.18Å; S135-N137 PolarHBondContact O-N 2.83Å; S135-N137 VanDerWaalsContact O-N 3.14Å
136	P	43.2	Very low	48.9	Very low	104 Å²	104	97.8 Å²	97.8	68%	0.675	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-75.3	9.7	169.3	32.9	-33	0	0	0	113.3	S139	P136-S139 PolarHBondContact O-OG 2.76Å
137	N	36	Very low	49.7	Very low	131 Å²	131	94.2 Å²	94.2	70%	0.701	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-84.9	-4.5	-171.1	-97.7	14.7	0	0	0	116.4	S135	S135-N137 PolarHBondContact O-N 2.83Å; S135-N137 VanDerWaalsContact O-N 3.14Å
138	N	39.4	Very low	50.6	Low	106 Å²	106	92 Å²	92	57%	0.567	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-106.7	-3.9	176.9	-77.8	22.5	0	0	0	114.7	N140	N138-N140 PolarHBondContact O-N 3.18Å
139	S	41.5	Very low	51.3	Low	83 Å²	83	89.6 Å²	89.6	58%	0.58	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-19.1	-176.9	56.7	0	0	0	0	114.5	P136	P136-S139 PolarHBondContact O-OG 2.76Å
140	N	39.9	Very low	52.2	Low	134 Å²	134	88.3 Å²	88.3	72%	0.717	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-14.3	-177.8	-81.5	-8.8	0	0	0	114.8	N138 H143	N138-N140 PolarHBondContact O-N 3.18Å; N140-H143 PolarHBondContact O-CD2 2.96Å
141	E	39.7	Very low	53.5	Low	172 Å²	172	82.8 Å²	82.8	80%	0.804	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-8	-179.1	-70.5	-162.4	162.8	0	0	114.9	H143	E141-H143 PolarHBondContact O-N 3.41Å
142	D	40.4	Very low	54.6	Low	84 Å²	84	78.8 Å²	78.8	45%	0.449	47%	0.474	S	S	.	.			trans	-81.5	33.7	178.1	-67.9	-9.2	0	0	0	112.9	G144 L145	D142-G144 PolarHBondContact O-N 2.9Å; D142-L145 HydrophobicContact CB-CD1 4.28Å; D142-L145 WeakPolarHBondContact OD1-CD1 3.38Å
143	H	40.1	Very low	56.3	Low	153 Å²	153	77.7 Å²	77.7	71%	0.708	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	79	170.3	-79.3	-75.8	0	0	0	110	N140 E141	N140-H143 PolarHBondContact O-CD2 2.96Å; E141-H143 PolarHBondContact O-N 3.41Å
144	G	50.6	Low	58.4	Low	55 Å²	55	71.6 Å²	71.6	57%	0.567	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.9	16.1	169.8	0	0	0	0	0	115.9	D142 L146	D142-G144 PolarHBondContact O-N 2.9Å; G144-L146 PolarHBondContact O-N 3.27Å
145	L	57.4	Low	60.6	Low	110 Å²	110	72.2 Å²	72.2	58%	0.576	41%	0.406	S	S	*	.			trans	-66.5	118.1	168.6	-70.6	-179.1	0	0	0	109.8	D142 A147	D142-L145 HydrophobicContact CB-CD1 4.28Å; D142-L145 WeakPolarHBondContact OD1-CD1 3.38Å; L145-A147 PolarHBondContact O-N 3.42Å
146	L	66.2	Low	63.2	Low	114 Å²	114	68.1 Å²	68.1	60%	0.597	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	110.8	174.7	-81	161.3	0	0	0	108.7	K120 G144	K120-L146 CarbonylContact O-C 3.56Å; K120-L146 WeakPolarHBondContact O-CA 3.46Å; G144-L146 PolarHBondContact O-N 3.27Å
147	A	69	Low	65.5	Low	15 Å²	15	63.4 Å²	63.4	12%	0.124	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	148.5	175.1	0	0	0	0	0	110.9	Y119 K120 A122 L145 F149 E203	Y119-A147 VanDerWaalsContact CA-O 3.31Å; Y119-A147 WeakPolarHBondContact CA-O 3.48Å; K120-A147 PolarHBondContact N-O 3.27Å; K120-A147 PolarHBondContact O-N 3.17Å; A122-A147 HydrophobicContact CB-CB 3.95Å; L145-A147 PolarHBondContact O-N 3.42Å; A147-F149 HydrophobicContact CB-CE2 4.07Å; A147-F149 WeakPolarHBondContact O-CD2 3.42Å; A147-E203 HydrophobicContact CB-CG 4.27Å
148	P	76.7	Confident	68.1	Low	32 Å²	32	57.2 Å²	57.2	21%	0.208	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	127.7	174.2	28.8	-31.8	0	0	0	111.1	L117 Y119 V204	L117-P148 HydrophobicContact CD1-CB 3.95Å; Y119-P148 HydrophobicContact CD1-CB 4.25Å; Y119-P148 HydrophobicContact CE1-CB 3.86Å; P148-V204 PolarHBondContact O-N 2.96Å
149	F	78.9	Confident	70.5	Confident	14 Å²	14	52.1 Å²	52.1	6%	0.061	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.6	175.9	-80.5	-103.7	0	0	0	110.7	T118 K120 A147 W201 L202 E203	T118-F149 HydrophobicContact CG2-CB 4.03Å; T118-F149 PolarHBondContact N-O 2.93Å; T118-F149 PolarHBondContact O-N 3.37Å; K120-F149 HydrophobicContact CB-CD2 3.63Å; K120-F149 HydrophobicContact CB-CE2 3.67Å; K120-F149 HydrophobicContact CB-CG 4.29Å; K120-F149 HydrophobicContact CB-CZ 4.35Å; K120-F149 HydrophobicContact CD-CG 4.46Å; K120-F149 HydrophobicContact CG-CD2 4.19Å; K120-F149 HydrophobicContact CG-CG 4.42Å; A147-F149 HydrophobicContact CB-CE2 4.07Å; A147-F149 WeakPolarHBondContact O-CD2 3.42Å; F149-W201 HydrophobicContact CB-CB 4.22Å; F149-W201 HydrophobicContact CB-CE3 4.21Å; F149-W201 HydrophobicContact CD1-CB 3.87Å; F149-W201 HydrophobicContact CG-CB 4.47Å; F149-L202 CarbonylContact C-O 3.54Å; F149-L202 WeakPolarHBondContact CA-O 3.28Å; F149-E203 HydrophobicContact CD1-CB 4.12Å; F149-E203 HydrophobicContact CE1-CB 3.62Å; F149-E203 HydrophobicContact CE1-CG 4.19Å; F149-E203 HydrophobicContact CE2-CB 4.31Å; F149-E203 HydrophobicContact CE2-CG 3.98Å; F149-E203 HydrophobicContact CZ-CB 3.73Å; F149-E203 HydrophobicContact CZ-CG 3.77Å
150	W	82.9	Confident	72.8	Confident	3 Å²	3	54 Å²	54	1%	0.011	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.8	175.2	172.5	-103.9	0	0	0	111.3	C83 V85 L116 S152 W201 L202 V204 L213 E214 M215	C83-W150 HydrophobicContact CB-CH2 4.19Å; C83-W150 HydrophobicContact CB-CZ2 4Å; V85-W150 HydrophobicContact CG1-CZ3 4.43Å; V85-W150 HydrophobicContact CG2-CE3 4.35Å; V85-W150 HydrophobicContact CG2-CH2 3.52Å; V85-W150 HydrophobicContact CG2-CZ2 4.11Å; V85-W150 HydrophobicContact CG2-CZ3 3.67Å; L116-W150 HydrophobicContact CB-CE3 4.14Å; L116-W150 HydrophobicContact CB-CH2 3.98Å; L116-W150 HydrophobicContact CB-CZ3 3.59Å; L116-W150 HydrophobicContact CD1-CH2 3.66Å; L116-W150 HydrophobicContact CD1-CZ2 4.47Å; L116-W150 HydrophobicContact CD1-CZ3 4.06Å; L116-W150 HydrophobicContact CG-CH2 4.43Å; L116-W150 HydrophobicContact CG-CZ3 4.49Å; W150-S152 PolarHBondContact O-N 3.33Å; W150-W201 CarbonylContact O-C 3.59Å; W150-W201 WeakPolarHBondContact O-CA 3.26Å; W150-L202 PolarHBondContact N-O 3.34Å; W150-L202 PolarHBondContact O-N 3.21Å; W150-V204 HydrophobicContact CB-CG2 3.75Å; W150-L213 HydrophobicContact CB-CD1 4.08Å; W150-L213 HydrophobicContact CD2-CB 4.09Å; W150-L213 HydrophobicContact CD2-CD1 3.66Å; W150-L213 HydrophobicContact CD2-CG 4.47Å; W150-L213 HydrophobicContact CE3-CD1 3.95Å; W150-L213 HydrophobicContact CG-CB 4.25Å; W150-L213 HydrophobicContact CG-CD1 3.71Å; W150-L213 HydrophobicContact CG-CG 4.43Å; W150-L213 HydrophobicContact CZ2-CB 4.07Å; W150-E214 PolarHBondContact NE1-O 3.28Å; W150-E214 VanDerWaalsContact NE1-O 3.17Å; W150-M215 HydrophobicContact CH2-CE 4.16Å; W150-M215 HydrophobicContact CZ2-CB 4.5Å; W150-M215 HydrophobicContact CZ2-CE 3.74Å
151	L	84.3	Confident	74.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	94.9	173.3	-174.1	63.4	0	0	0	110.4	F114 L116 T153 L154 P193 W201	F114-L151 HydrophobicContact CD2-CD2 4.26Å; F114-L151 HydrophobicContact CE2-CD2 4.34Å; L116-L151 HydrophobicContact CD2-CB 4.38Å; L116-L151 HydrophobicContact CD2-CD2 3.98Å; L116-L151 PolarHBondContact O-N 2.93Å; L151-T153 WeakPolarHBondContact CD1-O 3.4Å; L151-L154 HydrophobicContact CD2-CB 4.16Å; L151-L154 HydrophobicContact CD2-CD1 4.07Å; L151-P193 HydrophobicContact CD1-CB 4.36Å; L151-P193 HydrophobicContact CD2-CB 3.93Å; L151-P193 HydrophobicContact CD2-CG 4.32Å; L151-W201 HydrophobicContact CB-CE3 4Å; L151-W201 HydrophobicContact CB-CH2 4.03Å; L151-W201 HydrophobicContact CB-CZ3 3.65Å; L151-W201 HydrophobicContact CD1-CD2 4.04Å; L151-W201 HydrophobicContact CD1-CE3 4.22Å; L151-W201 HydrophobicContact CD1-CH2 3.98Å; L151-W201 HydrophobicContact CD1-CZ2 3.77Å; L151-W201 HydrophobicContact CD1-CZ3 4.19Å; L151-W201 HydrophobicContact CG-CH2 4.44Å; L151-W201 HydrophobicContact CG-CZ3 4.47Å
152	S	84.7	Confident	77.1	Confident	24 Å²	24	44.8 Å²	44.8	17%	0.168	24%	0.242	C	C	.	.			trans	-77.1	-31	-179.7	74.8	0	0	0	0	112.3	W150 D200 M215 I216	W150-S152 PolarHBondContact O-N 3.33Å; S152-D200 PolarHBondContact N-O 3.03Å; S152-D200 PolarHBondContact OG-O 2.91Å; S152-M215 CarbonylContact O-C 3.57Å; S152-M215 VanDerWaalsContact O-CA 3.31Å; S152-M215 WeakPolarHBondContact O-CA 3.43Å; S152-I216 PolarHBondContact O-N 3.05Å
153	T	86.8	Confident	79.3	Confident	21 Å²	21	41.1 Å²	41.1	13%	0.129	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	116.8	179.8	-56.5	0	0	0	0	111.2	L151 R155 Q196 D200 I216	L151-T153 WeakPolarHBondContact CD1-O 3.4Å; T153-R155 HydrophobicContact CG2-CG 4.11Å; T153-Q196 PolarHBondContact O-NE2 3.44Å; T153-D200 PolarHBondContact N-O 3.34Å; T153-D200 VanDerWaalsContact N-O 3.12Å; T153-I216 CarbonylContact C-O 3.54Å; T153-I216 VanDerWaalsContact CA-O 3.28Å; T153-I216 WeakPolarHBondContact CA-O 3.32Å; T153-I216 HydrophobicContact CG2-CB 4.25Å
154	L	88.3	Confident	81.5	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	115.3	172.4	175.7	65.5	0	0	0	109.6	F114 L151 V156 V191 P193 I216 L217 S218	F114-L154 HydrophobicContact CD2-CD1 4.49Å; F114-L154 HydrophobicContact CE1-CD2 4.13Å; F114-L154 HydrophobicContact CE2-CD1 4.03Å; F114-L154 HydrophobicContact CE2-CD2 3.62Å; F114-L154 HydrophobicContact CE2-CG 4.44Å; F114-L154 HydrophobicContact CZ-CD1 4.11Å; F114-L154 HydrophobicContact CZ-CD2 3.26Å; F114-L154 HydrophobicContact CZ-CG 4.35Å; L151-L154 HydrophobicContact CD2-CB 4.16Å; L151-L154 HydrophobicContact CD2-CD1 4.07Å; L154-V156 HydrophobicContact CG-CG2 4.3Å; L154-V191 HydrophobicContact CD1-CG1 4.38Å; L154-P193 HydrophobicContact CD1-CB 4.41Å; L154-P193 HydrophobicContact CD1-CG 3.65Å; L154-I216 PolarHBondContact N-O 3.47Å; L154-L217 HydrophobicContact CB-CD1 4.4Å; L154-L217 HydrophobicContact CD2-CD1 3.82Å; L154-L217 HydrophobicContact CG-CD1 4.11Å; L154-S218 PolarHBondContact O-N 3.47Å
155	R	90.1	Very high	83.2	Confident	75 Å²	75	32.7 Å²	32.7	28%	0.283	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122	178.5	-64.6	-179.7	-175.4	-112	7.5	110.8	T153 Y157 Q196 D200 S218 E220	T153-R155 HydrophobicContact CG2-CG 4.11Å; R155-Y157 HydrophobicContact CB-CE2 3.83Å; R155-Y157 VanDerWaalsContact CD-OH 3.26Å; R155-Y157 WeakPolarHBondContact CD-OH 3.37Å; R155-Q196 HydrophobicContact CB-CG 4.41Å; R155-Q196 VanDerWaalsContact N-CD 3.29Å; R155-D200 IonicContact CZ-OD1 3.83Å; R155-D200 IonicContact NE-OD1 2.66Å; R155-D200 PolarHBondContact NE-OD1 3.45Å; R155-D200 IonicContact NE-OD2 3.56Å; R155-D200 PolarHBondContact NE-OD2 3.35Å; R155-D200 IonicContact NH2-OD1 2.74Å; R155-S218 CarbonylContact C-O 3.56Å; R155-S218 VanDerWaalsContact CA-O 3.32Å; R155-S218 WeakPolarHBondContact CA-O 3.5Å; R155-E220 IonicContact CZ-OE1 3.68Å; R155-E220 IonicContact NH1-OE1 2.83Å; R155-E220 PolarHBondContact NH1-OE1 3.16Å; R155-E220 IonicContact NH1-OE2 3.44Å; R155-E220 PolarHBondContact NH1-OE2 3.13Å
156	V	90.3	Very high	84.4	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	116.1	178.6	175.1	0	0	0	0	107.6	L99 L101 L154 V158 V191 L217 S218 I219 E220	L99-V156 HydrophobicContact CD2-CG1 4.37Å; L99-V156 HydrophobicContact CD2-CG2 3.44Å; L99-V156 VanDerWaalsContact CD2-CG2 3.44Å; L101-V156 HydrophobicContact CD1-CG1 4.16Å; L154-V156 HydrophobicContact CG-CG2 4.3Å; V156-V158 HydrophobicContact CG1-CG2 4.43Å; V156-V191 HydrophobicContact CB-CG2 4.22Å; V156-V191 HydrophobicContact CG1-CG2 3.75Å; V156-V191 HydrophobicContact CG2-CG1 4.46Å; V156-V191 HydrophobicContact CG2-CG2 4.03Å; V156-L217 HydrophobicContact CG2-CD1 3.93Å; V156-S218 PolarHBondContact N-O 2.83Å; V156-I219 HydrophobicContact CB-CG1 4.31Å; V156-I219 HydrophobicContact CG1-CG2 4.42Å; V156-I219 CarbonylContact O-C 3.58Å; V156-I219 VanDerWaalsContact O-CA 3.28Å; V156-I219 WeakPolarHBondContact O-CA 3.46Å; V156-E220 PolarHBondContact O-N 2.98Å
157	Y	91.8	Very high	85.2	Confident	5 Å²	5	32.4 Å²	32.4	2%	0.02	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	131.6	-179.4	-59.8	-82.9	0	0	0	110.3	R155 T189 Y190 E220 L222 R230	R155-Y157 HydrophobicContact CB-CE2 3.83Å; R155-Y157 VanDerWaalsContact CD-OH 3.26Å; R155-Y157 WeakPolarHBondContact CD-OH 3.37Å; Y157-T189 CarbonylContact O-C 3.58Å; Y157-T189 WeakPolarHBondContact O-CA 3.49Å; Y157-Y190 AromaticContact CD2-CD1 3.87Å; Y157-Y190 HydrophobicContact CD2-CD1 3.87Å; Y157-Y190 PolarHBondContact N-O 3.06Å; Y157-Y190 PolarHBondContact O-N 3.12Å; Y157-E220 WeakPolarHBondContact CA-O 3.49Å; Y157-E220 HydrophobicContact CD1-CB 3.89Å; Y157-E220 HydrophobicContact CE1-CB 4.04Å; Y157-E220 VanDerWaalsContact CE1-OE2 3.3Å; Y157-E220 WeakPolarHBondContact CE1-OE2 3.36Å; Y157-L222 HydrophobicContact CD1-CD2 4.23Å; Y157-L222 HydrophobicContact CG-CD2 4.33Å; Y157-R230 PolarHBondContact OH-NH1 3.47Å; Y157-R230 PolarHBondContact OH-NH2 3.34Å
158	V	91.4	Very high	85.7	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.2	178.3	-172.6	0	0	0	0	109.1	L49 F71 I73 L101 V156 R160 P187 T189 I219 E220 P221 L222	L49-V158 HydrophobicContact CD1-CG1 4.48Å; F71-V158 HydrophobicContact CE2-CG2 4.28Å; F71-V158 HydrophobicContact CZ-CG2 4.31Å; I73-V158 HydrophobicContact CG1-CG1 4.41Å; I73-V158 HydrophobicContact CG2-CG1 3.92Å; L101-V158 HydrophobicContact CD2-CG2 4.17Å; V156-V158 HydrophobicContact CG1-CG2 4.43Å; V158-R160 PolarHBondContact O-N 3.3Å; V158-P187 HydrophobicContact CG1-CB 4.39Å; V158-T189 HydrophobicContact CG1-CG2 4.31Å; V158-T189 HydrophobicContact CG2-CG2 4.24Å; V158-I219 HydrophobicContact CG2-CG2 3.79Å; V158-E220 PolarHBondContact N-O 2.96Å; V158-P221 WeakPolarHBondContact O-CA 3.42Å; V158-L222 PolarHBondContact O-N 3.39Å
159	L	90.7	Very high	86	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	120.4	175.8	-178.2	61.5	0	0	0	110	W43 T161 V188 I224 L227	W43-L159 HydrophobicContact CH2-CB 4.36Å; W43-L159 HydrophobicContact CH2-CD2 4.46Å; W43-L159 HydrophobicContact CH2-CG 4.14Å; W43-L159 WeakPolarHBondContact CH2-O 2.88Å; W43-L159 HydrophobicContact CZ2-CB 4.47Å; W43-L159 HydrophobicContact CZ2-CD2 4.1Å; W43-L159 HydrophobicContact CZ2-CG 4.25Å; W43-L159 WeakPolarHBondContact CZ3-O 3.32Å; L159-T161 WeakPolarHBondContact CG-O 3.4Å; L159-V188 HydrophobicContact CB-CB 4.12Å; L159-V188 WeakPolarHBondContact CB-O 3.35Å; L159-V188 HydrophobicContact CD2-CB 4.2Å; L159-V188 HydrophobicContact CD2-CG2 4.16Å; L159-V188 PolarHBondContact N-O 2.81Å; L159-I224 HydrophobicContact CD1-CB 3.93Å; L159-I224 HydrophobicContact CD1-CD1 4.13Å; L159-I224 HydrophobicContact CD2-CD1 4.38Å; L159-L227 HydrophobicContact CB-CD2 4.14Å; L159-L227 HydrophobicContact CD1-CD2 4.13Å
160	R	88.3	Confident	86.2	Confident	122 Å²	122	46.1 Å²	46.1	46%	0.46	22%	0.218	S	C	.	.			trans	-80.5	-41.1	-179.3	-173.5	-173.3	-178.7	-170.9	-0.1	112.5	N74 V158 P221 L222	N74-R160 PolarHBondContact OD1-NE 3.46Å; N74-R160 PolarHBondContact OD1-NH2 3.27Å; V158-R160 PolarHBondContact O-N 3.3Å; R160-P221 HydrophobicContact CB-CB 3.96Å; R160-P221 HydrophobicContact CG-CB 4.08Å; R160-L222 WeakPolarHBondContact CB-O 3.26Å; R160-L222 PolarHBondContact N-O 3.11Å
161	T	85.5	Confident	86.3	Confident	55 Å²	55	46.7 Å²	46.7	34%	0.337	22%	0.223	S	C	.	.	S	Bend	trans	-95.9	120.7	-170.3	50.1	0	0	0	0	111.1	L159 V163	L159-T161 WeakPolarHBondContact CG-O 3.4Å; T161-V163 PolarHBondContact O-N 3.04Å
162	P	85.5	Confident	86.4	Confident	57 Å²	57	50.4 Å²	50.4	37%	0.37	25%	0.253	S	S	.	.			trans	-67.8	124.6	172	25.9	-31.5	0	0	0	109.6	P41 W43 P45	P41-P162 HydrophobicContact CB-CB 3.94Å; P41-P162 HydrophobicContact CG-CB 3.44Å; P41-P162 VanDerWaalsContact CG-CB 3.44Å; W43-P162 HydrophobicContact CH2-CB 4.49Å; P45-P162 HydrophobicContact CG-CG 4.32Å
163	V	86.3	Confident	86.5	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.042	26%	0.256	C	S	.	.			trans	-123.1	131.4	-178.8	178.7	0	0	0	0	108.4	P29 T161 F165 Y185 I224	P29-V163 HydrophobicContact CG-CG1 4.23Å; T161-V163 PolarHBondContact O-N 3.04Å; V163-F165 HydrophobicContact CB-CE1 4.23Å; V163-F165 HydrophobicContact CB-CE2 4.25Å; V163-F165 HydrophobicContact CB-CZ 3.91Å; V163-F165 HydrophobicContact CG1-CD1 4.11Å; V163-F165 HydrophobicContact CG1-CE1 3.73Å; V163-F165 HydrophobicContact CG1-CE2 4.48Å; V163-F165 HydrophobicContact CG1-CZ 3.94Å; V163-Y185 PolarHBondContact N-OH 2.83Å; V163-Y185 VanDerWaalsContact N-OH 3.15Å; V163-Y185 VanDerWaalsContact O-CE1 3.25Å; V163-Y185 WeakPolarHBondContact O-CE1 3.43Å; V163-Y185 PolarHBondContact O-OH 3.3Å; V163-I224 HydrophobicContact CG2-CB 4.29Å; V163-I224 HydrophobicContact CG2-CG1 4.43Å; V163-I224 HydrophobicContact CG2-CG2 4.34Å
164	S	86.1	Confident	86.5	Confident	24 Å²	24	50.5 Å²	50.5	17%	0.168	25%	0.25	C	C	.	.			trans	-86.5	113	172.2	56.5	0	0	0	0	109.8	N31 C32 I39	N31-S164 WeakPolarHBondContact CB-OG 3.21Å; C32-S164 VanDerWaalsContact CB-O 3.3Å; C32-S164 WeakPolarHBondContact CB-O 3.49Å; C32-S164 PolarHBondContact N-O 2.93Å; C32-S164 PolarHBondContact N-OG 3.47Å; C32-S164 VanDerWaalsContact N-OG 3.12Å; C32-S164 PolarHBondContact O-OG 2.95Å; I39-S164 WeakPolarHBondContact O-CA 3.45Å
165	F	85.2	Confident	86.4	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.035	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	146.7	178.1	-60.3	-72.3	0	0	0	110.7	C38 I39 V163 V170 I174 I178 Y185 I224	C38-F165 CarbonylContact C-O 3.56Å; C38-F165 WeakPolarHBondContact CA-O 3.3Å; I39-F165 PolarHBondContact N-O 2.7Å; I39-F165 PolarHBondContact O-N 2.95Å; I39-F165 VanDerWaalsContact O-N 3.13Å; V163-F165 HydrophobicContact CB-CE1 4.23Å; V163-F165 HydrophobicContact CB-CE2 4.25Å; V163-F165 HydrophobicContact CB-CZ 3.91Å; V163-F165 HydrophobicContact CG1-CD1 4.11Å; V163-F165 HydrophobicContact CG1-CE1 3.73Å; V163-F165 HydrophobicContact CG1-CE2 4.48Å; V163-F165 HydrophobicContact CG1-CZ 3.94Å; F165-V170 HydrophobicContact CB-CG2 4.09Å; F165-I174 HydrophobicContact CE1-CD1 3.8Å; F165-I174 HydrophobicContact CE2-CD1 4.35Å; F165-I174 HydrophobicContact CZ-CD1 3.59Å; F165-I178 HydrophobicContact CD2-CD1 4.26Å; F165-I178 HydrophobicContact CE2-CD1 4.09Å; F165-Y185 HydrophobicContact CD2-CE1 4.13Å; F165-Y185 HydrophobicContact CE2-CE1 4.25Å; F165-Y185 HydrophobicContact CE2-CE2 4.36Å; F165-Y185 AromaticContact CE2-CZ 3.94Å; F165-I224 HydrophobicContact CZ-CD1 4.11Å
166	S	84.6	Confident	86.2	Confident	43 Å²	43	61.5 Å²	61.5	30%	0.301	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	133.6	165.1	174.9	0	0	0	0	109	Y168 N169 V170	S166-Y168 PolarHBondContact O-N 3.34Å; S166-N169 CarbonylContact O-C 3.52Å; S166-N169 PolarHBondContact O-N 3.12Å; S166-V170 VanDerWaalsContact O-CG2 3.31Å; S166-V170 WeakPolarHBondContact O-CG2 3.47Å; S166-V170 PolarHBondContact O-N 2.81Å
167	R	81.3	Confident	85.9	Confident	174 Å²	174	64.5 Å²	64.5	66%	0.657	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-28.5	-178.4	-176.8	175	-171.7	175.2	2.5	113.6	G37 I39	G37-R167 WeakPolarHBondContact O-CB 3.31Å; G37-R167 PolarHBondContact O-N 3.42Å; I39-R167 HydrophobicContact CD1-CB 4.32Å; I39-R167 HydrophobicContact CD1-CG 4.43Å; I39-R167 HydrophobicContact CG1-CB 4.2Å
168	Y	81.3	Confident	85.7	Confident	201 Å²	201	65.5 Å²	65.5	79%	0.788	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-9.7	-179.7	-56.8	-71	0	0	0	114	S166	S166-Y168 PolarHBondContact O-N 3.34Å
169	N	81.4	Confident	85.4	Confident	118 Å²	118	69.7 Å²	69.7	63%	0.631	34%	0.335	S	S	*	.			trans	-129.9	45.9	-177.3	-162.7	22.5	0	0	0	110.8	S166	S166-N169 CarbonylContact O-C 3.52Å; S166-N169 PolarHBondContact O-N 3.12Å
170	V	84.1	Confident	85.1	Confident	30 Å²	30	75.7 Å²	75.7	18%	0.182	37%	0.366	C	S	.	.			trans	-79.1	128.3	169.9	-174.3	0	0	0	0	107.6	I39 F165 S166 A172 I174 V175 I178	I39-V170 HydrophobicContact CD1-CG2 4.13Å; F165-V170 HydrophobicContact CB-CG2 4.09Å; S166-V170 VanDerWaalsContact O-CG2 3.31Å; S166-V170 WeakPolarHBondContact O-CG2 3.47Å; S166-V170 PolarHBondContact O-N 2.81Å; V170-A172 PolarHBondContact O-N 3.25Å; V170-I174 HydrophobicContact CG1-CG1 4.48Å; V170-V175 HydrophobicContact CB-CG2 4.25Å; V170-V175 HydrophobicContact CG1-CB 4.08Å; V170-V175 HydrophobicContact CG1-CG2 3.97Å; V170-I178 HydrophobicContact CG1-CD1 3.68Å
171	P	84.8	Confident	84.8	Confident	16 Å²	16	72.4 Å²	72.4	10%	0.104	36%	0.362	C	S	.	.			trans	-58.2	129.1	177.9	-20.6	29.6	0	0	0	111.9	E173 I174 V175	P171-E173 VanDerWaalsContact C-OE2 3.32Å; P171-E173 VanDerWaalsContact CB-CD 3.43Å; P171-E173 HydrophobicContact CB-CG 4.36Å; P171-E173 WeakPolarHBondContact CB-OE1 3.44Å; P171-E173 VanDerWaalsContact CB-OE2 3.27Å; P171-E173 WeakPolarHBondContact CB-OE2 3.36Å; P171-E173 PolarHBondContact O-N 3.29Å; P171-I174 HydrophobicContact CB-CD1 4.36Å; P171-I174 HydrophobicContact CB-CG1 4.09Å; P171-I174 HydrophobicContact CG-CD1 4.14Å; P171-I174 HydrophobicContact CG-CG1 4.37Å; P171-I174 WeakPolarHBondContact O-CG1 3.42Å; P171-I174 PolarHBondContact O-N 3.32Å; P171-I174 VanDerWaalsContact O-N 3.16Å; P171-V175 PolarHBondContact O-N 2.78Å; P171-V175 VanDerWaalsContact O-N 3.08Å
172	A	85.8	Confident	84.5	Confident	77 Å²	77	75.6 Å²	75.6	64%	0.636	39%	0.387	S	S	*	.	H	α-helix	trans	-62.1	-27.7	-172.2	0	0	0	0	0	113.1	V170 I174 V175	V170-A172 PolarHBondContact O-N 3.25Å; A172-I174 VanDerWaalsContact C-N 3.34Å; A172-I174 PolarHBondContact O-N 3.07Å; A172-V175 WeakPolarHBondContact O-CG1 3.22Å
173	E	86.1	Confident	84.2	Confident	47 Å²	47	80.8 Å²	80.8	22%	0.22	40%	0.403	C	S	.	.	H	α-helix	trans	-70.7	-25.7	179.8	64	-88.1	-154.8	0	0	113.5	P171 R228 C231 M232	P171-E173 VanDerWaalsContact C-OE2 3.32Å; P171-E173 VanDerWaalsContact CB-CD 3.43Å; P171-E173 HydrophobicContact CB-CG 4.36Å; P171-E173 WeakPolarHBondContact CB-OE1 3.44Å; P171-E173 VanDerWaalsContact CB-OE2 3.27Å; P171-E173 WeakPolarHBondContact CB-OE2 3.36Å; P171-E173 PolarHBondContact O-N 3.29Å; E173-R228 HydrophobicContact CG-CB 4.28Å; E173-R228 HydrophobicContact CG-CG 4.34Å; E173-R228 IonicContact OE1-CZ 3.12Å; E173-R228 IonicContact OE1-NE 2.66Å; E173-R228 PolarHBondContact OE1-NE 3.11Å; E173-R228 IonicContact OE1-NH2 2.72Å; E173-R228 PolarHBondContact OE1-NH2 3.41Å; E173-C231 HydrophobicContact CB-CB 3.88Å; E173-C231 HydrophobicContact CG-CB 4.28Å; E173-C231 WeakPolarHBondContact O-CB 3.18Å; E173-M232 HydrophobicContact CB-CG 4.06Å; E173-M232 HydrophobicContact CG-CG 4.08Å
174	I	87	Confident	84.1	Confident	1 Å²	1	81 Å²	81	1%	0.005	41%	0.407	C	S	.	.	H	α-helix	trans	-108.3	-16.5	178.2	63.2	176.6	0	0	0	112.9	F165 V170 P171 A172 R176 R177 I178 I224 R228	F165-I174 HydrophobicContact CE1-CD1 3.8Å; F165-I174 HydrophobicContact CE2-CD1 4.35Å; F165-I174 HydrophobicContact CZ-CD1 3.59Å; V170-I174 HydrophobicContact CG1-CG1 4.48Å; P171-I174 HydrophobicContact CB-CD1 4.36Å; P171-I174 HydrophobicContact CB-CG1 4.09Å; P171-I174 HydrophobicContact CG-CD1 4.14Å; P171-I174 HydrophobicContact CG-CG1 4.37Å; P171-I174 WeakPolarHBondContact O-CG1 3.42Å; P171-I174 PolarHBondContact O-N 3.32Å; P171-I174 VanDerWaalsContact O-N 3.16Å; A172-I174 VanDerWaalsContact C-N 3.34Å; A172-I174 PolarHBondContact O-N 3.07Å; I174-R176 PolarHBondContact O-N 3Å; I174-R176 VanDerWaalsContact O-N 3.1Å; I174-R177 WeakPolarHBondContact O-CA 2.91Å; I174-R177 PolarHBondContact O-N 2.65Å; I174-I178 HydrophobicContact CB-CD1 4.47Å; I174-I178 HydrophobicContact CD1-CD1 3.94Å; I174-I178 HydrophobicContact CG1-CD1 3.89Å; I174-I178 PolarHBondContact O-N 2.92Å; I174-I224 HydrophobicContact CD1-CD1 4.03Å; I174-R228 HydrophobicContact CG2-CG 4.05Å
175	V	86.7	Confident	84.2	Confident	71 Å²	71	79.9 Å²	79.9	43%	0.43	40%	0.399	S	S	.	.	H	α-helix	trans	-54.5	-37.1	-172.8	77.9	0	0	0	0	112.7	V170 P171 A172 R177 I178	V170-V175 HydrophobicContact CB-CG2 4.25Å; V170-V175 HydrophobicContact CG1-CB 4.08Å; V170-V175 HydrophobicContact CG1-CG2 3.97Å; P171-V175 PolarHBondContact O-N 2.78Å; P171-V175 VanDerWaalsContact O-N 3.08Å; A172-V175 WeakPolarHBondContact O-CG1 3.22Å; V175-R177 PolarHBondContact O-N 3.4Å; V175-I178 PolarHBondContact O-N 3.45Å
176	R	85.4	Confident	84.4	Confident	235 Å²	235	80.5 Å²	80.5	89%	0.887	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-20	179.3	-62.7	-175.6	-179.9	-162.6	-0	113.7	I174	I174-R176 PolarHBondContact O-N 3Å; I174-R176 VanDerWaalsContact O-N 3.1Å
177	R	85.5	Confident	84.6	Confident	63 Å²	63	78.6 Å²	78.6	24%	0.238	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-6.8	-178.4	-59.7	-179.6	-178.8	-85.1	4	112.4	I174 V175 V188 E234	I174-R177 WeakPolarHBondContact O-CA 2.91Å; I174-R177 PolarHBondContact O-N 2.65Å; V175-R177 PolarHBondContact O-N 3.4Å; R177-V188 HydrophobicContact CB-CG1 4Å; R177-E234 IonicContact CZ-OE2 3.17Å; R177-E234 IonicContact NH2-OE1 2.74Å; R177-E234 PolarHBondContact NH2-OE1 2.9Å; R177-E234 VanDerWaalsContact NH2-OE1 3.17Å; R177-E234 IonicContact NH2-OE2 3.7Å; R177-E234 PolarHBondContact NH2-OE2 2.87Å
178	I	86.1	Confident	84.9	Confident	26 Å²	26	70.3 Å²	70.3	13%	0.133	36%	0.359	C	S	.	.			trans	-89.8	115.9	177.8	-65.4	169.6	0	0	0	108.9	F165 V170 I174 V175 Y185 V188	F165-I178 HydrophobicContact CD2-CD1 4.26Å; F165-I178 HydrophobicContact CE2-CD1 4.09Å; V170-I178 HydrophobicContact CG1-CD1 3.68Å; I174-I178 HydrophobicContact CB-CD1 4.47Å; I174-I178 HydrophobicContact CD1-CD1 3.94Å; I174-I178 HydrophobicContact CG1-CD1 3.89Å; I174-I178 PolarHBondContact O-N 2.92Å; V175-I178 PolarHBondContact O-N 3.45Å; I178-Y185 HydrophobicContact CG2-CD2 4.16Å; I178-Y185 HydrophobicContact CG2-CG 4.11Å; I178-V188 HydrophobicContact CG1-CG2 3.71Å
179	Q	85.3	Confident	85.3	Confident	89 Å²	89	61.1 Å²	61.1	42%	0.416	32%	0.323	S	S	.	.			trans	-102.2	134.7	172.2	-66.3	-174.3	-10.8	0	0	110.4	I108 I109 Y185 L186	I108-Q179 PolarHBondContact O-OE1 3.21Å; I109-Q179 VanDerWaalsContact O-CD 3.28Å; I109-Q179 PolarHBondContact O-OE1 3.04Å; I109-Q179 VanDerWaalsContact O-OE1 3.05Å; Q179-Y185 CarbonylContact O-C 3.34Å; Q179-Y185 VanDerWaalsContact O-CA 3.28Å; Q179-Y185 WeakPolarHBondContact O-CA 3.34Å; Q179-L186 HydrophobicContact CB-CB 4.46Å; Q179-L186 HydrophobicContact CB-CD1 4.08Å; Q179-L186 PolarHBondContact O-N 3.18Å
180	L	84.2	Confident	85.7	Confident	125 Å²	125	55.6 Å²	55.6	65%	0.654	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.6	179.1	-66.4	167.4	0	0	0	110.3	I39	I39-L180 HydrophobicContact CD1-CD2 4.47Å; I39-L180 HydrophobicContact CG2-CD2 3.53Å
181	S	81.9	Confident	86	Confident	54 Å²	54	54.6 Å²	54.6	38%	0.378	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	173	171.8	-174.3	0	0	0	0	109.8	K183 G184	S181-K183 PolarHBondContact O-N 3.36Å; S181-G184 CarbonylContact C-O 3.48Å; S181-G184 WeakPolarHBondContact CA-O 3.46Å; S181-G184 WeakPolarHBondContact CB-O 3.36Å; S181-G184 PolarHBondContact N-O 2.91Å; S181-G184 PolarHBondContact O-N 3.41Å; S181-G184 VanDerWaalsContact O-N 3.17Å; S181-G184 VanDerWaalsContact O-O 3.1Å
182	S	80	Confident	86	Confident	121 Å²	121	55.1 Å²	55.1	85%	0.846	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.4	-179.3	56.9	0	0	0	0	113.6
183	K	80	Confident	85.8	Confident	166 Å²	166	51.9 Å²	51.9	72%	0.722	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	1	179.6	-65	-176.2	179	179.4	0	114.2	G42 S181	G42-K183 WeakPolarHBondContact CA-O 3.49Å; S181-K183 PolarHBondContact O-N 3.36Å
184	G	84.3	Confident	85.4	Confident	12 Å²	12	54.7 Å²	54.7	12%	0.124	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.9	-169.7	-170.2	0	0	0	0	0	112.1	T40 S181	T40-G184 CarbonylContact O-C 3.56Å; T40-G184 WeakPolarHBondContact O-CA 3.5Å; S181-G184 CarbonylContact C-O 3.48Å; S181-G184 WeakPolarHBondContact CA-O 3.46Å; S181-G184 WeakPolarHBondContact CB-O 3.36Å; S181-G184 PolarHBondContact N-O 2.91Å; S181-G184 PolarHBondContact O-N 3.41Å; S181-G184 VanDerWaalsContact O-N 3.17Å; S181-G184 VanDerWaalsContact O-O 3.1Å
185	Y	88.5	Confident	85.1	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	146.1	178.9	76.5	-90.4	0	0	0	112.1	I39 T40 P41 G42 W43 V163 F165 I178 Q179 V188	I39-Y185 HydrophobicContact CG2-CD1 3.87Å; I39-Y185 HydrophobicContact CG2-CG 4.41Å; T40-Y185 VanDerWaalsContact C-CD1 3.44Å; T40-Y185 WeakPolarHBondContact O-CD1 3.32Å; T40-Y185 PolarHBondContact O-N 2.84Å; P41-Y185 HydrophobicContact CB-CD1 4.29Å; P41-Y185 HydrophobicContact CB-CE1 3.59Å; P41-Y185 HydrophobicContact CB-CE2 4.4Å; P41-Y185 HydrophobicContact CG-CE1 4.09Å; P41-Y185 VanDerWaalsContact N-CE1 3.27Å; G42-Y185 PolarHBondContact N-O 2.83Å; W43-Y185 HydrophobicContact CZ2-CE2 4.3Å; W43-Y185 AromaticContact NE1-CD2 3.97Å; W43-Y185 AromaticContact NE1-CE2 3.47Å; W43-Y185 AromaticContact NE1-CZ 3.96Å; V163-Y185 PolarHBondContact N-OH 2.83Å; V163-Y185 VanDerWaalsContact N-OH 3.15Å; V163-Y185 VanDerWaalsContact O-CE1 3.25Å; V163-Y185 WeakPolarHBondContact O-CE1 3.43Å; V163-Y185 PolarHBondContact O-OH 3.3Å; F165-Y185 HydrophobicContact CD2-CE1 4.13Å; F165-Y185 HydrophobicContact CE2-CE1 4.25Å; F165-Y185 HydrophobicContact CE2-CE2 4.36Å; F165-Y185 AromaticContact CE2-CZ 3.94Å; I178-Y185 HydrophobicContact CG2-CD2 4.16Å; I178-Y185 HydrophobicContact CG2-CG 4.11Å; Q179-Y185 CarbonylContact O-C 3.34Å; Q179-Y185 VanDerWaalsContact O-CA 3.28Å; Q179-Y185 WeakPolarHBondContact O-CA 3.34Å; Y185-V188 HydrophobicContact CD2-CG2 4.25Å; Y185-V188 HydrophobicContact CE2-CG2 4.04Å
186	L	88.8	Confident	85	Confident	21 Å²	21	52 Å²	52	11%	0.11	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-75	157.5	177.5	-66.8	177.9	0	0	0	111.7	T103 I109 Q179 V188	T103-L186 HydrophobicContact CG2-CD2 3.89Å; I109-L186 HydrophobicContact CG1-CB 4.48Å; I109-L186 HydrophobicContact CG1-CD1 4.4Å; I109-L186 HydrophobicContact CG2-CB 4.36Å; Q179-L186 HydrophobicContact CB-CB 4.46Å; Q179-L186 HydrophobicContact CB-CD1 4.08Å; Q179-L186 PolarHBondContact O-N 3.18Å; L186-V188 PolarHBondContact O-N 2.99Å
187	P	87.4	Confident	84.8	Confident	4 Å²	4	41.4 Å²	41.4	3%	0.026	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-51.1	130.3	177	-24.2	30.8	0	0	0	112.2	W43 L49 I73 I109 V158	W43-P187 HydrophobicContact CB-CG 3.85Å; W43-P187 HydrophobicContact CD2-CB 4.19Å; W43-P187 HydrophobicContact CD2-CG 3.92Å; W43-P187 HydrophobicContact CG-CB 4.29Å; W43-P187 HydrophobicContact CG-CG 3.57Å; L49-P187 HydrophobicContact CD1-CB 4.35Å; L49-P187 HydrophobicContact CD1-CG 4.22Å; L49-P187 HydrophobicContact CD2-CG 4.38Å; I73-P187 HydrophobicContact CD1-CB 4.41Å; I73-P187 HydrophobicContact CD1-CG 4.11Å; I109-P187 HydrophobicContact CD1-CG 4.07Å; I109-P187 WeakPolarHBondContact CG2-O 3.41Å; V158-P187 HydrophobicContact CG1-CB 4.39Å
188	V	89.2	Confident	84.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-80.4	130.4	179.1	-172.2	0	0	0	0	108.7	L159 R177 I178 Y185 L186 L227	L159-V188 HydrophobicContact CB-CB 4.12Å; L159-V188 WeakPolarHBondContact CB-O 3.35Å; L159-V188 HydrophobicContact CD2-CB 4.2Å; L159-V188 HydrophobicContact CD2-CG2 4.16Å; L159-V188 PolarHBondContact N-O 2.81Å; R177-V188 HydrophobicContact CB-CG1 4Å; I178-V188 HydrophobicContact CG1-CG2 3.71Å; Y185-V188 HydrophobicContact CD2-CG2 4.25Å; Y185-V188 HydrophobicContact CE2-CG2 4.04Å; L186-V188 PolarHBondContact O-N 2.99Å; V188-L227 HydrophobicContact CB-CD2 4.19Å; V188-L227 HydrophobicContact CG1-CD2 3.83Å
189	T	89.7	Confident	83.9	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.043	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	142.4	-176.8	62.7	0	0	0	0	109.8	L101 I109 S110 Y157 V158	L101-T189 HydrophobicContact CD2-CG2 3.61Å; I109-T189 HydrophobicContact CG2-CG2 4.02Å; S110-T189 WeakPolarHBondContact CB-OG1 3.29Å; S110-T189 PolarHBondContact OG-OG1 3.4Å; Y157-T189 CarbonylContact O-C 3.58Å; Y157-T189 WeakPolarHBondContact O-CA 3.49Å; V158-T189 HydrophobicContact CG1-CG2 4.31Å; V158-T189 HydrophobicContact CG2-CG2 4.24Å
190	Y	89.9	Confident	83.8	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.008	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.8	174.7	177.5	-77.9	0	0	0	108.9	Y157 N192 F195 L227 R230 E234	Y157-Y190 AromaticContact CD2-CD1 3.87Å; Y157-Y190 HydrophobicContact CD2-CD1 3.87Å; Y157-Y190 PolarHBondContact N-O 3.06Å; Y157-Y190 PolarHBondContact O-N 3.12Å; Y190-N192 HydrophobicContact CE1-CB 4.09Å; Y190-F195 WeakPolarHBondContact OH-CD1 3.46Å; Y190-L227 HydrophobicContact CG-CD1 4.4Å; Y190-R230 HydrophobicContact CD2-CB 4.39Å; Y190-R230 HydrophobicContact CE2-CB 4.14Å; Y190-E234 VanDerWaalsContact CE2-OE2 3.22Å; Y190-E234 WeakPolarHBondContact CE2-OE2 3.5Å
191	V	88.6	Confident	83.7	Confident	9 Å²	9	35.3 Å²	35.3	6%	0.055	21%	0.211	C	C	.	.			trans	-139.3	114.1	177.4	-174.2	0	0	0	0	107	L99 L154 V156	L99-V191 HydrophobicContact CD2-CG1 4.2Å; L99-V191 HydrophobicContact CD2-CG2 4.06Å; L154-V191 HydrophobicContact CD1-CG1 4.38Å; V156-V191 HydrophobicContact CB-CG2 4.22Å; V156-V191 HydrophobicContact CG1-CG2 3.75Å; V156-V191 HydrophobicContact CG2-CG1 4.46Å; V156-V191 HydrophobicContact CG2-CG2 4.03Å
192	N	85.7	Confident	83.7	Confident	28 Å²	28	37.1 Å²	37.1	15%	0.15	22%	0.216	C	C	.	.			trans	-151.7	99	170.2	-176.7	-15.5	0	0	0	108.6	Y190 N194 F195 Q196 E234	Y190-N192 HydrophobicContact CE1-CB 4.09Å; N192-N194 VanDerWaalsContact C-N 3.28Å; N192-N194 PolarHBondContact O-N 3.28Å; N192-N194 WeakPolarHBondContact OD1-CB 3.4Å; N192-N194 PolarHBondContact OD1-N 2.91Å; N192-F195 HydrophobicContact CB-CB 4.14Å; N192-F195 CarbonylContact O-C 3.59Å; N192-F195 PolarHBondContact O-N 3.33Å; N192-F195 PolarHBondContact OD1-N 3.3Å; N192-F195 VanDerWaalsContact OD1-N 3.15Å; N192-Q196 PolarHBondContact O-N 2.9Å; N192-E234 PolarHBondContact ND2-OE1 3.06Å
193	P	80.9	Confident	83.5	Confident	8 Å²	8	33.4 Å²	33.4	5%	0.052	19%	0.185	C	C	.	.	S	Bend	trans	-65.1	-29.8	179.2	-23.9	36	0	0	0	113.7	F114 L151 L154 F195 Q196 W201	F114-P193 HydrophobicContact CB-CG 3.71Å; F114-P193 HydrophobicContact CD1-CG 4.28Å; F114-P193 HydrophobicContact CD2-CG 3.89Å; F114-P193 HydrophobicContact CG-CG 3.7Å; L151-P193 HydrophobicContact CD1-CB 4.36Å; L151-P193 HydrophobicContact CD2-CB 3.93Å; L151-P193 HydrophobicContact CD2-CG 4.32Å; L154-P193 HydrophobicContact CD1-CB 4.41Å; L154-P193 HydrophobicContact CD1-CG 3.65Å; P193-F195 PolarHBondContact O-N 3.28Å; P193-Q196 VanDerWaalsContact O-CB 3.31Å; P193-Q196 WeakPolarHBondContact O-CB 3.17Å; P193-Q196 PolarHBondContact O-N 3.47Å; P193-Q196 VanDerWaalsContact O-N 3.09Å; P193-W201 HydrophobicContact CB-CZ2 4.19Å; P193-W201 WeakPolarHBondContact O-CZ2 3.36Å; P193-W201 PolarHBondContact O-NE1 2.8Å
194	N	78.1	Confident	83.1	Confident	107 Å²	107	26.3 Å²	26.3	57%	0.572	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-29.5	177.6	-63.4	-21.6	0	0	0	111.2	N192 Q196	N192-N194 VanDerWaalsContact C-N 3.28Å; N192-N194 PolarHBondContact O-N 3.28Å; N192-N194 WeakPolarHBondContact OD1-CB 3.4Å; N192-N194 PolarHBondContact OD1-N 2.91Å; N194-Q196 VanDerWaalsContact C-N 3.33Å
195	F	81.8	Confident	82.1	Confident	12 Å²	12	30.9 Å²	30.9	5%	0.053	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	35.5	171.6	-151.8	-114.6	0	0	0	111.4	Y190 N192 P193 L233 E234 A237 I250 R254 L258	Y190-F195 WeakPolarHBondContact OH-CD1 3.46Å; N192-F195 HydrophobicContact CB-CB 4.14Å; N192-F195 CarbonylContact O-C 3.59Å; N192-F195 PolarHBondContact O-N 3.33Å; N192-F195 PolarHBondContact OD1-N 3.3Å; N192-F195 VanDerWaalsContact OD1-N 3.15Å; P193-F195 PolarHBondContact O-N 3.28Å; F195-L233 HydrophobicContact CE1-CB 3.93Å; F195-L233 HydrophobicContact CZ-CB 3.68Å; F195-E234 HydrophobicContact CD1-CB 4.24Å; F195-E234 HydrophobicContact CE1-CB 4.24Å; F195-A237 HydrophobicContact CD2-CB 4.24Å; F195-A237 HydrophobicContact CE2-CB 3.57Å; F195-A237 HydrophobicContact CZ-CB 4.31Å; F195-I250 HydrophobicContact CE2-CG2 4.04Å; F195-R254 VanDerWaalsContact CD1-CD 3.48Å; F195-R254 HydrophobicContact CD1-CG 4.26Å; F195-R254 VanDerWaalsContact CE1-CD 3.41Å; F195-R254 HydrophobicContact CE1-CG 3.68Å; F195-R254 HydrophobicContact CE2-CB 4.1Å; F195-R254 HydrophobicContact CE2-CG 4.02Å; F195-R254 HydrophobicContact CZ-CB 3.91Å; F195-R254 VanDerWaalsContact CZ-CD 3.43Å; F195-R254 HydrophobicContact CZ-CG 3.53Å; F195-R254 PolarHBondContact O-NE 3.08Å; F195-R254 PolarHBondContact O-NH1 3.4Å; F195-R254 PolarHBondContact O-NH2 2.85Å; F195-L258 HydrophobicContact CE1-CD1 4.07Å
196	Q	84.3	Confident	80.7	Confident	3 Å²	3	38.6 Å²	38.6	1%	0.014	22%	0.217	C	C	.	.	S	Bend	trans	-108.6	155.8	169.1	-81.3	-170.8	-112.6	0	0	113.6	T153 R155 N192 P193 N194 D200 R254	T153-Q196 PolarHBondContact O-NE2 3.44Å; R155-Q196 HydrophobicContact CB-CG 4.41Å; R155-Q196 VanDerWaalsContact N-CD 3.29Å; N192-Q196 PolarHBondContact O-N 2.9Å; P193-Q196 VanDerWaalsContact O-CB 3.31Å; P193-Q196 WeakPolarHBondContact O-CB 3.17Å; P193-Q196 PolarHBondContact O-N 3.47Å; P193-Q196 VanDerWaalsContact O-N 3.09Å; N194-Q196 VanDerWaalsContact C-N 3.33Å; Q196-D200 PolarHBondContact NE2-OD2 2.86Å; Q196-R254 VanDerWaalsContact CA-NH2 3.25Å; Q196-R254 VanDerWaalsContact N-NH1 3.11Å; Q196-R254 PolarHBondContact O-NH1 3.26Å
197	A	80.8	Confident	79.2	Confident	12 Å²	12	40.5 Å²	40.5	10%	0.099	23%	0.233	C	C	.	.			trans	-64.2	145.4	-162.7	0	0	0	0	0	109.3	S199 D200	A197-S199 PolarHBondContact O-N 3.36Å; A197-D200 PolarHBondContact N-OD2 3.26Å; A197-D200 VanDerWaalsContact O-CB 3.31Å; A197-D200 WeakPolarHBondContact O-CB 3.48Å; A197-D200 PolarHBondContact O-N 2.92Å
198	S	75.8	Confident	77.8	Confident	61 Å²	61	42.1 Å²	42.1	43%	0.427	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-59.1	-23.8	179.6	-65	0	0	0	0	113	D200 W201 D251	S198-D200 VanDerWaalsContact C-N 3.29Å; S198-D200 PolarHBondContact O-N 2.86Å; S198-W201 WeakPolarHBondContact O-CB 3.37Å; S198-W201 PolarHBondContact O-N 3.44Å; S198-D251 PolarHBondContact OG-OD2 3.36Å; S198-D251 VanDerWaalsContact OG-OD2 3.14Å
199	S	76.9	Confident	76.1	Confident	98 Å²	98	51.6 Å²	51.6	69%	0.685	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-67.9	-23.1	171.5	57.3	0	0	0	0	114.6	A197 W201	A197-S199 PolarHBondContact O-N 3.36Å; S199-W201 PolarHBondContact O-N 2.99Å
200	D	83.1	Confident	74.6	Confident	6 Å²	6	57.4 Å²	57.4	3%	0.032	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-76.3	-7.3	175	-63.3	-26.2	0	0	0	111.2	S152 T153 R155 Q196 A197 S198	S152-D200 PolarHBondContact N-O 3.03Å; S152-D200 PolarHBondContact OG-O 2.91Å; T153-D200 PolarHBondContact N-O 3.34Å; T153-D200 VanDerWaalsContact N-O 3.12Å; R155-D200 IonicContact CZ-OD1 3.83Å; R155-D200 IonicContact NE-OD1 2.66Å; R155-D200 PolarHBondContact NE-OD1 3.45Å; R155-D200 IonicContact NE-OD2 3.56Å; R155-D200 PolarHBondContact NE-OD2 3.35Å; R155-D200 IonicContact NH2-OD1 2.74Å; Q196-D200 PolarHBondContact NE2-OD2 2.86Å; A197-D200 PolarHBondContact N-OD2 3.26Å; A197-D200 VanDerWaalsContact O-CB 3.31Å; A197-D200 WeakPolarHBondContact O-CB 3.48Å; A197-D200 PolarHBondContact O-N 2.92Å; S198-D200 VanDerWaalsContact C-N 3.29Å; S198-D200 PolarHBondContact O-N 2.86Å
201	W	83.1	Confident	73.2	Confident	11 Å²	11	63.7 Å²	63.7	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.1	177.4	-64.3	89.1	0	0	0	110.2	T118 F149 W150 L151 P193 S198 S199	T118-W201 HydrophobicContact CG2-CD2 3.91Å; T118-W201 HydrophobicContact CG2-CE3 3.44Å; T118-W201 VanDerWaalsContact CG2-CE3 3.44Å; T118-W201 HydrophobicContact CG2-CH2 3.68Å; T118-W201 HydrophobicContact CG2-CZ2 4.11Å; T118-W201 HydrophobicContact CG2-CZ3 3.32Å; F149-W201 HydrophobicContact CB-CB 4.22Å; F149-W201 HydrophobicContact CB-CE3 4.21Å; F149-W201 HydrophobicContact CD1-CB 3.87Å; F149-W201 HydrophobicContact CG-CB 4.47Å; W150-W201 CarbonylContact O-C 3.59Å; W150-W201 WeakPolarHBondContact O-CA 3.26Å; L151-W201 HydrophobicContact CB-CE3 4Å; L151-W201 HydrophobicContact CB-CH2 4.03Å; L151-W201 HydrophobicContact CB-CZ3 3.65Å; L151-W201 HydrophobicContact CD1-CD2 4.04Å; L151-W201 HydrophobicContact CD1-CE3 4.22Å; L151-W201 HydrophobicContact CD1-CH2 3.98Å; L151-W201 HydrophobicContact CD1-CZ2 3.77Å; L151-W201 HydrophobicContact CD1-CZ3 4.19Å; L151-W201 HydrophobicContact CG-CH2 4.44Å; L151-W201 HydrophobicContact CG-CZ3 4.47Å; P193-W201 HydrophobicContact CB-CZ2 4.19Å; P193-W201 WeakPolarHBondContact O-CZ2 3.36Å; P193-W201 PolarHBondContact O-NE1 2.8Å; S198-W201 WeakPolarHBondContact O-CB 3.37Å; S198-W201 PolarHBondContact O-N 3.44Å; S199-W201 PolarHBondContact O-N 2.99Å
202	L	80.7	Confident	72.1	Confident	92 Å²	92	70.8 Å²	70.8	48%	0.482	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.7	178.8	-179.6	65.5	0	0	0	109.8	F149 W150 V204	F149-L202 CarbonylContact C-O 3.54Å; F149-L202 WeakPolarHBondContact CA-O 3.28Å; W150-L202 PolarHBondContact N-O 3.34Å; W150-L202 PolarHBondContact O-N 3.21Å; L202-V204 PolarHBondContact O-N 3.4Å
203	E	76	Confident	71.4	Confident	43 Å²	43	70.1 Å²	70.1	20%	0.201	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	124.4	174	-167.7	175.3	164.9	0	0	110.2	T123 A147 F149 T205	T123-E203 WeakPolarHBondContact CB-OE2 3.27Å; T123-E203 PolarHBondContact N-OE2 2.95Å; T123-E203 PolarHBondContact OG1-OE2 2.7Å; A147-E203 HydrophobicContact CB-CG 4.27Å; F149-E203 HydrophobicContact CD1-CB 4.12Å; F149-E203 HydrophobicContact CE1-CB 3.62Å; F149-E203 HydrophobicContact CE1-CG 4.19Å; F149-E203 HydrophobicContact CE2-CB 4.31Å; F149-E203 HydrophobicContact CE2-CG 3.98Å; F149-E203 HydrophobicContact CZ-CB 3.73Å; F149-E203 HydrophobicContact CZ-CG 3.77Å; E203-T205 HydrophobicContact CG-CG2 3.9Å; E203-T205 PolarHBondContact O-N 3.33Å
204	V	71.6	Confident	71.2	Confident	16 Å²	16	75 Å²	75	10%	0.097	39%	0.386	C	S	.	.			trans	-99.3	83.2	178.5	-173	0	0	0	0	108.5	L89 P148 W150 L202 L213	L89-V204 HydrophobicContact CD1-CB 4.22Å; L89-V204 HydrophobicContact CD1-CG1 3.86Å; L89-V204 HydrophobicContact CD1-CG2 4.42Å; P148-V204 PolarHBondContact O-N 2.96Å; W150-V204 HydrophobicContact CB-CG2 3.75Å; L202-V204 PolarHBondContact O-N 3.4Å; V204-L213 HydrophobicContact CG2-CD1 4.42Å
205	T	64.1	Low	71.3	Confident	109 Å²	109	70 Å²	70	67%	0.669	36%	0.359	S	S	*	.			trans	-76	-32.4	179.4	51.8	0	0	0	0	112.8	E203	E203-T205 HydrophobicContact CG-CG2 3.9Å; E203-T205 PolarHBondContact O-N 3.33Å
206	Q	58.9	Low	71.5	Confident	161 Å²	161	71.4 Å²	71.4	75%	0.752	37%	0.367	S	S	*	.	S	Bend	trans	-135.7	145.3	179.6	-64.7	-179.8	8.6	0	0	109.9	P208	Q206-P208 WeakPolarHBondContact O-CD 3.23Å; Q206-P208 VanDerWaalsContact O-N 3.13Å
207	S	56.5	Low	71.6	Confident	62 Å²	62	71.2 Å²	71.2	43%	0.434	37%	0.366	S	S	.	.			trans	-57.9	117.7	172.2	-178.6	0	0	0	0	108.5	E209	S207-E209 PolarHBondContact O-N 2.96Å
208	P	57.7	Low	72	Confident	37 Å²	37	71.1 Å²	71.1	24%	0.24	37%	0.365	C	S	.	.			trans	-58	136.2	179.6	20.4	-29.1	0	0	0	109.5	Q206 N210 R211 L213	Q206-P208 WeakPolarHBondContact O-CD 3.23Å; Q206-P208 VanDerWaalsContact O-N 3.13Å; P208-N210 PolarHBondContact O-N 3.28Å; P208-R211 PolarHBondContact O-N 3.35Å; P208-L213 HydrophobicContact CG-CD2 4.05Å; P208-L213 HydrophobicContact CG-CG 4.35Å
209	E	54.9	Low	72.6	Confident	200 Å²	200	68.4 Å²	68.4	94%	0.935	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-34.5	-177.1	-73.7	-176	153.4	0	0	112.3	S207	S207-E209 PolarHBondContact O-N 2.96Å
210	N	57	Low	73.3	Confident	128 Å²	128	66.1 Å²	66.1	68%	0.684	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	1.9	-178.8	-69.9	-24.9	0	0	0	115.2	P208 R212	P208-N210 PolarHBondContact O-N 3.28Å; N210-R212 WeakPolarHBondContact O-CG 3.48Å; N210-R212 PolarHBondContact O-N 2.8Å
211	R	61.7	Low	73.7	Confident	134 Å²	134	68 Å²	68	51%	0.506	34%	0.337	S	S	.	.			trans	50.3	21.8	-176.7	-59.4	-176.6	-176.6	175.3	0.9	115.2	V85 P208	V85-R211 PolarHBondContact N-O 3.33Å; P208-R211 PolarHBondContact O-N 3.35Å
212	R	64.3	Low	74	Confident	159 Å²	159	68.6 Å²	68.6	60%	0.6	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.1	-179.9	-73.3	173.7	-173.6	-168.8	1.7	108.3	C83 I84 N210	C83-R212 WeakPolarHBondContact O-CA 3.38Å; I84-R212 HydrophobicContact CG1-CG 4.27Å; N210-R212 WeakPolarHBondContact O-CG 3.48Å; N210-R212 PolarHBondContact O-N 2.8Å
213	L	70.7	Confident	74.4	Confident	14 Å²	14	66.3 Å²	66.3	7%	0.073	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.9	173	-69.4	172.6	0	0	0	108.2	C83 V85 W150 V204 P208	C83-L213 PolarHBondContact N-O 3Å; C83-L213 PolarHBondContact O-N 2.86Å; V85-L213 HydrophobicContact CB-CD1 4.17Å; V85-L213 HydrophobicContact CG1-CD1 4.4Å; V85-L213 HydrophobicContact CG2-CB 4.13Å; V85-L213 HydrophobicContact CG2-CD1 3.99Å; V85-L213 HydrophobicContact CG2-CG 4.37Å; W150-L213 HydrophobicContact CB-CD1 4.08Å; W150-L213 HydrophobicContact CD2-CB 4.09Å; W150-L213 HydrophobicContact CD2-CD1 3.66Å; W150-L213 HydrophobicContact CD2-CG 4.47Å; W150-L213 HydrophobicContact CE3-CD1 3.95Å; W150-L213 HydrophobicContact CG-CB 4.25Å; W150-L213 HydrophobicContact CG-CD1 3.71Å; W150-L213 HydrophobicContact CG-CG 4.43Å; W150-L213 HydrophobicContact CZ2-CB 4.07Å; V204-L213 HydrophobicContact CG2-CD1 4.42Å; P208-L213 HydrophobicContact CG-CD2 4.05Å; P208-L213 HydrophobicContact CG-CG 4.35Å
214	E	77.5	Confident	74.9	Confident	111 Å²	111	64.7 Å²	64.7	52%	0.519	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	139.5	176.2	-57.7	-167.3	169.8	0	0	109.5	W150	W150-E214 PolarHBondContact NE1-O 3.28Å; W150-E214 VanDerWaalsContact NE1-O 3.17Å
215	M	80	Confident	75.6	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.9	169.9	-178.1	-170.2	-61.6	0	0	109.4	F55 Y81 L116 W150 S152	F55-M215 HydrophobicContact CE1-CE 3.75Å; F55-M215 HydrophobicContact CE1-SD 4.11Å; F55-M215 HydrophobicContact CZ-CE 4.33Å; F55-M215 HydrophobicContact CZ-SD 4.17Å; Y81-M215 PolarHBondContact N-O 2.94Å; Y81-M215 PolarHBondContact O-N 2.83Å; L116-M215 HydrophobicContact CD1-CE 3.59Å; L116-M215 HydrophobicContact CD2-CE 3.33Å; L116-M215 HydrophobicContact CD2-SD 4.41Å; L116-M215 HydrophobicContact CG-CE 4.02Å; W150-M215 HydrophobicContact CH2-CE 4.16Å; W150-M215 HydrophobicContact CZ2-CB 4.5Å; W150-M215 HydrophobicContact CZ2-CE 3.74Å; S152-M215 CarbonylContact O-C 3.57Å; S152-M215 VanDerWaalsContact O-CA 3.31Å; S152-M215 WeakPolarHBondContact O-CA 3.43Å
216	I	85.1	Confident	76.7	Confident	42 Å²	42	62.6 Å²	62.6	22%	0.215	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	119.1	175.7	-51.5	-175.2	0	0	0	108.3	V78 K79 K80 S152 T153 L154	V78-I216 HydrophobicContact CG1-CG2 3.76Å; K79-I216 CarbonylContact O-C 3.58Å; K79-I216 WeakPolarHBondContact O-CA 3.43Å; K80-I216 HydrophobicContact CG-CD1 4.47Å; K80-I216 HydrophobicContact CG-CG1 4.14Å; S152-I216 PolarHBondContact O-N 3.05Å; T153-I216 CarbonylContact C-O 3.54Å; T153-I216 VanDerWaalsContact CA-O 3.28Å; T153-I216 WeakPolarHBondContact CA-O 3.32Å; T153-I216 HydrophobicContact CG2-CB 4.25Å; L154-I216 PolarHBondContact N-O 3.47Å
217	L	86.3	Confident	78.1	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	113.7	167.6	177.8	65.8	0	0	0	108.2	I51 V78 K79 Y81 L99 L154 V156 I219	I51-L217 HydrophobicContact CD1-CD1 4.38Å; I51-L217 HydrophobicContact CD1-CD2 4.13Å; I51-L217 HydrophobicContact CG2-CD2 4.23Å; V78-L217 WeakPolarHBondContact CA-O 3.26Å; K79-L217 PolarHBondContact N-O 3.15Å; K79-L217 PolarHBondContact O-N 3.32Å; Y81-L217 HydrophobicContact CD2-CB 4.13Å; Y81-L217 HydrophobicContact CE2-CB 3.73Å; Y81-L217 HydrophobicContact CE2-CD2 3.89Å; L99-L217 HydrophobicContact CD1-CD1 4.4Å; L154-L217 HydrophobicContact CB-CD1 4.4Å; L154-L217 HydrophobicContact CD2-CD1 3.82Å; L154-L217 HydrophobicContact CG-CD1 4.11Å; V156-L217 HydrophobicContact CG2-CD1 3.93Å; L217-I219 HydrophobicContact CG-CG1 4.36Å
218	S	89.2	Confident	79.7	Confident	10 Å²	10	53.4 Å²	53.4	7%	0.07	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	115.4	175.1	-171.5	0	0	0	0	109.6	L154 R155 V156 E220	L154-S218 PolarHBondContact O-N 3.47Å; R155-S218 CarbonylContact C-O 3.56Å; R155-S218 VanDerWaalsContact CA-O 3.32Å; R155-S218 WeakPolarHBondContact CA-O 3.5Å; V156-S218 PolarHBondContact N-O 2.83Å; S218-E220 PolarHBondContact OG-OE1 2.86Å
219	I	89.8	Confident	81.2	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	117.3	173.6	-50.3	178.7	0	0	0	107.8	I51 F71 G76 L77 V156 V158 L217	I51-I219 HydrophobicContact CB-CD1 4.33Å; I51-I219 HydrophobicContact CD1-CD1 3.42Å; I51-I219 VanDerWaalsContact CD1-CD1 3.42Å; I51-I219 HydrophobicContact CD1-CG1 4.06Å; I51-I219 HydrophobicContact CG2-CD1 4.16Å; F71-I219 HydrophobicContact CD1-CD1 3.49Å; F71-I219 VanDerWaalsContact CD1-CD1 3.49Å; F71-I219 HydrophobicContact CD2-CD1 4.29Å; F71-I219 HydrophobicContact CD2-CG2 4.02Å; F71-I219 HydrophobicContact CE1-CD1 3.49Å; F71-I219 VanDerWaalsContact CE1-CD1 3.49Å; F71-I219 HydrophobicContact CE1-CG2 4.49Å; F71-I219 HydrophobicContact CE2-CD1 4.3Å; F71-I219 HydrophobicContact CE2-CG2 3.59Å; F71-I219 HydrophobicContact CG-CD1 3.91Å; F71-I219 HydrophobicContact CZ-CD1 3.92Å; F71-I219 HydrophobicContact CZ-CG2 3.84Å; G76-I219 CarbonylContact C-O 3.55Å; G76-I219 WeakPolarHBondContact CA-O 3.43Å; L77-I219 HydrophobicContact CB-CB 4.25Å; L77-I219 HydrophobicContact CB-CD1 4Å; L77-I219 HydrophobicContact CB-CG1 4.28Å; L77-I219 HydrophobicContact CD2-CD1 4.11Å; L77-I219 PolarHBondContact N-O 3.48Å; L77-I219 PolarHBondContact O-N 3.3Å; V156-I219 HydrophobicContact CB-CG1 4.31Å; V156-I219 HydrophobicContact CG1-CG2 4.42Å; V156-I219 CarbonylContact O-C 3.58Å; V156-I219 VanDerWaalsContact O-CA 3.28Å; V156-I219 WeakPolarHBondContact O-CA 3.46Å; V158-I219 HydrophobicContact CG2-CG2 3.79Å; L217-I219 HydrophobicContact CG-CG1 4.36Å
220	E	90.6	Very high	82.8	Confident	50 Å²	50	44.3 Å²	44.3	23%	0.234	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.6	-171.1	-70.9	170.3	-151.1	0	0	111	R155 V156 Y157 V158 S218	R155-E220 IonicContact CZ-OE1 3.68Å; R155-E220 IonicContact NH1-OE1 2.83Å; R155-E220 PolarHBondContact NH1-OE1 3.16Å; R155-E220 IonicContact NH1-OE2 3.44Å; R155-E220 PolarHBondContact NH1-OE2 3.13Å; V156-E220 PolarHBondContact O-N 2.98Å; Y157-E220 WeakPolarHBondContact CA-O 3.49Å; Y157-E220 HydrophobicContact CD1-CB 3.89Å; Y157-E220 HydrophobicContact CE1-CB 4.04Å; Y157-E220 VanDerWaalsContact CE1-OE2 3.3Å; Y157-E220 WeakPolarHBondContact CE1-OE2 3.36Å; V158-E220 PolarHBondContact N-O 2.96Å; S218-E220 PolarHBondContact OG-OE1 2.86Å
221	P	91.5	Very high	84.4	Confident	46 Å²	46	38.5 Å²	38.5	30%	0.299	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	131.8	172	25.3	-30.3	0	0	0	111.1	I73 V158 R160	I73-P221 WeakPolarHBondContact O-CB 3.48Å; V158-P221 WeakPolarHBondContact O-CA 3.42Å; R160-P221 HydrophobicContact CB-CB 3.96Å; R160-P221 HydrophobicContact CG-CB 4.08Å
222	L	89.4	Confident	85.7	Confident	22 Å²	22	35.1 Å²	35.1	12%	0.115	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	146.7	-177.4	-160.7	63.9	0	0	0	112.1	Y157 V158 R160 H226 L227	Y157-L222 HydrophobicContact CD1-CD2 4.23Å; Y157-L222 HydrophobicContact CG-CD2 4.33Å; V158-L222 PolarHBondContact O-N 3.39Å; R160-L222 WeakPolarHBondContact CB-O 3.26Å; R160-L222 PolarHBondContact N-O 3.11Å; L222-H226 HydrophobicContact CD1-CB 3.53Å; L222-H226 HydrophobicContact CD2-CB 3.92Å; L222-H226 HydrophobicContact CG-CB 3.66Å; L222-L227 HydrophobicContact CD2-CB 4.03Å; L222-L227 HydrophobicContact CD2-CD1 4.2Å
223	S	89	Confident	86.8	Confident	44 Å²	44	28.7 Å²	28.7	31%	0.308	15%	0.147	S	C	.	.			trans	-76.5	158.5	171	74.2	0	0	0	0	111.4	G225 H226 L227	S223-G225 VanDerWaalsContact C-N 3.29Å; S223-G225 PolarHBondContact O-N 3.28Å; S223-H226 PolarHBondContact O-N 3.45Å; S223-H226 PolarHBondContact OG-ND1 3.14Å; S223-L227 WeakPolarHBondContact O-CB 3.31Å; S223-L227 PolarHBondContact O-N 3.27Å
224	I	87.7	Confident	87.7	Confident	10 Å²	10	29.2 Å²	29.2	5%	0.051	15%	0.149	C	C	.	.	H	α-helix	trans	-56.9	-41.4	179.8	-175.3	57.8	0	0	0	112.8	P29 L159 V163 F165 I174 L227 R228	P29-I224 HydrophobicContact CG-CG1 3.98Å; P29-I224 HydrophobicContact CG-CG2 3.78Å; L159-I224 HydrophobicContact CD1-CB 3.93Å; L159-I224 HydrophobicContact CD1-CD1 4.13Å; L159-I224 HydrophobicContact CD2-CD1 4.38Å; V163-I224 HydrophobicContact CG2-CB 4.29Å; V163-I224 HydrophobicContact CG2-CG1 4.43Å; V163-I224 HydrophobicContact CG2-CG2 4.34Å; F165-I224 HydrophobicContact CZ-CD1 4.11Å; I174-I224 HydrophobicContact CD1-CD1 4.03Å; I224-L227 PolarHBondContact O-N 3.45Å; I224-R228 HydrophobicContact CD1-CG 4.04Å; I224-R228 HydrophobicContact CG1-CG 4.3Å; I224-R228 VanDerWaalsContact O-CG 3.32Å; I224-R228 WeakPolarHBondContact O-CG 3.44Å; I224-R228 PolarHBondContact O-N 2.91Å
225	G	86.3	Confident	88.2	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.3	-50.2	178.7	0	0	0	0	0	113.7	S223 L227 R228 L229	S223-G225 VanDerWaalsContact C-N 3.29Å; S223-G225 PolarHBondContact O-N 3.28Å; G225-L227 VanDerWaalsContact C-N 3.31Å; G225-L227 PolarHBondContact O-N 2.93Å; G225-R228 PolarHBondContact O-N 2.94Å; G225-L229 WeakPolarHBondContact O-CB 3.37Å; G225-L229 PolarHBondContact O-N 3.22Å
226	H	86.6	Confident	88.6	Confident	81 Å²	81	29.7 Å²	29.7	38%	0.375	16%	0.164	S	C	.	.	H	α-helix	trans	-66.7	-35.2	178.4	-67.9	94.6	0	0	0	111.8	L222 S223 L229 R230	L222-H226 HydrophobicContact CD1-CB 3.53Å; L222-H226 HydrophobicContact CD2-CB 3.92Å; L222-H226 HydrophobicContact CG-CB 3.66Å; S223-H226 PolarHBondContact O-N 3.45Å; S223-H226 PolarHBondContact OG-ND1 3.14Å; H226-L229 PolarHBondContact O-N 3.43Å; H226-R230 VanDerWaalsContact O-CG 3.31Å; H226-R230 WeakPolarHBondContact O-CG 3.26Å; H226-R230 PolarHBondContact O-N 3.4Å
227	L	89.3	Confident	88.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-47.3	175.4	-173.7	72.8	0	0	0	111.4	L159 V188 Y190 L222 S223 I224 G225 L229 R230 C231	L159-L227 HydrophobicContact CB-CD2 4.14Å; L159-L227 HydrophobicContact CD1-CD2 4.13Å; V188-L227 HydrophobicContact CB-CD2 4.19Å; V188-L227 HydrophobicContact CG1-CD2 3.83Å; Y190-L227 HydrophobicContact CG-CD1 4.4Å; L222-L227 HydrophobicContact CD2-CB 4.03Å; L222-L227 HydrophobicContact CD2-CD1 4.2Å; S223-L227 WeakPolarHBondContact O-CB 3.31Å; S223-L227 PolarHBondContact O-N 3.27Å; I224-L227 PolarHBondContact O-N 3.45Å; G225-L227 VanDerWaalsContact C-N 3.31Å; G225-L227 PolarHBondContact O-N 2.93Å; L227-L229 VanDerWaalsContact C-N 3.35Å; L227-R230 WeakPolarHBondContact O-CB 3.41Å; L227-R230 PolarHBondContact O-N 2.93Å; L227-C231 PolarHBondContact O-N 3.49Å; L227-C231 PolarHBondContact O-SG 2.96Å
228	R	89.8	Confident	88.6	Confident	30 Å²	30	32.5 Å²	32.5	11%	0.113	18%	0.18	C	C	.	.	H	α-helix	trans	-61.8	-43.4	176.5	-70.6	178.4	69.5	-177.2	1.2	111.3	E25 V26 E173 I174 I224 G225 R230 C231 M232	E25-R228 PolarHBondContact O-NH1 3.41Å; V26-R228 HydrophobicContact CG1-CB 4.28Å; E173-R228 HydrophobicContact CG-CB 4.28Å; E173-R228 HydrophobicContact CG-CG 4.34Å; E173-R228 IonicContact OE1-CZ 3.12Å; E173-R228 IonicContact OE1-NE 2.66Å; E173-R228 PolarHBondContact OE1-NE 3.11Å; E173-R228 IonicContact OE1-NH2 2.72Å; E173-R228 PolarHBondContact OE1-NH2 3.41Å; I174-R228 HydrophobicContact CG2-CG 4.05Å; I224-R228 HydrophobicContact CD1-CG 4.04Å; I224-R228 HydrophobicContact CG1-CG 4.3Å; I224-R228 VanDerWaalsContact O-CG 3.32Å; I224-R228 WeakPolarHBondContact O-CG 3.44Å; I224-R228 PolarHBondContact O-N 2.91Å; G225-R228 PolarHBondContact O-N 2.94Å; R228-R230 VanDerWaalsContact C-N 3.32Å; R228-R230 PolarHBondContact O-N 3.32Å; R228-C231 PolarHBondContact O-N 3.44Å; R228-M232 HydrophobicContact CB-CE 4.35Å; R228-M232 WeakPolarHBondContact O-CG 3.38Å; R228-M232 PolarHBondContact O-N 3Å
229	L	88.1	Confident	88.6	Confident	32 Å²	32	37.5 Å²	37.5	17%	0.168	20%	0.203	C	C	.	.	H	α-helix	trans	-57.9	-44.7	175.2	-177.1	63.4	0	0	0	111.6	F27 G225 H226 L227 M232 L233 L258	F27-L229 HydrophobicContact CZ-CD2 4.25Å; G225-L229 WeakPolarHBondContact O-CB 3.37Å; G225-L229 PolarHBondContact O-N 3.22Å; H226-L229 PolarHBondContact O-N 3.43Å; L227-L229 VanDerWaalsContact C-N 3.35Å; L229-M232 PolarHBondContact O-N 3.44Å; L229-L233 HydrophobicContact CD1-CD1 4.09Å; L229-L233 HydrophobicContact CD1-CG 4.18Å; L229-L233 HydrophobicContact CG-CD1 3.94Å; L229-L233 HydrophobicContact CG-CG 4.43Å; L229-L233 WeakPolarHBondContact O-CB 3.45Å; L229-L233 VanDerWaalsContact O-CG 3.29Å; L229-L233 WeakPolarHBondContact O-CG 3.42Å; L229-L233 PolarHBondContact O-N 3.28Å; L229-L258 HydrophobicContact CD2-CD2 4.01Å; L229-L258 HydrophobicContact CG-CD2 4.05Å
230	R	89.3	Confident	88.5	Confident	14 Å²	14	39.4 Å²	39.4	5%	0.053	21%	0.213	C	C	.	.	H	α-helix	trans	-59.2	-49.4	175.3	-75.8	-179.9	-177.9	-94.4	-5.1	112.1	Y157 Y190 H226 L227 R228 M232 L233 E234 L258	Y157-R230 PolarHBondContact OH-NH1 3.47Å; Y157-R230 PolarHBondContact OH-NH2 3.34Å; Y190-R230 HydrophobicContact CD2-CB 4.39Å; Y190-R230 HydrophobicContact CE2-CB 4.14Å; H226-R230 VanDerWaalsContact O-CG 3.31Å; H226-R230 WeakPolarHBondContact O-CG 3.26Å; H226-R230 PolarHBondContact O-N 3.4Å; L227-R230 WeakPolarHBondContact O-CB 3.41Å; L227-R230 PolarHBondContact O-N 2.93Å; R228-R230 VanDerWaalsContact C-N 3.32Å; R228-R230 PolarHBondContact O-N 3.32Å; R230-M232 PolarHBondContact O-N 3.06Å; R230-L233 PolarHBondContact O-N 3.35Å; R230-E234 WeakPolarHBondContact O-CB 3.39Å; R230-E234 PolarHBondContact O-N 3.06Å; R230-L258 HydrophobicContact CG-CD1 3.65Å; R230-L258 HydrophobicContact CG-CD2 3.47Å; R230-L258 VanDerWaalsContact CG-CD2 3.47Å; R230-L258 HydrophobicContact CG-CG 4.22Å
231	C	89.7	Confident	88.1	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.034	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-39.6	178	-66.3	0	0	0	0	112.8	E173 L227 R228 A235	E173-C231 HydrophobicContact CB-CB 3.88Å; E173-C231 HydrophobicContact CG-CB 4.28Å; E173-C231 WeakPolarHBondContact O-CB 3.18Å; L227-C231 PolarHBondContact O-N 3.49Å; L227-C231 PolarHBondContact O-SG 2.96Å; R228-C231 PolarHBondContact O-N 3.44Å; C231-A235 PolarHBondContact O-N 2.87Å
232	M	88.6	Confident	87.8	Confident	64 Å²	64	43.5 Å²	43.5	32%	0.315	24%	0.24	S	C	.	.	H	α-helix	trans	-66.3	-44.3	177.1	-75.1	-172	-75.3	0	0	111.5	V26 E173 R228 L229 R230 E234 A235 V236	V26-M232 HydrophobicContact CG1-CE 3.7Å; V26-M232 HydrophobicContact CG2-CE 4.46Å; E173-M232 HydrophobicContact CB-CG 4.06Å; E173-M232 HydrophobicContact CG-CG 4.08Å; R228-M232 HydrophobicContact CB-CE 4.35Å; R228-M232 WeakPolarHBondContact O-CG 3.38Å; R228-M232 PolarHBondContact O-N 3Å; L229-M232 PolarHBondContact O-N 3.44Å; R230-M232 PolarHBondContact O-N 3.06Å; M232-E234 VanDerWaalsContact C-N 3.34Å; M232-A235 PolarHBondContact O-N 3.26Å; M232-V236 WeakPolarHBondContact O-CG2 3.37Å; M232-V236 PolarHBondContact O-N 3.42Å
233	L	89	Confident	87.8	Confident	24 Å²	24	51.5 Å²	51.5	13%	0.126	27%	0.27	C	S	.	.	H	α-helix	trans	-67	-35.4	178.2	-70	171.7	0	0	0	112.1	F195 L229 R230 V236 A237 F257 L258	F195-L233 HydrophobicContact CE1-CB 3.93Å; F195-L233 HydrophobicContact CZ-CB 3.68Å; L229-L233 HydrophobicContact CD1-CD1 4.09Å; L229-L233 HydrophobicContact CD1-CG 4.18Å; L229-L233 HydrophobicContact CG-CD1 3.94Å; L229-L233 HydrophobicContact CG-CG 4.43Å; L229-L233 WeakPolarHBondContact O-CB 3.45Å; L229-L233 VanDerWaalsContact O-CG 3.29Å; L229-L233 WeakPolarHBondContact O-CG 3.42Å; L229-L233 PolarHBondContact O-N 3.28Å; R230-L233 PolarHBondContact O-N 3.35Å; L233-V236 PolarHBondContact O-N 2.91Å; L233-A237 WeakPolarHBondContact O-CB 3.43Å; L233-A237 PolarHBondContact O-N 3.49Å; L233-F257 HydrophobicContact CD1-CB 3.61Å; L233-F257 HydrophobicContact CD1-CG 4.33Å; L233-F257 HydrophobicContact CD2-CD2 4.22Å; L233-F257 HydrophobicContact CD2-CG 4.45Å; L233-L258 HydrophobicContact CD1-CD1 4.29Å; L233-L258 HydrophobicContact CD1-CD2 3.81Å; L233-L258 HydrophobicContact CD1-CG 3.78Å
234	E	88.8	Confident	87.5	Confident	25 Å²	25	52.4 Å²	52.4	12%	0.117	29%	0.287	C	S	.	.	H	α-helix	trans	-60.5	-48.8	171.7	-178.9	-174.6	-154.2	0	0	110.7	R177 Y190 N192 F195 R230 M232 V236 A237 D238	R177-E234 IonicContact CZ-OE2 3.17Å; R177-E234 IonicContact NH2-OE1 2.74Å; R177-E234 PolarHBondContact NH2-OE1 2.9Å; R177-E234 VanDerWaalsContact NH2-OE1 3.17Å; R177-E234 IonicContact NH2-OE2 3.7Å; R177-E234 PolarHBondContact NH2-OE2 2.87Å; Y190-E234 VanDerWaalsContact CE2-OE2 3.22Å; Y190-E234 WeakPolarHBondContact CE2-OE2 3.5Å; N192-E234 PolarHBondContact ND2-OE1 3.06Å; F195-E234 HydrophobicContact CD1-CB 4.24Å; F195-E234 HydrophobicContact CE1-CB 4.24Å; R230-E234 WeakPolarHBondContact O-CB 3.39Å; R230-E234 PolarHBondContact O-N 3.06Å; M232-E234 VanDerWaalsContact C-N 3.34Å; E234-V236 VanDerWaalsContact C-N 3.35Å; E234-V236 PolarHBondContact O-N 3.48Å; E234-A237 WeakPolarHBondContact O-CB 3.4Å; E234-A237 PolarHBondContact O-N 3.14Å; E234-D238 PolarHBondContact O-N 3.49Å
235	A	87.9	Confident	87.1	Confident	51 Å²	51	54.5 Å²	54.5	42%	0.421	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-38.5	178.3	0	0	0	0	0	112.9	C231 M232 Q239	C231-A235 PolarHBondContact O-N 2.87Å; M232-A235 PolarHBondContact O-N 3.26Å; A235-Q239 WeakPolarHBondContact O-CG 3.41Å; A235-Q239 PolarHBondContact O-N 3.26Å
236	V	88.5	Confident	86.8	Confident	69 Å²	69	60.5 Å²	60.5	42%	0.418	32%	0.323	S	S	.	.	H	α-helix	trans	-66.9	-43.1	174	170.9	0	0	0	0	110.3	M232 L233 E234 D238 Q239 L240	M232-V236 WeakPolarHBondContact O-CG2 3.37Å; M232-V236 PolarHBondContact O-N 3.42Å; L233-V236 PolarHBondContact O-N 2.91Å; E234-V236 VanDerWaalsContact C-N 3.35Å; E234-V236 PolarHBondContact O-N 3.48Å; V236-D238 PolarHBondContact O-N 3.46Å; V236-Q239 WeakPolarHBondContact O-CB 3.46Å; V236-Q239 PolarHBondContact O-N 2.96Å; V236-L240 HydrophobicContact CG1-CD1 3.86Å; V236-L240 HydrophobicContact CG1-CG 4.11Å; V236-L240 VanDerWaalsContact O-CG 3.29Å; V236-L240 WeakPolarHBondContact O-CG 3.46Å; V236-L240 PolarHBondContact O-N 3.33Å
237	A	87	Confident	86.2	Confident	4 Å²	4	60.4 Å²	60.4	3%	0.033	33%	0.332	C	S	.	.	H	α-helix	trans	-57.8	-48.7	177	0	0	0	0	0	111.8	F195 L233 E234 Q239 L240 I241 I250	F195-A237 HydrophobicContact CD2-CB 4.24Å; F195-A237 HydrophobicContact CE2-CB 3.57Å; F195-A237 HydrophobicContact CZ-CB 4.31Å; L233-A237 WeakPolarHBondContact O-CB 3.43Å; L233-A237 PolarHBondContact O-N 3.49Å; E234-A237 WeakPolarHBondContact O-CB 3.4Å; E234-A237 PolarHBondContact O-N 3.14Å; A237-Q239 PolarHBondContact O-N 3.4Å; A237-L240 PolarHBondContact O-N 3.47Å; A237-I241 WeakPolarHBondContact O-CG1 3.48Å; A237-I241 PolarHBondContact O-N 3.39Å; A237-I250 HydrophobicContact CB-CD1 4.47Å; A237-I250 HydrophobicContact CB-CG2 3.43Å; A237-I250 VanDerWaalsContact CB-CG2 3.43Å
238	D	85.2	Confident	85.4	Confident	97 Å²	97	65.3 Å²	65.3	52%	0.519	35%	0.353	S	S	.	.	H	α-helix	trans	-57.8	-38.8	177.3	-70.4	-20.6	0	0	0	111.7	E234 V236 S242	E234-D238 PolarHBondContact O-N 3.49Å; V236-D238 PolarHBondContact O-N 3.46Å; D238-S242 PolarHBondContact O-N 3.04Å; D238-S242 VanDerWaalsContact O-N 3.14Å
239	Q	87.9	Confident	84.8	Confident	115 Å²	115	68.3 Å²	68.3	54%	0.537	37%	0.368	S	S	.	.	H	α-helix	trans	-67.2	-43.2	173.8	-70.3	179.5	-0	0	0	112.3	A235 V236 A237 I241 S242 Y243	A235-Q239 WeakPolarHBondContact O-CG 3.41Å; A235-Q239 PolarHBondContact O-N 3.26Å; V236-Q239 WeakPolarHBondContact O-CB 3.46Å; V236-Q239 PolarHBondContact O-N 2.96Å; A237-Q239 PolarHBondContact O-N 3.4Å; Q239-I241 PolarHBondContact O-N 3.25Å; Q239-S242 WeakPolarHBondContact O-CB 3.31Å; Q239-S242 PolarHBondContact O-N 3.03Å; Q239-S242 VanDerWaalsContact O-N 3.14Å; Q239-S242 PolarHBondContact O-OG 3.46Å; Q239-Y243 WeakPolarHBondContact O-CD2 3.46Å; Q239-Y243 PolarHBondContact O-N 3.41Å; Q239-Y243 VanDerWaalsContact O-N 3.12Å
240	L	88	Confident	84.4	Confident	44 Å²	44	67.2 Å²	67.2	23%	0.23	36%	0.363	C	S	.	.	H	α-helix	trans	-64.5	-39.7	178.7	-67.3	176.5	0	0	0	111.7	V236 A237 S242 Y243 G244 I245 I250 I253	V236-L240 HydrophobicContact CG1-CD1 3.86Å; V236-L240 HydrophobicContact CG1-CG 4.11Å; V236-L240 VanDerWaalsContact O-CG 3.29Å; V236-L240 WeakPolarHBondContact O-CG 3.46Å; V236-L240 PolarHBondContact O-N 3.33Å; A237-L240 PolarHBondContact O-N 3.47Å; L240-S242 VanDerWaalsContact C-N 3.27Å; L240-S242 PolarHBondContact O-N 3.29Å; L240-Y243 CarbonylContact O-C 3.55Å; L240-Y243 PolarHBondContact O-N 3.1Å; L240-Y243 VanDerWaalsContact O-N 3.1Å; L240-G244 PolarHBondContact O-N 3.26Å; L240-I245 HydrophobicContact CB-CB 4.12Å; L240-I245 HydrophobicContact CB-CD1 3.68Å; L240-I245 HydrophobicContact CB-CG1 4.44Å; L240-I245 HydrophobicContact CB-CG2 4.39Å; L240-I245 HydrophobicContact CD1-CD1 4.31Å; L240-I245 HydrophobicContact CD2-CD1 3.4Å; L240-I245 VanDerWaalsContact CD2-CD1 3.4Å; L240-I245 HydrophobicContact CG-CD1 3.93Å; L240-I245 WeakPolarHBondContact O-CB 3.11Å; L240-I245 PolarHBondContact O-N 2.99Å; L240-I250 HydrophobicContact CB-CD1 4.05Å; L240-I250 HydrophobicContact CB-CG1 4.39Å; L240-I253 HydrophobicContact CD1-CD1 4.34Å
241	I	82.8	Confident	83.9	Confident	91 Å²	91	67.6 Å²	67.6	47%	0.467	37%	0.366	S	S	.	.	H	α-helix	trans	-58.7	-43.4	172.3	-64.4	172	0	0	0	109.7	A237 Q239 Y243 G244 I250	A237-I241 WeakPolarHBondContact O-CG1 3.48Å; A237-I241 PolarHBondContact O-N 3.39Å; Q239-I241 PolarHBondContact O-N 3.25Å; I241-Y243 PolarHBondContact O-N 3.21Å; I241-G244 PolarHBondContact O-N 2.76Å; I241-I250 HydrophobicContact CB-CD1 4.38Å; I241-I250 HydrophobicContact CD1-CD1 3.97Å; I241-I250 HydrophobicContact CG1-CD1 3.2Å
242	S	86	Confident	83.4	Confident	91 Å²	91	72.8 Å²	72.8	64%	0.636	39%	0.389	S	S	*	.	H	α-helix	trans	-63.3	-27.3	178.1	81.5	0	0	0	0	113.4	D238 Q239 L240 G244	D238-S242 PolarHBondContact O-N 3.04Å; D238-S242 VanDerWaalsContact O-N 3.14Å; Q239-S242 WeakPolarHBondContact O-CB 3.31Å; Q239-S242 PolarHBondContact O-N 3.03Å; Q239-S242 VanDerWaalsContact O-N 3.14Å; Q239-S242 PolarHBondContact O-OG 3.46Å; L240-S242 VanDerWaalsContact C-N 3.27Å; L240-S242 PolarHBondContact O-N 3.29Å; S242-G244 VanDerWaalsContact C-N 3.31Å
243	Y	87.5	Confident	83	Confident	190 Å²	190	73 Å²	73	75%	0.745	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	0.7	173.3	-67.8	-55.1	0	0	0	114	Q239 L240 I241	Q239-Y243 WeakPolarHBondContact O-CD2 3.46Å; Q239-Y243 PolarHBondContact O-N 3.41Å; Q239-Y243 VanDerWaalsContact O-N 3.12Å; L240-Y243 CarbonylContact O-C 3.55Å; L240-Y243 PolarHBondContact O-N 3.1Å; L240-Y243 VanDerWaalsContact O-N 3.1Å; I241-Y243 PolarHBondContact O-N 3.21Å
244	G	83.2	Confident	82.8	Confident	64 Å²	64	72 Å²	72	66%	0.66	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	13.8	176.4	0	0	0	0	0	115.3	L240 I241 S242	L240-G244 PolarHBondContact O-N 3.26Å; I241-G244 PolarHBondContact O-N 2.76Å; S242-G244 VanDerWaalsContact C-N 3.31Å
245	I	79.8	Confident	82.4	Confident	54 Å²	54	71.6 Å²	71.6	28%	0.277	39%	0.389	S	S	.	.			trans	-70.3	138.6	172.5	-72	167.2	0	0	0	109.6	L240 E249 I250	L240-I245 HydrophobicContact CB-CB 4.12Å; L240-I245 HydrophobicContact CB-CD1 3.68Å; L240-I245 HydrophobicContact CB-CG1 4.44Å; L240-I245 HydrophobicContact CB-CG2 4.39Å; L240-I245 HydrophobicContact CD1-CD1 4.31Å; L240-I245 HydrophobicContact CD2-CD1 3.4Å; L240-I245 VanDerWaalsContact CD2-CD1 3.4Å; L240-I245 HydrophobicContact CG-CD1 3.93Å; L240-I245 WeakPolarHBondContact O-CB 3.11Å; L240-I245 PolarHBondContact O-N 2.99Å; I245-E249 HydrophobicContact CG2-CB 3.99Å; I245-E249 WeakPolarHBondContact CG2-OE2 3.37Å; I245-I250 HydrophobicContact CG2-CD1 4.11Å; I245-I250 HydrophobicContact CG2-CG1 3.79Å
246	K	79.8	Confident	82	Confident	125 Å²	125	73 Å²	73	54%	0.543	39%	0.388	S	S	.	.			trans	-70	142.8	-178.2	-66.2	-177.2	177.4	-172.3	0	110.7	K248 E249 I250	K246-K248 PolarHBondContact O-N 3.23Å; K246-K248 VanDerWaalsContact O-N 3.12Å; K246-E249 HydrophobicContact CB-CG 4.43Å; K246-E249 PolarHBondContact O-N 2.65Å; K246-I250 PolarHBondContact O-N 3.35Å
247	S	74.6	Confident	81.6	Confident	79 Å²	79	74.6 Å²	74.6	55%	0.552	39%	0.39	S	S	*	.	H	α-helix	trans	-54.6	-33.7	177.7	53.2	0	0	0	0	113.2	I250 D251	S247-I250 WeakPolarHBondContact O-CB 3.38Å; S247-I250 PolarHBondContact O-N 3.21Å; S247-D251 PolarHBondContact O-N 2.97Å
248	K	71.9	Confident	81.3	Confident	103 Å²	103	75.3 Å²	75.3	45%	0.448	39%	0.393	S	S	.	.	H	α-helix	trans	-60.8	-43.7	175.5	-176.8	178.5	-178.2	172.1	0	113.6	E121 K246 I250 D251 E252	E121-K248 IonicContact OE2-NZ 3.26Å; E121-K248 PolarHBondContact OE2-NZ 3.43Å; K246-K248 PolarHBondContact O-N 3.23Å; K246-K248 VanDerWaalsContact O-N 3.12Å; K248-I250 VanDerWaalsContact C-N 3.26Å; K248-I250 PolarHBondContact O-N 2.9Å; K248-D251 PolarHBondContact O-N 3.16Å; K248-E252 WeakPolarHBondContact O-CG 3.44Å; K248-E252 PolarHBondContact O-N 2.91Å
249	E	76.6	Confident	80.9	Confident	93 Å²	93	74.8 Å²	74.8	44%	0.435	39%	0.39	S	S	.	.	H	α-helix	trans	-67.2	-34.1	-180	-65.9	173.4	175.3	0	0	110.6	I245 K246 E252 I253	I245-E249 HydrophobicContact CG2-CB 3.99Å; I245-E249 WeakPolarHBondContact CG2-OE2 3.37Å; K246-E249 HydrophobicContact CB-CG 4.43Å; K246-E249 PolarHBondContact O-N 2.65Å; E249-E252 PolarHBondContact O-N 3.37Å; E249-I253 VanDerWaalsContact O-CG1 3.32Å; E249-I253 WeakPolarHBondContact O-CG1 3.11Å; E249-I253 PolarHBondContact O-N 2.85Å
250	I	79.6	Confident	80.3	Confident	9 Å²	9	71.8 Å²	71.8	5%	0.046	38%	0.38	C	S	.	.	H	α-helix	trans	-69	-42.9	175	-67.3	172.8	0	0	0	111.2	F195 A237 L240 I241 I245 K246 S247 K248 E252 I253 R254	F195-I250 HydrophobicContact CE2-CG2 4.04Å; A237-I250 HydrophobicContact CB-CD1 4.47Å; A237-I250 HydrophobicContact CB-CG2 3.43Å; A237-I250 VanDerWaalsContact CB-CG2 3.43Å; L240-I250 HydrophobicContact CB-CD1 4.05Å; L240-I250 HydrophobicContact CB-CG1 4.39Å; I241-I250 HydrophobicContact CB-CD1 4.38Å; I241-I250 HydrophobicContact CD1-CD1 3.97Å; I241-I250 HydrophobicContact CG1-CD1 3.2Å; I245-I250 HydrophobicContact CG2-CD1 4.11Å; I245-I250 HydrophobicContact CG2-CG1 3.79Å; K246-I250 PolarHBondContact O-N 3.35Å; S247-I250 WeakPolarHBondContact O-CB 3.38Å; S247-I250 PolarHBondContact O-N 3.21Å; K248-I250 VanDerWaalsContact C-N 3.26Å; K248-I250 PolarHBondContact O-N 2.9Å; I250-E252 VanDerWaalsContact C-N 3.26Å; I250-E252 PolarHBondContact O-N 2.85Å; I250-I253 PolarHBondContact O-N 3.46Å; I250-R254 VanDerWaalsContact O-CB 3.23Å; I250-R254 WeakPolarHBondContact O-CB 3.42Å; I250-R254 PolarHBondContact O-N 2.98Å
251	D	78.9	Confident	79.9	Confident	22 Å²	22	74.4 Å²	74.4	12%	0.118	39%	0.394	C	S	.	.	H	α-helix	trans	-59.5	-38.8	174.2	-82	-20.5	0	0	0	111	K120 S198 S247 K248 R254 G255	K120-D251 IonicContact NZ-OD2 3.33Å; K120-D251 PolarHBondContact NZ-OD2 3.02Å; S198-D251 PolarHBondContact OG-OD2 3.36Å; S198-D251 VanDerWaalsContact OG-OD2 3.14Å; S247-D251 PolarHBondContact O-N 2.97Å; K248-D251 PolarHBondContact O-N 3.16Å; D251-R254 IonicContact OD1-NH1 3.93Å; D251-G255 PolarHBondContact O-N 2.89Å
252	E	79.3	Confident	79.6	Confident	114 Å²	114	75.3 Å²	75.3	53%	0.533	40%	0.399	S	S	.	.	H	α-helix	trans	-65	-50.8	174.1	-72.3	174.4	-164.4	0	0	112.2	K248 E249 I250 R254 G255 I256	K248-E252 WeakPolarHBondContact O-CG 3.44Å; K248-E252 PolarHBondContact O-N 2.91Å; E249-E252 PolarHBondContact O-N 3.37Å; I250-E252 VanDerWaalsContact C-N 3.26Å; I250-E252 PolarHBondContact O-N 2.85Å; E252-R254 PolarHBondContact O-N 3.02Å; E252-G255 PolarHBondContact O-N 3.49Å; E252-I256 VanDerWaalsContact O-CG1 3.26Å; E252-I256 WeakPolarHBondContact O-CG1 3.41Å; E252-I256 PolarHBondContact O-N 3.17Å
253	I	80.7	Confident	79.3	Confident	69 Å²	69	80 Å²	80	35%	0.354	40%	0.404	S	S	.	.	H	α-helix	trans	-55.3	-46.1	176.6	-70.7	166.3	0	0	0	110	L240 E249 I250 I256 F257	L240-I253 HydrophobicContact CD1-CD1 4.34Å; E249-I253 VanDerWaalsContact O-CG1 3.32Å; E249-I253 WeakPolarHBondContact O-CG1 3.11Å; E249-I253 PolarHBondContact O-N 2.85Å; I250-I253 PolarHBondContact O-N 3.46Å; I253-I256 WeakPolarHBondContact O-CB 3.48Å; I253-I256 PolarHBondContact O-N 3.47Å; I253-F257 HydrophobicContact CG2-CD2 4.05Å; I253-F257 HydrophobicContact CG2-CE2 4.16Å; I253-F257 VanDerWaalsContact O-CD2 3.29Å; I253-F257 WeakPolarHBondContact O-CD2 3.47Å; I253-F257 PolarHBondContact O-N 3.29Å
254	R	84.2	Confident	78.9	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.008	40%	0.395	C	S	.	.	H	α-helix	trans	-62.7	-47.7	179.6	-177.5	-169.6	142.5	-128.6	-14.4	112	F195 Q196 I250 D251 E252 I256 F257 L258	F195-R254 VanDerWaalsContact CD1-CD 3.48Å; F195-R254 HydrophobicContact CD1-CG 4.26Å; F195-R254 VanDerWaalsContact CE1-CD 3.41Å; F195-R254 HydrophobicContact CE1-CG 3.68Å; F195-R254 HydrophobicContact CE2-CB 4.1Å; F195-R254 HydrophobicContact CE2-CG 4.02Å; F195-R254 HydrophobicContact CZ-CB 3.91Å; F195-R254 VanDerWaalsContact CZ-CD 3.43Å; F195-R254 HydrophobicContact CZ-CG 3.53Å; F195-R254 PolarHBondContact O-NE 3.08Å; F195-R254 PolarHBondContact O-NH1 3.4Å; F195-R254 PolarHBondContact O-NH2 2.85Å; Q196-R254 VanDerWaalsContact CA-NH2 3.25Å; Q196-R254 VanDerWaalsContact N-NH1 3.11Å; Q196-R254 PolarHBondContact O-NH1 3.26Å; I250-R254 VanDerWaalsContact O-CB 3.23Å; I250-R254 WeakPolarHBondContact O-CB 3.42Å; I250-R254 PolarHBondContact O-N 2.98Å; D251-R254 IonicContact OD1-NH1 3.93Å; E252-R254 PolarHBondContact O-N 3.02Å; R254-I256 PolarHBondContact O-N 2.89Å; R254-F257 PolarHBondContact O-N 2.92Å; R254-F257 VanDerWaalsContact O-N 3.11Å; R254-L258 HydrophobicContact CG-CD1 3.45Å; R254-L258 VanDerWaalsContact CG-CD1 3.45Å; R254-L258 HydrophobicContact CG-CG 4.11Å; R254-L258 WeakPolarHBondContact O-CB 3.17Å; R254-L258 PolarHBondContact O-N 2.75Å
255	G	81.1	Confident	78.7	Confident	18 Å²	18	74.5 Å²	74.5	19%	0.186	37%	0.372	C	S	.	.	H	α-helix	trans	-58.2	-36.9	178.6	0	0	0	0	0	112.2	D251 E252 D259 T260	D251-G255 PolarHBondContact O-N 2.89Å; E252-G255 PolarHBondContact O-N 3.49Å; G255-D259 WeakPolarHBondContact O-CB 3.48Å; G255-D259 PolarHBondContact O-N 3.47Å; G255-D259 VanDerWaalsContact O-N 3.16Å; G255-T260 PolarHBondContact O-N 3.41Å; G255-T260 PolarHBondContact O-OG1 3.47Å
256	I	79.6	Confident	78.7	Confident	80 Å²	80	77.4 Å²	77.4	41%	0.41	39%	0.388	S	S	.	.	H	α-helix	trans	-62	-43.2	175.1	-68.4	166.3	0	0	0	111.7	E252 I253 R254 T260 L265	E252-I256 VanDerWaalsContact O-CG1 3.26Å; E252-I256 WeakPolarHBondContact O-CG1 3.41Å; E252-I256 PolarHBondContact O-N 3.17Å; I253-I256 WeakPolarHBondContact O-CB 3.48Å; I253-I256 PolarHBondContact O-N 3.47Å; R254-I256 PolarHBondContact O-N 2.89Å; I256-T260 VanDerWaalsContact O-CB 3.24Å; I256-T260 WeakPolarHBondContact O-CB 3.27Å; I256-T260 PolarHBondContact O-OG1 3.17Å; I256-L265 HydrophobicContact CG2-CD1 3.44Å; I256-L265 VanDerWaalsContact CG2-CD1 3.44Å; I256-L265 HydrophobicContact CG2-CD2 4.15Å; I256-L265 HydrophobicContact CG2-CG 4.44Å
257	F	79.8	Confident	78.6	Confident	102 Å²	102	74.7 Å²	74.7	45%	0.447	38%	0.382	S	S	.	.	H	α-helix	trans	-88.2	-30.8	-175.7	-78.1	-76.6	0	0	0	115	L233 I253 R254 L265	L233-F257 HydrophobicContact CD1-CB 3.61Å; L233-F257 HydrophobicContact CD1-CG 4.33Å; L233-F257 HydrophobicContact CD2-CD2 4.22Å; L233-F257 HydrophobicContact CD2-CG 4.45Å; I253-F257 HydrophobicContact CG2-CD2 4.05Å; I253-F257 HydrophobicContact CG2-CE2 4.16Å; I253-F257 VanDerWaalsContact O-CD2 3.29Å; I253-F257 WeakPolarHBondContact O-CD2 3.47Å; I253-F257 PolarHBondContact O-N 3.29Å; R254-F257 PolarHBondContact O-N 2.92Å; R254-F257 VanDerWaalsContact O-N 3.11Å; F257-L265 HydrophobicContact CD1-CD2 4.17Å; F257-L265 HydrophobicContact CE1-CD2 4.28Å
258	L	81	Confident	78.9	Confident	19 Å²	19	73 Å²	73	10%	0.099	37%	0.368	C	S	.	.	H	α-helix	trans	-103.7	-36.6	-170.9	-65.6	-177.2	0	0	0	114.2	F195 L229 R230 L233 R254	F195-L258 HydrophobicContact CE1-CD1 4.07Å; L229-L258 HydrophobicContact CD2-CD2 4.01Å; L229-L258 HydrophobicContact CG-CD2 4.05Å; R230-L258 HydrophobicContact CG-CD1 3.65Å; R230-L258 HydrophobicContact CG-CD2 3.47Å; R230-L258 VanDerWaalsContact CG-CD2 3.47Å; R230-L258 HydrophobicContact CG-CG 4.22Å; L233-L258 HydrophobicContact CD1-CD1 4.29Å; L233-L258 HydrophobicContact CD1-CD2 3.81Å; L233-L258 HydrophobicContact CD1-CG 3.78Å; R254-L258 HydrophobicContact CG-CD1 3.45Å; R254-L258 VanDerWaalsContact CG-CD1 3.45Å; R254-L258 HydrophobicContact CG-CG 4.11Å; R254-L258 WeakPolarHBondContact O-CB 3.17Å; R254-L258 PolarHBondContact O-N 2.75Å
259	D	76.9	Confident	79.3	Confident	87 Å²	87	73 Å²	73	47%	0.465	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-18.9	-172.9	-56.9	-28.4	0	0	0	111.2	G255	G255-D259 WeakPolarHBondContact O-CB 3.48Å; G255-D259 PolarHBondContact O-N 3.47Å; G255-D259 VanDerWaalsContact O-N 3.16Å
260	T	75.7	Confident	79.6	Confident	51 Å²	51	74.5 Å²	74.5	31%	0.313	38%	0.377	S	S	.	.	S	Bend	trans	-89.5	140.3	176.8	-50.4	0	0	0	0	111.3	G255 I256 L262 L264 L265	G255-T260 PolarHBondContact O-N 3.41Å; G255-T260 PolarHBondContact O-OG1 3.47Å; I256-T260 VanDerWaalsContact O-CB 3.24Å; I256-T260 WeakPolarHBondContact O-CB 3.27Å; I256-T260 PolarHBondContact O-OG1 3.17Å; T260-L262 PolarHBondContact O-N 2.97Å; T260-L264 HydrophobicContact CG2-CB 4.27Å; T260-L264 HydrophobicContact CG2-CD2 4.07Å; T260-L264 HydrophobicContact CG2-CG 4.42Å; T260-L265 HydrophobicContact CG2-CB 4.38Å
261	N	79.7	Confident	79.5	Confident	100 Å²	100	74.2 Å²	74.2	54%	0.535	38%	0.376	S	S	.	.			trans	-63	126.8	171.5	-172.8	-37.7	0	0	0	110.1	Y263 L264 L265	N261-Y263 PolarHBondContact O-N 3.3Å; N261-Y263 VanDerWaalsContact O-N 3.11Å; N261-Y263 WeakPolarHBondContact OD1-CB 3.33Å; N261-Y263 VanDerWaalsContact OD1-CD2 3.29Å; N261-Y263 WeakPolarHBondContact OD1-CD2 3.17Å; N261-Y263 PolarHBondContact OD1-N 3.48Å; N261-L264 HydrophobicContact CB-CB 4.32Å; N261-L264 WeakPolarHBondContact O-CA 3.42Å; N261-L264 WeakPolarHBondContact O-CB 3.23Å; N261-L264 PolarHBondContact O-N 3.12Å; N261-L265 PolarHBondContact O-N 3.47Å
262	L	75.7	Confident	79.7	Confident	109 Å²	109	74.6 Å²	74.6	57%	0.571	38%	0.381	S	S	*	.	H	α-helix	trans	-52.8	-35.6	-179.3	-175	64.9	0	0	0	113	T260 L265 L266	T260-L262 PolarHBondContact O-N 2.97Å; L262-L265 PolarHBondContact O-N 3.38Å; L262-L266 WeakPolarHBondContact O-CB 3.45Å; L262-L266 PolarHBondContact O-N 3.3Å
263	Y	78.9	Confident	79.9	Confident	189 Å²	189	73.9 Å²	73.9	74%	0.741	38%	0.38	S	S	*	.	H	α-helix	trans	-65.7	-39.2	176.5	-67.3	-71.8	0	0	0	112.3	N261 T267	N261-Y263 PolarHBondContact O-N 3.3Å; N261-Y263 VanDerWaalsContact O-N 3.11Å; N261-Y263 WeakPolarHBondContact OD1-CB 3.33Å; N261-Y263 VanDerWaalsContact OD1-CD2 3.29Å; N261-Y263 WeakPolarHBondContact OD1-CD2 3.17Å; N261-Y263 PolarHBondContact OD1-N 3.48Å; Y263-T267 WeakPolarHBondContact O-CB 3.07Å; Y263-T267 PolarHBondContact O-N 3.35Å; Y263-T267 VanDerWaalsContact O-N 3.12Å; Y263-T267 PolarHBondContact O-OG1 2.92Å
264	L	80	Confident	79.9	Confident	104 Å²	104	74.1 Å²	74.1	55%	0.545	38%	0.378	S	S	.	.	H	α-helix	trans	-67.5	-44.7	176.1	-174.7	66.5	0	0	0	110.2	T260 N261 T267 T268	T260-L264 HydrophobicContact CG2-CB 4.27Å; T260-L264 HydrophobicContact CG2-CD2 4.07Å; T260-L264 HydrophobicContact CG2-CG 4.42Å; N261-L264 HydrophobicContact CB-CB 4.32Å; N261-L264 WeakPolarHBondContact O-CA 3.42Å; N261-L264 WeakPolarHBondContact O-CB 3.23Å; N261-L264 PolarHBondContact O-N 3.12Å; L264-T267 WeakPolarHBondContact O-CB 2.94Å; L264-T267 PolarHBondContact O-N 3.4Å; L264-T268 WeakPolarHBondContact O-CG2 3.33Å; L264-T268 PolarHBondContact O-N 3.27Å; L264-T268 PolarHBondContact O-OG1 3.02Å
265	L	79.9	Confident	79.7	Confident	35 Å²	35	74.6 Å²	74.6	18%	0.183	38%	0.38	C	S	.	.	H	α-helix	trans	-61	-45.9	178.3	-179.1	62.5	0	0	0	112.7	I256 F257 T260 N261 L262 T267 T268 L269	I256-L265 HydrophobicContact CG2-CD1 3.44Å; I256-L265 VanDerWaalsContact CG2-CD1 3.44Å; I256-L265 HydrophobicContact CG2-CD2 4.15Å; I256-L265 HydrophobicContact CG2-CG 4.44Å; F257-L265 HydrophobicContact CD1-CD2 4.17Å; F257-L265 HydrophobicContact CE1-CD2 4.28Å; T260-L265 HydrophobicContact CG2-CB 4.38Å; N261-L265 PolarHBondContact O-N 3.47Å; L262-L265 PolarHBondContact O-N 3.38Å; L265-T267 VanDerWaalsContact C-N 3.27Å; L265-T267 PolarHBondContact O-N 3.06Å; L265-T268 WeakPolarHBondContact CA-OG1 3.17Å; L265-T268 PolarHBondContact O-N 3.47Å; L265-T268 PolarHBondContact O-OG1 2.95Å; L265-L269 WeakPolarHBondContact O-CB 3.28Å; L265-L269 PolarHBondContact O-N 3.17Å
266	L	79.2	Confident	79.9	Confident	116 Å²	116	78 Å²	78	61%	0.607	39%	0.394	S	S	*	.	H	α-helix	trans	-64.1	-39	178.6	-174.9	65.4	0	0	0	111	L262 L269 F270	L262-L266 WeakPolarHBondContact O-CB 3.45Å; L262-L266 PolarHBondContact O-N 3.3Å; L266-L269 PolarHBondContact O-N 3.03Å; L266-F270 WeakPolarHBondContact O-CB 3.28Å; L266-F270 PolarHBondContact O-N 2.83Å
267	T	77.7	Confident	80	Confident	68 Å²	68	78.2 Å²	78.2	42%	0.417	40%	0.395	S	S	.	.	H	α-helix	trans	-63.6	-49.1	176.3	-57.5	0	0	0	0	110.7	Y263 L264 L265 L269 F270 V271	Y263-T267 WeakPolarHBondContact O-CB 3.07Å; Y263-T267 PolarHBondContact O-N 3.35Å; Y263-T267 VanDerWaalsContact O-N 3.12Å; Y263-T267 PolarHBondContact O-OG1 2.92Å; L264-T267 WeakPolarHBondContact O-CB 2.94Å; L264-T267 PolarHBondContact O-N 3.4Å; L265-T267 VanDerWaalsContact C-N 3.27Å; L265-T267 PolarHBondContact O-N 3.06Å; T267-L269 VanDerWaalsContact C-N 3.32Å; T267-L269 PolarHBondContact O-N 3.26Å; T267-F270 PolarHBondContact O-N 2.94Å; T267-V271 HydrophobicContact CG2-CG2 4.03Å; T267-V271 VanDerWaalsContact O-CB 3.29Å; T267-V271 WeakPolarHBondContact O-CB 3.46Å; T267-V271 WeakPolarHBondContact O-CG2 3.42Å; T267-V271 PolarHBondContact O-N 3.12Å
268	T	79.5	Confident	80	Confident	43 Å²	43	76.7 Å²	76.7	26%	0.264	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-39	178.9	56.4	0	0	0	0	112.1	L264 L265 S272 I460	L264-T268 WeakPolarHBondContact O-CG2 3.33Å; L264-T268 PolarHBondContact O-N 3.27Å; L264-T268 PolarHBondContact O-OG1 3.02Å; L265-T268 WeakPolarHBondContact CA-OG1 3.17Å; L265-T268 PolarHBondContact O-N 3.47Å; L265-T268 PolarHBondContact O-OG1 2.95Å; T268-S272 WeakPolarHBondContact O-CB 2.99Å; T268-S272 PolarHBondContact O-N 3.41Å; T268-S272 PolarHBondContact O-OG 2.9Å; T268-I460 HydrophobicContact CG2-CG2 3.88Å
269	L	82	Confident	80	Confident	102 Å²	102	76.8 Å²	76.8	53%	0.534	39%	0.391	S	S	.	.	H	α-helix	trans	-61.7	-50.5	174.7	178.2	64.6	0	0	0	111.7	L265 L266 T267 V271 S272 I273	L265-L269 WeakPolarHBondContact O-CB 3.28Å; L265-L269 PolarHBondContact O-N 3.17Å; L266-L269 PolarHBondContact O-N 3.03Å; T267-L269 VanDerWaalsContact C-N 3.32Å; T267-L269 PolarHBondContact O-N 3.26Å; L269-V271 PolarHBondContact O-N 3.01Å; L269-S272 WeakPolarHBondContact O-CB 3.37Å; L269-S272 PolarHBondContact O-N 2.89Å; L269-I273 HydrophobicContact CD1-CD1 4.48Å; L269-I273 HydrophobicContact CG-CD1 4.34Å; L269-I273 WeakPolarHBondContact O-CG1 3.49Å; L269-I273 PolarHBondContact O-N 2.91Å; L269-I273 VanDerWaalsContact O-N 3.09Å
270	F	81.1	Confident	80.4	Confident	125 Å²	125	78.9 Å²	78.9	55%	0.548	40%	0.396	S	S	.	.	H	α-helix	trans	-59.5	-48.2	179.4	-175.1	-96.3	0	0	0	111.1	L266 T267 S272 I273 F274	L266-F270 WeakPolarHBondContact O-CB 3.28Å; L266-F270 PolarHBondContact O-N 2.83Å; T267-F270 PolarHBondContact O-N 2.94Å; F270-S272 VanDerWaalsContact C-N 3.29Å; F270-S272 PolarHBondContact O-N 3.25Å; F270-I273 PolarHBondContact O-N 2.86Å; F270-F274 AromaticContact CD1-CD2 3.83Å; F270-F274 HydrophobicContact CD1-CD2 3.83Å; F270-F274 AromaticContact CD1-CE2 3.97Å; F270-F274 HydrophobicContact CD1-CE2 3.97Å; F270-F274 HydrophobicContact CD2-CD2 4.42Å; F270-F274 HydrophobicContact CD2-CE2 4.02Å; F270-F274 AromaticContact CE1-CD2 3.59Å; F270-F274 HydrophobicContact CE1-CD2 3.59Å; F270-F274 AromaticContact CE1-CE2 3.37Å; F270-F274 HydrophobicContact CE1-CE2 3.37Å; F270-F274 HydrophobicContact CE1-CZ 4.24Å; F270-F274 HydrophobicContact CE2-CD2 4.23Å; F270-F274 AromaticContact CE2-CE2 3.45Å; F270-F274 HydrophobicContact CE2-CE2 3.45Å; F270-F274 VanDerWaalsContact CE2-CE2 3.45Å; F270-F274 HydrophobicContact CE2-CZ 4.33Å; F270-F274 HydrophobicContact CG-CD2 4.26Å; F270-F274 HydrophobicContact CG-CE2 4.28Å; F270-F274 AromaticContact CZ-CD2 3.83Å; F270-F274 HydrophobicContact CZ-CD2 3.83Å; F270-F274 AromaticContact CZ-CE2 3.1Å; F270-F274 HydrophobicContact CZ-CE2 3.1Å; F270-F274 AromaticContact CZ-CZ 3.8Å; F270-F274 HydrophobicContact CZ-CZ 3.8Å; F270-F274 WeakPolarHBondContact O-CD2 3.25Å; F270-F274 PolarHBondContact O-N 3.35Å; F270-F274 VanDerWaalsContact O-N 3.12Å
271	V	79.4	Confident	80.6	Confident	3 Å²	3	80.5 Å²	80.5	2%	0.018	40%	0.402	C	S	.	.	H	α-helix	trans	-56.2	-43.9	176.2	172.4	0	0	0	0	111	T267 L269 I273 F274 H275 F456 F457 I460 I461	T267-V271 HydrophobicContact CG2-CG2 4.03Å; T267-V271 VanDerWaalsContact O-CB 3.29Å; T267-V271 WeakPolarHBondContact O-CB 3.46Å; T267-V271 WeakPolarHBondContact O-CG2 3.42Å; T267-V271 PolarHBondContact O-N 3.12Å; L269-V271 PolarHBondContact O-N 3.01Å; V271-I273 PolarHBondContact O-N 3.5Å; V271-F274 PolarHBondContact O-N 3.38Å; V271-H275 PolarHBondContact O-N 2.68Å; V271-F456 HydrophobicContact CG1-CE1 4.46Å; V271-F456 HydrophobicContact CG2-CE1 3.74Å; V271-F456 HydrophobicContact CG2-CZ 4.29Å; V271-F457 HydrophobicContact CB-CE1 4.42Å; V271-F457 HydrophobicContact CG1-CD1 3.32Å; V271-F457 HydrophobicContact CG1-CE1 3.38Å; V271-F457 WeakPolarHBondContact O-CE1 3.46Å; V271-I460 HydrophobicContact CB-CD1 4.43Å; V271-I460 HydrophobicContact CB-CG2 4.45Å; V271-I460 HydrophobicContact CG1-CB 4.29Å; V271-I460 HydrophobicContact CG1-CD1 4.02Å; V271-I460 HydrophobicContact CG1-CG2 4.05Å; V271-I460 HydrophobicContact CG2-CD1 3.55Å; V271-I460 HydrophobicContact CG2-CG2 4.36Å; V271-I461 HydrophobicContact CG1-CD1 4.43Å
272	S	81.4	Confident	80.6	Confident	31 Å²	31	77.8 Å²	77.8	22%	0.217	39%	0.394	C	S	.	.	H	α-helix	trans	-62.4	-40.5	178.6	-58	0	0	0	0	112.6	T268 L269 F270 H275 L276 L326	T268-S272 WeakPolarHBondContact O-CB 2.99Å; T268-S272 PolarHBondContact O-N 3.41Å; T268-S272 PolarHBondContact O-OG 2.9Å; L269-S272 WeakPolarHBondContact O-CB 3.37Å; L269-S272 PolarHBondContact O-N 2.89Å; F270-S272 VanDerWaalsContact C-N 3.29Å; F270-S272 PolarHBondContact O-N 3.25Å; S272-H275 WeakPolarHBondContact O-CB 3.12Å; S272-H275 PolarHBondContact O-N 3.34Å; S272-L276 WeakPolarHBondContact O-CG 3.47Å; S272-L276 PolarHBondContact O-N 3.19Å; S272-L326 VanDerWaalsContact OG-CD2 3.31Å; S272-L326 WeakPolarHBondContact OG-CD2 3.06Å
273	I	84.8	Confident	81	Confident	99 Å²	99	74.2 Å²	74.2	51%	0.508	37%	0.374	S	S	.	.	H	α-helix	trans	-63.3	-45.9	176.8	-67.1	166.6	0	0	0	110.4	L269 F270 V271 L276 L277	L269-I273 HydrophobicContact CD1-CD1 4.48Å; L269-I273 HydrophobicContact CG-CD1 4.34Å; L269-I273 WeakPolarHBondContact O-CG1 3.49Å; L269-I273 PolarHBondContact O-N 2.91Å; L269-I273 VanDerWaalsContact O-N 3.09Å; F270-I273 PolarHBondContact O-N 2.86Å; V271-I273 PolarHBondContact O-N 3.5Å; I273-L276 PolarHBondContact O-N 2.77Å; I273-L277 WeakPolarHBondContact O-CB 3.35Å; I273-L277 PolarHBondContact O-N 3.38Å
274	F	81.3	Confident	81.2	Confident	74 Å²	74	71.5 Å²	71.5	33%	0.325	37%	0.366	S	S	.	.	H	α-helix	trans	-66	-37.2	177.3	-83.8	-85.3	0	0	0	112.3	F270 V271 L277 F278	F270-F274 AromaticContact CD1-CD2 3.83Å; F270-F274 HydrophobicContact CD1-CD2 3.83Å; F270-F274 AromaticContact CD1-CE2 3.97Å; F270-F274 HydrophobicContact CD1-CE2 3.97Å; F270-F274 HydrophobicContact CD2-CD2 4.42Å; F270-F274 HydrophobicContact CD2-CE2 4.02Å; F270-F274 AromaticContact CE1-CD2 3.59Å; F270-F274 HydrophobicContact CE1-CD2 3.59Å; F270-F274 AromaticContact CE1-CE2 3.37Å; F270-F274 HydrophobicContact CE1-CE2 3.37Å; F270-F274 HydrophobicContact CE1-CZ 4.24Å; F270-F274 HydrophobicContact CE2-CD2 4.23Å; F270-F274 AromaticContact CE2-CE2 3.45Å; F270-F274 HydrophobicContact CE2-CE2 3.45Å; F270-F274 VanDerWaalsContact CE2-CE2 3.45Å; F270-F274 HydrophobicContact CE2-CZ 4.33Å; F270-F274 HydrophobicContact CG-CD2 4.26Å; F270-F274 HydrophobicContact CG-CE2 4.28Å; F270-F274 AromaticContact CZ-CD2 3.83Å; F270-F274 HydrophobicContact CZ-CD2 3.83Å; F270-F274 AromaticContact CZ-CE2 3.1Å; F270-F274 HydrophobicContact CZ-CE2 3.1Å; F270-F274 AromaticContact CZ-CZ 3.8Å; F270-F274 HydrophobicContact CZ-CZ 3.8Å; F270-F274 WeakPolarHBondContact O-CD2 3.25Å; F270-F274 PolarHBondContact O-N 3.35Å; F270-F274 VanDerWaalsContact O-N 3.12Å; V271-F274 PolarHBondContact O-N 3.38Å; F274-L277 HydrophobicContact CD1-CD2 4.48Å; F274-L277 PolarHBondContact O-N 2.92Å; F274-F278 HydrophobicContact CB-CD2 4.29Å; F274-F278 HydrophobicContact CB-CE2 4.05Å; F274-F278 AromaticContact CD1-CE2 3.7Å; F274-F278 HydrophobicContact CD1-CE2 3.7Å; F274-F278 AromaticContact CD1-CZ 3.77Å; F274-F278 HydrophobicContact CD1-CZ 3.77Å; F274-F278 HydrophobicContact CE1-CZ 4.42Å; F274-F278 HydrophobicContact CG-CE2 4.34Å; F274-F278 WeakPolarHBondContact O-CB 3.34Å; F274-F278 WeakPolarHBondContact O-CD2 3.28Å; F274-F278 WeakPolarHBondContact O-CG 3.35Å; F274-F278 PolarHBondContact O-N 3.3Å
275	H	80	Confident	81.1	Confident	12 Å²	12	70.3 Å²	70.3	6%	0.056	36%	0.36	C	S	.	.	H	α-helix	trans	-56.1	-55.4	173.9	-174.4	76.2	0	0	0	110.8	V271 S272 L277 F278 S279 L326 F457	V271-H275 PolarHBondContact O-N 2.68Å; S272-H275 WeakPolarHBondContact O-CB 3.12Å; S272-H275 PolarHBondContact O-N 3.34Å; H275-L277 VanDerWaalsContact C-N 3.32Å; H275-L277 PolarHBondContact O-N 3.09Å; H275-F278 PolarHBondContact O-N 2.93Å; H275-S279 WeakPolarHBondContact O-CB 3.5Å; H275-S279 PolarHBondContact O-N 2.91Å; H275-S279 PolarHBondContact O-OG 3.11Å; H275-L326 HydrophobicContact CB-CD1 4.45Å; H275-L326 PolarHBondContact CD2-O 3.36Å; H275-L326 PolarHBondContact NE2-O 3.35Å; H275-F457 VanDerWaalsContact CA-CE2 3.44Å; H275-F457 HydrophobicContact CB-CD1 4.34Å; H275-F457 HydrophobicContact CB-CD2 4.18Å; H275-F457 HydrophobicContact CB-CE1 3.8Å; H275-F457 HydrophobicContact CB-CE2 3.49Å; H275-F457 VanDerWaalsContact CB-CE2 3.49Å; H275-F457 HydrophobicContact CB-CZ 3.34Å; H275-F457 AromaticContact CE1-CD2 3.8Å; H275-F457 AromaticContact CG-CD2 3.89Å; H275-F457 AromaticContact CG-CE2 3.56Å; H275-F457 AromaticContact CG-CZ 3.97Å; H275-F457 VanDerWaalsContact N-CZ 3.32Å; H275-F457 AromaticContact ND1-CD2 2.92Å; H275-F457 WeakPolarHBondContact ND1-CD2 3.42Å; H275-F457 AromaticContact ND1-CE2 2.91Å; H275-F457 WeakPolarHBondContact ND1-CE2 3.37Å; H275-F457 AromaticContact ND1-CG 3.64Å; H275-F457 AromaticContact ND1-CZ 3.75Å
276	L	83.5	Confident	81.2	Confident	88 Å²	88	70.8 Å²	70.8	46%	0.461	36%	0.363	S	S	.	.	H	α-helix	trans	-60.2	-41.8	-179.9	-68.7	173.2	0	0	0	112.4	S272 I273 F280 L326 P330	S272-L276 WeakPolarHBondContact O-CG 3.47Å; S272-L276 PolarHBondContact O-N 3.19Å; I273-L276 PolarHBondContact O-N 2.77Å; L276-F280 VanDerWaalsContact O-CB 3.26Å; L276-F280 WeakPolarHBondContact O-CB 3.27Å; L276-F280 PolarHBondContact O-N 3.35Å; L276-L326 HydrophobicContact CD1-CD1 3.93Å; L276-L326 HydrophobicContact CD2-CD1 3.69Å; L276-L326 HydrophobicContact CG-CD1 3.53Å; L276-P330 HydrophobicContact CD2-CG 4.44Å
277	L	83.3	Confident	81.4	Confident	86 Å²	86	68 Å²	68	45%	0.45	35%	0.348	S	S	.	.	H	α-helix	trans	-59.9	-49.2	177.8	-175.2	80.7	0	0	0	111.2	I273 F274 H275 F280 L281	I273-L277 WeakPolarHBondContact O-CB 3.35Å; I273-L277 PolarHBondContact O-N 3.38Å; F274-L277 HydrophobicContact CD1-CD2 4.48Å; F274-L277 PolarHBondContact O-N 2.92Å; H275-L277 VanDerWaalsContact C-N 3.32Å; H275-L277 PolarHBondContact O-N 3.09Å; L277-F280 PolarHBondContact O-N 3.3Å; L277-L281 HydrophobicContact CG-CD1 4.28Å; L277-L281 VanDerWaalsContact O-CG 3.31Å; L277-L281 WeakPolarHBondContact O-CG 3.49Å; L277-L281 PolarHBondContact O-N 3.26Å
278	F	79.6	Confident	81.4	Confident	70 Å²	70	66.8 Å²	66.8	31%	0.307	34%	0.342	S	S	.	.	H	α-helix	trans	-71.8	-41	-177.2	-65.9	-45.1	0	0	0	112.4	F274 H275 F280 L281 A282 I453	F274-F278 HydrophobicContact CB-CD2 4.29Å; F274-F278 HydrophobicContact CB-CE2 4.05Å; F274-F278 AromaticContact CD1-CE2 3.7Å; F274-F278 HydrophobicContact CD1-CE2 3.7Å; F274-F278 AromaticContact CD1-CZ 3.77Å; F274-F278 HydrophobicContact CD1-CZ 3.77Å; F274-F278 HydrophobicContact CE1-CZ 4.42Å; F274-F278 HydrophobicContact CG-CE2 4.34Å; F274-F278 WeakPolarHBondContact O-CB 3.34Å; F274-F278 WeakPolarHBondContact O-CD2 3.28Å; F274-F278 WeakPolarHBondContact O-CG 3.35Å; F274-F278 PolarHBondContact O-N 3.3Å; H275-F278 PolarHBondContact O-N 2.93Å; F278-F280 VanDerWaalsContact C-N 3.29Å; F278-F280 PolarHBondContact O-N 3.07Å; F278-L281 HydrophobicContact CD1-CD1 4.25Å; F278-L281 PolarHBondContact O-N 3.26Å; F278-A282 WeakPolarHBondContact O-CB 3.44Å; F278-A282 PolarHBondContact O-N 3Å; F278-I453 HydrophobicContact CB-CD1 4.35Å; F278-I453 HydrophobicContact CD1-CD1 4.28Å; F278-I453 HydrophobicContact CD2-CD1 3.32Å; F278-I453 HydrophobicContact CD2-CG1 4.05Å; F278-I453 HydrophobicContact CD2-CG2 4.04Å; F278-I453 HydrophobicContact CE1-CD1 4.42Å; F278-I453 HydrophobicContact CE2-CD1 3.45Å; F278-I453 VanDerWaalsContact CE2-CD1 3.45Å; F278-I453 HydrophobicContact CE2-CG1 4.07Å; F278-I453 HydrophobicContact CG-CD1 3.76Å; F278-I453 HydrophobicContact CZ-CD1 4.03Å
279	S	81.2	Confident	81.1	Confident	21 Å²	21	68.6 Å²	68.6	15%	0.147	35%	0.346	C	S	.	.	H	α-helix	trans	-57.3	-44.7	172.2	-56.2	0	0	0	0	111	H275 L281 A282 F283	H275-S279 WeakPolarHBondContact O-CB 3.5Å; H275-S279 PolarHBondContact O-N 2.91Å; H275-S279 PolarHBondContact O-OG 3.11Å; S279-L281 PolarHBondContact O-N 3.46Å; S279-A282 PolarHBondContact O-N 2.99Å; S279-F283 WeakPolarHBondContact O-CD2 3.45Å; S279-F283 VanDerWaalsContact O-CG 3.23Å; S279-F283 WeakPolarHBondContact O-CG 3.42Å; S279-F283 PolarHBondContact O-N 3.09Å
280	F	84	Confident	80.9	Confident	131 Å²	131	65 Å²	65	58%	0.575	33%	0.326	S	S	*	.	H	α-helix	trans	-61.7	-43.7	176.6	177.9	-100.6	0	0	0	112.7	L276 L277 F278 A282 F283 K284	L276-F280 VanDerWaalsContact O-CB 3.26Å; L276-F280 WeakPolarHBondContact O-CB 3.27Å; L276-F280 PolarHBondContact O-N 3.35Å; L277-F280 PolarHBondContact O-N 3.3Å; F278-F280 VanDerWaalsContact C-N 3.29Å; F278-F280 PolarHBondContact O-N 3.07Å; F280-A282 VanDerWaalsContact C-N 3.33Å; F280-A282 PolarHBondContact O-N 3.2Å; F280-F283 PolarHBondContact O-N 3.27Å; F280-K284 HydrophobicContact CE1-CD 4.49Å; F280-K284 WeakPolarHBondContact O-CB 3.33Å; F280-K284 PolarHBondContact O-N 3.23Å
281	L	81.3	Confident	80.8	Confident	84 Å²	84	67.9 Å²	67.9	44%	0.44	33%	0.333	S	S	.	.	H	α-helix	trans	-63.8	-38.9	176.6	-72.4	171.1	0	0	0	112	L277 F278 S279 K284 N285	L277-L281 HydrophobicContact CG-CD1 4.28Å; L277-L281 VanDerWaalsContact O-CG 3.31Å; L277-L281 WeakPolarHBondContact O-CG 3.49Å; L277-L281 PolarHBondContact O-N 3.26Å; F278-L281 HydrophobicContact CD1-CD1 4.25Å; F278-L281 PolarHBondContact O-N 3.26Å; S279-L281 PolarHBondContact O-N 3.46Å; L281-K284 PolarHBondContact O-N 3.45Å; L281-N285 WeakPolarHBondContact O-CB 3.19Å; L281-N285 PolarHBondContact O-N 2.97Å
282	A	78.6	Confident	80.5	Confident	44 Å²	44	77.3 Å²	77.3	36%	0.364	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-49.6	175.7	0	0	0	0	0	111.2	F278 S279 F280 K284 N285 D286	F278-A282 WeakPolarHBondContact O-CB 3.44Å; F278-A282 PolarHBondContact O-N 3Å; S279-A282 PolarHBondContact O-N 2.99Å; F280-A282 VanDerWaalsContact C-N 3.33Å; F280-A282 PolarHBondContact O-N 3.2Å; A282-K284 VanDerWaalsContact C-N 3.34Å; A282-K284 PolarHBondContact O-N 3.24Å; A282-N285 PolarHBondContact O-N 3.44Å; A282-D286 WeakPolarHBondContact O-CB 3.26Å; A282-D286 PolarHBondContact O-N 3.39Å
283	F	84.1	Confident	79.9	Confident	33 Å²	33	77.5 Å²	77.5	15%	0.145	37%	0.37	C	S	.	.	H	α-helix	trans	-59.8	-43.7	175.9	-60.6	-37.4	0	0	0	112.2	S279 F280 N285 D286 I287 P330 I333 I337	S279-F283 WeakPolarHBondContact O-CD2 3.45Å; S279-F283 VanDerWaalsContact O-CG 3.23Å; S279-F283 WeakPolarHBondContact O-CG 3.42Å; S279-F283 PolarHBondContact O-N 3.09Å; F280-F283 PolarHBondContact O-N 3.27Å; F283-N285 VanDerWaalsContact C-N 3.34Å; F283-N285 PolarHBondContact O-N 3.14Å; F283-D286 PolarHBondContact O-N 2.76Å; F283-I287 WeakPolarHBondContact O-CB 3.31Å; F283-I287 VanDerWaalsContact O-CG1 3.26Å; F283-I287 WeakPolarHBondContact O-CG1 3.16Å; F283-I287 PolarHBondContact O-N 2.92Å; F283-P330 HydrophobicContact CE2-CB 4.06Å; F283-P330 HydrophobicContact CZ-CB 3.92Å; F283-P330 WeakPolarHBondContact CZ-O 3.14Å; F283-I333 HydrophobicContact CD2-CG2 3.88Å; F283-I333 HydrophobicContact CE2-CB 4.14Å; F283-I333 HydrophobicContact CE2-CG2 3.91Å; F283-I333 HydrophobicContact CG-CG2 4.23Å; F283-I333 HydrophobicContact CZ-CB 4.32Å; F283-I333 HydrophobicContact CZ-CG2 4.27Å; F283-I337 HydrophobicContact CB-CD1 3.78Å; F283-I337 HydrophobicContact CD1-CD1 3.5Å; F283-I337 VanDerWaalsContact CD1-CD1 3.5Å; F283-I337 HydrophobicContact CE1-CD1 4.29Å; F283-I337 HydrophobicContact CG-CD1 3.75Å
284	K	83.4	Confident	78.8	Confident	133 Å²	133	79.1 Å²	79.1	58%	0.578	38%	0.38	S	S	*	.	H	α-helix	trans	-60.6	-43.7	177.8	-179.1	-178.1	176.7	-178.3	0	111.8	F280 L281 A282 S288	F280-K284 HydrophobicContact CE1-CD 4.49Å; F280-K284 WeakPolarHBondContact O-CB 3.33Å; F280-K284 PolarHBondContact O-N 3.23Å; L281-K284 PolarHBondContact O-N 3.45Å; A282-K284 VanDerWaalsContact C-N 3.34Å; A282-K284 PolarHBondContact O-N 3.24Å; K284-S288 VanDerWaalsContact O-CB 3.23Å; K284-S288 WeakPolarHBondContact O-CB 3.48Å; K284-S288 PolarHBondContact O-N 2.96Å
285	N	78.3	Confident	77.6	Confident	79 Å²	79	82 Å²	82	42%	0.422	40%	0.398	S	S	.	.	H	α-helix	trans	-65.1	-46.1	179.1	-169.8	9.3	0	0	0	111	L281 A282 F283 S288 F289	L281-N285 WeakPolarHBondContact O-CB 3.19Å; L281-N285 PolarHBondContact O-N 2.97Å; A282-N285 PolarHBondContact O-N 3.44Å; F283-N285 VanDerWaalsContact C-N 3.34Å; F283-N285 PolarHBondContact O-N 3.14Å; N285-S288 WeakPolarHBondContact O-CB 3.39Å; N285-S288 PolarHBondContact O-N 3.5Å; N285-F289 PolarHBondContact O-N 2.87Å
286	D	81.2	Confident	76.7	Confident	44 Å²	44	82.4 Å²	82.4	24%	0.235	40%	0.402	C	S	.	.	H	α-helix	trans	-62.6	-48.4	179.8	-168.8	25.9	0	0	0	112	A282 F283 S288 F289 W290 K341	A282-D286 WeakPolarHBondContact O-CB 3.26Å; A282-D286 PolarHBondContact O-N 3.39Å; F283-D286 PolarHBondContact O-N 2.76Å; D286-S288 VanDerWaalsContact C-N 3.3Å; D286-S288 PolarHBondContact O-N 3.27Å; D286-F289 PolarHBondContact O-N 3.46Å; D286-F289 VanDerWaalsContact O-N 3.16Å; D286-W290 PolarHBondContact O-N 3.38Å; D286-W290 PolarHBondContact OD1-NE1 2.91Å; D286-K341 VanDerWaalsContact CG-NZ 3.31Å; D286-K341 WeakPolarHBondContact OD1-CE 3.29Å; D286-K341 IonicContact OD1-NZ 3.11Å; D286-K341 PolarHBondContact OD1-NZ 3.41Å; D286-K341 WeakPolarHBondContact OD2-CE 2.94Å; D286-K341 IonicContact OD2-NZ 2.75Å; D286-K341 PolarHBondContact OD2-NZ 3.44Å
287	I	83	Confident	75.3	Confident	58 Å²	58	81.7 Å²	81.7	30%	0.297	40%	0.402	S	S	.	.	H	α-helix	trans	-60.4	-41.2	174.7	-66.4	166.7	0	0	0	110.9	F283 F289 R291 I337	F283-I287 WeakPolarHBondContact O-CB 3.31Å; F283-I287 VanDerWaalsContact O-CG1 3.26Å; F283-I287 WeakPolarHBondContact O-CG1 3.16Å; F283-I287 PolarHBondContact O-N 2.92Å; I287-F289 VanDerWaalsContact C-N 3.32Å; I287-F289 PolarHBondContact O-N 3.43Å; I287-R291 WeakPolarHBondContact O-CB 3.49Å; I287-R291 PolarHBondContact O-N 2.98Å; I287-I337 HydrophobicContact CD1-CD1 4.07Å; I287-I337 HydrophobicContact CD1-CG1 4.3Å; I287-I337 HydrophobicContact CG1-CD1 4.32Å; I287-I337 HydrophobicContact CG1-CG1 4.41Å
288	S	78.1	Confident	74.2	Confident	42 Å²	42	78.1 Å²	78.1	29%	0.294	39%	0.386	S	S	.	.	H	α-helix	trans	-64.3	-36.4	178	-178.8	0	0	0	0	112.3	K284 N285 D286 R292	K284-S288 VanDerWaalsContact O-CB 3.23Å; K284-S288 WeakPolarHBondContact O-CB 3.48Å; K284-S288 PolarHBondContact O-N 2.96Å; N285-S288 WeakPolarHBondContact O-CB 3.39Å; N285-S288 PolarHBondContact O-N 3.5Å; D286-S288 VanDerWaalsContact C-N 3.3Å; D286-S288 PolarHBondContact O-N 3.27Å; S288-R292 WeakPolarHBondContact O-CG 3.32Å; S288-R292 PolarHBondContact O-N 3.47Å
289	F	74.1	Confident	73.7	Confident	81 Å²	81	76.8 Å²	76.8	36%	0.355	38%	0.381	S	S	.	.	H	α-helix	trans	-67.4	-53.3	177.4	174.3	-99.4	0	0	0	110.8	N285 D286 I287 R291 R292 S293	N285-F289 PolarHBondContact O-N 2.87Å; D286-F289 PolarHBondContact O-N 3.46Å; D286-F289 VanDerWaalsContact O-N 3.16Å; I287-F289 VanDerWaalsContact C-N 3.32Å; I287-F289 PolarHBondContact O-N 3.43Å; F289-R291 VanDerWaalsContact C-N 3.27Å; F289-R291 PolarHBondContact O-N 3.33Å; F289-R292 PolarHBondContact O-N 3.21Å; F289-S293 PolarHBondContact O-N 3.2Å; F289-S293 VanDerWaalsContact O-N 3.08Å
290	W	77.3	Confident	73.3	Confident	26 Å²	26	75.9 Å²	75.9	10%	0.098	38%	0.375	C	S	.	.	H	α-helix	trans	-67.4	-24.9	-178.9	-79.7	91.7	0	0	0	114.1	D286 R292 I299 I304 W340 K341 M345	D286-W290 PolarHBondContact O-N 3.38Å; D286-W290 PolarHBondContact OD1-NE1 2.91Å; W290-R292 VanDerWaalsContact C-N 3.34Å; W290-I299 HydrophobicContact CH2-CD1 3.69Å; W290-I299 HydrophobicContact CH2-CG2 4.16Å; W290-I299 HydrophobicContact CZ2-CD1 3.96Å; W290-I299 HydrophobicContact CZ3-CD1 4.39Å; W290-I304 HydrophobicContact CH2-CD1 3.67Å; W290-I304 HydrophobicContact CZ2-CD1 4.36Å; W290-I304 HydrophobicContact CZ3-CD1 4.5Å; W290-W340 HydrophobicContact CB-CH2 3.76Å; W290-W340 HydrophobicContact CB-CZ3 3.56Å; W290-W340 HydrophobicContact CG-CZ3 4.33Å; W290-K341 HydrophobicContact CD2-CD 4.15Å; W290-K341 HydrophobicContact CD2-CG 3.86Å; W290-K341 HydrophobicContact CE3-CG 4.3Å; W290-K341 HydrophobicContact CG-CD 4.43Å; W290-K341 HydrophobicContact CG-CG 4.13Å; W290-K341 HydrophobicContact CZ2-CD 3.93Å; W290-K341 HydrophobicContact CZ2-CG 4.27Å; W290-K341 VanDerWaalsContact NE1-CE 3.33Å; W290-M345 HydrophobicContact CH2-CG 4.16Å; W290-M345 HydrophobicContact CH2-SD 4.41Å; W290-M345 HydrophobicContact CZ3-CG 3.85Å; W290-M345 HydrophobicContact CZ3-SD 4.14Å
291	R	78.8	Confident	73.1	Confident	186 Å²	186	71.9 Å²	71.9	70%	0.702	36%	0.359	S	S	*	.	H	α-helix	trans	-71.1	-29.4	172.4	-173.9	179.4	-70.6	-174.6	-2.4	112.5	I287 F289	I287-R291 WeakPolarHBondContact O-CB 3.49Å; I287-R291 PolarHBondContact O-N 2.98Å; F289-R291 VanDerWaalsContact C-N 3.27Å; F289-R291 PolarHBondContact O-N 3.33Å
292	R	73.5	Confident	73	Confident	201 Å²	201	74.4 Å²	74.4	76%	0.758	36%	0.363	S	S	*	.	H	α-helix	trans	-93.3	-21.5	-177.7	-68.7	177.6	-173.1	-179.6	1.8	113.7	S288 F289 W290 D294	S288-R292 WeakPolarHBondContact O-CG 3.32Å; S288-R292 PolarHBondContact O-N 3.47Å; F289-R292 PolarHBondContact O-N 3.21Å; W290-R292 VanDerWaalsContact C-N 3.34Å; R292-D294 PolarHBondContact O-N 3Å
293	S	67.7	Low	73.1	Confident	35 Å²	35	74.5 Å²	74.5	25%	0.245	36%	0.359	C	S	.	.			trans	-84.8	103.3	-176.6	-157.8	0	0	0	0	111.2	F289 N295	F289-S293 PolarHBondContact O-N 3.2Å; F289-S293 VanDerWaalsContact O-N 3.08Å; S293-N295 PolarHBondContact OG-O 3Å
294	D	62	Low	73.1	Confident	134 Å²	134	73.1 Å²	73.1	72%	0.717	35%	0.353	S	S	*	.			trans	-85.5	-34.9	172.3	-74.8	-33.4	0	0	0	112.2	R292 S296	R292-D294 PolarHBondContact O-N 3Å; D294-S296 PolarHBondContact O-N 3.4Å
295	N	57.3	Low	73.2	Confident	134 Å²	134	69.4 Å²	69.4	72%	0.717	34%	0.341	S	S	*	.			trans	-84.8	113.1	175	-68.3	-19.6	0	0	0	109.4	S293 V297	S293-N295 PolarHBondContact OG-O 3Å; N295-V297 VanDerWaalsContact C-N 3.31Å
296	S	59.6	Low	73.6	Confident	20 Å²	20	68.9 Å²	68.9	14%	0.14	33%	0.334	C	S	.	.			trans	-95.4	12.7	176.6	-57.5	0	0	0	0	112.7	D294 G298 I299 M345	D294-S296 PolarHBondContact O-N 3.4Å; S296-G298 PolarHBondContact O-N 3.28Å; S296-I299 PolarHBondContact O-N 3.36Å; S296-M345 WeakPolarHBondContact CB-SD 3.46Å
297	V	56	Low	73.8	Confident	74 Å²	74	72.6 Å²	72.6	45%	0.448	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	126.5	176.5	-174.9	0	0	0	0	108.6	N295 E364 E365	N295-V297 VanDerWaalsContact C-N 3.31Å; V297-E364 HydrophobicContact CG1-CB 3.87Å; V297-E364 HydrophobicContact CG2-CB 4.48Å; V297-E365 HydrophobicContact CG2-CG 4.15Å
298	G	59.1	Low	74.2	Confident	11 Å²	11	71.4 Å²	71.4	11%	0.113	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.1	-5.9	-173.3	0	0	0	0	0	114.5	S296 N499	S296-G298 PolarHBondContact O-N 3.28Å; G298-N499 WeakPolarHBondContact O-CB 3.45Å; G298-N499 PolarHBondContact O-ND2 3.47Å
299	I	69.1	Low	74.9	Confident	41 Å²	41	72.7 Å²	72.7	21%	0.21	34%	0.34	C	S	.	.			trans	-112.9	115.1	175	-47.4	179	0	0	0	109.8	W290 S296 I304 M345	W290-I299 HydrophobicContact CH2-CD1 3.69Å; W290-I299 HydrophobicContact CH2-CG2 4.16Å; W290-I299 HydrophobicContact CZ2-CD1 3.96Å; W290-I299 HydrophobicContact CZ3-CD1 4.39Å; S296-I299 PolarHBondContact O-N 3.36Å; I299-I304 HydrophobicContact CG2-CD1 3.66Å; I299-I304 HydrophobicContact CG2-CG1 3.98Å; I299-M345 HydrophobicContact CB-CE 4.13Å; I299-M345 HydrophobicContact CG2-CE 4.22Å; I299-M345 WeakPolarHBondContact O-CE 3.47Å
300	S	73.6	Confident	75.6	Confident	2 Å²	2	69.5 Å²	69.5	1%	0.014	33%	0.328	C	S	.	.			trans	-74.4	135.5	177.4	166.3	0	0	0	0	112	R302 T303 I304 D369 D372	S300-R302 PolarHBondContact O-N 2.92Å; S300-R302 PolarHBondContact OG-N 3.29Å; S300-T303 PolarHBondContact O-N 3.47Å; S300-I304 PolarHBondContact O-N 3.44Å; S300-D369 WeakPolarHBondContact CA-OD1 3.33Å; S300-D369 WeakPolarHBondContact CB-OD1 3.49Å; S300-D369 PolarHBondContact OG-OD1 3.37Å; S300-D372 WeakPolarHBondContact CB-OD2 3.2Å
301	L	79.5	Confident	76.3	Confident	47 Å²	47	68.8 Å²	68.8	25%	0.246	33%	0.327	C	S	.	.	H	α-helix	trans	-60.9	-37.8	175.2	177.2	63.9	0	0	0	110.9	T303 I304 V305 L342 M345 T346 D369	L301-T303 VanDerWaalsContact C-N 3.34Å; L301-T303 PolarHBondContact O-N 3.07Å; L301-I304 PolarHBondContact O-N 2.99Å; L301-V305 HydrophobicContact CD1-CG2 4.42Å; L301-V305 HydrophobicContact CG-CG2 4.39Å; L301-V305 WeakPolarHBondContact O-CG2 3.37Å; L301-V305 PolarHBondContact O-N 3.49Å; L301-L342 HydrophobicContact CD1-CD1 3.79Å; L301-M345 HydrophobicContact CD1-CB 4.09Å; L301-T346 HydrophobicContact CD1-CG2 3.78Å; L301-T346 HydrophobicContact CD2-CG2 4.34Å; L301-D369 PolarHBondContact N-OD1 3.01Å
302	R	79.7	Confident	77	Confident	137 Å²	137	62.6 Å²	62.6	52%	0.517	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-40.3	-177.4	-63.3	177.2	-179.7	-128.8	-1.6	111.5	S300 I304 V305 W306	S300-R302 PolarHBondContact O-N 2.92Å; S300-R302 PolarHBondContact OG-N 3.29Å; R302-I304 VanDerWaalsContact C-N 3.31Å; R302-I304 PolarHBondContact O-N 2.91Å; R302-V305 PolarHBondContact O-N 3.43Å; R302-W306 WeakPolarHBondContact O-CB 3.06Å; R302-W306 PolarHBondContact O-N 3.21Å
303	T	80.1	Confident	77.9	Confident	47 Å²	47	54 Å²	54	29%	0.288	28%	0.276	S	S	.	.	H	α-helix	trans	-63.8	-39.2	178.1	-56	0	0	0	0	111.1	S300 L301 W306 R307	S300-T303 PolarHBondContact O-N 3.47Å; L301-T303 VanDerWaalsContact C-N 3.34Å; L301-T303 PolarHBondContact O-N 3.07Å; T303-W306 PolarHBondContact O-N 3.27Å; T303-R307 WeakPolarHBondContact O-CB 3.15Å; T303-R307 VanDerWaalsContact O-CG 3.29Å; T303-R307 WeakPolarHBondContact O-CG 3.43Å; T303-R307 PolarHBondContact O-N 3.29Å
304	I	83.3	Confident	78.9	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-69.6	-44.4	176.3	-61.5	173.9	0	0	0	111.4	W290 I299 S300 L301 R302 W306 R307 F308 K341 L342 M345	W290-I304 HydrophobicContact CH2-CD1 3.67Å; W290-I304 HydrophobicContact CZ2-CD1 4.36Å; W290-I304 HydrophobicContact CZ3-CD1 4.5Å; I299-I304 HydrophobicContact CG2-CD1 3.66Å; I299-I304 HydrophobicContact CG2-CG1 3.98Å; S300-I304 PolarHBondContact O-N 3.44Å; L301-I304 PolarHBondContact O-N 2.99Å; R302-I304 VanDerWaalsContact C-N 3.31Å; R302-I304 PolarHBondContact O-N 2.91Å; I304-W306 PolarHBondContact O-N 2.87Å; I304-R307 PolarHBondContact O-N 2.88Å; I304-F308 PolarHBondContact O-N 3.06Å; I304-K341 HydrophobicContact CG2-CB 4.22Å; I304-L342 HydrophobicContact CG2-CB 4.21Å; I304-L342 HydrophobicContact CG2-CD1 4.43Å; I304-M345 HydrophobicContact CD1-CB 4.19Å; I304-M345 HydrophobicContact CD1-CE 3.66Å; I304-M345 HydrophobicContact CD1-CG 3.46Å; I304-M345 VanDerWaalsContact CD1-CG 3.46Å; I304-M345 HydrophobicContact CD1-SD 4.13Å
305	V	86.3	Confident	80.4	Confident	54 Å²	54	49.3 Å²	49.3	33%	0.327	25%	0.246	S	C	.	.	H	α-helix	trans	-55	-45.8	174	170.3	0	0	0	0	109.9	L301 R302 F308 L309 L342	L301-V305 HydrophobicContact CD1-CG2 4.42Å; L301-V305 HydrophobicContact CG-CG2 4.39Å; L301-V305 WeakPolarHBondContact O-CG2 3.37Å; L301-V305 PolarHBondContact O-N 3.49Å; R302-V305 PolarHBondContact O-N 3.43Å; V305-F308 PolarHBondContact O-N 3.4Å; V305-L309 HydrophobicContact CG1-CD1 3.98Å; V305-L309 HydrophobicContact CG1-CG 4.45Å; V305-L309 WeakPolarHBondContact O-CG 3.35Å; V305-L309 PolarHBondContact O-N 2.91Å; V305-L342 HydrophobicContact CG2-CD1 3.45Å; V305-L342 VanDerWaalsContact CG2-CD1 3.45Å; V305-L342 HydrophobicContact CG2-CD2 4.47Å
306	W	85.9	Confident	82	Confident	69 Å²	69	45.9 Å²	45.9	26%	0.261	23%	0.227	S	C	.	.	H	α-helix	trans	-65	-42	178.7	-176.1	-106	0	0	0	112.9	R302 T303 I304 L309 S310 M376 V415 F418	R302-W306 WeakPolarHBondContact O-CB 3.06Å; R302-W306 PolarHBondContact O-N 3.21Å; T303-W306 PolarHBondContact O-N 3.27Å; I304-W306 PolarHBondContact O-N 2.87Å; W306-L309 PolarHBondContact O-N 3.01Å; W306-S310 PolarHBondContact NE1-OG 3.47Å; W306-S310 VanDerWaalsContact O-CB 3.24Å; W306-S310 WeakPolarHBondContact O-CB 2.91Å; W306-S310 PolarHBondContact O-N 3.45Å; W306-S310 PolarHBondContact O-OG 3.25Å; W306-M376 HydrophobicContact CG-CE 4.49Å; W306-V415 HydrophobicContact CZ2-CG2 4.36Å; W306-F418 AromaticContact CD1-CD1 3.68Å; W306-F418 AromaticContact CD1-CE1 3.44Å; W306-F418 VanDerWaalsContact CD1-CE1 3.44Å; W306-F418 HydrophobicContact CD2-CD1 4.34Å; W306-F418 HydrophobicContact CD2-CE1 4.09Å; W306-F418 AromaticContact CE2-CD1 3.34Å; W306-F418 AromaticContact CE2-CE1 3.53Å; W306-F418 AromaticContact CE2-CG 3.79Å; W306-F418 HydrophobicContact CG-CD1 4.5Å; W306-F418 HydrophobicContact CG-CE1 4.03Å; W306-F418 HydrophobicContact CZ2-CB 3.83Å; W306-F418 AromaticContact CZ2-CD1 3.66Å; W306-F418 HydrophobicContact CZ2-CD1 3.66Å; W306-F418 HydrophobicContact CZ2-CD2 4.07Å; W306-F418 HydrophobicContact CZ2-CE1 4.14Å; W306-F418 AromaticContact CZ2-CG 3.57Å; W306-F418 HydrophobicContact CZ2-CG 3.57Å; W306-F418 AromaticContact NE1-CD1 2.89Å; W306-F418 AromaticContact NE1-CE1 3.13Å; W306-F418 AromaticContact NE1-CG 3.77Å
307	R	86.5	Confident	83.4	Confident	121 Å²	121	45.2 Å²	45.2	46%	0.457	22%	0.222	S	C	.	.	H	α-helix	trans	-61.3	-43.1	175	-76.4	174.5	62.4	134.6	7.8	112.3	T303 I304 S310 S311 E338	T303-R307 WeakPolarHBondContact O-CB 3.15Å; T303-R307 VanDerWaalsContact O-CG 3.29Å; T303-R307 WeakPolarHBondContact O-CG 3.43Å; T303-R307 PolarHBondContact O-N 3.29Å; I304-R307 PolarHBondContact O-N 2.88Å; R307-S310 PolarHBondContact O-N 3.29Å; R307-S311 WeakPolarHBondContact O-CB 3.25Å; R307-S311 PolarHBondContact O-N 3.44Å; R307-E338 IonicContact CZ-OE1 2.76Å; R307-E338 IonicContact NE-OE1 3.21Å; R307-E338 PolarHBondContact NE-OE1 3.4Å; R307-E338 IonicContact NE-OE2 3.3Å; R307-E338 IonicContact NH2-OE1 2.65Å; R307-E338 PolarHBondContact NH2-OE1 2.87Å
308	F	91.2	Very high	84.9	Confident	33 Å²	33	41.7 Å²	41.7	15%	0.145	20%	0.201	C	C	.	.	H	α-helix	trans	-61.3	-51.3	174.7	165.4	-108.8	0	0	0	111.4	I304 V305 S310 S311 L312 T335 E338 L339 L342	I304-F308 PolarHBondContact O-N 3.06Å; V305-F308 PolarHBondContact O-N 3.4Å; F308-S310 VanDerWaalsContact C-N 3.31Å; F308-S310 PolarHBondContact O-N 3.1Å; F308-S311 PolarHBondContact O-N 3.43Å; F308-L312 HydrophobicContact CE1-CD2 4.35Å; F308-L312 HydrophobicContact CZ-CD2 4.01Å; F308-L312 VanDerWaalsContact O-CB 3.32Å; F308-L312 WeakPolarHBondContact O-CB 2.92Å; F308-L312 PolarHBondContact O-N 3.39Å; F308-T335 HydrophobicContact CD2-CG2 4.23Å; F308-T335 HydrophobicContact CE2-CG2 3.93Å; F308-E338 HydrophobicContact CB-CB 4.13Å; F308-E338 HydrophobicContact CD2-CB 4.43Å; F308-L339 HydrophobicContact CD2-CB 3.93Å; F308-L339 HydrophobicContact CD2-CD1 4.42Å; F308-L339 HydrophobicContact CE1-CD1 4.49Å; F308-L339 HydrophobicContact CE2-CB 3.73Å; F308-L339 HydrophobicContact CE2-CD1 3.9Å; F308-L339 HydrophobicContact CE2-CG 4.25Å; F308-L339 HydrophobicContact CZ-CD1 3.93Å; F308-L342 HydrophobicContact CD1-CD2 4.05Å; F308-L342 HydrophobicContact CG-CD2 4.43Å
309	L	91.6	Very high	86.3	Confident	69 Å²	69	49 Å²	49	36%	0.361	23%	0.225	S	C	.	.	H	α-helix	trans	-59.6	-43.3	178.2	-71.3	174	0	0	0	111.6	V305 W306 L312 I313	V305-L309 HydrophobicContact CG1-CD1 3.98Å; V305-L309 HydrophobicContact CG1-CG 4.45Å; V305-L309 WeakPolarHBondContact O-CG 3.35Å; V305-L309 PolarHBondContact O-N 2.91Å; W306-L309 PolarHBondContact O-N 3.01Å; L309-L312 PolarHBondContact O-N 3.44Å; L309-I313 WeakPolarHBondContact O-CB 3.43Å; L309-I313 WeakPolarHBondContact O-CD1 2.98Å; L309-I313 WeakPolarHBondContact O-CG1 2.94Å; L309-I313 PolarHBondContact O-N 3.43Å
310	S	89.8	Confident	87	Confident	15 Å²	15	49.5 Å²	49.5	11%	0.105	23%	0.226	C	C	.	.	H	α-helix	trans	-59.6	-50.3	176.5	-63.2	0	0	0	0	111.4	W306 R307 F308 L312 I313 I314 V415	W306-S310 PolarHBondContact NE1-OG 3.47Å; W306-S310 VanDerWaalsContact O-CB 3.24Å; W306-S310 WeakPolarHBondContact O-CB 2.91Å; W306-S310 PolarHBondContact O-N 3.45Å; W306-S310 PolarHBondContact O-OG 3.25Å; R307-S310 PolarHBondContact O-N 3.29Å; F308-S310 VanDerWaalsContact C-N 3.31Å; F308-S310 PolarHBondContact O-N 3.1Å; S310-L312 VanDerWaalsContact C-N 3.33Å; S310-L312 PolarHBondContact O-N 2.93Å; S310-I313 PolarHBondContact O-N 2.96Å; S310-I314 WeakPolarHBondContact O-CD1 3.4Å; S310-I314 WeakPolarHBondContact O-CG1 3.19Å; S310-I314 PolarHBondContact O-N 3.17Å; S310-V415 VanDerWaalsContact CB-CG1 3.45Å
311	S	90.8	Very high	87.4	Confident	11 Å²	11	53 Å²	53	8%	0.077	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-39.8	178.3	-178.2	0	0	0	0	111.9	R307 F308 I314 F315 T335	R307-S311 WeakPolarHBondContact O-CB 3.25Å; R307-S311 PolarHBondContact O-N 3.44Å; F308-S311 PolarHBondContact O-N 3.43Å; S311-I314 PolarHBondContact O-N 3.03Å; S311-F315 VanDerWaalsContact O-CB 3.31Å; S311-F315 WeakPolarHBondContact O-CB 3.35Å; S311-F315 PolarHBondContact O-N 3.04Å; S311-T335 PolarHBondContact O-OG1 2.95Å; S311-T335 WeakPolarHBondContact OG-CA 3.38Å; S311-T335 PolarHBondContact OG-N 3.48Å; S311-T335 PolarHBondContact OG-OG1 3.22Å
312	L	94	Very high	87.1	Confident	56 Å²	56	57.6 Å²	57.6	29%	0.293	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-46.1	176.9	179.6	65	0	0	0	111.9	F308 L309 S310 F315 L316 T335	F308-L312 HydrophobicContact CE1-CD2 4.35Å; F308-L312 HydrophobicContact CZ-CD2 4.01Å; F308-L312 VanDerWaalsContact O-CB 3.32Å; F308-L312 WeakPolarHBondContact O-CB 2.92Å; F308-L312 PolarHBondContact O-N 3.39Å; L309-L312 PolarHBondContact O-N 3.44Å; S310-L312 VanDerWaalsContact C-N 3.33Å; S310-L312 PolarHBondContact O-N 2.93Å; L312-F315 PolarHBondContact O-N 3.43Å; L312-L316 HydrophobicContact CD1-CD1 4.44Å; L312-L316 HydrophobicContact CD1-CG 4.45Å; L312-L316 HydrophobicContact CG-CD1 4.23Å; L312-L316 WeakPolarHBondContact O-CB 3.25Å; L312-L316 VanDerWaalsContact O-CG 3.3Å; L312-L316 WeakPolarHBondContact O-CG 3.42Å; L312-L316 PolarHBondContact O-N 3.17Å; L312-T335 HydrophobicContact CB-CG2 3.91Å; L312-T335 HydrophobicContact CD1-CG2 3.99Å
313	I	92.4	Very high	86.8	Confident	19 Å²	19	51.8 Å²	51.8	10%	0.097	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-45.3	177.9	-69.7	162.9	0	0	0	110.5	L309 S310 L316 H317 M411 V412 V415	L309-I313 WeakPolarHBondContact O-CB 3.43Å; L309-I313 WeakPolarHBondContact O-CD1 2.98Å; L309-I313 WeakPolarHBondContact O-CG1 2.94Å; L309-I313 PolarHBondContact O-N 3.43Å; S310-I313 PolarHBondContact O-N 2.96Å; I313-L316 PolarHBondContact O-N 3.36Å; I313-H317 WeakPolarHBondContact O-CB 3.37Å; I313-H317 PolarHBondContact O-N 3.46Å; I313-M411 HydrophobicContact CD1-CE 3.63Å; I313-M411 HydrophobicContact CG1-CE 3.85Å; I313-M411 HydrophobicContact CG2-CB 3.79Å; I313-V412 HydrophobicContact CG2-CB 4.43Å; I313-V412 HydrophobicContact CG2-CG2 3.65Å; I313-V415 HydrophobicContact CB-CG2 4.24Å; I313-V415 HydrophobicContact CD1-CG2 3.7Å; I313-V415 HydrophobicContact CG2-CG2 4.08Å
314	I	89.4	Confident	86.7	Confident	20 Å²	20	51.4 Å²	51.4	10%	0.103	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-44.3	177.1	-65.2	163.1	0	0	0	110.5	S310 S311 H317 L318 M331 V415 Y416	S310-I314 WeakPolarHBondContact O-CD1 3.4Å; S310-I314 WeakPolarHBondContact O-CG1 3.19Å; S310-I314 PolarHBondContact O-N 3.17Å; S311-I314 PolarHBondContact O-N 3.03Å; I314-H317 PolarHBondContact O-N 3.28Å; I314-L318 HydrophobicContact CG2-CD1 4.07Å; I314-L318 HydrophobicContact CG2-CG 4.35Å; I314-L318 WeakPolarHBondContact O-CG 3.28Å; I314-L318 PolarHBondContact O-N 3.33Å; I314-M331 HydrophobicContact CB-SD 4.49Å; I314-M331 HydrophobicContact CG2-CE 3.83Å; I314-M331 HydrophobicContact CG2-CG 4.14Å; I314-M331 HydrophobicContact CG2-SD 4.08Å; I314-V415 HydrophobicContact CD1-CG1 3.94Å; I314-V415 HydrophobicContact CG1-CG1 4.19Å; I314-Y416 HydrophobicContact CD1-CD1 4.4Å; I314-Y416 HydrophobicContact CD1-CE1 3.7Å; I314-Y416 HydrophobicContact CG1-CE1 3.89Å
315	F	92.3	Very high	86.7	Confident	52 Å²	52	57.1 Å²	57.1	23%	0.228	27%	0.27	C	S	.	.	H	α-helix	trans	-60.3	-47.9	177	174.3	-113.9	0	0	0	112.1	S311 L312 H317 L318 W319 S328 M331 G332	S311-F315 VanDerWaalsContact O-CB 3.31Å; S311-F315 WeakPolarHBondContact O-CB 3.35Å; S311-F315 PolarHBondContact O-N 3.04Å; L312-F315 PolarHBondContact O-N 3.43Å; F315-H317 VanDerWaalsContact C-N 3.26Å; F315-H317 PolarHBondContact O-N 2.88Å; F315-L318 PolarHBondContact O-N 3.25Å; F315-W319 HydrophobicContact CZ-CE3 4.39Å; F315-W319 WeakPolarHBondContact O-CB 3.49Å; F315-W319 PolarHBondContact O-N 2.98Å; F315-S328 WeakPolarHBondContact CE2-O 3.31Å; F315-M331 HydrophobicContact CB-CG 4.01Å; F315-G332 VanDerWaalsContact CD2-CA 3.45Å
316	L	91.9	Very high	86.4	Confident	62 Å²	62	56 Å²	56	33%	0.325	26%	0.262	S	S	.	.	H	α-helix	trans	-58.8	-40.1	176.9	-73.7	172.4	0	0	0	111.4	L312 I313 W319 E320 L408	L312-L316 HydrophobicContact CD1-CD1 4.44Å; L312-L316 HydrophobicContact CD1-CG 4.45Å; L312-L316 HydrophobicContact CG-CD1 4.23Å; L312-L316 WeakPolarHBondContact O-CB 3.25Å; L312-L316 VanDerWaalsContact O-CG 3.3Å; L312-L316 WeakPolarHBondContact O-CG 3.42Å; L312-L316 PolarHBondContact O-N 3.17Å; I313-L316 PolarHBondContact O-N 3.36Å; L316-W319 WeakPolarHBondContact O-CB 3.14Å; L316-W319 PolarHBondContact O-N 3.04Å; L316-E320 WeakPolarHBondContact O-CB 3.39Å; L316-E320 PolarHBondContact O-N 3.05Å; L316-L408 HydrophobicContact CB-CD1 3.84Å; L316-L408 HydrophobicContact CB-CD2 4.42Å
317	H	88.7	Confident	86.2	Confident	6 Å²	6	53.1 Å²	53.1	3%	0.028	25%	0.252	C	S	.	.	H	α-helix	trans	-68	-44.6	177.3	178.5	68	0	0	0	113.5	I313 I314 F315 W319 E320 E321 L408 V412	I313-H317 WeakPolarHBondContact O-CB 3.37Å; I313-H317 PolarHBondContact O-N 3.46Å; I314-H317 PolarHBondContact O-N 3.28Å; F315-H317 VanDerWaalsContact C-N 3.26Å; F315-H317 PolarHBondContact O-N 2.88Å; H317-W319 PolarHBondContact O-N 3.39Å; H317-E320 PolarHBondContact O-N 3.47Å; H317-E321 WeakPolarHBondContact O-CB 3.3Å; H317-E321 PolarHBondContact O-N 3.18Å; H317-L408 HydrophobicContact CB-CD2 4.17Å; H317-L408 HydrophobicContact CB-CG 4.06Å; H317-V412 HydrophobicContact CB-CB 4.5Å; H317-V412 HydrophobicContact CB-CG2 3.27Å; H317-V412 VanDerWaalsContact CG-CG2 3.47Å
318	L	88.1	Confident	86.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-34.2	175.4	-70.1	175.5	0	0	0	111.8	I314 F315 K322 S323 V327 M331 P464	I314-L318 HydrophobicContact CG2-CD1 4.07Å; I314-L318 HydrophobicContact CG2-CG 4.35Å; I314-L318 WeakPolarHBondContact O-CG 3.28Å; I314-L318 PolarHBondContact O-N 3.33Å; F315-L318 PolarHBondContact O-N 3.25Å; L318-K322 PolarHBondContact O-N 3Å; L318-S323 PolarHBondContact O-N 3.18Å; L318-V327 HydrophobicContact CD1-CG1 4.09Å; L318-M331 HydrophobicContact CD1-CB 3.95Å; L318-M331 HydrophobicContact CD1-CG 3.98Å; L318-P464 HydrophobicContact CD2-CG 4.02Å
319	W	87.4	Confident	86.1	Confident	165 Å²	165	49.8 Å²	49.8	63%	0.625	25%	0.248	S	C	*	.	H	α-helix	trans	-67.6	-46.4	174.3	-174.1	-91.8	0	0	0	112.2	F315 L316 H317 K322	F315-W319 HydrophobicContact CZ-CE3 4.39Å; F315-W319 WeakPolarHBondContact O-CB 3.49Å; F315-W319 PolarHBondContact O-N 2.98Å; L316-W319 WeakPolarHBondContact O-CB 3.14Å; L316-W319 PolarHBondContact O-N 3.04Å; H317-W319 PolarHBondContact O-N 3.39Å; W319-K322 PolarHBondContact O-N 3.17Å; W319-K322 VanDerWaalsContact O-N 3.12Å
320	E	85.1	Confident	85.9	Confident	51 Å²	51	47 Å²	47	24%	0.238	23%	0.234	C	C	.	.	H	α-helix	trans	-64.5	-41.9	178.5	177.7	63.8	-173.3	0	0	112.5	L316 H317 K322 Y404 S405 L408	L316-E320 WeakPolarHBondContact O-CB 3.39Å; L316-E320 PolarHBondContact O-N 3.05Å; H317-E320 PolarHBondContact O-N 3.47Å; E320-K322 PolarHBondContact O-N 2.86Å; E320-Y404 HydrophobicContact CG-CE1 4.3Å; E320-S405 PolarHBondContact OE1-OG 3.45Å; E320-L408 HydrophobicContact CB-CD2 3.67Å; E320-L408 HydrophobicContact CG-CD2 4.02Å
321	E	80.6	Confident	85.9	Confident	75 Å²	75	48 Å²	48	35%	0.35	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-5.3	175.2	-77.5	-61.6	161.3	0	0	113.2	H317 S323 P464	H317-E321 WeakPolarHBondContact O-CB 3.3Å; H317-E321 PolarHBondContact O-N 3.18Å; E321-S323 PolarHBondContact O-N 3.4Å; E321-P464 HydrophobicContact CB-CG 4.25Å; E321-P464 HydrophobicContact CG-CG 4.21Å
322	K	74.5	Confident	85.9	Confident	144 Å²	144	48 Å²	48	63%	0.626	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	42.7	-171.9	-59.9	-174.8	176	-175.6	0	111.5	L318 W319 E320	L318-K322 PolarHBondContact O-N 3Å; W319-K322 PolarHBondContact O-N 3.17Å; W319-K322 VanDerWaalsContact O-N 3.12Å; E320-K322 PolarHBondContact O-N 2.86Å
323	S	73.5	Confident	85.8	Confident	15 Å²	15	48.7 Å²	48.7	11%	0.105	24%	0.243	C	C	.	.			trans	-62.5	163.6	176.6	-165.7	0	0	0	0	110.4	L318 E321 L325 S328 V462	L318-S323 PolarHBondContact O-N 3.18Å; E321-S323 PolarHBondContact O-N 3.4Å; S323-L325 PolarHBondContact O-N 2.97Å; S323-S328 PolarHBondContact O-OG 3.24Å; S323-V462 PolarHBondContact OG-O 3.02Å
324	S	77	Confident	85.7	Confident	39 Å²	39	49.5 Å²	49.5	27%	0.273	25%	0.25	S	C	.	.			trans	-50.9	129.6	-177.9	67.5	0	0	0	0	111.2	L326 V327 S328 I461	S324-L326 PolarHBondContact O-N 2.99Å; S324-V327 PolarHBondContact O-N 3.19Å; S324-V327 WeakPolarHBondContact OG-CG2 3.36Å; S324-S328 PolarHBondContact O-N 3Å; S324-S328 PolarHBondContact O-OG 3.49Å; S324-I461 VanDerWaalsContact OG-CG2 3.25Å; S324-I461 WeakPolarHBondContact OG-CG2 3.49Å
325	L	82.8	Confident	85.9	Confident	123 Å²	123	49 Å²	49	64%	0.644	25%	0.247	S	C	*	.	H	α-helix	trans	-53.8	-28.6	177	-68.9	175.2	0	0	0	111.8	S323 V327 S328 V329	S323-L325 PolarHBondContact O-N 2.97Å; L325-V327 PolarHBondContact O-N 3.38Å; L325-S328 PolarHBondContact O-N 3.43Å; L325-V329 HydrophobicContact CB-CG2 4.47Å; L325-V329 VanDerWaalsContact O-CB 3.25Å; L325-V329 WeakPolarHBondContact O-CB 3.35Å; L325-V329 VanDerWaalsContact O-CG2 3.28Å; L325-V329 WeakPolarHBondContact O-CG2 3.34Å; L325-V329 PolarHBondContact O-N 2.94Å
326	L	81.9	Confident	86	Confident	31 Å²	31	52 Å²	52	16%	0.162	27%	0.265	C	S	.	.	H	α-helix	trans	-53.9	-35.7	173.9	-177.8	65.4	0	0	0	113.6	S272 H275 L276 S324 P330 I461	S272-L326 VanDerWaalsContact OG-CD2 3.31Å; S272-L326 WeakPolarHBondContact OG-CD2 3.06Å; H275-L326 HydrophobicContact CB-CD1 4.45Å; H275-L326 PolarHBondContact CD2-O 3.36Å; H275-L326 PolarHBondContact NE2-O 3.35Å; L276-L326 HydrophobicContact CD1-CD1 3.93Å; L276-L326 HydrophobicContact CD2-CD1 3.69Å; L276-L326 HydrophobicContact CG-CD1 3.53Å; S324-L326 PolarHBondContact O-N 2.99Å; L326-P330 WeakPolarHBondContact O-CD 3.45Å; L326-P330 WeakPolarHBondContact O-CG 3.15Å; L326-I461 HydrophobicContact CD2-CD1 3.47Å; L326-I461 VanDerWaalsContact CD2-CD1 3.47Å; L326-I461 HydrophobicContact CD2-CG1 4.13Å; L326-I461 HydrophobicContact CG-CD1 4.45Å
327	V	81.6	Confident	85.9	Confident	8 Å²	8	49.6 Å²	49.6	5%	0.048	25%	0.253	C	S	.	.	H	α-helix	trans	-98.7	-39.5	179.6	-176.9	0	0	0	0	110.7	L318 S324 L325 V329 P330 M331 I461 M463	L318-V327 HydrophobicContact CD1-CG1 4.09Å; S324-V327 PolarHBondContact O-N 3.19Å; S324-V327 WeakPolarHBondContact OG-CG2 3.36Å; L325-V327 PolarHBondContact O-N 3.38Å; V327-V329 PolarHBondContact O-N 3.38Å; V327-P330 WeakPolarHBondContact O-CD 3.44Å; V327-M331 WeakPolarHBondContact O-CB 3.38Å; V327-M331 PolarHBondContact O-N 3.04Å; V327-M331 VanDerWaalsContact O-N 3.07Å; V327-I461 HydrophobicContact CG2-CG2 3.99Å; V327-M463 HydrophobicContact CG1-SD 4.27Å; V327-M463 HydrophobicContact CG2-CE 3.56Å; V327-M463 HydrophobicContact CG2-CG 4.22Å; V327-M463 HydrophobicContact CG2-SD 4.12Å
328	S	85.6	Confident	86	Confident	5 Å²	5	49.7 Å²	49.7	4%	0.035	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-39.7	-178.4	-57.2	0	0	0	0	112.6	F315 S323 S324 L325 M331 G332	F315-S328 WeakPolarHBondContact CE2-O 3.31Å; S323-S328 PolarHBondContact O-OG 3.24Å; S324-S328 PolarHBondContact O-N 3Å; S324-S328 PolarHBondContact O-OG 3.49Å; L325-S328 PolarHBondContact O-N 3.43Å; S328-M331 PolarHBondContact O-N 2.95Å; S328-G332 PolarHBondContact O-N 2.9Å
329	V	89	Confident	86.2	Confident	79 Å²	79	53.6 Å²	53.6	48%	0.479	27%	0.274	S	S	.	.	H	α-helix	trans	-68.1	-51.4	-179.6	171	0	0	0	0	111.9	L325 V327 M331 G332 I333	L325-V329 HydrophobicContact CB-CG2 4.47Å; L325-V329 VanDerWaalsContact O-CB 3.25Å; L325-V329 WeakPolarHBondContact O-CB 3.35Å; L325-V329 VanDerWaalsContact O-CG2 3.28Å; L325-V329 WeakPolarHBondContact O-CG2 3.34Å; L325-V329 PolarHBondContact O-N 2.94Å; V327-V329 PolarHBondContact O-N 3.38Å; V329-M331 VanDerWaalsContact C-N 3.28Å; V329-M331 PolarHBondContact O-N 3.49Å; V329-G332 PolarHBondContact O-N 3.44Å; V329-I333 HydrophobicContact CG1-CD1 4.05Å; V329-I333 WeakPolarHBondContact O-CG1 3.48Å; V329-I333 PolarHBondContact O-N 2.99Å
330	P	87.3	Confident	86.3	Confident	11 Å²	11	50.5 Å²	50.5	7%	0.071	26%	0.262	C	S	.	.	H	α-helix	trans	-56.5	-40.1	172	-28.1	37.1	0	0	0	113	L276 F283 L326 V327 G332 I333 S334	L276-P330 HydrophobicContact CD2-CG 4.44Å; F283-P330 HydrophobicContact CE2-CB 4.06Å; F283-P330 HydrophobicContact CZ-CB 3.92Å; F283-P330 WeakPolarHBondContact CZ-O 3.14Å; L326-P330 WeakPolarHBondContact O-CD 3.45Å; L326-P330 WeakPolarHBondContact O-CG 3.15Å; V327-P330 WeakPolarHBondContact O-CD 3.44Å; P330-G332 PolarHBondContact O-N 3.06Å; P330-I333 PolarHBondContact O-N 2.89Å; P330-S334 WeakPolarHBondContact O-CB 3.04Å; P330-S334 PolarHBondContact O-N 3.43Å
331	M	89.1	Confident	86.4	Confident	35 Å²	35	48.2 Å²	48.2	17%	0.172	25%	0.251	C	S	.	.	H	α-helix	trans	-62.5	-42.7	176.5	-172.1	59.6	66	0	0	111.8	I314 F315 L318 V327 S328 V329 I333 S334 T335	I314-M331 HydrophobicContact CB-SD 4.49Å; I314-M331 HydrophobicContact CG2-CE 3.83Å; I314-M331 HydrophobicContact CG2-CG 4.14Å; I314-M331 HydrophobicContact CG2-SD 4.08Å; F315-M331 HydrophobicContact CB-CG 4.01Å; L318-M331 HydrophobicContact CD1-CB 3.95Å; L318-M331 HydrophobicContact CD1-CG 3.98Å; V327-M331 WeakPolarHBondContact O-CB 3.38Å; V327-M331 PolarHBondContact O-N 3.04Å; V327-M331 VanDerWaalsContact O-N 3.07Å; S328-M331 PolarHBondContact O-N 2.95Å; V329-M331 VanDerWaalsContact C-N 3.28Å; V329-M331 PolarHBondContact O-N 3.49Å; M331-I333 PolarHBondContact O-N 2.94Å; M331-S334 VanDerWaalsContact O-CB 3.26Å; M331-S334 WeakPolarHBondContact O-CB 3.45Å; M331-S334 PolarHBondContact O-N 3.27Å; M331-S334 VanDerWaalsContact O-N 3.17Å; M331-T335 PolarHBondContact O-N 3.01Å; M331-T335 PolarHBondContact O-OG1 2.96Å; M331-T335 VanDerWaalsContact O-OG1 3.06Å
332	G	92.7	Very high	86.6	Confident	11 Å²	11	46.1 Å²	46.1	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-41.4	175	0	0	0	0	0	113	F315 S328 V329 P330 S334 T335 L336	F315-G332 VanDerWaalsContact CD2-CA 3.45Å; S328-G332 PolarHBondContact O-N 2.9Å; V329-G332 PolarHBondContact O-N 3.44Å; P330-G332 PolarHBondContact O-N 3.06Å; G332-S334 VanDerWaalsContact C-N 3.33Å; G332-S334 PolarHBondContact O-N 2.89Å; G332-T335 WeakPolarHBondContact O-CB 3.44Å; G332-T335 PolarHBondContact O-N 2.86Å; G332-L336 WeakPolarHBondContact O-CG 3.31Å; G332-L336 PolarHBondContact O-N 3.48Å
333	I	92	Very high	87	Confident	72 Å²	72	40.9 Å²	40.9	37%	0.369	23%	0.229	S	C	.	.	H	α-helix	trans	-62.4	-42.1	173.3	-65.4	167.9	0	0	0	110.6	F283 V329 P330 M331 T335 L336 I337	F283-I333 HydrophobicContact CD2-CG2 3.88Å; F283-I333 HydrophobicContact CE2-CB 4.14Å; F283-I333 HydrophobicContact CE2-CG2 3.91Å; F283-I333 HydrophobicContact CG-CG2 4.23Å; F283-I333 HydrophobicContact CZ-CB 4.32Å; F283-I333 HydrophobicContact CZ-CG2 4.27Å; V329-I333 HydrophobicContact CG1-CD1 4.05Å; V329-I333 WeakPolarHBondContact O-CG1 3.48Å; V329-I333 PolarHBondContact O-N 2.99Å; P330-I333 PolarHBondContact O-N 2.89Å; M331-I333 PolarHBondContact O-N 2.94Å; I333-T335 VanDerWaalsContact C-N 3.34Å; I333-T335 PolarHBondContact O-N 3.31Å; I333-L336 PolarHBondContact O-N 3.02Å; I333-I337 HydrophobicContact CG2-CD1 3.81Å; I333-I337 HydrophobicContact CG2-CG1 4.4Å; I333-I337 WeakPolarHBondContact O-CG1 3.33Å; I333-I337 PolarHBondContact O-N 3.28Å
334	S	89.3	Confident	87.3	Confident	35 Å²	35	46.1 Å²	46.1	25%	0.245	25%	0.246	C	C	.	.	H	α-helix	trans	-58.1	-45.3	175	-167.9	0	0	0	0	111.5	P330 M331 G332 L336 I337 E338	P330-S334 WeakPolarHBondContact O-CB 3.04Å; P330-S334 PolarHBondContact O-N 3.43Å; M331-S334 VanDerWaalsContact O-CB 3.26Å; M331-S334 WeakPolarHBondContact O-CB 3.45Å; M331-S334 PolarHBondContact O-N 3.27Å; M331-S334 VanDerWaalsContact O-N 3.17Å; G332-S334 VanDerWaalsContact C-N 3.33Å; G332-S334 PolarHBondContact O-N 2.89Å; S334-L336 VanDerWaalsContact C-N 3.34Å; S334-L336 PolarHBondContact O-N 3.49Å; S334-I337 PolarHBondContact O-N 2.9Å; S334-E338 WeakPolarHBondContact O-CG 3.33Å; S334-E338 PolarHBondContact O-N 3.38Å
335	T	93	Very high	87.1	Confident	9 Å²	9	44.5 Å²	44.5	6%	0.055	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-42.2	176	-52	0	0	0	0	112	F308 S311 L312 M331 G332 I333 E338 L339	F308-T335 HydrophobicContact CD2-CG2 4.23Å; F308-T335 HydrophobicContact CE2-CG2 3.93Å; S311-T335 PolarHBondContact O-OG1 2.95Å; S311-T335 WeakPolarHBondContact OG-CA 3.38Å; S311-T335 PolarHBondContact OG-N 3.48Å; S311-T335 PolarHBondContact OG-OG1 3.22Å; L312-T335 HydrophobicContact CB-CG2 3.91Å; L312-T335 HydrophobicContact CD1-CG2 3.99Å; M331-T335 PolarHBondContact O-N 3.01Å; M331-T335 PolarHBondContact O-OG1 2.96Å; M331-T335 VanDerWaalsContact O-OG1 3.06Å; G332-T335 WeakPolarHBondContact O-CB 3.44Å; G332-T335 PolarHBondContact O-N 2.86Å; I333-T335 VanDerWaalsContact C-N 3.34Å; I333-T335 PolarHBondContact O-N 3.31Å; T335-E338 PolarHBondContact O-N 3.43Å; T335-L339 WeakPolarHBondContact O-CB 3.43Å; T335-L339 PolarHBondContact O-N 3Å
336	L	94.6	Very high	86.6	Confident	115 Å²	115	40.2 Å²	40.2	60%	0.602	21%	0.214	S	C	*	.	H	α-helix	trans	-65.5	-37.9	176.3	-68.9	174.4	0	0	0	112.3	G332 I333 S334 L339 W340	G332-L336 WeakPolarHBondContact O-CG 3.31Å; G332-L336 PolarHBondContact O-N 3.48Å; I333-L336 PolarHBondContact O-N 3.02Å; S334-L336 VanDerWaalsContact C-N 3.34Å; S334-L336 PolarHBondContact O-N 3.49Å; L336-L339 PolarHBondContact O-N 3.32Å; L336-W340 WeakPolarHBondContact O-CB 3.45Å; L336-W340 PolarHBondContact O-N 3.08Å
337	I	90.9	Very high	85.9	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.067	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-43.7	175.3	-70.6	166.9	0	0	0	110.4	F283 I287 I333 S334 W340 K341	F283-I337 HydrophobicContact CB-CD1 3.78Å; F283-I337 HydrophobicContact CD1-CD1 3.5Å; F283-I337 VanDerWaalsContact CD1-CD1 3.5Å; F283-I337 HydrophobicContact CE1-CD1 4.29Å; F283-I337 HydrophobicContact CG-CD1 3.75Å; I287-I337 HydrophobicContact CD1-CD1 4.07Å; I287-I337 HydrophobicContact CD1-CG1 4.3Å; I287-I337 HydrophobicContact CG1-CD1 4.32Å; I287-I337 HydrophobicContact CG1-CG1 4.41Å; I333-I337 HydrophobicContact CG2-CD1 3.81Å; I333-I337 HydrophobicContact CG2-CG1 4.4Å; I333-I337 WeakPolarHBondContact O-CG1 3.33Å; I333-I337 PolarHBondContact O-N 3.28Å; S334-I337 PolarHBondContact O-N 2.9Å; I337-W340 WeakPolarHBondContact O-CB 3.16Å; I337-W340 PolarHBondContact O-N 3.06Å; I337-K341 WeakPolarHBondContact O-CG 3.29Å; I337-K341 PolarHBondContact O-N 3.24Å
338	E	90.7	Very high	84.7	Confident	8 Å²	8	47.9 Å²	47.9	4%	0.037	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-37.6	175.7	-68.3	-65.6	162.3	0	0	112.1	R307 F308 S334 T335 W340 K341 L342	R307-E338 IonicContact CZ-OE1 2.76Å; R307-E338 IonicContact NE-OE1 3.21Å; R307-E338 PolarHBondContact NE-OE1 3.4Å; R307-E338 IonicContact NE-OE2 3.3Å; R307-E338 IonicContact NH2-OE1 2.65Å; R307-E338 PolarHBondContact NH2-OE1 2.87Å; F308-E338 HydrophobicContact CB-CB 4.13Å; F308-E338 HydrophobicContact CD2-CB 4.43Å; S334-E338 WeakPolarHBondContact O-CG 3.33Å; S334-E338 PolarHBondContact O-N 3.38Å; T335-E338 PolarHBondContact O-N 3.43Å; E338-W340 VanDerWaalsContact C-N 3.34Å; E338-W340 PolarHBondContact O-N 3.27Å; E338-K341 WeakPolarHBondContact O-CB 3.44Å; E338-K341 PolarHBondContact O-N 2.88Å; E338-K341 IonicContact OE1-NZ 2.94Å; E338-K341 PolarHBondContact OE1-NZ 3.24Å; E338-K341 WeakPolarHBondContact OE2-CD 3.47Å; E338-K341 IonicContact OE2-NZ 2.83Å; E338-L342 PolarHBondContact O-N 2.83Å
339	L	91	Very high	82.9	Confident	82 Å²	82	51 Å²	51	43%	0.429	27%	0.267	S	S	.	.	H	α-helix	trans	-61.8	-42.5	172.1	-179.2	59.3	0	0	0	111.7	F308 T335 L336 L342 G343	F308-L339 HydrophobicContact CD2-CB 3.93Å; F308-L339 HydrophobicContact CD2-CD1 4.42Å; F308-L339 HydrophobicContact CE1-CD1 4.49Å; F308-L339 HydrophobicContact CE2-CB 3.73Å; F308-L339 HydrophobicContact CE2-CD1 3.9Å; F308-L339 HydrophobicContact CE2-CG 4.25Å; F308-L339 HydrophobicContact CZ-CD1 3.93Å; T335-L339 WeakPolarHBondContact O-CB 3.43Å; T335-L339 PolarHBondContact O-N 3Å; L336-L339 PolarHBondContact O-N 3.32Å; L339-L342 WeakPolarHBondContact O-CB 3.36Å; L339-L342 PolarHBondContact O-N 2.66Å; L339-G343 PolarHBondContact O-N 3.33Å
340	W	89.9	Confident	80.7	Confident	100 Å²	100	53.6 Å²	53.6	38%	0.379	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-41.6	175.5	172.2	74.4	0	0	0	112.1	W290 L336 I337 E338 L342 G343 R344	W290-W340 HydrophobicContact CB-CH2 3.76Å; W290-W340 HydrophobicContact CB-CZ3 3.56Å; W290-W340 HydrophobicContact CG-CZ3 4.33Å; L336-W340 WeakPolarHBondContact O-CB 3.45Å; L336-W340 PolarHBondContact O-N 3.08Å; I337-W340 WeakPolarHBondContact O-CB 3.16Å; I337-W340 PolarHBondContact O-N 3.06Å; E338-W340 VanDerWaalsContact C-N 3.34Å; E338-W340 PolarHBondContact O-N 3.27Å; W340-L342 VanDerWaalsContact C-N 3.34Å; W340-L342 PolarHBondContact O-N 2.82Å; W340-G343 PolarHBondContact O-N 2.91Å; W340-R344 HydrophobicContact CD2-CG 4.42Å; W340-R344 HydrophobicContact CZ2-CG 4.12Å; W340-R344 WeakPolarHBondContact O-CG 3.34Å; W340-R344 PolarHBondContact O-N 2.98Å
341	K	87.2	Confident	78.5	Confident	3 Å²	3	55.7 Å²	55.7	1%	0.013	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-43.6	173.6	-68	172.1	-166.7	170.9	0	111.6	D286 W290 I304 I337 E338 G343 R344 M345	D286-K341 VanDerWaalsContact CG-NZ 3.31Å; D286-K341 WeakPolarHBondContact OD1-CE 3.29Å; D286-K341 IonicContact OD1-NZ 3.11Å; D286-K341 PolarHBondContact OD1-NZ 3.41Å; D286-K341 WeakPolarHBondContact OD2-CE 2.94Å; D286-K341 IonicContact OD2-NZ 2.75Å; D286-K341 PolarHBondContact OD2-NZ 3.44Å; W290-K341 HydrophobicContact CD2-CD 4.15Å; W290-K341 HydrophobicContact CD2-CG 3.86Å; W290-K341 HydrophobicContact CE3-CG 4.3Å; W290-K341 HydrophobicContact CG-CD 4.43Å; W290-K341 HydrophobicContact CG-CG 4.13Å; W290-K341 HydrophobicContact CZ2-CD 3.93Å; W290-K341 HydrophobicContact CZ2-CG 4.27Å; W290-K341 VanDerWaalsContact NE1-CE 3.33Å; I304-K341 HydrophobicContact CG2-CB 4.22Å; I337-K341 WeakPolarHBondContact O-CG 3.29Å; I337-K341 PolarHBondContact O-N 3.24Å; E338-K341 WeakPolarHBondContact O-CB 3.44Å; E338-K341 PolarHBondContact O-N 2.88Å; E338-K341 IonicContact OE1-NZ 2.94Å; E338-K341 PolarHBondContact OE1-NZ 3.24Å; E338-K341 WeakPolarHBondContact OE2-CD 3.47Å; E338-K341 IonicContact OE2-NZ 2.83Å; K341-G343 VanDerWaalsContact C-N 3.33Å; K341-G343 PolarHBondContact O-N 3.04Å; K341-R344 PolarHBondContact O-N 3.08Å; K341-M345 WeakPolarHBondContact O-CB 3.32Å; K341-M345 WeakPolarHBondContact O-CG 3.26Å; K341-M345 PolarHBondContact O-N 2.96Å
342	L	85.2	Confident	76.6	Confident	30 Å²	30	64.3 Å²	64.3	16%	0.157	33%	0.329	C	S	.	.	H	α-helix	trans	-60.3	-43.3	177.3	-178.5	60.2	0	0	0	111.7	L301 I304 V305 F308 E338 L339 W340 R344 M345 T346	L301-L342 HydrophobicContact CD1-CD1 3.79Å; I304-L342 HydrophobicContact CG2-CB 4.21Å; I304-L342 HydrophobicContact CG2-CD1 4.43Å; V305-L342 HydrophobicContact CG2-CD1 3.45Å; V305-L342 VanDerWaalsContact CG2-CD1 3.45Å; V305-L342 HydrophobicContact CG2-CD2 4.47Å; F308-L342 HydrophobicContact CD1-CD2 4.05Å; F308-L342 HydrophobicContact CG-CD2 4.43Å; E338-L342 PolarHBondContact O-N 2.83Å; L339-L342 WeakPolarHBondContact O-CB 3.36Å; L339-L342 PolarHBondContact O-N 2.66Å; W340-L342 VanDerWaalsContact C-N 3.34Å; W340-L342 PolarHBondContact O-N 2.82Å; L342-R344 PolarHBondContact O-N 3.13Å; L342-M345 PolarHBondContact O-N 3.02Å; L342-T346 HydrophobicContact CD1-CG2 4.23Å; L342-T346 WeakPolarHBondContact O-CG2 3.36Å; L342-T346 PolarHBondContact O-N 3.41Å; L342-T346 VanDerWaalsContact O-N 3.1Å; L342-T346 PolarHBondContact O-OG1 3.06Å
343	G	83.2	Confident	74.5	Confident	34 Å²	34	71.4 Å²	71.4	35%	0.351	36%	0.359	S	S	.	.	H	α-helix	trans	-62.1	-39.8	174.7	0	0	0	0	0	113.3	L339 W340 K341 T346 F348	L339-G343 PolarHBondContact O-N 3.33Å; W340-G343 PolarHBondContact O-N 2.91Å; K341-G343 VanDerWaalsContact C-N 3.33Å; K341-G343 PolarHBondContact O-N 3.04Å; G343-T346 PolarHBondContact O-OG1 3.05Å; G343-F348 PolarHBondContact O-N 3.3Å
344	R	79.6	Confident	72.1	Confident	125 Å²	125	74.1 Å²	74.1	47%	0.472	37%	0.37	S	S	.	.	H	α-helix	trans	-65.6	-45.1	175.8	-73.3	-77.5	-70.8	-179.8	-0.4	112.1	W340 K341 L342 K347	W340-R344 HydrophobicContact CD2-CG 4.42Å; W340-R344 HydrophobicContact CZ2-CG 4.12Å; W340-R344 WeakPolarHBondContact O-CG 3.34Å; W340-R344 PolarHBondContact O-N 2.98Å; K341-R344 PolarHBondContact O-N 3.08Å; L342-R344 PolarHBondContact O-N 3.13Å; R344-K347 PolarHBondContact O-N 3.23Å; R344-K347 VanDerWaalsContact O-N 3.13Å
345	M	73.2	Confident	70.1	Confident	5 Å²	5	74.6 Å²	74.6	3%	0.025	38%	0.38	C	S	.	.	H	α-helix	trans	-71.7	-33.7	-174.9	-81.6	-77.6	-71.7	0	0	114.2	W290 S296 I299 L301 I304 K341 L342 K347 R361	W290-M345 HydrophobicContact CH2-CG 4.16Å; W290-M345 HydrophobicContact CH2-SD 4.41Å; W290-M345 HydrophobicContact CZ3-CG 3.85Å; W290-M345 HydrophobicContact CZ3-SD 4.14Å; S296-M345 WeakPolarHBondContact CB-SD 3.46Å; I299-M345 HydrophobicContact CB-CE 4.13Å; I299-M345 HydrophobicContact CG2-CE 4.22Å; I299-M345 WeakPolarHBondContact O-CE 3.47Å; L301-M345 HydrophobicContact CD1-CB 4.09Å; I304-M345 HydrophobicContact CD1-CB 4.19Å; I304-M345 HydrophobicContact CD1-CE 3.66Å; I304-M345 HydrophobicContact CD1-CG 3.46Å; I304-M345 VanDerWaalsContact CD1-CG 3.46Å; I304-M345 HydrophobicContact CD1-SD 4.13Å; K341-M345 WeakPolarHBondContact O-CB 3.32Å; K341-M345 WeakPolarHBondContact O-CG 3.26Å; K341-M345 PolarHBondContact O-N 2.96Å; L342-M345 PolarHBondContact O-N 3.02Å; M345-K347 PolarHBondContact O-N 3.27Å; M345-R361 PolarHBondContact O-NH1 3.44Å
346	T	72.7	Confident	67.8	Low	33 Å²	33	77.9 Å²	77.9	20%	0.202	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-5.5	172.9	49.9	0	0	0	0	112.7	L301 L342 G343 F348	L301-T346 HydrophobicContact CD1-CG2 3.78Å; L301-T346 HydrophobicContact CD2-CG2 4.34Å; L342-T346 HydrophobicContact CD1-CG2 4.23Å; L342-T346 WeakPolarHBondContact O-CG2 3.36Å; L342-T346 PolarHBondContact O-N 3.41Å; L342-T346 VanDerWaalsContact O-N 3.1Å; L342-T346 PolarHBondContact O-OG1 3.06Å; G343-T346 PolarHBondContact O-OG1 3.05Å; T346-F348 PolarHBondContact O-N 2.94Å
347	K	66.7	Low	65.5	Low	106 Å²	106	80.6 Å²	80.6	46%	0.461	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	40.3	-171.7	-63	179.5	-176.4	170.5	0	111.1	R344 M345 S349	R344-K347 PolarHBondContact O-N 3.23Å; R344-K347 VanDerWaalsContact O-N 3.13Å; M345-K347 PolarHBondContact O-N 3.27Å; K347-S349 PolarHBondContact O-N 3.5Å; K347-S349 VanDerWaalsContact O-N 3.14Å
348	F	56.6	Low	63.7	Low	94 Å²	94	89.1 Å²	89.1	41%	0.412	43%	0.433	S	S	.	.			trans	-68.9	109.3	-172.5	-159.2	-109.1	0	0	0	109.9	G343 T346 I350 V356	G343-F348 PolarHBondContact O-N 3.3Å; T346-F348 PolarHBondContact O-N 2.94Å; F348-I350 HydrophobicContact CD1-CD1 3.89Å; F348-I350 HydrophobicContact CD1-CG1 3.75Å; F348-I350 HydrophobicContact CE1-CD1 3.46Å; F348-I350 VanDerWaalsContact CE1-CD1 3.46Å; F348-I350 HydrophobicContact CE1-CG1 3.33Å; F348-I350 HydrophobicContact CZ-CG1 4.24Å; F348-V356 HydrophobicContact CD2-CG1 4.09Å; F348-V356 HydrophobicContact CE2-CG1 3.37Å; F348-V356 HydrophobicContact CZ-CG1 3.9Å; F348-V356 HydrophobicContact CZ-CG2 4.29Å
349	S	47.1	Very low	62.2	Low	72 Å²	72	90.4 Å²	90.4	50%	0.503	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	106.2	170.7	-176.4	0	0	0	0	108.6	K347 S351	K347-S349 PolarHBondContact O-N 3.5Å; K347-S349 VanDerWaalsContact O-N 3.14Å; S349-S351 PolarHBondContact O-N 3.42Å
350	I	43.9	Very low	60.7	Low	133 Å²	133	96.1 Å²	96.1	68%	0.682	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	106.4	167.2	-71.3	157.7	0	0	0	106.9	F348	F348-I350 HydrophobicContact CD1-CD1 3.89Å; F348-I350 HydrophobicContact CD1-CG1 3.75Å; F348-I350 HydrophobicContact CE1-CD1 3.46Å; F348-I350 VanDerWaalsContact CE1-CD1 3.46Å; F348-I350 HydrophobicContact CE1-CG1 3.33Å; F348-I350 HydrophobicContact CZ-CG1 4.24Å
351	S	40.6	Very low	59.5	Low	54 Å²	54	93.7 Å²	93.7	38%	0.378	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123	163.8	172.7	0	0	0	0	108.7	S349 H353 H354 G355	S349-S351 PolarHBondContact O-N 3.42Å; S351-H353 PolarHBondContact O-N 2.81Å; S351-H353 PolarHBondContact OG-N 3.44Å; S351-H354 PolarHBondContact O-N 2.92Å; S351-G355 PolarHBondContact O-N 3.12Å
352	F	49.6	Very low	58.4	Low	217 Å²	217	95.3 Å²	95.3	95%	0.952	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.2	179	-157.8	-98.1	0	0	0	112.9
353	H	48.6	Very low	57.7	Low	160 Å²	160	102.2 Å²	102.2	74%	0.741	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-18.6	-173.7	-151.3	51.9	0	0	0	114.8	S351	S351-H353 PolarHBondContact O-N 2.81Å; S351-H353 PolarHBondContact OG-N 3.44Å
354	H	40.3	Very low	56.8	Low	129 Å²	129	106 Å²	106	60%	0.597	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.7	16.7	-170.8	-82.2	96.4	0	0	0	115.5	S351	S351-H354 PolarHBondContact O-N 2.92Å
355	G	47.3	Very low	56.3	Low	45 Å²	45	100.6 Å²	100.6	46%	0.464	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	72.3	-178.7	173	0	0	0	0	0	114.5	S351 R357	S351-G355 PolarHBondContact O-N 3.12Å; G355-R357 PolarHBondContact O-N 3.28Å
356	V	44.9	Very low	56.2	Low	78 Å²	78	105 Å²	105	47%	0.473	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	112.8	-174.3	179.8	0	0	0	0	110.1	F348 W358	F348-V356 HydrophobicContact CD2-CG1 4.09Å; F348-V356 HydrophobicContact CE2-CG1 3.37Å; F348-V356 HydrophobicContact CZ-CG1 3.9Å; F348-V356 HydrophobicContact CZ-CG2 4.29Å; V356-W358 HydrophobicContact CG1-CD2 4.42Å; V356-W358 HydrophobicContact CG1-CZ2 4.3Å
357	R	46.8	Very low	56.2	Low	172 Å²	172	106.1 Å²	106.1	65%	0.649	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.4	170.6	-72	-172	-179.4	-174.9	1	110.4	G355	G355-R357 PolarHBondContact O-N 3.28Å
358	W	53.6	Low	56.4	Low	191 Å²	191	102.4 Å²	102.4	72%	0.723	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-83.9	120.9	164.2	-73.5	-65.4	0	0	0	109.5	V356	V356-W358 HydrophobicContact CG1-CD2 4.42Å; V356-W358 HydrophobicContact CG1-CZ2 4.3Å
359	G	57.8	Low	57.1	Low	36 Å²	36	99 Å²	99	37%	0.371	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-67.6	141.9	175.1	0	0	0	0	0	111.6	R361	G359-R361 PolarHBondContact O-N 3.17Å
360	K	59.9	Low	58.6	Low	202 Å²	202	102.1 Å²	102.1	88%	0.878	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-64.8	132	172.6	-71.4	-174.6	177.2	-177.7	0	110.1
361	R	64.8	Low	60	Low	48 Å²	48	101.4 Å²	101.4	18%	0.181	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-82.1	157.2	174.1	-72.5	177.6	72.9	75.3	-4.7	110.1	M345 G359 E365 E366 D369	M345-R361 PolarHBondContact O-NH1 3.44Å; G359-R361 PolarHBondContact O-N 3.17Å; R361-E365 WeakPolarHBondContact CA-OE2 3.37Å; R361-E365 HydrophobicContact CB-CB 4.29Å; R361-E365 WeakPolarHBondContact CB-OE2 3.36Å; R361-E365 IonicContact CZ-OE2 3.47Å; R361-E365 IonicContact NH1-OE2 3.94Å; R361-E366 HydrophobicContact CB-CG 4.28Å; R361-D369 IonicContact CZ-OD2 3.91Å; R361-D369 IonicContact NE-OD2 3.37Å; R361-D369 PolarHBondContact NE-OD2 3.09Å; R361-D369 IonicContact NH2-OD1 2.95Å; R361-D369 IonicContact NH2-OD2 3.67Å; R361-D369 PolarHBondContact NH2-OD2 3.36Å
362	S	65.2	Low	61.5	Low	38 Å²	38	100.5 Å²	100.5	27%	0.266	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-75	159.3	176.3	96	0	0	0	0	110.5	E364 E365 E366	S362-E364 WeakPolarHBondContact CB-OE2 3.5Å; S362-E364 PolarHBondContact O-N 2.86Å; S362-E364 PolarHBondContact OG-N 3.1Å; S362-E364 PolarHBondContact OG-OE2 2.94Å; S362-E365 PolarHBondContact N-OE2 3.16Å; S362-E365 WeakPolarHBondContact O-CB 3.49Å; S362-E365 PolarHBondContact O-N 3.27Å; S362-E365 PolarHBondContact OG-N 2.66Å; S362-E366 PolarHBondContact O-N 3.12Å; S362-E366 VanDerWaalsContact O-N 3.08Å
363	K	70.3	Confident	62.8	Low	174 Å²	174	90.9 Å²	90.9	76%	0.757	45%	0.451	S	S	*	.	H	α-helix	trans	-61.7	-34	178.4	-72.6	-174.2	176.7	-178.3	0	112	E366 A367	K363-E366 PolarHBondContact O-N 2.96Å; K363-A367 WeakPolarHBondContact O-CB 3.23Å; K363-A367 PolarHBondContact O-N 2.92Å
364	E	64.1	Low	64.2	Low	113 Å²	113	89.1 Å²	89.1	53%	0.528	44%	0.443	S	S	.	.	H	α-helix	trans	-70.1	-36	178.3	-55.4	74	-157.3	0	0	111.8	V297 S362 T368	V297-E364 HydrophobicContact CG1-CB 3.87Å; V297-E364 HydrophobicContact CG2-CB 4.48Å; S362-E364 WeakPolarHBondContact CB-OE2 3.5Å; S362-E364 PolarHBondContact O-N 2.86Å; S362-E364 PolarHBondContact OG-N 3.1Å; S362-E364 PolarHBondContact OG-OE2 2.94Å; E364-T368 PolarHBondContact O-N 3.31Å; E364-T368 PolarHBondContact O-OG1 3.5Å
365	E	67.6	Low	66.1	Low	13 Å²	13	87 Å²	87	6%	0.061	43%	0.432	C	S	.	.	H	α-helix	trans	-65.2	-45.8	173	-69.4	175.6	165.2	0	0	111	V297 R361 S362 A367 T368 D369	V297-E365 HydrophobicContact CG2-CG 4.15Å; R361-E365 WeakPolarHBondContact CA-OE2 3.37Å; R361-E365 HydrophobicContact CB-CB 4.29Å; R361-E365 WeakPolarHBondContact CB-OE2 3.36Å; R361-E365 IonicContact CZ-OE2 3.47Å; R361-E365 IonicContact NH1-OE2 3.94Å; S362-E365 PolarHBondContact N-OE2 3.16Å; S362-E365 WeakPolarHBondContact O-CB 3.49Å; S362-E365 PolarHBondContact O-N 3.27Å; S362-E365 PolarHBondContact OG-N 2.66Å; E365-A367 PolarHBondContact O-N 3.06Å; E365-T368 WeakPolarHBondContact O-CB 3.17Å; E365-T368 PolarHBondContact O-N 3.17Å; E365-D369 PolarHBondContact O-N 3.35Å
366	E	71.9	Confident	67.6	Low	97 Å²	97	85.9 Å²	85.9	45%	0.453	42%	0.415	S	S	.	.	H	α-helix	trans	-63.8	-39.3	178.2	-72.9	-178.6	179.4	0	0	112.6	R361 S362 K363 T368 D369 Q370	R361-E366 HydrophobicContact CB-CG 4.28Å; S362-E366 PolarHBondContact O-N 3.12Å; S362-E366 VanDerWaalsContact O-N 3.08Å; K363-E366 PolarHBondContact O-N 2.96Å; E366-T368 VanDerWaalsContact C-N 3.32Å; E366-T368 PolarHBondContact O-N 3.37Å; E366-D369 PolarHBondContact O-N 3.02Å; E366-Q370 VanDerWaalsContact O-CG 3.32Å; E366-Q370 WeakPolarHBondContact O-CG 3.42Å; E366-Q370 PolarHBondContact O-N 3.27Å
367	A	73.1	Confident	69.4	Low	57 Å²	57	89.4 Å²	89.4	47%	0.471	42%	0.42	S	S	.	.	H	α-helix	trans	-62.8	-40.2	175.6	0	0	0	0	0	111.8	K363 E365 Q370 L371	K363-A367 WeakPolarHBondContact O-CB 3.23Å; K363-A367 PolarHBondContact O-N 2.92Å; E365-A367 PolarHBondContact O-N 3.06Å; A367-Q370 PolarHBondContact O-N 3.42Å; A367-L371 PolarHBondContact O-N 2.85Å
368	T	70.7	Confident	71.2	Confident	28 Å²	28	89.7 Å²	89.7	17%	0.172	42%	0.421	C	S	.	.	H	α-helix	trans	-63.8	-45.3	174.7	-51.8	0	0	0	0	110.9	E364 E365 E366 Q370 L371 D372	E364-T368 PolarHBondContact O-N 3.31Å; E364-T368 PolarHBondContact O-OG1 3.5Å; E365-T368 WeakPolarHBondContact O-CB 3.17Å; E365-T368 PolarHBondContact O-N 3.17Å; E366-T368 VanDerWaalsContact C-N 3.32Å; E366-T368 PolarHBondContact O-N 3.37Å; T368-Q370 VanDerWaalsContact C-N 3.29Å; T368-Q370 PolarHBondContact O-N 3.26Å; T368-L371 PolarHBondContact O-N 3.19Å; T368-D372 PolarHBondContact O-N 3.29Å; T368-D372 VanDerWaalsContact O-N 3.15Å
369	D	72.2	Confident	72.5	Confident	21 Å²	21	81.1 Å²	81.1	11%	0.112	39%	0.389	C	S	.	.	H	α-helix	trans	-61.8	-35.2	178.7	-74.9	-42.9	0	0	0	112.3	S300 L301 R361 E365 E366 A373	S300-D369 WeakPolarHBondContact CA-OD1 3.33Å; S300-D369 WeakPolarHBondContact CB-OD1 3.49Å; S300-D369 PolarHBondContact OG-OD1 3.37Å; L301-D369 PolarHBondContact N-OD1 3.01Å; R361-D369 IonicContact CZ-OD2 3.91Å; R361-D369 IonicContact NE-OD2 3.37Å; R361-D369 PolarHBondContact NE-OD2 3.09Å; R361-D369 IonicContact NH2-OD1 2.95Å; R361-D369 IonicContact NH2-OD2 3.67Å; R361-D369 PolarHBondContact NH2-OD2 3.36Å; E365-D369 PolarHBondContact O-N 3.35Å; E366-D369 PolarHBondContact O-N 3.02Å; D369-A373 VanDerWaalsContact O-CB 3.25Å; D369-A373 WeakPolarHBondContact O-CB 3.36Å; D369-A373 PolarHBondContact O-N 3.12Å
370	Q	77.7	Confident	73.8	Confident	138 Å²	138	83.5 Å²	83.5	65%	0.645	39%	0.392	S	S	*	.	H	α-helix	trans	-71.2	-41.8	178.1	-74.3	175.7	14.6	0	0	112.8	E366 A367 T368 A373 Q374	E366-Q370 VanDerWaalsContact O-CG 3.32Å; E366-Q370 WeakPolarHBondContact O-CG 3.42Å; E366-Q370 PolarHBondContact O-N 3.27Å; A367-Q370 PolarHBondContact O-N 3.42Å; T368-Q370 VanDerWaalsContact C-N 3.29Å; T368-Q370 PolarHBondContact O-N 3.26Å; Q370-A373 WeakPolarHBondContact O-CB 3.36Å; Q370-A373 PolarHBondContact O-N 3.29Å; Q370-Q374 PolarHBondContact O-N 3.44Å; Q370-Q374 VanDerWaalsContact O-N 3.14Å
371	L	72.1	Confident	75.1	Confident	118 Å²	118	81.3 Å²	81.3	62%	0.618	38%	0.379	S	S	*	.	H	α-helix	trans	-59.9	-49.2	175.9	-171.1	78.6	0	0	0	110.4	A367 T368 A373 Q374 F375	A367-L371 PolarHBondContact O-N 2.85Å; T368-L371 PolarHBondContact O-N 3.19Å; L371-A373 VanDerWaalsContact C-N 3.31Å; L371-A373 PolarHBondContact O-N 2.85Å; L371-Q374 PolarHBondContact O-N 2.74Å; L371-F375 PolarHBondContact O-N 3.4Å
372	D	73.2	Confident	76	Confident	36 Å²	36	84.1 Å²	84.1	19%	0.193	40%	0.397	C	S	.	.	H	α-helix	trans	-64.6	-35.3	177.4	-81	-1.2	0	0	0	111.8	S300 T368 Q374 F375 M376	S300-D372 WeakPolarHBondContact CB-OD2 3.2Å; T368-D372 PolarHBondContact O-N 3.29Å; T368-D372 VanDerWaalsContact O-N 3.15Å; D372-Q374 VanDerWaalsContact C-N 3.32Å; D372-Q374 PolarHBondContact O-N 2.63Å; D372-F375 PolarHBondContact O-N 2.76Å; D372-M376 WeakPolarHBondContact O-CB 3.41Å; D372-M376 WeakPolarHBondContact O-CG 3.39Å; D372-M376 PolarHBondContact O-N 3.12Å
373	A	77.6	Confident	76.9	Confident	14 Å²	14	82.8 Å²	82.8	12%	0.116	39%	0.387	C	S	.	.	H	α-helix	trans	-62.4	-37.9	177.2	0	0	0	0	0	112.8	D369 Q370 L371 R377	D369-A373 VanDerWaalsContact O-CB 3.25Å; D369-A373 WeakPolarHBondContact O-CB 3.36Å; D369-A373 PolarHBondContact O-N 3.12Å; Q370-A373 WeakPolarHBondContact O-CB 3.36Å; Q370-A373 PolarHBondContact O-N 3.29Å; L371-A373 VanDerWaalsContact C-N 3.31Å; L371-A373 PolarHBondContact O-N 2.85Å; A373-R377 PolarHBondContact O-N 3.02Å; A373-R377 VanDerWaalsContact O-N 3.17Å
374	Q	78.2	Confident	77.7	Confident	124 Å²	124	79 Å²	79	58%	0.579	37%	0.374	S	S	*	.	H	α-helix	trans	-66.4	-45.6	176.3	-171	176.5	16	0	0	110.7	Q370 L371 D372 R377 W378	Q370-Q374 PolarHBondContact O-N 3.44Å; Q370-Q374 VanDerWaalsContact O-N 3.14Å; L371-Q374 PolarHBondContact O-N 2.74Å; D372-Q374 VanDerWaalsContact C-N 3.32Å; D372-Q374 PolarHBondContact O-N 2.63Å; Q374-R377 PolarHBondContact O-N 2.87Å; Q374-W378 VanDerWaalsContact O-CD1 3.3Å; Q374-W378 PolarHBondContact O-N 3.2Å
375	F	78.4	Confident	78.9	Confident	83 Å²	83	77.5 Å²	77.5	36%	0.364	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-48.2	178.2	177.7	-99.8	0	0	0	112.2	L371 D372 R377 W378 L379 L422 P425	L371-F375 PolarHBondContact O-N 3.4Å; D372-F375 PolarHBondContact O-N 2.76Å; F375-R377 VanDerWaalsContact C-N 3.25Å; F375-R377 PolarHBondContact O-N 2.95Å; F375-W378 PolarHBondContact O-N 3.4Å; F375-L379 HydrophobicContact CE1-CD2 4.23Å; F375-L379 PolarHBondContact O-N 3.21Å; F375-L422 HydrophobicContact CE1-CD2 3.96Å; F375-P425 HydrophobicContact CE2-CB 4.03Å; F375-P425 HydrophobicContact CE2-CG 4Å; F375-P425 HydrophobicContact CZ-CB 4.05Å; F375-P425 HydrophobicContact CZ-CG 3.77Å
376	M	79.5	Confident	79.8	Confident	22 Å²	22	82 Å²	82	11%	0.108	40%	0.398	C	S	.	.	H	α-helix	trans	-60.9	-33.1	178.9	-70.1	-70.6	-79.7	0	0	112.4	W306 D372 L379 M380 F418 L422	W306-M376 HydrophobicContact CG-CE 4.49Å; D372-M376 WeakPolarHBondContact O-CB 3.41Å; D372-M376 WeakPolarHBondContact O-CG 3.39Å; D372-M376 PolarHBondContact O-N 3.12Å; M376-L379 WeakPolarHBondContact O-CB 3.42Å; M376-L379 PolarHBondContact O-N 2.82Å; M376-L379 HydrophobicContact SD-CD2 4.35Å; M376-M380 VanDerWaalsContact O-CG 3.32Å; M376-M380 WeakPolarHBondContact O-CG 3.33Å; M376-M380 PolarHBondContact O-N 3.35Å; M376-F418 HydrophobicContact CE-CE1 3.95Å; M376-F418 HydrophobicContact CE-CZ 3.49Å; M376-F418 VanDerWaalsContact CE-CZ 3.49Å; M376-F418 HydrophobicContact SD-CE1 4.28Å; M376-F418 HydrophobicContact SD-CZ 3.8Å; M376-L422 HydrophobicContact SD-CD2 3.98Å
377	R	82.9	Confident	80.6	Confident	153 Å²	153	79.4 Å²	79.4	58%	0.577	39%	0.389	S	S	*	.	H	α-helix	trans	-65	-47.4	176.6	-172.6	-178.8	-63.1	162.4	1.2	112.2	A373 Q374 F375 L379 M380 Y381	A373-R377 PolarHBondContact O-N 3.02Å; A373-R377 VanDerWaalsContact O-N 3.17Å; Q374-R377 PolarHBondContact O-N 2.87Å; F375-R377 VanDerWaalsContact C-N 3.25Å; F375-R377 PolarHBondContact O-N 2.95Å; R377-L379 VanDerWaalsContact C-N 3.28Å; R377-L379 PolarHBondContact O-N 3.46Å; R377-M380 HydrophobicContact CB-CE 4.49Å; R377-M380 PolarHBondContact O-N 3.01Å; R377-Y381 HydrophobicContact CG-CD2 4.46Å; R377-Y381 HydrophobicContact CG-CE2 3.91Å; R377-Y381 VanDerWaalsContact O-CD2 3.23Å; R377-Y381 WeakPolarHBondContact O-CD2 3.44Å; R377-Y381 PolarHBondContact O-N 3.36Å
378	W	83.6	Confident	81.3	Confident	177 Å²	177	81.2 Å²	81.2	67%	0.67	39%	0.39	S	S	*	.	H	α-helix	trans	-61.1	-40.5	174.7	-77.9	106.1	0	0	0	111.6	Q374 F375 M380 Y381	Q374-W378 VanDerWaalsContact O-CD1 3.3Å; Q374-W378 PolarHBondContact O-N 3.2Å; F375-W378 PolarHBondContact O-N 3.4Å; W378-M380 PolarHBondContact O-N 3.25Å; W378-Y381 PolarHBondContact O-N 3.26Å
379	L	82.8	Confident	82.1	Confident	11 Å²	11	81.8 Å²	81.8	6%	0.058	40%	0.402	C	S	.	.	H	α-helix	trans	-61.6	-42.7	177.4	-156.4	65.2	0	0	0	112.5	F375 M376 R377 Y381 I382 M383 F418 L421 L422	F375-L379 HydrophobicContact CE1-CD2 4.23Å; F375-L379 PolarHBondContact O-N 3.21Å; M376-L379 WeakPolarHBondContact O-CB 3.42Å; M376-L379 PolarHBondContact O-N 2.82Å; M376-L379 HydrophobicContact SD-CD2 4.35Å; R377-L379 VanDerWaalsContact C-N 3.28Å; R377-L379 PolarHBondContact O-N 3.46Å; L379-Y381 VanDerWaalsContact C-N 3.33Å; L379-Y381 PolarHBondContact O-N 3Å; L379-I382 PolarHBondContact O-N 3.28Å; L379-M383 HydrophobicContact CG-CG 4.46Å; L379-M383 WeakPolarHBondContact O-CG 3.44Å; L379-M383 PolarHBondContact O-N 3.33Å; L379-F418 HydrophobicContact CD2-CD2 4.42Å; L379-F418 HydrophobicContact CD2-CE1 4.07Å; L379-F418 HydrophobicContact CD2-CE2 3.7Å; L379-F418 HydrophobicContact CD2-CZ 3.52Å; L379-F418 HydrophobicContact CG-CE2 4.1Å; L379-F418 HydrophobicContact CG-CZ 4.38Å; L379-L421 HydrophobicContact CD1-CB 3.85Å; L379-L421 HydrophobicContact CD1-CD1 3.77Å; L379-L421 HydrophobicContact CD1-CG 4.44Å; L379-L421 HydrophobicContact CG-CB 4.39Å; L379-L421 HydrophobicContact CG-CD1 4.37Å; L379-L422 HydrophobicContact CD2-CD2 3.41Å; L379-L422 VanDerWaalsContact CD2-CD2 3.41Å; L379-L422 HydrophobicContact CD2-CG 4.01Å
380	M	83.7	Confident	82.8	Confident	86 Å²	86	82.7 Å²	82.7	42%	0.424	42%	0.416	S	S	.	.	H	α-helix	trans	-62.4	-36.4	177.6	-75.8	-174.7	-63.2	0	0	112.8	M376 R377 W378 I382 M383 I384	M376-M380 VanDerWaalsContact O-CG 3.32Å; M376-M380 WeakPolarHBondContact O-CG 3.33Å; M376-M380 PolarHBondContact O-N 3.35Å; R377-M380 HydrophobicContact CB-CE 4.49Å; R377-M380 PolarHBondContact O-N 3.01Å; W378-M380 PolarHBondContact O-N 3.25Å; M380-I382 PolarHBondContact O-N 3.47Å; M380-M383 PolarHBondContact O-N 3.22Å; M380-I384 HydrophobicContact CB-CD1 4.19Å; M380-I384 WeakPolarHBondContact O-CB 3.39Å; M380-I384 VanDerWaalsContact O-CG1 3.25Å; M380-I384 WeakPolarHBondContact O-CG1 3.17Å; M380-I384 PolarHBondContact O-N 2.61Å
381	Y	87	Confident	83.3	Confident	156 Å²	156	77.1 Å²	77.1	61%	0.612	39%	0.393	S	S	*	.	H	α-helix	trans	-61.3	-31.9	176.1	-77.6	-62.2	0	0	0	113.1	R377 W378 L379 P385	R377-Y381 HydrophobicContact CG-CD2 4.46Å; R377-Y381 HydrophobicContact CG-CE2 3.91Å; R377-Y381 VanDerWaalsContact O-CD2 3.23Å; R377-Y381 WeakPolarHBondContact O-CD2 3.44Å; R377-Y381 PolarHBondContact O-N 3.36Å; W378-Y381 PolarHBondContact O-N 3.26Å; L379-Y381 VanDerWaalsContact C-N 3.33Å; L379-Y381 PolarHBondContact O-N 3Å; Y381-P385 WeakPolarHBondContact O-CD 3.36Å; Y381-P385 WeakPolarHBondContact O-CG 3.5Å
382	I	84.9	Confident	84.1	Confident	107 Å²	107	75.9 Å²	75.9	55%	0.549	39%	0.385	S	S	.	.	H	α-helix	trans	-82.2	-39.4	176.3	-60.5	174	0	0	0	110.4	L379 M380 L421	L379-I382 PolarHBondContact O-N 3.28Å; M380-I382 PolarHBondContact O-N 3.47Å; I382-L421 HydrophobicContact CB-CD1 4.34Å; I382-L421 HydrophobicContact CG2-CD1 3.9Å
383	M	84	Confident	84.8	Confident	11 Å²	11	80.9 Å²	80.9	5%	0.054	40%	0.403	C	S	.	.	H	α-helix	trans	-74.8	-38.5	-174.2	-71.1	-77.2	79.6	0	0	114.6	L379 M380 L386 C387 A417 F418 L421	L379-M383 HydrophobicContact CG-CG 4.46Å; L379-M383 WeakPolarHBondContact O-CG 3.44Å; L379-M383 PolarHBondContact O-N 3.33Å; M380-M383 PolarHBondContact O-N 3.22Å; M383-L386 HydrophobicContact CE-CB 4.13Å; M383-L386 HydrophobicContact CE-CD2 3.68Å; M383-L386 HydrophobicContact CE-CG 4.49Å; M383-L386 PolarHBondContact O-N 2.86Å; M383-C387 WeakPolarHBondContact O-CB 3.42Å; M383-C387 PolarHBondContact O-N 3.04Å; M383-C387 PolarHBondContact O-SG 3.49Å; M383-A417 HydrophobicContact SD-CB 4.36Å; M383-F418 HydrophobicContact CB-CD2 4.28Å; M383-F418 HydrophobicContact CG-CD2 3.7Å; M383-F418 HydrophobicContact CG-CE2 4.22Å; M383-F418 HydrophobicContact SD-CB 4.24Å; M383-F418 HydrophobicContact SD-CD2 4.14Å; M383-L421 HydrophobicContact CE-CD1 3.14Å; M383-L421 HydrophobicContact CE-CG 3.56Å; M383-L421 HydrophobicContact CG-CD1 3.6Å; M383-L421 HydrophobicContact CG-CG 4.46Å; M383-L421 HydrophobicContact SD-CB 4.04Å; M383-L421 HydrophobicContact SD-CD1 3.41Å; M383-L421 WeakPolarHBondContact SD-CD1 3.32Å; M383-L421 HydrophobicContact SD-CG 3.71Å
384	I	86.8	Confident	85.2	Confident	94 Å²	94	80.4 Å²	80.4	48%	0.482	40%	0.398	S	S	.	.	H	α-helix	trans	-60	-50.9	-176.9	-70.8	166.6	0	0	0	111.2	M380 L386 C387 I388	M380-I384 HydrophobicContact CB-CD1 4.19Å; M380-I384 WeakPolarHBondContact O-CB 3.39Å; M380-I384 VanDerWaalsContact O-CG1 3.25Å; M380-I384 WeakPolarHBondContact O-CG1 3.17Å; M380-I384 PolarHBondContact O-N 2.61Å; I384-L386 VanDerWaalsContact C-N 3.32Å; I384-L386 PolarHBondContact O-N 3.37Å; I384-C387 PolarHBondContact O-N 3.14Å; I384-I388 HydrophobicContact CG2-CD1 3.64Å; I384-I388 HydrophobicContact CG2-CG1 4.42Å; I384-I388 VanDerWaalsContact O-CG1 3.27Å; I384-I388 WeakPolarHBondContact O-CG1 3.29Å; I384-I388 PolarHBondContact O-N 2.99Å
385	P	89.1	Confident	85.5	Confident	81 Å²	81	76.3 Å²	76.3	53%	0.526	38%	0.38	S	S	.	.	H	α-helix	trans	-59.7	-39.9	176.6	-24.2	34	0	0	0	113.4	Y381 I388 G389	Y381-P385 WeakPolarHBondContact O-CD 3.36Å; Y381-P385 WeakPolarHBondContact O-CG 3.5Å; P385-I388 PolarHBondContact O-N 2.87Å; P385-G389 PolarHBondContact O-N 2.9Å
386	L	86.7	Confident	85.7	Confident	108 Å²	108	78.4 Å²	78.4	57%	0.565	39%	0.39	S	S	*	.	H	α-helix	trans	-65.1	-43.8	179.9	-156.5	93.4	0	0	0	111.4	M383 I384 G389 G390 A417	M383-L386 HydrophobicContact CE-CB 4.13Å; M383-L386 HydrophobicContact CE-CD2 3.68Å; M383-L386 HydrophobicContact CE-CG 4.49Å; M383-L386 PolarHBondContact O-N 2.86Å; I384-L386 VanDerWaalsContact C-N 3.32Å; I384-L386 PolarHBondContact O-N 3.37Å; L386-G389 PolarHBondContact O-N 3.49Å; L386-G390 PolarHBondContact O-N 3.14Å; L386-A417 HydrophobicContact CD2-CB 4.27Å
387	C	87.5	Confident	85.8	Confident	42 Å²	42	85 Å²	85	28%	0.284	42%	0.415	S	S	.	.	H	α-helix	trans	-66.7	-40.3	177.6	-65.2	0	0	0	0	111.6	M383 I384 G390 S391	M383-C387 WeakPolarHBondContact O-CB 3.42Å; M383-C387 PolarHBondContact O-N 3.04Å; M383-C387 PolarHBondContact O-SG 3.49Å; I384-C387 PolarHBondContact O-N 3.14Å; C387-G390 PolarHBondContact O-N 2.86Å; C387-S391 VanDerWaalsContact O-CB 3.26Å; C387-S391 WeakPolarHBondContact O-CB 3.24Å; C387-S391 PolarHBondContact O-N 2.96Å
388	I	87.8	Confident	85.6	Confident	95 Å²	95	81 Å²	81	49%	0.487	40%	0.404	S	S	.	.	H	α-helix	trans	-63.6	-47.9	176.2	-68.5	168	0	0	0	110.4	I384 P385 G390 S391 I392	I384-I388 HydrophobicContact CG2-CD1 3.64Å; I384-I388 HydrophobicContact CG2-CG1 4.42Å; I384-I388 VanDerWaalsContact O-CG1 3.27Å; I384-I388 WeakPolarHBondContact O-CG1 3.29Å; I384-I388 PolarHBondContact O-N 2.99Å; P385-I388 PolarHBondContact O-N 2.87Å; I388-G390 PolarHBondContact O-N 3.27Å; I388-S391 WeakPolarHBondContact O-CB 3.37Å; I388-S391 PolarHBondContact O-N 3.33Å; I388-I392 HydrophobicContact CG2-CD1 3.92Å; I388-I392 WeakPolarHBondContact O-CG1 3.42Å; I388-I392 PolarHBondContact O-N 3.37Å
389	G	89	Confident	85.3	Confident	40 Å²	40	76 Å²	76	41%	0.412	39%	0.394	S	S	.	.	H	α-helix	trans	-60.2	-44.4	177.6	0	0	0	0	0	112.5	P385 L386 I392 Y393	P385-G389 PolarHBondContact O-N 2.9Å; L386-G389 PolarHBondContact O-N 3.49Å; G389-I392 PolarHBondContact O-N 3.32Å; G389-Y393 PolarHBondContact O-N 3.2Å
390	G	86.4	Confident	85	Confident	40 Å²	40	75.8 Å²	75.8	41%	0.412	39%	0.393	S	S	.	.	H	α-helix	trans	-64.6	-37.9	175.7	0	0	0	0	0	113.6	L386 C387 I388 Y393 S394	L386-G390 PolarHBondContact O-N 3.14Å; C387-G390 PolarHBondContact O-N 2.86Å; I388-G390 PolarHBondContact O-N 3.27Å; G390-Y393 PolarHBondContact O-N 3.31Å; G390-S394 WeakPolarHBondContact O-CB 3.29Å; G390-S394 PolarHBondContact O-N 2.87Å
391	S	88.4	Confident	84.4	Confident	22 Å²	22	76.6 Å²	76.6	15%	0.154	39%	0.391	C	S	.	.	H	α-helix	trans	-63.2	-45.5	176.3	-175.6	0	0	0	0	112.1	C387 I388 S394 L395 W406 T410	C387-S391 VanDerWaalsContact O-CB 3.26Å; C387-S391 WeakPolarHBondContact O-CB 3.24Å; C387-S391 PolarHBondContact O-N 2.96Å; I388-S391 WeakPolarHBondContact O-CB 3.37Å; I388-S391 PolarHBondContact O-N 3.33Å; S391-S394 PolarHBondContact O-N 3.39Å; S391-L395 PolarHBondContact O-N 3.4Å; S391-W406 PolarHBondContact O-NE1 2.78Å; S391-W406 WeakPolarHBondContact OG-CZ2 3.45Å; S391-T410 VanDerWaalsContact CB-CG2 3.43Å; S391-T410 WeakPolarHBondContact OG-CG2 3.32Å
392	I	88.7	Confident	84	Confident	91 Å²	91	71 Å²	71	47%	0.467	38%	0.375	S	S	.	.	H	α-helix	trans	-62.8	-46.2	177	-67	168.6	0	0	0	110	I388 G389 S394 L395 F396	I388-I392 HydrophobicContact CG2-CD1 3.92Å; I388-I392 WeakPolarHBondContact O-CG1 3.42Å; I388-I392 PolarHBondContact O-N 3.37Å; G389-I392 PolarHBondContact O-N 3.32Å; I392-S394 PolarHBondContact O-N 2.93Å; I392-L395 PolarHBondContact O-N 3.14Å; I392-F396 HydrophobicContact CG2-CD2 3.88Å; I392-F396 HydrophobicContact CG2-CE2 3.85Å; I392-F396 VanDerWaalsContact O-CD2 3.28Å; I392-F396 WeakPolarHBondContact O-CD2 3.15Å; I392-F396 PolarHBondContact O-N 3.32Å
393	Y	87.3	Confident	84	Confident	141 Å²	141	72.8 Å²	72.8	55%	0.553	38%	0.375	S	S	*	.	H	α-helix	trans	-59.2	-47.3	177.2	179.7	-94.5	0	0	0	112	G389 G390 L395 F396 Y397	G389-Y393 PolarHBondContact O-N 3.2Å; G390-Y393 PolarHBondContact O-N 3.31Å; Y393-L395 VanDerWaalsContact C-N 3.26Å; Y393-L395 PolarHBondContact O-N 3.2Å; Y393-F396 PolarHBondContact O-N 3.02Å; Y393-Y397 AromaticContact CD2-CD2 3.46Å; Y393-Y397 HydrophobicContact CD2-CD2 3.46Å; Y393-Y397 VanDerWaalsContact CD2-CD2 3.46Å; Y393-Y397 AromaticContact CD2-CE2 3.85Å; Y393-Y397 HydrophobicContact CD2-CE2 3.85Å; Y393-Y397 HydrophobicContact CD2-CG 4.41Å; Y393-Y397 AromaticContact CE2-CD2 3.44Å; Y393-Y397 HydrophobicContact CE2-CD2 3.44Å; Y393-Y397 VanDerWaalsContact CE2-CD2 3.44Å; Y393-Y397 AromaticContact CE2-CE2 3.9Å; Y393-Y397 HydrophobicContact CE2-CE2 3.9Å; Y393-Y397 HydrophobicContact CE2-CG 4.01Å; Y393-Y397 HydrophobicContact CG-CD2 4.14Å; Y393-Y397 WeakPolarHBondContact O-CD2 3.49Å; Y393-Y397 PolarHBondContact O-N 3.4Å; Y393-Y397 VanDerWaalsContact O-N 3.09Å
394	S	85.4	Confident	84.1	Confident	4 Å²	4	78 Å²	78	3%	0.028	40%	0.395	C	S	.	.	H	α-helix	trans	-59.8	-36.8	178.4	-179.3	0	0	0	0	112.3	G390 S391 I392 L398 H400	G390-S394 WeakPolarHBondContact O-CB 3.29Å; G390-S394 PolarHBondContact O-N 2.87Å; S391-S394 PolarHBondContact O-N 3.39Å; I392-S394 PolarHBondContact O-N 2.93Å; S394-L398 WeakPolarHBondContact O-CB 3.41Å; S394-L398 PolarHBondContact O-N 3.4Å; S394-H400 PolarHBondContact O-NE2 2.74Å; S394-H400 PolarHBondContact OG-CE1 3.46Å; S394-H400 VanDerWaalsContact OG-CE1 3.3Å; S394-H400 PolarHBondContact OG-NE2 2.92Å; S394-H400 VanDerWaalsContact OG-NE2 3.07Å
395	L	85.7	Confident	84	Confident	38 Å²	38	74 Å²	74	20%	0.199	38%	0.376	C	S	.	.	H	α-helix	trans	-67.7	-36.3	179.7	-173.9	61.2	0	0	0	113.3	L129 S391 I392 Y393 W403 W406	L129-L395 HydrophobicContact CD1-CD1 4.42Å; S391-L395 PolarHBondContact O-N 3.4Å; I392-L395 PolarHBondContact O-N 3.14Å; Y393-L395 VanDerWaalsContact C-N 3.26Å; Y393-L395 PolarHBondContact O-N 3.2Å; L395-W403 HydrophobicContact CD1-CH2 4.2Å; L395-W403 HydrophobicContact CD1-CZ3 4Å; L395-W406 HydrophobicContact CB-CZ2 4.21Å; L395-W406 HydrophobicContact CD1-CD2 4.26Å; L395-W406 HydrophobicContact CD1-CG 4.41Å; L395-W406 HydrophobicContact CD1-CZ2 4.34Å; L395-W406 HydrophobicContact CD2-CZ2 4.28Å
396	F	83.3	Confident	83.9	Confident	128 Å²	128	72.4 Å²	72.4	56%	0.561	36%	0.359	S	S	*	.	H	α-helix	trans	-86.3	-35.9	-176	-79.8	-69.4	0	0	0	113.8	M130 I392 Y393	M130-F396 HydrophobicContact CE-CE1 4.45Å; I392-F396 HydrophobicContact CG2-CD2 3.88Å; I392-F396 HydrophobicContact CG2-CE2 3.85Å; I392-F396 VanDerWaalsContact O-CD2 3.28Å; I392-F396 WeakPolarHBondContact O-CD2 3.15Å; I392-F396 PolarHBondContact O-N 3.32Å; Y393-F396 PolarHBondContact O-N 3.02Å
397	Y	80.9	Confident	84	Confident	161 Å²	161	70 Å²	70	63%	0.631	35%	0.351	S	S	*	.	H	α-helix	trans	-110.8	-20.2	-167.6	-65.7	-76.5	0	0	0	114.6	Y393	Y393-Y397 AromaticContact CD2-CD2 3.46Å; Y393-Y397 HydrophobicContact CD2-CD2 3.46Å; Y393-Y397 VanDerWaalsContact CD2-CD2 3.46Å; Y393-Y397 AromaticContact CD2-CE2 3.85Å; Y393-Y397 HydrophobicContact CD2-CE2 3.85Å; Y393-Y397 HydrophobicContact CD2-CG 4.41Å; Y393-Y397 AromaticContact CE2-CD2 3.44Å; Y393-Y397 HydrophobicContact CE2-CD2 3.44Å; Y393-Y397 VanDerWaalsContact CE2-CD2 3.44Å; Y393-Y397 AromaticContact CE2-CE2 3.9Å; Y393-Y397 HydrophobicContact CE2-CE2 3.9Å; Y393-Y397 HydrophobicContact CE2-CG 4.01Å; Y393-Y397 HydrophobicContact CG-CD2 4.14Å; Y393-Y397 WeakPolarHBondContact O-CD2 3.49Å; Y393-Y397 PolarHBondContact O-N 3.4Å; Y393-Y397 VanDerWaalsContact O-N 3.09Å
398	L	78.3	Confident	84	Confident	67 Å²	67	68.4 Å²	68.4	35%	0.351	34%	0.339	S	S	.	.	S	Bend	trans	-104.2	132.8	-178.2	-63.4	173.2	0	0	0	110.7	S394 H400	S394-L398 WeakPolarHBondContact O-CB 3.41Å; S394-L398 PolarHBondContact O-N 3.4Å; L398-H400 PolarHBondContact O-CD2 3.06Å; L398-H400 PolarHBondContact O-NE2 3.02Å
399	P	77.6	Confident	83.9	Confident	73 Å²	73	65.6 Å²	65.6	47%	0.474	32%	0.324	S	S	.	.			trans	-73.9	136.1	172.8	29.3	-32.2	0	0	0	110.3	N128	N128-P399 WeakPolarHBondContact OD1-CA 3.31Å; N128-P399 WeakPolarHBondContact OD1-CB 3.33Å
400	H	76.2	Confident	83.9	Confident	6 Å²	6	64.9 Å²	64.9	3%	0.028	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-129.4	141.7	-176.6	-67.3	-69.9	0	0	0	110.1	F127 L129 S394 L398 S402 W406 E409	F127-H400 PolarHBondContact O-N 2.88Å; L129-H400 HydrophobicContact CD1-CB 3.64Å; L129-H400 HydrophobicContact CG-CB 4.19Å; S394-H400 PolarHBondContact O-NE2 2.74Å; S394-H400 PolarHBondContact OG-CE1 3.46Å; S394-H400 VanDerWaalsContact OG-CE1 3.3Å; S394-H400 PolarHBondContact OG-NE2 2.92Å; S394-H400 VanDerWaalsContact OG-NE2 3.07Å; L398-H400 PolarHBondContact O-CD2 3.06Å; L398-H400 PolarHBondContact O-NE2 3.02Å; H400-S402 VanDerWaalsContact C-N 3.33Å; H400-S402 PolarHBondContact O-N 2.83Å; H400-W406 HydrophobicContact CB-CB 4.13Å; H400-W406 AromaticContact CD2-CD1 3.69Å; H400-W406 AromaticContact NE2-CD1 3.57Å; H400-E409 IonicContact CE1-OE2 3.4Å; H400-E409 PolarHBondContact CE1-OE2 2.91Å; H400-E409 IonicContact ND1-OE2 3.92Å; H400-E409 PolarHBondContact ND1-OE2 2.91Å
401	R	70.4	Confident	84	Confident	103 Å²	103	67.1 Å²	67.1	39%	0.389	31%	0.313	S	S	.	.	S	Bend	trans	-65.7	-36.9	178	-68.8	179	-174.4	159.2	9	112.9	T126 F127	T126-R401 HydrophobicContact CG2-CG 3.95Å; F127-R401 WeakPolarHBondContact CE1-O 3.43Å; F127-R401 WeakPolarHBondContact CZ-O 3.31Å
402	S	80.2	Confident	84.1	Confident	39 Å²	39	66.1 Å²	66.1	27%	0.273	31%	0.305	S	S	.	.			trans	-158.5	166.1	-174.8	73.3	0	0	0	0	110.5	H400 Y404 S405 W406	H400-S402 VanDerWaalsContact C-N 3.33Å; H400-S402 PolarHBondContact O-N 2.83Å; S402-Y404 PolarHBondContact O-N 3.34Å; S402-Y404 PolarHBondContact OG-N 2.77Å; S402-S405 PolarHBondContact O-N 2.99Å; S402-S405 PolarHBondContact OG-N 3.05Å; S402-S405 PolarHBondContact OG-OG 2.82Å; S402-W406 PolarHBondContact O-N 3.41Å
403	W	84.1	Confident	84.1	Confident	145 Å²	145	64.4 Å²	64.4	55%	0.549	30%	0.297	S	S	.	.	H	α-helix	trans	-59.1	-33.1	170	-74.3	99.9	0	0	0	112.8	L129 L395 W406 C407	L129-W403 HydrophobicContact CD1-CD2 4.48Å; L129-W403 HydrophobicContact CD2-CD2 4.45Å; L129-W403 HydrophobicContact CD2-CG 4.26Å; L395-W403 HydrophobicContact CD1-CH2 4.2Å; L395-W403 HydrophobicContact CD1-CZ3 4Å; W403-W406 AromaticContact CE3-CE3 3.9Å; W403-W406 HydrophobicContact CE3-CE3 3.9Å; W403-W406 HydrophobicContact CE3-CZ3 4.17Å; W403-W406 HydrophobicContact CZ3-CE3 4.24Å; W403-W406 HydrophobicContact CZ3-CZ3 4.23Å; W403-C407 WeakPolarHBondContact O-CB 3.4Å; W403-C407 PolarHBondContact O-N 3Å
404	Y	85.6	Confident	84.2	Confident	120 Å²	120	58.3 Å²	58.3	47%	0.471	28%	0.277	S	S	.	.	H	α-helix	trans	-64.9	-48.3	175.2	175.3	-102.6	0	0	0	111.2	E320 S402 W406 C407 L408	E320-Y404 HydrophobicContact CG-CE1 4.3Å; S402-Y404 PolarHBondContact O-N 3.34Å; S402-Y404 PolarHBondContact OG-N 2.77Å; Y404-W406 PolarHBondContact O-N 3.22Å; Y404-C407 PolarHBondContact O-N 2.94Å; Y404-L408 HydrophobicContact CE1-CD2 4.01Å; Y404-L408 WeakPolarHBondContact O-CB 3.31Å; Y404-L408 PolarHBondContact O-N 2.87Å
405	S	84.4	Confident	84.3	Confident	11 Å²	11	58.6 Å²	58.6	8%	0.077	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-41.4	179.7	-41.6	0	0	0	0	111.4	E320 S402 L408 E409	E320-S405 PolarHBondContact OE1-OG 3.45Å; S402-S405 PolarHBondContact O-N 2.99Å; S402-S405 PolarHBondContact OG-N 3.05Å; S402-S405 PolarHBondContact OG-OG 2.82Å; S405-L408 PolarHBondContact O-N 3.38Å; S405-E409 WeakPolarHBondContact O-CB 3.49Å; S405-E409 PolarHBondContact O-N 3.37Å
406	W	87.6	Confident	84.3	Confident	47 Å²	47	57.8 Å²	57.8	18%	0.178	27%	0.273	C	S	.	.	H	α-helix	trans	-60.4	-46.5	174.3	167.7	74.8	0	0	0	112.8	L129 S391 L395 H400 S402 W403 Y404 L408 T410	L129-W406 HydrophobicContact CD1-CB 4.09Å; S391-W406 PolarHBondContact O-NE1 2.78Å; S391-W406 WeakPolarHBondContact OG-CZ2 3.45Å; L395-W406 HydrophobicContact CB-CZ2 4.21Å; L395-W406 HydrophobicContact CD1-CD2 4.26Å; L395-W406 HydrophobicContact CD1-CG 4.41Å; L395-W406 HydrophobicContact CD1-CZ2 4.34Å; L395-W406 HydrophobicContact CD2-CZ2 4.28Å; H400-W406 HydrophobicContact CB-CB 4.13Å; H400-W406 AromaticContact CD2-CD1 3.69Å; H400-W406 AromaticContact NE2-CD1 3.57Å; S402-W406 PolarHBondContact O-N 3.41Å; W403-W406 AromaticContact CE3-CE3 3.9Å; W403-W406 HydrophobicContact CE3-CE3 3.9Å; W403-W406 HydrophobicContact CE3-CZ3 4.17Å; W403-W406 HydrophobicContact CZ3-CE3 4.24Å; W403-W406 HydrophobicContact CZ3-CZ3 4.23Å; Y404-W406 PolarHBondContact O-N 3.22Å; W406-L408 VanDerWaalsContact C-N 3.35Å; W406-T410 WeakPolarHBondContact O-CB 3.43Å; W406-T410 PolarHBondContact O-N 3.46Å; W406-T410 PolarHBondContact O-OG1 2.89Å
407	C	88.4	Confident	84.3	Confident	58 Å²	58	52.7 Å²	52.7	39%	0.392	26%	0.255	S	S	.	.	H	α-helix	trans	-62.2	-46.4	179.2	-175.9	0	0	0	0	110.5	W403 Y404 T410 M411	W403-C407 WeakPolarHBondContact O-CB 3.4Å; W403-C407 PolarHBondContact O-N 3Å; Y404-C407 PolarHBondContact O-N 2.94Å; C407-T410 WeakPolarHBondContact O-CB 3.37Å; C407-T410 PolarHBondContact O-N 2.94Å; C407-M411 VanDerWaalsContact O-CG 3.29Å; C407-M411 WeakPolarHBondContact O-CG 3.41Å; C407-M411 PolarHBondContact O-N 3.2Å
408	L	87.9	Confident	84.5	Confident	7 Å²	7	45.6 Å²	45.6	4%	0.037	23%	0.227	C	C	.	.	H	α-helix	trans	-63.5	-46	-179.6	-168.8	65.3	0	0	0	111.9	L316 H317 E320 Y404 S405 W406 T410 M411 V412	L316-L408 HydrophobicContact CB-CD1 3.84Å; L316-L408 HydrophobicContact CB-CD2 4.42Å; H317-L408 HydrophobicContact CB-CD2 4.17Å; H317-L408 HydrophobicContact CB-CG 4.06Å; E320-L408 HydrophobicContact CB-CD2 3.67Å; E320-L408 HydrophobicContact CG-CD2 4.02Å; Y404-L408 HydrophobicContact CE1-CD2 4.01Å; Y404-L408 WeakPolarHBondContact O-CB 3.31Å; Y404-L408 PolarHBondContact O-N 2.87Å; S405-L408 PolarHBondContact O-N 3.38Å; W406-L408 VanDerWaalsContact C-N 3.35Å; L408-T410 VanDerWaalsContact C-N 3.32Å; L408-T410 PolarHBondContact O-N 2.98Å; L408-M411 PolarHBondContact O-N 3.42Å; L408-V412 WeakPolarHBondContact O-CG2 3.38Å; L408-V412 PolarHBondContact O-N 2.99Å
409	E	85.7	Confident	84.6	Confident	37 Å²	37	43.6 Å²	43.6	17%	0.173	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-41.1	176.6	-169.6	-178.2	160.6	0	0	111.8	H400 S405 M411 V412 N413	H400-E409 IonicContact CE1-OE2 3.4Å; H400-E409 PolarHBondContact CE1-OE2 2.91Å; H400-E409 IonicContact ND1-OE2 3.92Å; H400-E409 PolarHBondContact ND1-OE2 2.91Å; S405-E409 WeakPolarHBondContact O-CB 3.49Å; S405-E409 PolarHBondContact O-N 3.37Å; E409-M411 PolarHBondContact O-N 3.41Å; E409-V412 PolarHBondContact O-N 3.26Å; E409-N413 WeakPolarHBondContact O-CB 3.45Å; E409-N413 VanDerWaalsContact O-CG 3.27Å; E409-N413 PolarHBondContact O-N 3.43Å; E409-N413 PolarHBondContact O-ND2 2.72Å
410	T	89	Confident	84.7	Confident	24 Å²	24	42.9 Å²	42.9	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-45.7	174.6	-61.3	0	0	0	0	111.3	S391 W406 C407 L408 V412 N413 G414	S391-T410 VanDerWaalsContact CB-CG2 3.43Å; S391-T410 WeakPolarHBondContact OG-CG2 3.32Å; W406-T410 WeakPolarHBondContact O-CB 3.43Å; W406-T410 PolarHBondContact O-N 3.46Å; W406-T410 PolarHBondContact O-OG1 2.89Å; C407-T410 WeakPolarHBondContact O-CB 3.37Å; C407-T410 PolarHBondContact O-N 2.94Å; L408-T410 VanDerWaalsContact C-N 3.32Å; L408-T410 PolarHBondContact O-N 2.98Å; T410-V412 VanDerWaalsContact C-N 3.34Å; T410-V412 PolarHBondContact O-N 2.93Å; T410-N413 PolarHBondContact O-N 3.17Å; T410-G414 PolarHBondContact O-N 3.48Å
411	M	89.9	Confident	84.9	Confident	88 Å²	88	44.4 Å²	44.4	43%	0.433	22%	0.223	S	C	.	.	H	α-helix	trans	-61.7	-42.6	178	-71.8	177.2	76.7	0	0	111.6	I313 C407 L408 E409 G414 V415	I313-M411 HydrophobicContact CD1-CE 3.63Å; I313-M411 HydrophobicContact CG1-CE 3.85Å; I313-M411 HydrophobicContact CG2-CB 3.79Å; C407-M411 VanDerWaalsContact O-CG 3.29Å; C407-M411 WeakPolarHBondContact O-CG 3.41Å; C407-M411 PolarHBondContact O-N 3.2Å; L408-M411 PolarHBondContact O-N 3.42Å; E409-M411 PolarHBondContact O-N 3.41Å; M411-G414 PolarHBondContact O-N 2.94Å; M411-V415 WeakPolarHBondContact O-CG2 3.29Å; M411-V415 PolarHBondContact O-N 3.46Å
412	V	89.9	Confident	85.2	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.1	-47.3	178.7	171.9	0	0	0	0	111.4	I313 H317 L408 E409 T410 G414 V415 Y416	I313-V412 HydrophobicContact CG2-CB 4.43Å; I313-V412 HydrophobicContact CG2-CG2 3.65Å; H317-V412 HydrophobicContact CB-CB 4.5Å; H317-V412 HydrophobicContact CB-CG2 3.27Å; H317-V412 VanDerWaalsContact CG-CG2 3.47Å; L408-V412 WeakPolarHBondContact O-CG2 3.38Å; L408-V412 PolarHBondContact O-N 2.99Å; E409-V412 PolarHBondContact O-N 3.26Å; T410-V412 VanDerWaalsContact C-N 3.34Å; T410-V412 PolarHBondContact O-N 2.93Å; V412-G414 PolarHBondContact O-N 2.86Å; V412-V415 PolarHBondContact O-N 2.8Å; V412-V415 VanDerWaalsContact O-N 3.15Å; V412-Y416 HydrophobicContact CG1-CD2 3.67Å; V412-Y416 HydrophobicContact CG1-CE2 3.12Å; V412-Y416 WeakPolarHBondContact O-CD2 3.22Å; V412-Y416 PolarHBondContact O-N 3.11Å
413	N	88.2	Confident	85.1	Confident	56 Å²	56	43.5 Å²	43.5	30%	0.299	22%	0.221	S	C	.	.	H	α-helix	trans	-59.9	-39	175.9	-71	-24.5	0	0	0	110.9	E409 T410 Y416 A417 S466	E409-N413 WeakPolarHBondContact O-CB 3.45Å; E409-N413 VanDerWaalsContact O-CG 3.27Å; E409-N413 PolarHBondContact O-N 3.43Å; E409-N413 PolarHBondContact O-ND2 2.72Å; T410-N413 PolarHBondContact O-N 3.17Å; N413-Y416 PolarHBondContact O-N 3.38Å; N413-A417 WeakPolarHBondContact O-CB 3.48Å; N413-A417 PolarHBondContact O-N 3.01Å; N413-S466 WeakPolarHBondContact OD1-CB 3.4Å; N413-S466 PolarHBondContact OD1-OG 3.27Å; N413-S466 VanDerWaalsContact OD1-OG 3.09Å
414	G	88.5	Confident	84.6	Confident	13 Å²	13	39.2 Å²	39.2	13%	0.134	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-46.3	172.4	0	0	0	0	0	113.2	T410 M411 V412 Y416 A417 F418	T410-G414 PolarHBondContact O-N 3.48Å; M411-G414 PolarHBondContact O-N 2.94Å; V412-G414 PolarHBondContact O-N 2.86Å; G414-Y416 PolarHBondContact O-N 3.12Å; G414-A417 PolarHBondContact O-N 2.92Å; G414-F418 WeakPolarHBondContact O-CB 3.49Å; G414-F418 PolarHBondContact O-N 3.19Å
415	V	88.2	Confident	84	Confident	9 Å²	9	35.6 Å²	35.6	6%	0.055	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-45.4	176	164.7	0	0	0	0	111.1	W306 S310 I313 I314 M411 V412 F418 G419	W306-V415 HydrophobicContact CZ2-CG2 4.36Å; S310-V415 VanDerWaalsContact CB-CG1 3.45Å; I313-V415 HydrophobicContact CB-CG2 4.24Å; I313-V415 HydrophobicContact CD1-CG2 3.7Å; I313-V415 HydrophobicContact CG2-CG2 4.08Å; I314-V415 HydrophobicContact CD1-CG1 3.94Å; I314-V415 HydrophobicContact CG1-CG1 4.19Å; M411-V415 WeakPolarHBondContact O-CG2 3.29Å; M411-V415 PolarHBondContact O-N 3.46Å; V412-V415 PolarHBondContact O-N 2.8Å; V412-V415 VanDerWaalsContact O-N 3.15Å; V415-F418 PolarHBondContact O-N 3.33Å; V415-G419 PolarHBondContact O-N 3.23Å
416	Y	87.1	Confident	83.5	Confident	21 Å²	21	37.7 Å²	37.7	8%	0.082	21%	0.211	C	C	.	.	H	α-helix	trans	-63	-48.7	176	-66.5	-38.2	0	0	0	111	I314 V412 N413 G414 F418 G419 L420 H467 A470 R473	I314-Y416 HydrophobicContact CD1-CD1 4.4Å; I314-Y416 HydrophobicContact CD1-CE1 3.7Å; I314-Y416 HydrophobicContact CG1-CE1 3.89Å; V412-Y416 HydrophobicContact CG1-CD2 3.67Å; V412-Y416 HydrophobicContact CG1-CE2 3.12Å; V412-Y416 WeakPolarHBondContact O-CD2 3.22Å; V412-Y416 PolarHBondContact O-N 3.11Å; N413-Y416 PolarHBondContact O-N 3.38Å; G414-Y416 PolarHBondContact O-N 3.12Å; Y416-F418 PolarHBondContact O-N 2.88Å; Y416-G419 PolarHBondContact O-N 3.16Å; Y416-G419 VanDerWaalsContact O-N 3.13Å; Y416-L420 PolarHBondContact O-N 3Å; Y416-H467 HydrophobicContact CE2-CB 4.43Å; Y416-H467 WeakPolarHBondContact OH-CB 3.26Å; Y416-H467 PolarHBondContact OH-CD2 2.88Å; Y416-A470 HydrophobicContact CD1-CB 3.48Å; Y416-A470 VanDerWaalsContact CD1-CB 3.48Å; Y416-A470 HydrophobicContact CD2-CB 4.02Å; Y416-A470 HydrophobicContact CE1-CB 3.85Å; Y416-A470 HydrophobicContact CE2-CB 4.32Å; Y416-A470 HydrophobicContact CG-CB 3.61Å; Y416-R473 VanDerWaalsContact C-NH1 3.3Å; Y416-R473 PolarHBondContact O-NH1 3.47Å; Y416-R473 PolarHBondContact O-NH2 2.91Å
417	A	83.3	Confident	83.1	Confident	22 Å²	22	36.4 Å²	36.4	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-57.6	-37.9	177.1	0	0	0	0	0	112.2	M383 L386 N413 G414 L420 L421	M383-A417 HydrophobicContact SD-CB 4.36Å; L386-A417 HydrophobicContact CD2-CB 4.27Å; N413-A417 WeakPolarHBondContact O-CB 3.48Å; N413-A417 PolarHBondContact O-N 3.01Å; G414-A417 PolarHBondContact O-N 2.92Å; A417-L420 WeakPolarHBondContact O-CB 3.45Å; A417-L420 PolarHBondContact O-N 2.89Å; A417-L421 PolarHBondContact O-N 2.94Å; A417-L421 VanDerWaalsContact O-N 3.14Å
418	F	83.9	Confident	82.5	Confident	12 Å²	12	39.7 Å²	39.7	5%	0.053	22%	0.215	C	C	.	.	H	α-helix	trans	-66.7	-42	176.2	-165.2	-85.6	0	0	0	112.7	W306 M376 L379 M383 G414 V415 Y416 L420 L421 L422	W306-F418 AromaticContact CD1-CD1 3.68Å; W306-F418 AromaticContact CD1-CE1 3.44Å; W306-F418 VanDerWaalsContact CD1-CE1 3.44Å; W306-F418 HydrophobicContact CD2-CD1 4.34Å; W306-F418 HydrophobicContact CD2-CE1 4.09Å; W306-F418 AromaticContact CE2-CD1 3.34Å; W306-F418 AromaticContact CE2-CE1 3.53Å; W306-F418 AromaticContact CE2-CG 3.79Å; W306-F418 HydrophobicContact CG-CD1 4.5Å; W306-F418 HydrophobicContact CG-CE1 4.03Å; W306-F418 HydrophobicContact CZ2-CB 3.83Å; W306-F418 AromaticContact CZ2-CD1 3.66Å; W306-F418 HydrophobicContact CZ2-CD1 3.66Å; W306-F418 HydrophobicContact CZ2-CD2 4.07Å; W306-F418 HydrophobicContact CZ2-CE1 4.14Å; W306-F418 AromaticContact CZ2-CG 3.57Å; W306-F418 HydrophobicContact CZ2-CG 3.57Å; W306-F418 AromaticContact NE1-CD1 2.89Å; W306-F418 AromaticContact NE1-CE1 3.13Å; W306-F418 AromaticContact NE1-CG 3.77Å; M376-F418 HydrophobicContact CE-CE1 3.95Å; M376-F418 HydrophobicContact CE-CZ 3.49Å; M376-F418 VanDerWaalsContact CE-CZ 3.49Å; M376-F418 HydrophobicContact SD-CE1 4.28Å; M376-F418 HydrophobicContact SD-CZ 3.8Å; L379-F418 HydrophobicContact CD2-CD2 4.42Å; L379-F418 HydrophobicContact CD2-CE1 4.07Å; L379-F418 HydrophobicContact CD2-CE2 3.7Å; L379-F418 HydrophobicContact CD2-CZ 3.52Å; L379-F418 HydrophobicContact CG-CE2 4.1Å; L379-F418 HydrophobicContact CG-CZ 4.38Å; M383-F418 HydrophobicContact CB-CD2 4.28Å; M383-F418 HydrophobicContact CG-CD2 3.7Å; M383-F418 HydrophobicContact CG-CE2 4.22Å; M383-F418 HydrophobicContact SD-CB 4.24Å; M383-F418 HydrophobicContact SD-CD2 4.14Å; G414-F418 WeakPolarHBondContact O-CB 3.49Å; G414-F418 PolarHBondContact O-N 3.19Å; V415-F418 PolarHBondContact O-N 3.33Å; Y416-F418 PolarHBondContact O-N 2.88Å; F418-L420 VanDerWaalsContact C-N 3.31Å; F418-L420 PolarHBondContact O-N 3.31Å; F418-L421 PolarHBondContact O-N 3.28Å; F418-L421 VanDerWaalsContact O-N 3.11Å; F418-L422 HydrophobicContact CD1-CD1 3.75Å; F418-L422 HydrophobicContact CD1-CG 3.83Å; F418-L422 HydrophobicContact CE1-CD1 3.5Å; F418-L422 HydrophobicContact CE1-CD2 3.87Å; F418-L422 HydrophobicContact CE1-CG 3.58Å; F418-L422 HydrophobicContact CZ-CD2 4.32Å; F418-L422 HydrophobicContact CZ-CG 4.42Å; F418-L422 PolarHBondContact O-N 3.41Å
419	G	81.2	Confident	81.8	Confident	24 Å²	24	43.2 Å²	43.2	25%	0.247	23%	0.233	C	C	.	.	H	α-helix	trans	-56	-44.3	175	0	0	0	0	0	112.6	V415 Y416 L421 L422 M423	V415-G419 PolarHBondContact O-N 3.23Å; Y416-G419 PolarHBondContact O-N 3.16Å; Y416-G419 VanDerWaalsContact O-N 3.13Å; G419-L421 PolarHBondContact O-N 3.21Å; G419-L422 PolarHBondContact O-N 3.15Å; G419-M423 PolarHBondContact O-N 3.09Å
420	L	79.9	Confident	81.4	Confident	59 Å²	59	41.5 Å²	41.5	31%	0.309	23%	0.226	S	C	.	.	H	α-helix	trans	-57.7	-48	172.9	168.6	61.6	0	0	0	111.9	Y416 A417 F418 L422 M423 T424 R473 I477	Y416-L420 PolarHBondContact O-N 3Å; A417-L420 WeakPolarHBondContact O-CB 3.45Å; A417-L420 PolarHBondContact O-N 2.89Å; F418-L420 VanDerWaalsContact C-N 3.31Å; F418-L420 PolarHBondContact O-N 3.31Å; L420-L422 VanDerWaalsContact C-N 3.29Å; L420-L422 PolarHBondContact O-N 2.75Å; L420-M423 PolarHBondContact O-N 3.47Å; L420-T424 PolarHBondContact O-N 3.32Å; L420-T424 PolarHBondContact O-OG1 3.39Å; L420-R473 HydrophobicContact CD1-CG 4.15Å; L420-I477 HydrophobicContact CD1-CD1 3.41Å; L420-I477 VanDerWaalsContact CD1-CD1 3.41Å; L420-I477 HydrophobicContact CD1-CG1 4.19Å
421	L	79.8	Confident	81	Confident	37 Å²	37	46.3 Å²	46.3	19%	0.194	24%	0.242	C	C	.	.	H	α-helix	trans	-68.2	-26.5	-177.5	-89.2	-147.4	0	0	0	113.6	L379 I382 M383 A417 F418 G419 P425	L379-L421 HydrophobicContact CD1-CB 3.85Å; L379-L421 HydrophobicContact CD1-CD1 3.77Å; L379-L421 HydrophobicContact CD1-CG 4.44Å; L379-L421 HydrophobicContact CG-CB 4.39Å; L379-L421 HydrophobicContact CG-CD1 4.37Å; I382-L421 HydrophobicContact CB-CD1 4.34Å; I382-L421 HydrophobicContact CG2-CD1 3.9Å; M383-L421 HydrophobicContact CE-CD1 3.14Å; M383-L421 HydrophobicContact CE-CG 3.56Å; M383-L421 HydrophobicContact CG-CD1 3.6Å; M383-L421 HydrophobicContact CG-CG 4.46Å; M383-L421 HydrophobicContact SD-CB 4.04Å; M383-L421 HydrophobicContact SD-CD1 3.41Å; M383-L421 WeakPolarHBondContact SD-CD1 3.32Å; M383-L421 HydrophobicContact SD-CG 3.71Å; A417-L421 PolarHBondContact O-N 2.94Å; A417-L421 VanDerWaalsContact O-N 3.14Å; F418-L421 PolarHBondContact O-N 3.28Å; F418-L421 VanDerWaalsContact O-N 3.11Å; G419-L421 PolarHBondContact O-N 3.21Å; L421-P425 WeakPolarHBondContact O-CD 3.43Å
422	L	76.3	Confident	80.4	Confident	58 Å²	58	50.5 Å²	50.5	30%	0.304	25%	0.253	S	S	.	.	H	α-helix	trans	-71	-34.7	172.3	-75.3	178.7	0	0	0	112.6	F375 M376 L379 F418 G419 L420	F375-L422 HydrophobicContact CE1-CD2 3.96Å; M376-L422 HydrophobicContact SD-CD2 3.98Å; L379-L422 HydrophobicContact CD2-CD2 3.41Å; L379-L422 VanDerWaalsContact CD2-CD2 3.41Å; L379-L422 HydrophobicContact CD2-CG 4.01Å; F418-L422 HydrophobicContact CD1-CD1 3.75Å; F418-L422 HydrophobicContact CD1-CG 3.83Å; F418-L422 HydrophobicContact CE1-CD1 3.5Å; F418-L422 HydrophobicContact CE1-CD2 3.87Å; F418-L422 HydrophobicContact CE1-CG 3.58Å; F418-L422 HydrophobicContact CZ-CD2 4.32Å; F418-L422 HydrophobicContact CZ-CG 4.42Å; F418-L422 PolarHBondContact O-N 3.41Å; G419-L422 PolarHBondContact O-N 3.15Å; L420-L422 VanDerWaalsContact C-N 3.29Å; L420-L422 PolarHBondContact O-N 2.75Å
423	M	77.5	Confident	79.8	Confident	65 Å²	65	55 Å²	55	32%	0.32	28%	0.276	S	S	.	.	H	α-helix	trans	-81.8	-27.5	-179.5	-66.9	-166.2	155.5	0	0	113.4	G419 L420 Q426 I477	G419-M423 PolarHBondContact O-N 3.09Å; L420-M423 PolarHBondContact O-N 3.47Å; M423-Q426 PolarHBondContact O-N 3.38Å; M423-I477 HydrophobicContact CB-CD1 4.21Å; M423-I477 HydrophobicContact CB-CG2 3.83Å; M423-I477 HydrophobicContact SD-CD1 4.39Å; M423-I477 HydrophobicContact SD-CG2 4.11Å
424	T	75.2	Confident	79.4	Confident	55 Å²	55	57 Å²	57	34%	0.337	28%	0.283	S	S	.	.	H	α-helix	trans	-62.5	-43.1	-174.3	-60.3	0	0	0	0	113.8	L420 Q426 L427 F428	L420-T424 PolarHBondContact O-N 3.32Å; L420-T424 PolarHBondContact O-OG1 3.39Å; T424-Q426 VanDerWaalsContact C-N 3.27Å; T424-Q426 PolarHBondContact O-N 3.26Å; T424-L427 WeakPolarHBondContact O-CB 3.33Å; T424-L427 PolarHBondContact O-N 3.38Å; T424-L427 VanDerWaalsContact O-N 3.17Å; T424-F428 PolarHBondContact O-N 3.01Å
425	P	72.5	Confident	78.8	Confident	45 Å²	45	57 Å²	57	29%	0.292	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-30.3	179.9	-31.8	42.7	0	0	0	113.7	F375 L421 F428 L429	F375-P425 HydrophobicContact CE2-CB 4.03Å; F375-P425 HydrophobicContact CE2-CG 4Å; F375-P425 HydrophobicContact CZ-CB 4.05Å; F375-P425 HydrophobicContact CZ-CG 3.77Å; L421-P425 WeakPolarHBondContact O-CD 3.43Å; P425-F428 PolarHBondContact O-N 3.21Å; P425-L429 WeakPolarHBondContact O-CB 3.28Å; P425-L429 PolarHBondContact O-N 3.46Å
426	Q	73.5	Confident	78.1	Confident	54 Å²	54	56.6 Å²	56.6	25%	0.252	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-42.8	175.3	-174.1	171.2	-24.7	0	0	111.3	M423 T424 L429 N430 E497	M423-Q426 PolarHBondContact O-N 3.38Å; T424-Q426 VanDerWaalsContact C-N 3.27Å; T424-Q426 PolarHBondContact O-N 3.26Å; Q426-L429 PolarHBondContact O-N 2.96Å; Q426-N430 WeakPolarHBondContact O-CB 3.33Å; Q426-N430 PolarHBondContact O-N 3.33Å; Q426-N430 PolarHBondContact O-ND2 2.83Å; Q426-N430 PolarHBondContact O-OD1 3.04Å; Q426-E497 PolarHBondContact NE2-OE2 3.02Å
427	L	78.4	Confident	77.2	Confident	21 Å²	21	56 Å²	56	11%	0.11	28%	0.277	C	S	.	.	H	α-helix	trans	-62.7	-44	173.2	-69.9	171	0	0	0	111.7	T424 N430 Y431 I477 I480 Q484	T424-L427 WeakPolarHBondContact O-CB 3.33Å; T424-L427 PolarHBondContact O-N 3.38Å; T424-L427 VanDerWaalsContact O-N 3.17Å; L427-N430 PolarHBondContact O-N 2.75Å; L427-Y431 WeakPolarHBondContact O-CB 3.18Å; L427-Y431 PolarHBondContact O-N 2.77Å; L427-I477 HydrophobicContact CD1-CB 4.31Å; L427-I477 HydrophobicContact CD1-CG2 3.57Å; L427-I477 HydrophobicContact CG-CG2 4.28Å; L427-I480 HydrophobicContact CD1-CG2 4.4Å; L427-I480 HydrophobicContact CD2-CB 4.14Å; L427-I480 HydrophobicContact CD2-CG2 3.82Å; L427-Q484 PolarHBondContact O-NE2 2.98Å; L427-Q484 PolarHBondContact O-OE1 2.94Å
428	F	76	Confident	76.1	Confident	127 Å²	127	57.4 Å²	57.4	56%	0.557	28%	0.28	S	S	*	.	H	α-helix	trans	-64.3	-43.5	178.6	-179.2	-103.5	0	0	0	111.9	T424 P425 Y431 R432	T424-F428 PolarHBondContact O-N 3.01Å; P425-F428 PolarHBondContact O-N 3.21Å; F428-Y431 WeakPolarHBondContact O-CB 3.36Å; F428-Y431 PolarHBondContact O-N 3.18Å; F428-R432 HydrophobicContact CD1-CG 4.06Å; F428-R432 HydrophobicContact CD2-CG 4.41Å; F428-R432 HydrophobicContact CE1-CG 3.63Å; F428-R432 HydrophobicContact CE2-CG 4.02Å; F428-R432 HydrophobicContact CG-CG 4.44Å; F428-R432 HydrophobicContact CZ-CG 3.61Å; F428-R432 WeakPolarHBondContact O-CB 3.42Å; F428-R432 WeakPolarHBondContact O-CG 3.37Å; F428-R432 PolarHBondContact O-N 3.11Å
429	L	73.4	Confident	75.3	Confident	80 Å²	80	56.9 Å²	56.9	42%	0.419	28%	0.278	S	S	.	.	H	α-helix	trans	-64.4	-43.1	178.7	-174	64.5	0	0	0	111.4	P425 Q426 Y431 R432 L433 R494	P425-L429 WeakPolarHBondContact O-CB 3.28Å; P425-L429 PolarHBondContact O-N 3.46Å; Q426-L429 PolarHBondContact O-N 2.96Å; L429-Y431 VanDerWaalsContact C-N 3.3Å; L429-Y431 PolarHBondContact O-N 2.94Å; L429-R432 PolarHBondContact O-N 2.92Å; L429-L433 HydrophobicContact CD1-CD1 3.66Å; L429-L433 HydrophobicContact CD1-CG 3.92Å; L429-L433 HydrophobicContact CD2-CD1 4.45Å; L429-L433 HydrophobicContact CG-CD1 3.82Å; L429-L433 HydrophobicContact CG-CG 4.33Å; L429-L433 WeakPolarHBondContact O-CB 3.47Å; L429-L433 PolarHBondContact O-N 3.12Å; L429-R494 VanDerWaalsContact CD2-NH2 3.31Å
430	N	78.3	Confident	74.7	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.011	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-38.9	175.2	-70.1	-11.7	0	0	0	112	Q426 L427 K434 S435 V436 R494	Q426-N430 WeakPolarHBondContact O-CB 3.33Å; Q426-N430 PolarHBondContact O-N 3.33Å; Q426-N430 PolarHBondContact O-ND2 2.83Å; Q426-N430 PolarHBondContact O-OD1 3.04Å; L427-N430 PolarHBondContact O-N 2.75Å; N430-K434 WeakPolarHBondContact O-CA 3.42Å; N430-K434 PolarHBondContact O-N 3.25Å; N430-S435 WeakPolarHBondContact CA-O 3.33Å; N430-S435 PolarHBondContact O-N 3.28Å; N430-S435 PolarHBondContact OD1-O 2.66Å; N430-V436 HydrophobicContact CB-CG2 4.29Å; N430-R494 PolarHBondContact OD1-NH1 2.87Å; N430-R494 PolarHBondContact OD1-NH2 3.48Å
431	Y	80	Confident	74	Confident	125 Å²	125	63 Å²	63	49%	0.49	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-43.6	174	177.8	-95.4	0	0	0	112.6	L427 F428 L429 K434 Y488	L427-Y431 WeakPolarHBondContact O-CB 3.18Å; L427-Y431 PolarHBondContact O-N 2.77Å; F428-Y431 WeakPolarHBondContact O-CB 3.36Å; F428-Y431 PolarHBondContact O-N 3.18Å; L429-Y431 VanDerWaalsContact C-N 3.3Å; L429-Y431 PolarHBondContact O-N 2.94Å; Y431-K434 WeakPolarHBondContact O-CD 3.37Å; Y431-K434 VanDerWaalsContact O-CE 3.31Å; Y431-K434 WeakPolarHBondContact O-CE 3.47Å; Y431-Y488 VanDerWaalsContact CD2-OH 3.27Å; Y431-Y488 WeakPolarHBondContact CD2-OH 3.43Å
432	R	77.7	Confident	73.3	Confident	175 Å²	175	69 Å²	69	66%	0.66	32%	0.319	S	S	*	.	H	α-helix	trans	-71	-44.1	-178.2	-73.1	-70.6	-71	-171.1	-3.2	113	F428 L429 K434	F428-R432 HydrophobicContact CD1-CG 4.06Å; F428-R432 HydrophobicContact CD2-CG 4.41Å; F428-R432 HydrophobicContact CE1-CG 3.63Å; F428-R432 HydrophobicContact CE2-CG 4.02Å; F428-R432 HydrophobicContact CG-CG 4.44Å; F428-R432 HydrophobicContact CZ-CG 3.61Å; F428-R432 WeakPolarHBondContact O-CB 3.42Å; F428-R432 WeakPolarHBondContact O-CG 3.37Å; F428-R432 PolarHBondContact O-N 3.11Å; L429-R432 PolarHBondContact O-N 2.92Å; R432-K434 VanDerWaalsContact C-N 3.28Å
433	L	76.1	Confident	72.9	Confident	95 Å²	95	67.7 Å²	67.7	50%	0.497	32%	0.317	S	S	.	.	H	α-helix	trans	-80.4	-10.8	179.5	-65.8	179.8	0	0	0	112.9	L429 S435	L429-L433 HydrophobicContact CD1-CD1 3.66Å; L429-L433 HydrophobicContact CD1-CG 3.92Å; L429-L433 HydrophobicContact CD2-CD1 4.45Å; L429-L433 HydrophobicContact CG-CD1 3.82Å; L429-L433 HydrophobicContact CG-CG 4.33Å; L429-L433 WeakPolarHBondContact O-CB 3.47Å; L429-L433 PolarHBondContact O-N 3.12Å; L433-S435 PolarHBondContact O-N 3.17Å; L433-S435 VanDerWaalsContact O-N 3.12Å
434	K	80.7	Confident	72.4	Confident	99 Å²	99	65.3 Å²	65.3	43%	0.43	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	33.9	-174.5	-58.2	-70.7	177.3	177.9	0	111.7	N430 Y431 R432 Y488 P489	N430-K434 WeakPolarHBondContact O-CA 3.42Å; N430-K434 PolarHBondContact O-N 3.25Å; Y431-K434 WeakPolarHBondContact O-CD 3.37Å; Y431-K434 VanDerWaalsContact O-CE 3.31Å; Y431-K434 WeakPolarHBondContact O-CE 3.47Å; R432-K434 VanDerWaalsContact C-N 3.28Å; K434-Y488 HydrophobicContact CB-CD1 4.07Å; K434-Y488 HydrophobicContact CB-CE1 4.29Å; K434-Y488 HydrophobicContact CD-CD1 3.82Å; K434-Y488 HydrophobicContact CD-CE1 3.17Å; K434-Y488 HydrophobicContact CD-CE2 4.47Å; K434-Y488 HydrophobicContact CG-CE1 4.34Å; K434-Y488 PolarHBondContact NZ-OH 2.87Å; K434-Y488 WeakPolarHBondContact O-CB 3.37Å; K434-P489 WeakPolarHBondContact O-CD 3.34Å
435	S	75.6	Confident	72.2	Confident	13 Å²	13	64.7 Å²	64.7	9%	0.091	30%	0.301	C	S	.	.			trans	-144.9	151.2	177.7	75.7	0	0	0	0	110.5	N430 L433 P489 R494	N430-S435 WeakPolarHBondContact CA-O 3.33Å; N430-S435 PolarHBondContact O-N 3.28Å; N430-S435 PolarHBondContact OD1-O 2.66Å; L433-S435 PolarHBondContact O-N 3.17Å; L433-S435 VanDerWaalsContact O-N 3.12Å; S435-P489 VanDerWaalsContact CA-O 3.31Å; S435-P489 WeakPolarHBondContact CA-O 3.39Å; S435-R494 PolarHBondContact O-NH1 3.02Å; S435-R494 PolarHBondContact OG-NH1 2.83Å; S435-R494 VanDerWaalsContact OG-NH1 3.12Å
436	V	74.1	Confident	72.1	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.6	177	179.6	0	0	0	0	109.5	N430 Y481 Q484 R485 P489 V490 D491	N430-V436 HydrophobicContact CB-CG2 4.29Å; V436-Y481 HydrophobicContact CG1-CE2 3.61Å; V436-Y481 VanDerWaalsContact CG1-OH 3.28Å; V436-Y481 WeakPolarHBondContact CG1-OH 3.36Å; V436-Q484 HydrophobicContact CG2-CB 4.38Å; V436-R485 HydrophobicContact CG1-CB 4.37Å; V436-R485 HydrophobicContact CG2-CB 4.4Å; V436-P489 PolarHBondContact N-O 3.03Å; V436-P489 VanDerWaalsContact N-O 3.08Å; V436-V490 CarbonylContact O-C 3.58Å; V436-V490 WeakPolarHBondContact O-CA 3.34Å; V436-D491 PolarHBondContact O-N 3.1Å
437	A	68.3	Low	71.9	Confident	7 Å²	7	69.2 Å²	69.2	6%	0.058	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	143.6	177.2	0	0	0	0	0	111.2	L439 R494 N496	A437-L439 PolarHBondContact O-N 2.95Å; A437-R494 HydrophobicContact CB-CB 3.91Å; A437-N496 HydrophobicContact CB-CB 4.1Å
438	H	59.8	Low	71.7	Confident	52 Å²	52	69.7 Å²	69.7	24%	0.241	32%	0.32	C	S	.	.			trans	-66.1	107.2	179.2	177.7	-83	0	0	0	111.6	V490 D491 K492 N496	H438-V490 HydrophobicContact CB-CG1 3.86Å; H438-D491 PolarHBondContact N-O 3.35Å; H438-K492 HydrophobicContact CB-CG 4.43Å; H438-N496 WeakPolarHBondContact O-CB 3.17Å; H438-N496 PolarHBondContact O-ND2 3.06Å
439	L	66.3	Low	71.7	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.01	32%	0.32	C	S	.	.			trans	-95.5	129.5	165.4	-105.7	106.4	0	0	0	110.8	A437 W441 A443 Y481 N496 E497 F498	A437-L439 PolarHBondContact O-N 2.95Å; L439-W441 PolarHBondContact O-N 2.93Å; L439-A443 HydrophobicContact CD2-CB 4.46Å; L439-Y481 VanDerWaalsContact CD1-OH 3.26Å; L439-Y481 WeakPolarHBondContact CD1-OH 3.44Å; L439-N496 HydrophobicContact CD1-CB 4.1Å; L439-N496 HydrophobicContact CG-CB 4.38Å; L439-E497 HydrophobicContact CD1-CG 4.06Å; L439-E497 HydrophobicContact CD2-CG 4.44Å; L439-E497 WeakPolarHBondContact CD2-OE1 3.48Å; L439-F498 HydrophobicContact CD2-CD2 4.42Å; L439-F498 HydrophobicContact CD2-CE2 4.11Å
440	P	68.9	Low	71.7	Confident	42 Å²	42	69.3 Å²	69.3	27%	0.273	32%	0.318	S	S	.	.			trans	-59.4	134.3	175.5	22	-28.7	0	0	0	110.3	K442 A443 M444	P440-K442 PolarHBondContact O-N 2.91Å; P440-K442 VanDerWaalsContact O-N 3.14Å; P440-A443 HydrophobicContact CG-CB 4Å; P440-A443 PolarHBondContact O-N 3.38Å; P440-M444 PolarHBondContact O-N 2.9Å
441	W	65.2	Low	71.5	Confident	169 Å²	169	70.2 Å²	70.2	64%	0.64	32%	0.324	S	S	*	.	H	α-helix	trans	-53.4	-40.7	-172.2	-173.1	-103.4	0	0	0	112.9	L439 A443 M444 T445	L439-W441 PolarHBondContact O-N 2.93Å; W441-A443 PolarHBondContact O-N 3.22Å; W441-M444 HydrophobicContact CD2-CE 4.09Å; W441-M444 HydrophobicContact CE3-CE 3.49Å; W441-M444 VanDerWaalsContact CE3-CE 3.49Å; W441-M444 HydrophobicContact CH2-CE 3.45Å; W441-M444 VanDerWaalsContact CH2-CE 3.45Å; W441-M444 HydrophobicContact CZ2-CE 4.03Å; W441-M444 HydrophobicContact CZ3-CE 3.15Å; W441-M444 HydrophobicContact CZ3-SD 4.33Å; W441-M444 PolarHBondContact O-N 3.42Å; W441-T445 PolarHBondContact O-N 3.44Å; W441-T445 PolarHBondContact O-OG1 3.39Å
442	K	65.8	Low	71.2	Confident	162 Å²	162	71 Å²	71	70%	0.704	33%	0.33	S	S	*	.	H	α-helix	trans	-56.2	-48.2	176.8	-67.8	-178.4	179.8	175.9	0	112.1	P440 M444 T445 Y446	P440-K442 PolarHBondContact O-N 2.91Å; P440-K442 VanDerWaalsContact O-N 3.14Å; K442-M444 VanDerWaalsContact C-N 3.33Å; K442-M444 PolarHBondContact O-N 3.37Å; K442-T445 PolarHBondContact O-N 3.46Å; K442-Y446 HydrophobicContact CB-CE2 4.24Å; K442-Y446 WeakPolarHBondContact O-CD2 3.27Å; K442-Y446 PolarHBondContact O-N 2.92Å
443	A	66.9	Low	71	Confident	31 Å²	31	63.4 Å²	63.4	26%	0.256	30%	0.302	S	S	.	.	H	α-helix	trans	-64.4	-40	179.9	0	0	0	0	0	111.5	L439 P440 W441 Y446 K447	L439-A443 HydrophobicContact CD2-CB 4.46Å; P440-A443 HydrophobicContact CG-CB 4Å; P440-A443 PolarHBondContact O-N 3.38Å; W441-A443 PolarHBondContact O-N 3.22Å; A443-Y446 PolarHBondContact O-N 2.99Å; A443-K447 WeakPolarHBondContact O-CB 3.42Å; A443-K447 PolarHBondContact O-N 3.22Å
444	M	68.1	Low	71.1	Confident	16 Å²	16	61.1 Å²	61.1	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-64.2	-44	176.2	-169.6	-168.3	73.3	0	0	111.8	P440 W441 K442 Y446 K447 A448 F478 L482 R485	P440-M444 PolarHBondContact O-N 2.9Å; W441-M444 HydrophobicContact CD2-CE 4.09Å; W441-M444 HydrophobicContact CE3-CE 3.49Å; W441-M444 VanDerWaalsContact CE3-CE 3.49Å; W441-M444 HydrophobicContact CH2-CE 3.45Å; W441-M444 VanDerWaalsContact CH2-CE 3.45Å; W441-M444 HydrophobicContact CZ2-CE 4.03Å; W441-M444 HydrophobicContact CZ3-CE 3.15Å; W441-M444 HydrophobicContact CZ3-SD 4.33Å; W441-M444 PolarHBondContact O-N 3.42Å; K442-M444 VanDerWaalsContact C-N 3.33Å; K442-M444 PolarHBondContact O-N 3.37Å; M444-Y446 VanDerWaalsContact C-N 3.34Å; M444-Y446 PolarHBondContact O-N 3.45Å; M444-K447 PolarHBondContact O-N 2.95Å; M444-A448 WeakPolarHBondContact O-CB 3.41Å; M444-A448 PolarHBondContact O-N 3.41Å; M444-F478 HydrophobicContact CG-CZ 4.21Å; M444-L482 HydrophobicContact CE-CD2 4.42Å; M444-L482 HydrophobicContact CG-CD2 4.34Å; M444-L482 HydrophobicContact SD-CD2 3.67Å; M444-R485 PolarHBondContact SD-NH1 3.29Å
445	T	71.4	Confident	71	Confident	41 Å²	41	58.8 Å²	58.8	25%	0.252	28%	0.283	S	S	.	.	H	α-helix	trans	-61.3	-44	176.6	-56.6	0	0	0	0	111	W441 K442 K447 A448 F449	W441-T445 PolarHBondContact O-N 3.44Å; W441-T445 PolarHBondContact O-OG1 3.39Å; K442-T445 PolarHBondContact O-N 3.46Å; T445-K447 PolarHBondContact O-N 3Å; T445-A448 PolarHBondContact O-N 3.45Å; T445-F449 HydrophobicContact CG2-CD2 3.55Å; T445-F449 HydrophobicContact CG2-CE2 3.37Å; T445-F449 WeakPolarHBondContact O-CD2 3.35Å; T445-F449 PolarHBondContact O-N 2.97Å
446	Y	69.2	Low	71	Confident	142 Å²	142	62.8 Å²	62.8	56%	0.557	30%	0.299	S	S	*	.	H	α-helix	trans	-62.2	-42.7	175.2	-71.3	-56.7	0	0	0	112.6	K442 A443 M444 F449 N450	K442-Y446 HydrophobicContact CB-CE2 4.24Å; K442-Y446 WeakPolarHBondContact O-CD2 3.27Å; K442-Y446 PolarHBondContact O-N 2.92Å; A443-Y446 PolarHBondContact O-N 2.99Å; M444-Y446 VanDerWaalsContact C-N 3.34Å; M444-Y446 PolarHBondContact O-N 3.45Å; Y446-F449 PolarHBondContact O-N 2.92Å; Y446-N450 VanDerWaalsContact O-CB 3.32Å; Y446-N450 WeakPolarHBondContact O-CB 3.48Å; Y446-N450 PolarHBondContact O-N 3.36Å
447	K	69.4	Low	71	Confident	52 Å²	52	63 Å²	63	23%	0.226	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-45.5	176.9	-166.7	172.3	-174	178.9	0	111.3	A443 M444 T445 N450 T451 F478 E497	A443-K447 WeakPolarHBondContact O-CB 3.42Å; A443-K447 PolarHBondContact O-N 3.22Å; M444-K447 PolarHBondContact O-N 2.95Å; T445-K447 PolarHBondContact O-N 3Å; K447-N450 PolarHBondContact O-N 2.89Å; K447-T451 WeakPolarHBondContact O-CB 3.35Å; K447-T451 PolarHBondContact O-N 2.94Å; K447-T451 PolarHBondContact O-OG1 3.31Å; K447-F478 HydrophobicContact CB-CE2 4.16Å; K447-F478 HydrophobicContact CB-CZ 4.38Å; K447-F478 HydrophobicContact CD-CD2 3.89Å; K447-F478 HydrophobicContact CD-CE2 3.75Å; K447-F478 HydrophobicContact CG-CD2 4.04Å; K447-F478 HydrophobicContact CG-CE2 3.85Å; K447-F478 HydrophobicContact CG-CZ 4.42Å; K447-E497 IonicContact NZ-OE1 3.5Å; K447-E497 PolarHBondContact NZ-OE1 2.97Å; K447-E497 IonicContact NZ-OE2 3.35Å; K447-E497 PolarHBondContact NZ-OE2 2.74Å
448	A	74.5	Confident	71.2	Confident	32 Å²	32	63.1 Å²	63.1	26%	0.264	30%	0.301	S	S	.	.	H	α-helix	trans	-62.3	-44.3	178	0	0	0	0	0	112.8	M444 T445 F452 F478	M444-A448 WeakPolarHBondContact O-CB 3.41Å; M444-A448 PolarHBondContact O-N 3.41Å; T445-A448 PolarHBondContact O-N 3.45Å; A448-F452 WeakPolarHBondContact O-CB 3.48Å; A448-F452 PolarHBondContact O-N 3.05Å; A448-F478 VanDerWaalsContact CA-CE1 3.41Å; A448-F478 HydrophobicContact CB-CE1 3.52Å; A448-F478 HydrophobicContact CB-CZ 3.75Å
449	F	75.7	Confident	71.9	Confident	126 Å²	126	69 Å²	69	55%	0.553	33%	0.326	S	S	*	.	H	α-helix	trans	-63.3	-46.8	174.5	-83	-64.3	0	0	0	110.8	T445 Y446 T451 F452 I453	T445-F449 HydrophobicContact CG2-CD2 3.55Å; T445-F449 HydrophobicContact CG2-CE2 3.37Å; T445-F449 WeakPolarHBondContact O-CD2 3.35Å; T445-F449 PolarHBondContact O-N 2.97Å; Y446-F449 PolarHBondContact O-N 2.92Å; F449-T451 PolarHBondContact O-N 3.36Å; F449-F452 PolarHBondContact O-N 2.92Å; F449-I453 HydrophobicContact CB-CD1 4.18Å; F449-I453 WeakPolarHBondContact O-CB 3.31Å; F449-I453 WeakPolarHBondContact O-CD1 3.3Å; F449-I453 WeakPolarHBondContact O-CG1 3.39Å; F449-I453 PolarHBondContact O-N 3.45Å
450	N	73.3	Confident	72	Confident	72 Å²	72	70.8 Å²	70.8	39%	0.385	34%	0.335	S	S	.	.	H	α-helix	trans	-57.7	-48.9	-179.3	-165.9	70.2	0	0	0	111.8	Y446 K447 I453 D454	Y446-N450 VanDerWaalsContact O-CB 3.32Å; Y446-N450 WeakPolarHBondContact O-CB 3.48Å; Y446-N450 PolarHBondContact O-N 3.36Å; K447-N450 PolarHBondContact O-N 2.89Å; N450-I453 PolarHBondContact O-N 3.28Å; N450-D454 PolarHBondContact ND2-OD2 3.03Å; N450-D454 WeakPolarHBondContact O-CB 3.15Å; N450-D454 PolarHBondContact O-N 2.74Å
451	T	74.5	Confident	72	Confident	21 Å²	21	69.5 Å²	69.5	13%	0.129	33%	0.325	C	S	.	.	H	α-helix	trans	-52	-60.5	172.1	-85.3	0	0	0	0	111.9	K447 F449 I453 D454 D455 D475 F478	K447-T451 WeakPolarHBondContact O-CB 3.35Å; K447-T451 PolarHBondContact O-N 2.94Å; K447-T451 PolarHBondContact O-OG1 3.31Å; F449-T451 PolarHBondContact O-N 3.36Å; T451-I453 PolarHBondContact O-N 2.95Å; T451-I453 VanDerWaalsContact O-N 3.08Å; T451-D454 PolarHBondContact O-N 2.7Å; T451-D455 PolarHBondContact O-N 3.44Å; T451-D475 WeakPolarHBondContact CA-OD1 3.32Å; T451-D475 WeakPolarHBondContact CB-OD1 3.46Å; T451-D475 HydrophobicContact CG2-CB 3.51Å; T451-D475 WeakPolarHBondContact CG2-OD1 3.42Å; T451-D475 PolarHBondContact OG1-OD1 3.35Å; T451-F478 HydrophobicContact CG2-CD1 3.95Å
452	F	74.3	Confident	72	Confident	141 Å²	141	67 Å²	67	62%	0.618	33%	0.329	S	S	*	.	H	α-helix	trans	-56.6	-36.8	-177.8	177.9	-99.6	0	0	0	113.2	A448 F449 F456	A448-F452 WeakPolarHBondContact O-CB 3.48Å; A448-F452 PolarHBondContact O-N 3.05Å; F449-F452 PolarHBondContact O-N 2.92Å; F452-F456 WeakPolarHBondContact O-CB 3.39Å; F452-F456 PolarHBondContact O-N 3.26Å; F452-F456 VanDerWaalsContact O-N 3.16Å
453	I	73.4	Confident	72.3	Confident	17 Å²	17	60 Å²	60	9%	0.087	30%	0.299	C	S	.	.	H	α-helix	trans	-69.5	-44.5	179.1	-74.6	166.3	0	0	0	110.5	F278 F449 N450 T451 D455 F456 F457	F278-I453 HydrophobicContact CB-CD1 4.35Å; F278-I453 HydrophobicContact CD1-CD1 4.28Å; F278-I453 HydrophobicContact CD2-CD1 3.32Å; F278-I453 HydrophobicContact CD2-CG1 4.05Å; F278-I453 HydrophobicContact CD2-CG2 4.04Å; F278-I453 HydrophobicContact CE1-CD1 4.42Å; F278-I453 HydrophobicContact CE2-CD1 3.45Å; F278-I453 VanDerWaalsContact CE2-CD1 3.45Å; F278-I453 HydrophobicContact CE2-CG1 4.07Å; F278-I453 HydrophobicContact CG-CD1 3.76Å; F278-I453 HydrophobicContact CZ-CD1 4.03Å; F449-I453 HydrophobicContact CB-CD1 4.18Å; F449-I453 WeakPolarHBondContact O-CB 3.31Å; F449-I453 WeakPolarHBondContact O-CD1 3.3Å; F449-I453 WeakPolarHBondContact O-CG1 3.39Å; F449-I453 PolarHBondContact O-N 3.45Å; N450-I453 PolarHBondContact O-N 3.28Å; T451-I453 PolarHBondContact O-N 2.95Å; T451-I453 VanDerWaalsContact O-N 3.08Å; I453-D455 PolarHBondContact O-N 3.32Å; I453-F456 PolarHBondContact O-N 3.11Å; I453-F457 HydrophobicContact CB-CE2 4.28Å; I453-F457 HydrophobicContact CG2-CD2 3.46Å; I453-F457 VanDerWaalsContact CG2-CD2 3.46Å; I453-F457 HydrophobicContact CG2-CE2 2.89Å; I453-F457 HydrophobicContact CG2-CZ 3.49Å; I453-F457 VanDerWaalsContact CG2-CZ 3.49Å; I453-F457 WeakPolarHBondContact O-CB 3.4Å; I453-F457 WeakPolarHBondContact O-CD2 3.45Å; I453-F457 WeakPolarHBondContact O-CG 3.35Å; I453-F457 PolarHBondContact O-N 2.98Å
454	D	77.7	Confident	72.6	Confident	46 Å²	46	59.6 Å²	59.6	25%	0.246	29%	0.294	C	S	.	.	H	α-helix	trans	-62	-42	178.6	-71.2	-27.2	0	0	0	111.6	N450 T451 F457 A458 C471	N450-D454 PolarHBondContact ND2-OD2 3.03Å; N450-D454 WeakPolarHBondContact O-CB 3.15Å; N450-D454 PolarHBondContact O-N 2.74Å; T451-D454 PolarHBondContact O-N 2.7Å; D454-F457 PolarHBondContact O-N 3.17Å; D454-A458 WeakPolarHBondContact O-CB 3.45Å; D454-A458 PolarHBondContact O-N 3.5Å; D454-C471 HydrophobicContact CB-CB 4.47Å
455	D	79.3	Confident	73	Confident	50 Å²	50	63.4 Å²	63.4	27%	0.267	32%	0.318	S	S	.	.	H	α-helix	trans	-61.3	-47.4	173.2	-98.8	-6.7	0	0	0	112.8	T451 I453 F457 A458 F459 L472 D475	T451-D455 PolarHBondContact O-N 3.44Å; I453-D455 PolarHBondContact O-N 3.32Å; D455-F457 PolarHBondContact O-N 3.29Å; D455-A458 PolarHBondContact O-N 2.96Å; D455-F459 PolarHBondContact O-N 2.84Å; D455-L472 VanDerWaalsContact OD1-CA 3.25Å; D455-L472 WeakPolarHBondContact OD1-CA 3.34Å; D455-D475 VanDerWaalsContact OD1-OD2 3.12Å
456	F	74.3	Confident	73.2	Confident	98 Å²	98	62.6 Å²	62.6	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-61.3	-37.5	177.9	-172.4	-115	0	0	0	111.5	V271 F452 I453 I460	V271-F456 HydrophobicContact CG1-CE1 4.46Å; V271-F456 HydrophobicContact CG2-CE1 3.74Å; V271-F456 HydrophobicContact CG2-CZ 4.29Å; F452-F456 WeakPolarHBondContact O-CB 3.39Å; F452-F456 PolarHBondContact O-N 3.26Å; F452-F456 VanDerWaalsContact O-N 3.16Å; I453-F456 PolarHBondContact O-N 3.11Å; F456-I460 HydrophobicContact CD1-CD1 3.97Å; F456-I460 HydrophobicContact CD2-CD1 4.16Å; F456-I460 HydrophobicContact CE1-CD1 3.57Å; F456-I460 HydrophobicContact CE2-CD1 3.75Å; F456-I460 HydrophobicContact CG-CD1 4.26Å; F456-I460 HydrophobicContact CZ-CD1 3.44Å; F456-I460 VanDerWaalsContact CZ-CD1 3.44Å; F456-I460 WeakPolarHBondContact O-CG1 3.28Å; F456-I460 PolarHBondContact O-N 3.47Å
457	F	74	Confident	73.7	Confident	5 Å²	5	56.8 Å²	56.8	2%	0.022	29%	0.292	C	S	.	.	H	α-helix	trans	-73.5	-39.4	176.2	-66.1	-33.2	0	0	0	113.5	V271 H275 I453 D454 D455 F459 I460 I461 M463	V271-F457 HydrophobicContact CB-CE1 4.42Å; V271-F457 HydrophobicContact CG1-CD1 3.32Å; V271-F457 HydrophobicContact CG1-CE1 3.38Å; V271-F457 WeakPolarHBondContact O-CE1 3.46Å; H275-F457 VanDerWaalsContact CA-CE2 3.44Å; H275-F457 HydrophobicContact CB-CD1 4.34Å; H275-F457 HydrophobicContact CB-CD2 4.18Å; H275-F457 HydrophobicContact CB-CE1 3.8Å; H275-F457 HydrophobicContact CB-CE2 3.49Å; H275-F457 VanDerWaalsContact CB-CE2 3.49Å; H275-F457 HydrophobicContact CB-CZ 3.34Å; H275-F457 AromaticContact CE1-CD2 3.8Å; H275-F457 AromaticContact CG-CD2 3.89Å; H275-F457 AromaticContact CG-CE2 3.56Å; H275-F457 AromaticContact CG-CZ 3.97Å; H275-F457 VanDerWaalsContact N-CZ 3.32Å; H275-F457 AromaticContact ND1-CD2 2.92Å; H275-F457 WeakPolarHBondContact ND1-CD2 3.42Å; H275-F457 AromaticContact ND1-CE2 2.91Å; H275-F457 WeakPolarHBondContact ND1-CE2 3.37Å; H275-F457 AromaticContact ND1-CG 3.64Å; H275-F457 AromaticContact ND1-CZ 3.75Å; I453-F457 HydrophobicContact CB-CE2 4.28Å; I453-F457 HydrophobicContact CG2-CD2 3.46Å; I453-F457 VanDerWaalsContact CG2-CD2 3.46Å; I453-F457 HydrophobicContact CG2-CE2 2.89Å; I453-F457 HydrophobicContact CG2-CZ 3.49Å; I453-F457 VanDerWaalsContact CG2-CZ 3.49Å; I453-F457 WeakPolarHBondContact O-CB 3.4Å; I453-F457 WeakPolarHBondContact O-CD2 3.45Å; I453-F457 WeakPolarHBondContact O-CG 3.35Å; I453-F457 PolarHBondContact O-N 2.98Å; D454-F457 PolarHBondContact O-N 3.17Å; D455-F457 PolarHBondContact O-N 3.29Å; F457-F459 PolarHBondContact O-N 2.74Å; F457-I460 PolarHBondContact O-N 2.85Å; F457-I460 VanDerWaalsContact O-N 3.17Å; F457-I461 HydrophobicContact CB-CD1 4.09Å; F457-I461 HydrophobicContact CD1-CD1 4.11Å; F457-I461 HydrophobicContact CG-CD1 4.26Å; F457-I461 WeakPolarHBondContact O-CB 3.44Å; F457-I461 PolarHBondContact O-N 2.76Å; F457-M463 HydrophobicContact CB-CE 3.83Å
458	A	74	Confident	74.3	Confident	9 Å²	9	58.1 Å²	58.1	7%	0.074	30%	0.295	C	S	.	.	H	α-helix	trans	-58.5	-33.7	176.3	0	0	0	0	0	111.6	D454 D455 R468	D454-A458 WeakPolarHBondContact O-CB 3.45Å; D454-A458 PolarHBondContact O-N 3.5Å; D455-A458 PolarHBondContact O-N 2.96Å; A458-R468 HydrophobicContact CB-CB 4.23Å; A458-R468 HydrophobicContact CB-CG 4.02Å; A458-R468 WeakPolarHBondContact O-CD 3.32Å; A458-R468 VanDerWaalsContact O-CZ 3.27Å; A458-R468 PolarHBondContact O-NE 2.86Å; A458-R468 PolarHBondContact O-NH2 3.1Å
459	F	73.7	Confident	74.5	Confident	176 Å²	176	62 Å²	62	77%	0.772	31%	0.31	S	S	*	.	H	α-helix	trans	-72.1	-42.3	175.7	-174.6	-106.8	0	0	0	113.2	D455 F457	D455-F459 PolarHBondContact O-N 2.84Å; F457-F459 PolarHBondContact O-N 2.74Å
460	I	69.4	Low	74.7	Confident	38 Å²	38	56.2 Å²	56.2	20%	0.195	29%	0.286	C	S	.	.	H	α-helix	trans	-88.9	-42.9	-169.6	-63.3	174.5	0	0	0	112.5	T268 V271 F456 F457	T268-I460 HydrophobicContact CG2-CG2 3.88Å; V271-I460 HydrophobicContact CB-CD1 4.43Å; V271-I460 HydrophobicContact CB-CG2 4.45Å; V271-I460 HydrophobicContact CG1-CB 4.29Å; V271-I460 HydrophobicContact CG1-CD1 4.02Å; V271-I460 HydrophobicContact CG1-CG2 4.05Å; V271-I460 HydrophobicContact CG2-CD1 3.55Å; V271-I460 HydrophobicContact CG2-CG2 4.36Å; F456-I460 HydrophobicContact CD1-CD1 3.97Å; F456-I460 HydrophobicContact CD2-CD1 4.16Å; F456-I460 HydrophobicContact CE1-CD1 3.57Å; F456-I460 HydrophobicContact CE2-CD1 3.75Å; F456-I460 HydrophobicContact CG-CD1 4.26Å; F456-I460 HydrophobicContact CZ-CD1 3.44Å; F456-I460 VanDerWaalsContact CZ-CD1 3.44Å; F456-I460 WeakPolarHBondContact O-CG1 3.28Å; F456-I460 PolarHBondContact O-N 3.47Å; F457-I460 PolarHBondContact O-N 2.85Å; F457-I460 VanDerWaalsContact O-N 3.17Å
461	I	68.3	Low	75	Confident	15 Å²	15	53.6 Å²	53.6	8%	0.077	27%	0.273	C	S	.	.	S	Bend	trans	-92.3	137.7	-173.7	-62.6	160.3	0	0	0	109.1	V271 S324 L326 V327 F457 M463 R468	V271-I461 HydrophobicContact CG1-CD1 4.43Å; S324-I461 VanDerWaalsContact OG-CG2 3.25Å; S324-I461 WeakPolarHBondContact OG-CG2 3.49Å; L326-I461 HydrophobicContact CD2-CD1 3.47Å; L326-I461 VanDerWaalsContact CD2-CD1 3.47Å; L326-I461 HydrophobicContact CD2-CG1 4.13Å; L326-I461 HydrophobicContact CG-CD1 4.45Å; V327-I461 HydrophobicContact CG2-CG2 3.99Å; F457-I461 HydrophobicContact CB-CD1 4.09Å; F457-I461 HydrophobicContact CD1-CD1 4.11Å; F457-I461 HydrophobicContact CG-CD1 4.26Å; F457-I461 WeakPolarHBondContact O-CB 3.44Å; F457-I461 PolarHBondContact O-N 2.76Å; I461-M463 HydrophobicContact CB-CE 3.9Å; I461-M463 HydrophobicContact CB-CG 4.46Å; I461-M463 HydrophobicContact CD1-CE 4.25Å; I461-M463 HydrophobicContact CG2-CE 4.15Å; I461-M463 HydrophobicContact CG2-CG 4.16Å; I461-M463 PolarHBondContact O-N 2.77Å; I461-R468 PolarHBondContact O-NH2 2.8Å
462	V	65.8	Low	75.3	Confident	118 Å²	118	57.6 Å²	57.6	72%	0.715	29%	0.293	S	S	*	.			trans	-68.6	103.3	175.5	-172.9	0	0	0	0	109.2	S323	S323-V462 PolarHBondContact OG-O 3.02Å
463	M	72.3	Confident	75.6	Confident	14 Å²	14	53 Å²	53	7%	0.069	27%	0.272	C	S	.	.			trans	-122.9	155.1	175.2	-55.5	-173	-161.3	0	0	108.6	V327 F457 I461 R468	V327-M463 HydrophobicContact CG1-SD 4.27Å; V327-M463 HydrophobicContact CG2-CE 3.56Å; V327-M463 HydrophobicContact CG2-CG 4.22Å; V327-M463 HydrophobicContact CG2-SD 4.12Å; F457-M463 HydrophobicContact CB-CE 3.83Å; I461-M463 HydrophobicContact CB-CE 3.9Å; I461-M463 HydrophobicContact CB-CG 4.46Å; I461-M463 HydrophobicContact CD1-CE 4.25Å; I461-M463 HydrophobicContact CG2-CE 4.15Å; I461-M463 HydrophobicContact CG2-CG 4.16Å; I461-M463 PolarHBondContact O-N 2.77Å; M463-R468 HydrophobicContact CB-CG 3.98Å; M463-R468 PolarHBondContact O-NE 2.82Å
464	P	72.3	Confident	76.1	Confident	23 Å²	23	54.4 Å²	54.4	15%	0.149	28%	0.28	C	S	.	.			trans	-55.2	141.6	174.2	-23.9	34	0	0	0	111.3	L318 E321 S466 H467 R468	L318-P464 HydrophobicContact CD2-CG 4.02Å; E321-P464 HydrophobicContact CB-CG 4.25Å; E321-P464 HydrophobicContact CG-CG 4.21Å; P464-S466 VanDerWaalsContact C-N 3.25Å; P464-S466 PolarHBondContact O-N 3.11Å; P464-H467 WeakPolarHBondContact O-CB 3.38Å; P464-H467 PolarHBondContact O-N 3.03Å; P464-R468 PolarHBondContact O-N 2.9Å
465	T	76.7	Confident	76.4	Confident	96 Å²	96	52.4 Å²	52.4	59%	0.589	27%	0.269	S	S	*	.	H	α-helix	trans	-56.4	-40.4	-178.2	49	0	0	0	0	111.9	H467 R468 I469	T465-H467 VanDerWaalsContact C-N 3.33Å; T465-H467 PolarHBondContact O-N 2.79Å; T465-R468 PolarHBondContact O-N 3.41Å; T465-I469 VanDerWaalsContact O-CG1 3.3Å; T465-I469 WeakPolarHBondContact O-CG1 3.49Å; T465-I469 PolarHBondContact O-N 3.38Å
466	S	76.2	Confident	76.6	Confident	24 Å²	24	54.9 Å²	54.9	17%	0.168	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-41.4	175.9	-58.1	0	0	0	0	112.8	N413 P464 A470	N413-S466 WeakPolarHBondContact OD1-CB 3.4Å; N413-S466 PolarHBondContact OD1-OG 3.27Å; N413-S466 VanDerWaalsContact OD1-OG 3.09Å; P464-S466 VanDerWaalsContact C-N 3.25Å; P464-S466 PolarHBondContact O-N 3.11Å; S466-A470 WeakPolarHBondContact O-CB 3.49Å; S466-A470 PolarHBondContact O-N 3.15Å
467	H	78.3	Confident	77	Confident	20 Å²	20	51 Å²	51	9%	0.093	27%	0.265	C	S	.	.	H	α-helix	trans	-68.2	-43.3	176.8	-173.7	-71.8	0	0	0	111.2	Y416 P464 T465 I469 A470 C471	Y416-H467 HydrophobicContact CE2-CB 4.43Å; Y416-H467 WeakPolarHBondContact OH-CB 3.26Å; Y416-H467 PolarHBondContact OH-CD2 2.88Å; P464-H467 WeakPolarHBondContact O-CB 3.38Å; P464-H467 PolarHBondContact O-N 3.03Å; T465-H467 VanDerWaalsContact C-N 3.33Å; T465-H467 PolarHBondContact O-N 2.79Å; H467-I469 VanDerWaalsContact C-N 3.35Å; H467-I469 PolarHBondContact O-N 3.32Å; H467-A470 WeakPolarHBondContact O-CB 3.48Å; H467-A470 PolarHBondContact O-N 3.37Å; H467-A470 VanDerWaalsContact O-N 3.17Å; H467-C471 PolarHBondContact CE1-SG 3.41Å; H467-C471 PolarHBondContact O-N 3.43Å; H467-C471 PolarHBondContact O-SG 2.72Å
468	R	81.9	Confident	77.4	Confident	79 Å²	79	51.1 Å²	51.1	30%	0.298	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-44.7	177.6	-66.8	177.7	166.6	-179.1	-8.8	112.1	A458 I461 M463 P464 T465 A470 C471 L472	A458-R468 HydrophobicContact CB-CB 4.23Å; A458-R468 HydrophobicContact CB-CG 4.02Å; A458-R468 WeakPolarHBondContact O-CD 3.32Å; A458-R468 VanDerWaalsContact O-CZ 3.27Å; A458-R468 PolarHBondContact O-NE 2.86Å; A458-R468 PolarHBondContact O-NH2 3.1Å; I461-R468 PolarHBondContact O-NH2 2.8Å; M463-R468 HydrophobicContact CB-CG 3.98Å; M463-R468 PolarHBondContact O-NE 2.82Å; P464-R468 PolarHBondContact O-N 2.9Å; T465-R468 PolarHBondContact O-N 3.41Å; R468-A470 VanDerWaalsContact C-N 3.29Å; R468-A470 PolarHBondContact O-N 3.13Å; R468-C471 PolarHBondContact O-N 3.19Å; R468-L472 PolarHBondContact O-N 2.66Å; R468-L472 VanDerWaalsContact O-N 3.08Å
469	I	80.4	Confident	77.9	Confident	113 Å²	113	55.6 Å²	55.6	58%	0.579	29%	0.288	S	S	*	.	H	α-helix	trans	-64.4	-37.8	177.2	-66.8	167.2	0	0	0	110.4	T465 H467 R473	T465-I469 VanDerWaalsContact O-CG1 3.3Å; T465-I469 WeakPolarHBondContact O-CG1 3.49Å; T465-I469 PolarHBondContact O-N 3.38Å; H467-I469 VanDerWaalsContact C-N 3.35Å; H467-I469 PolarHBondContact O-N 3.32Å; I469-R473 WeakPolarHBondContact O-CB 3.41Å; I469-R473 PolarHBondContact O-N 2.93Å
470	A	79.6	Confident	78.5	Confident	5 Å²	5	50.5 Å²	50.5	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-63.7	-44.6	177	0	0	0	0	0	112.5	Y416 S466 H467 R468 R473 D474	Y416-A470 HydrophobicContact CD1-CB 3.48Å; Y416-A470 VanDerWaalsContact CD1-CB 3.48Å; Y416-A470 HydrophobicContact CD2-CB 4.02Å; Y416-A470 HydrophobicContact CE1-CB 3.85Å; Y416-A470 HydrophobicContact CE2-CB 4.32Å; Y416-A470 HydrophobicContact CG-CB 3.61Å; S466-A470 WeakPolarHBondContact O-CB 3.49Å; S466-A470 PolarHBondContact O-N 3.15Å; H467-A470 WeakPolarHBondContact O-CB 3.48Å; H467-A470 PolarHBondContact O-N 3.37Å; H467-A470 VanDerWaalsContact O-N 3.17Å; R468-A470 VanDerWaalsContact C-N 3.29Å; R468-A470 PolarHBondContact O-N 3.13Å; A470-R473 PolarHBondContact O-N 3.14Å; A470-D474 PolarHBondContact O-N 3.45Å
471	C	78.3	Confident	79.2	Confident	17 Å²	17	49.2 Å²	49.2	12%	0.115	26%	0.261	C	S	.	.	H	α-helix	trans	-59.8	-55.7	174.8	-65.9	0	0	0	0	111.7	D454 H467 R468 R473 D474 D475	D454-C471 HydrophobicContact CB-CB 4.47Å; H467-C471 PolarHBondContact CE1-SG 3.41Å; H467-C471 PolarHBondContact O-N 3.43Å; H467-C471 PolarHBondContact O-SG 2.72Å; R468-C471 PolarHBondContact O-N 3.19Å; C471-R473 PolarHBondContact O-N 3.49Å; C471-R473 VanDerWaalsContact O-N 3.13Å; C471-D474 PolarHBondContact O-N 3.29Å; C471-D475 VanDerWaalsContact O-CG 3.28Å; C471-D475 PolarHBondContact O-N 3.03Å
472	L	80.5	Confident	79.9	Confident	106 Å²	106	51.1 Å²	51.1	56%	0.555	27%	0.271	S	S	*	.	H	α-helix	trans	-54.8	-37.8	179.8	-173.3	83.6	0	0	0	112.4	D455 R468 L476	D455-L472 VanDerWaalsContact OD1-CA 3.25Å; D455-L472 WeakPolarHBondContact OD1-CA 3.34Å; R468-L472 PolarHBondContact O-N 2.66Å; R468-L472 VanDerWaalsContact O-N 3.08Å; L472-L476 PolarHBondContact O-N 3.45Å
473	R	82.3	Confident	80.9	Confident	43 Å²	43	52 Å²	52	16%	0.162	26%	0.262	C	S	.	.	H	α-helix	trans	-68.4	-47.8	177.6	175.2	-149.5	73.2	-163	-0	112	Y416 L420 I469 A470 C471 D475 L476 I477	Y416-R473 VanDerWaalsContact C-NH1 3.3Å; Y416-R473 PolarHBondContact O-NH1 3.47Å; Y416-R473 PolarHBondContact O-NH2 2.91Å; L420-R473 HydrophobicContact CD1-CG 4.15Å; I469-R473 WeakPolarHBondContact O-CB 3.41Å; I469-R473 PolarHBondContact O-N 2.93Å; A470-R473 PolarHBondContact O-N 3.14Å; C471-R473 PolarHBondContact O-N 3.49Å; C471-R473 VanDerWaalsContact O-N 3.13Å; R473-D475 PolarHBondContact O-N 2.9Å; R473-L476 WeakPolarHBondContact O-CB 3.35Å; R473-L476 PolarHBondContact O-N 3.36Å; R473-I477 HydrophobicContact CG-CD1 4.21Å; R473-I477 VanDerWaalsContact O-CG1 3.28Å; R473-I477 WeakPolarHBondContact O-CG1 3.4Å; R473-I477 PolarHBondContact O-N 2.93Å
474	D	82.8	Confident	81.5	Confident	48 Å²	48	52.1 Å²	52.1	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-60.5	-32.5	178.9	-72.4	-10.2	0	0	0	111.1	A470 C471 I477 F478	A470-D474 PolarHBondContact O-N 3.45Å; C471-D474 PolarHBondContact O-N 3.29Å; D474-I477 WeakPolarHBondContact O-CB 3.13Å; D474-I477 PolarHBondContact O-N 2.82Å; D474-F478 WeakPolarHBondContact O-CB 3.24Å; D474-F478 PolarHBondContact O-N 3.33Å
475	D	84.2	Confident	81.9	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-72.5	-40.7	176.4	-65.3	-9.4	0	0	0	112.1	T451 D455 C471 R473 I477 F478 L479	T451-D475 WeakPolarHBondContact CA-OD1 3.32Å; T451-D475 WeakPolarHBondContact CB-OD1 3.46Å; T451-D475 HydrophobicContact CG2-CB 3.51Å; T451-D475 WeakPolarHBondContact CG2-OD1 3.42Å; T451-D475 PolarHBondContact OG1-OD1 3.35Å; D455-D475 VanDerWaalsContact OD1-OD2 3.12Å; C471-D475 VanDerWaalsContact O-CG 3.28Å; C471-D475 PolarHBondContact O-N 3.03Å; R473-D475 PolarHBondContact O-N 2.9Å; D475-I477 VanDerWaalsContact C-N 3.35Å; D475-I477 PolarHBondContact O-N 3.44Å; D475-F478 CarbonylContact O-C 3.55Å; D475-F478 WeakPolarHBondContact O-CB 3.25Å; D475-F478 PolarHBondContact O-N 2.75Å; D475-F478 VanDerWaalsContact O-N 3.17Å; D475-L479 WeakPolarHBondContact O-CG 3.31Å; D475-L479 PolarHBondContact O-N 2.96Å
476	L	83.6	Confident	82.3	Confident	102 Å²	102	58.5 Å²	58.5	53%	0.534	27%	0.273	S	S	.	.	H	α-helix	trans	-59.2	-45	170.8	179.3	63.8	0	0	0	111.7	L472 R473 F478 L479 I480	L472-L476 PolarHBondContact O-N 3.45Å; R473-L476 WeakPolarHBondContact O-CB 3.35Å; R473-L476 PolarHBondContact O-N 3.36Å; L476-F478 VanDerWaalsContact C-N 3.28Å; L476-F478 PolarHBondContact O-N 2.9Å; L476-L479 PolarHBondContact O-N 2.88Å; L476-I480 HydrophobicContact CG-CD1 4.26Å; L476-I480 VanDerWaalsContact O-CG1 3.28Å; L476-I480 WeakPolarHBondContact O-CG1 3.34Å; L476-I480 PolarHBondContact O-N 2.87Å
477	I	82.9	Confident	82.6	Confident	15 Å²	15	61.4 Å²	61.4	8%	0.077	29%	0.286	C	S	.	.	H	α-helix	trans	-59.8	-43.3	175.5	-65.6	167.8	0	0	0	109.8	L420 M423 L427 R473 D474 D475 I480 Y481	L420-I477 HydrophobicContact CD1-CD1 3.41Å; L420-I477 VanDerWaalsContact CD1-CD1 3.41Å; L420-I477 HydrophobicContact CD1-CG1 4.19Å; M423-I477 HydrophobicContact CB-CD1 4.21Å; M423-I477 HydrophobicContact CB-CG2 3.83Å; M423-I477 HydrophobicContact SD-CD1 4.39Å; M423-I477 HydrophobicContact SD-CG2 4.11Å; L427-I477 HydrophobicContact CD1-CB 4.31Å; L427-I477 HydrophobicContact CD1-CG2 3.57Å; L427-I477 HydrophobicContact CG-CG2 4.28Å; R473-I477 HydrophobicContact CG-CD1 4.21Å; R473-I477 VanDerWaalsContact O-CG1 3.28Å; R473-I477 WeakPolarHBondContact O-CG1 3.4Å; R473-I477 PolarHBondContact O-N 2.93Å; D474-I477 WeakPolarHBondContact O-CB 3.13Å; D474-I477 PolarHBondContact O-N 2.82Å; D475-I477 VanDerWaalsContact C-N 3.35Å; D475-I477 PolarHBondContact O-N 3.44Å; I477-I480 PolarHBondContact O-N 2.73Å; I477-Y481 PolarHBondContact O-N 2.77Å
478	F	82.5	Confident	82.9	Confident	8 Å²	8	61.6 Å²	61.6	4%	0.035	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-38.8	178	-177.8	-108.3	0	0	0	112.6	M444 K447 A448 T451 D474 D475 L476 Y481 L482	M444-F478 HydrophobicContact CG-CZ 4.21Å; K447-F478 HydrophobicContact CB-CE2 4.16Å; K447-F478 HydrophobicContact CB-CZ 4.38Å; K447-F478 HydrophobicContact CD-CD2 3.89Å; K447-F478 HydrophobicContact CD-CE2 3.75Å; K447-F478 HydrophobicContact CG-CD2 4.04Å; K447-F478 HydrophobicContact CG-CE2 3.85Å; K447-F478 HydrophobicContact CG-CZ 4.42Å; A448-F478 VanDerWaalsContact CA-CE1 3.41Å; A448-F478 HydrophobicContact CB-CE1 3.52Å; A448-F478 HydrophobicContact CB-CZ 3.75Å; T451-F478 HydrophobicContact CG2-CD1 3.95Å; D474-F478 WeakPolarHBondContact O-CB 3.24Å; D474-F478 PolarHBondContact O-N 3.33Å; D475-F478 CarbonylContact O-C 3.55Å; D475-F478 WeakPolarHBondContact O-CB 3.25Å; D475-F478 PolarHBondContact O-N 2.75Å; D475-F478 VanDerWaalsContact O-N 3.17Å; L476-F478 VanDerWaalsContact C-N 3.28Å; L476-F478 PolarHBondContact O-N 2.9Å; F478-Y481 HydrophobicContact CD2-CD1 4.35Å; F478-Y481 HydrophobicContact CE2-CD1 4.26Å; F478-Y481 WeakPolarHBondContact O-CB 3.03Å; F478-Y481 PolarHBondContact O-N 2.73Å; F478-L482 HydrophobicContact CD1-CD1 4.06Å; F478-L482 HydrophobicContact CD1-CG 4.42Å; F478-L482 HydrophobicContact CE1-CD1 3.53Å; F478-L482 HydrophobicContact CE1-CD2 4.43Å; F478-L482 HydrophobicContact CE1-CG 3.95Å; F478-L482 HydrophobicContact CZ-CD1 4.03Å; F478-L482 HydrophobicContact CZ-CD2 4.07Å; F478-L482 HydrophobicContact CZ-CG 4.01Å; F478-L482 PolarHBondContact O-N 3.33Å
479	L	84.5	Confident	82.7	Confident	104 Å²	104	62.3 Å²	62.3	55%	0.545	30%	0.301	S	S	.	.	H	α-helix	trans	-63.2	-42.8	173.1	-73.5	173.7	0	0	0	111.9	D475 L476 Y481 L482 Y483	D475-L479 WeakPolarHBondContact O-CG 3.31Å; D475-L479 PolarHBondContact O-N 2.96Å; L476-L479 PolarHBondContact O-N 2.88Å; L479-Y481 VanDerWaalsContact C-N 3.28Å; L479-Y481 PolarHBondContact O-N 2.93Å; L479-L482 PolarHBondContact O-N 2.95Å; L479-Y483 PolarHBondContact O-N 3.19Å
480	I	85.3	Confident	82.3	Confident	69 Å²	69	59.7 Å²	59.7	35%	0.354	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-40.7	173.9	-62.3	165	0	0	0	109.9	L427 L476 I477 Y483 Q484	L427-I480 HydrophobicContact CD1-CG2 4.4Å; L427-I480 HydrophobicContact CD2-CB 4.14Å; L427-I480 HydrophobicContact CD2-CG2 3.82Å; L476-I480 HydrophobicContact CG-CD1 4.26Å; L476-I480 VanDerWaalsContact O-CG1 3.28Å; L476-I480 WeakPolarHBondContact O-CG1 3.34Å; L476-I480 PolarHBondContact O-N 2.87Å; I477-I480 PolarHBondContact O-N 2.73Å; I480-Y483 WeakPolarHBondContact O-CB 3.28Å; I480-Y483 PolarHBondContact O-N 2.82Å; I480-Q484 WeakPolarHBondContact O-CG 3.49Å; I480-Q484 PolarHBondContact O-N 2.86Å
481	Y	83.7	Confident	81.6	Confident	11 Å²	11	62.1 Å²	62.1	4%	0.043	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-43.5	175.4	172.8	-94.9	0	0	0	112.3	V436 L439 I477 F478 L479 Y483 Q484 R485	V436-Y481 HydrophobicContact CG1-CE2 3.61Å; V436-Y481 VanDerWaalsContact CG1-OH 3.28Å; V436-Y481 WeakPolarHBondContact CG1-OH 3.36Å; L439-Y481 VanDerWaalsContact CD1-OH 3.26Å; L439-Y481 WeakPolarHBondContact CD1-OH 3.44Å; I477-Y481 PolarHBondContact O-N 2.77Å; F478-Y481 HydrophobicContact CD2-CD1 4.35Å; F478-Y481 HydrophobicContact CE2-CD1 4.26Å; F478-Y481 WeakPolarHBondContact O-CB 3.03Å; F478-Y481 PolarHBondContact O-N 2.73Å; L479-Y481 VanDerWaalsContact C-N 3.28Å; L479-Y481 PolarHBondContact O-N 2.93Å; Y481-Y483 VanDerWaalsContact C-N 3.33Å; Y481-Y483 PolarHBondContact O-N 2.82Å; Y481-Q484 PolarHBondContact O-N 2.8Å; Y481-R485 PolarHBondContact O-N 2.89Å
482	L	83.5	Confident	80.7	Confident	55 Å²	55	66.1 Å²	66.1	29%	0.288	32%	0.318	S	S	.	.	H	α-helix	trans	-61.7	-41.7	174.4	-74.2	176.9	0	0	0	111.8	M444 F478 L479 R485 W486	M444-L482 HydrophobicContact CE-CD2 4.42Å; M444-L482 HydrophobicContact CG-CD2 4.34Å; M444-L482 HydrophobicContact SD-CD2 3.67Å; F478-L482 HydrophobicContact CD1-CD1 4.06Å; F478-L482 HydrophobicContact CD1-CG 4.42Å; F478-L482 HydrophobicContact CE1-CD1 3.53Å; F478-L482 HydrophobicContact CE1-CD2 4.43Å; F478-L482 HydrophobicContact CE1-CG 3.95Å; F478-L482 HydrophobicContact CZ-CD1 4.03Å; F478-L482 HydrophobicContact CZ-CD2 4.07Å; F478-L482 HydrophobicContact CZ-CG 4.01Å; F478-L482 PolarHBondContact O-N 3.33Å; L479-L482 PolarHBondContact O-N 2.95Å; L482-R485 PolarHBondContact O-N 2.8Å; L482-W486 PolarHBondContact O-N 3.08Å
483	Y	86.3	Confident	79.3	Confident	137 Å²	137	64.7 Å²	64.7	54%	0.537	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-43.7	175	179.2	-105.2	0	0	0	112	L479 I480 Y481 R485 W486 L487	L479-Y483 PolarHBondContact O-N 3.19Å; I480-Y483 WeakPolarHBondContact O-CB 3.28Å; I480-Y483 PolarHBondContact O-N 2.82Å; Y481-Y483 VanDerWaalsContact C-N 3.33Å; Y481-Y483 PolarHBondContact O-N 2.82Å; Y483-R485 VanDerWaalsContact C-N 3.33Å; Y483-R485 PolarHBondContact O-N 3.21Å; Y483-W486 HydrophobicContact CD2-CE3 4.31Å; Y483-W486 HydrophobicContact CE2-CE3 4.07Å; Y483-W486 HydrophobicContact CE2-CZ3 4.12Å; Y483-W486 PolarHBondContact O-N 3.16Å; Y483-L487 PolarHBondContact O-N 3.12Å
484	Q	85.2	Confident	78.2	Confident	15 Å²	15	64.4 Å²	64.4	7%	0.07	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-39.8	174.2	-72.9	-177	-16.9	0	0	112.4	L427 V436 I480 Y481 W486 L487 Y488	L427-Q484 PolarHBondContact O-NE2 2.98Å; L427-Q484 PolarHBondContact O-OE1 2.94Å; V436-Q484 HydrophobicContact CG2-CB 4.38Å; I480-Q484 WeakPolarHBondContact O-CG 3.49Å; I480-Q484 PolarHBondContact O-N 2.86Å; Y481-Q484 PolarHBondContact O-N 2.8Å; Q484-W486 VanDerWaalsContact C-N 3.29Å; Q484-W486 PolarHBondContact O-N 3.32Å; Q484-L487 PolarHBondContact O-N 3.43Å; Q484-Y488 HydrophobicContact CB-CD2 4.07Å; Q484-Y488 HydrophobicContact CB-CE2 4.23Å; Q484-Y488 HydrophobicContact CG-CD2 4.47Å; Q484-Y488 HydrophobicContact CG-CE2 4.15Å; Q484-Y488 WeakPolarHBondContact O-CB 3.05Å; Q484-Y488 WeakPolarHBondContact O-CD2 3.49Å; Q484-Y488 PolarHBondContact O-N 3.45Å
485	R	81.9	Confident	76.7	Confident	54 Å²	54	65.2 Å²	65.2	20%	0.204	32%	0.322	C	S	.	.	H	α-helix	trans	-66.5	-31.9	176.5	-177.2	178.3	174.9	159.1	6.6	112.5	V436 M444 Y481 L482 Y483 V490	V436-R485 HydrophobicContact CG1-CB 4.37Å; V436-R485 HydrophobicContact CG2-CB 4.4Å; M444-R485 PolarHBondContact SD-NH1 3.29Å; Y481-R485 PolarHBondContact O-N 2.89Å; L482-R485 PolarHBondContact O-N 2.8Å; Y483-R485 VanDerWaalsContact C-N 3.33Å; Y483-R485 PolarHBondContact O-N 3.21Å; R485-V490 HydrophobicContact CG-CG2 4.42Å
486	W	83.4	Confident	75.3	Confident	200 Å²	200	65.3 Å²	65.3	76%	0.758	32%	0.323	S	S	*	.	H	α-helix	trans	-70.9	-38.2	173.8	177	76.6	0	0	0	111.9	L482 Y483 Q484	L482-W486 PolarHBondContact O-N 3.08Å; Y483-W486 HydrophobicContact CD2-CE3 4.31Å; Y483-W486 HydrophobicContact CE2-CE3 4.07Å; Y483-W486 HydrophobicContact CE2-CZ3 4.12Å; Y483-W486 PolarHBondContact O-N 3.16Å; Q484-W486 VanDerWaalsContact C-N 3.29Å; Q484-W486 PolarHBondContact O-N 3.32Å
487	L	84.5	Confident	73.8	Confident	85 Å²	85	63.1 Å²	63.1	45%	0.445	31%	0.31	S	S	.	.	H	α-helix	trans	-81.5	-33.5	-177.3	-172.1	63	0	0	0	114.1	Y483 Q484	Y483-L487 PolarHBondContact O-N 3.12Å; Q484-L487 PolarHBondContact O-N 3.43Å
488	Y	84.2	Confident	72.1	Confident	23 Å²	23	67.4 Å²	67.4	9%	0.09	33%	0.328	C	S	.	.	S	Bend	trans	-112.9	143.3	-170.9	-58.5	-40.9	0	0	0	113	Y431 K434 Q484	Y431-Y488 VanDerWaalsContact CD2-OH 3.27Å; Y431-Y488 WeakPolarHBondContact CD2-OH 3.43Å; K434-Y488 HydrophobicContact CB-CD1 4.07Å; K434-Y488 HydrophobicContact CB-CE1 4.29Å; K434-Y488 HydrophobicContact CD-CD1 3.82Å; K434-Y488 HydrophobicContact CD-CE1 3.17Å; K434-Y488 HydrophobicContact CD-CE2 4.47Å; K434-Y488 HydrophobicContact CG-CE1 4.34Å; K434-Y488 PolarHBondContact NZ-OH 2.87Å; K434-Y488 WeakPolarHBondContact O-CB 3.37Å; Q484-Y488 HydrophobicContact CB-CD2 4.07Å; Q484-Y488 HydrophobicContact CB-CE2 4.23Å; Q484-Y488 HydrophobicContact CG-CD2 4.47Å; Q484-Y488 HydrophobicContact CG-CE2 4.15Å; Q484-Y488 WeakPolarHBondContact O-CB 3.05Å; Q484-Y488 WeakPolarHBondContact O-CD2 3.49Å; Q484-Y488 PolarHBondContact O-N 3.45Å
489	P	76.1	Confident	70.2	Confident	95 Å²	95	70.2 Å²	70.2	62%	0.617	34%	0.344	S	S	*	.			trans	-62.6	145.6	176.6	25.3	-34.5	0	0	0	112.6	K434 S435 V436	K434-P489 WeakPolarHBondContact O-CD 3.34Å; S435-P489 VanDerWaalsContact CA-O 3.31Å; S435-P489 WeakPolarHBondContact CA-O 3.39Å; V436-P489 PolarHBondContact N-O 3.03Å; V436-P489 VanDerWaalsContact N-O 3.08Å
490	V	73.2	Confident	68.1	Low	58 Å²	58	69.1 Å²	69.1	35%	0.352	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.5	178.6	-179.4	0	0	0	0	109.7	V436 H438 R485	V436-V490 CarbonylContact O-C 3.58Å; V436-V490 WeakPolarHBondContact O-CA 3.34Å; H438-V490 HydrophobicContact CB-CG1 3.86Å; R485-V490 HydrophobicContact CG-CG2 4.42Å
491	D	64.6	Low	65.8	Low	56 Å²	56	69.2 Å²	69.2	30%	0.299	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	111.6	178.2	-169.5	-12.5	0	0	0	110	V436 H438 S493 R494	V436-D491 PolarHBondContact O-N 3.1Å; H438-D491 PolarHBondContact N-O 3.35Å; D491-S493 VanDerWaalsContact C-N 3.26Å; D491-S493 VanDerWaalsContact CG-OG 3.32Å; D491-S493 PolarHBondContact O-N 3.29Å; D491-S493 WeakPolarHBondContact OD1-CB 3.44Å; D491-S493 PolarHBondContact OD1-N 3.32Å; D491-S493 PolarHBondContact OD1-OG 2.9Å; D491-S493 PolarHBondContact OD2-OG 2.84Å; D491-R494 HydrophobicContact CB-CG 4.22Å
492	K	60.5	Low	63.7	Low	101 Å²	101	69.3 Å²	69.3	44%	0.439	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-17.8	179.6	-71.7	-172.6	175.5	-171.3	0	113.3	H438 R494 S502 D504	H438-K492 HydrophobicContact CB-CG 4.43Å; K492-R494 VanDerWaalsContact C-N 3.34Å; K492-S502 PolarHBondContact O-OG 3.05Å; K492-D504 IonicContact NZ-OD2 3.02Å; K492-D504 PolarHBondContact NZ-OD2 3.01Å
493	S	50.7	Low	61.9	Low	75 Å²	75	73.1 Å²	73.1	52%	0.524	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-19.2	179.7	72.4	0	0	0	0	113.1	D491	D491-S493 VanDerWaalsContact C-N 3.26Å; D491-S493 VanDerWaalsContact CG-OG 3.32Å; D491-S493 PolarHBondContact O-N 3.29Å; D491-S493 WeakPolarHBondContact OD1-CB 3.44Å; D491-S493 PolarHBondContact OD1-N 3.32Å; D491-S493 PolarHBondContact OD1-OG 2.9Å; D491-S493 PolarHBondContact OD2-OG 2.84Å
494	R	58.1	Low	59.9	Low	38 Å²	38	70.9 Å²	70.9	14%	0.143	36%	0.356	C	S	.	.	S	Bend	trans	-81.4	132.3	-178.4	-73.4	-176.1	63.4	-159.8	-9	111.3	L429 N430 S435 A437 D491 K492 N496	L429-R494 VanDerWaalsContact CD2-NH2 3.31Å; N430-R494 PolarHBondContact OD1-NH1 2.87Å; N430-R494 PolarHBondContact OD1-NH2 3.48Å; S435-R494 PolarHBondContact O-NH1 3.02Å; S435-R494 PolarHBondContact OG-NH1 2.83Å; S435-R494 VanDerWaalsContact OG-NH1 3.12Å; A437-R494 HydrophobicContact CB-CB 3.91Å; D491-R494 HydrophobicContact CB-CG 4.22Å; K492-R494 VanDerWaalsContact C-N 3.34Å; R494-N496 PolarHBondContact O-N 3Å
495	V	51.8	Low	57.7	Low	64 Å²	64	71.2 Å²	71.2	39%	0.388	36%	0.359	S	S	.	.			trans	-62.5	127.2	168.6	-129.2	0	0	0	0	108.6	N499 M501	V495-N499 VanDerWaalsContact CG1-C 3.42Å; V495-N499 VanDerWaalsContact CG1-CA 3.47Å; V495-N499 HydrophobicContact CG1-CB 3.98Å; V495-N499 WeakPolarHBondContact CG1-O 3.32Å; V495-M501 HydrophobicContact CG1-CE 4.4Å; V495-M501 HydrophobicContact CG1-CG 4.05Å; V495-M501 HydrophobicContact CG2-CE 3.74Å
496	N	54.4	Low	55.8	Low	6 Å²	6	76.1 Å²	76.1	3%	0.032	38%	0.382	C	S	.	.			trans	-81	178.3	178.3	62.7	22.3	0	0	0	111.9	A437 H438 L439 R494 F498 N499 Q500	A437-N496 HydrophobicContact CB-CB 4.1Å; H438-N496 WeakPolarHBondContact O-CB 3.17Å; H438-N496 PolarHBondContact O-ND2 3.06Å; L439-N496 HydrophobicContact CD1-CB 4.1Å; L439-N496 HydrophobicContact CG-CB 4.38Å; R494-N496 PolarHBondContact O-N 3Å; N496-F498 PolarHBondContact O-N 3.32Å; N496-F498 PolarHBondContact OD1-N 2.87Å; N496-N499 WeakPolarHBondContact O-CA 3.36Å; N496-N499 PolarHBondContact O-N 2.98Å; N496-N499 PolarHBondContact OD1-N 3.05Å; N496-Q500 PolarHBondContact N-O 3.29Å; N496-Q500 PolarHBondContact ND2-O 3.19Å; N496-Q500 VanDerWaalsContact ND2-O 3.11Å; N496-Q500 WeakPolarHBondContact OD1-CA 3.09Å; N496-Q500 WeakPolarHBondContact OD1-CB 3.11Å; N496-Q500 PolarHBondContact OD1-N 3.49Å; N496-Q500 PolarHBondContact OD1-O 2.82Å; N496-Q500 VanDerWaalsContact OD1-O 3.07Å
497	E	52.7	Low	53.6	Low	56 Å²	56	73.1 Å²	73.1	26%	0.262	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-12	-178.7	67.6	-166.2	-167.3	0	0	114.9	Q426 L439 K447	Q426-E497 PolarHBondContact NE2-OE2 3.02Å; L439-E497 HydrophobicContact CD1-CG 4.06Å; L439-E497 HydrophobicContact CD2-CG 4.44Å; L439-E497 WeakPolarHBondContact CD2-OE1 3.48Å; K447-E497 IonicContact NZ-OE1 3.5Å; K447-E497 PolarHBondContact NZ-OE1 2.97Å; K447-E497 IonicContact NZ-OE2 3.35Å; K447-E497 PolarHBondContact NZ-OE2 2.74Å
498	F	46.2	Very low	51.7	Low	105 Å²	105	72.4 Å²	72.4	46%	0.461	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	13.1	173.4	-61.3	-75	0	0	0	112.4	L439 N496 Q500	L439-F498 HydrophobicContact CD2-CD2 4.42Å; L439-F498 HydrophobicContact CD2-CE2 4.11Å; N496-F498 PolarHBondContact O-N 3.32Å; N496-F498 PolarHBondContact OD1-N 2.87Å; F498-Q500 HydrophobicContact CB-CG 4.49Å; F498-Q500 PolarHBondContact O-N 2.86Å; F498-Q500 VanDerWaalsContact O-N 3.12Å
499	N	44.2	Very low	49.5	Very low	68 Å²	68	77.3 Å²	77.3	36%	0.364	40%	0.401	S	S	.	.	S	Bend	trans	49.7	29.9	-174	-76.4	-35.4	0	0	0	114.8	G298 V495 N496	G298-N499 WeakPolarHBondContact O-CB 3.45Å; G298-N499 PolarHBondContact O-ND2 3.47Å; V495-N499 VanDerWaalsContact CG1-C 3.42Å; V495-N499 VanDerWaalsContact CG1-CA 3.47Å; V495-N499 HydrophobicContact CG1-CB 3.98Å; V495-N499 WeakPolarHBondContact CG1-O 3.32Å; N496-N499 WeakPolarHBondContact O-CA 3.36Å; N496-N499 PolarHBondContact O-N 2.98Å; N496-N499 PolarHBondContact OD1-N 3.05Å
500	Q	40.5	Very low	47.9	Very low	80 Å²	80	75.6 Å²	75.6	37%	0.374	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-92.4	124.8	170.2	-65.8	173.2	2.7	0	0	109.5	N496 F498	N496-Q500 PolarHBondContact N-O 3.29Å; N496-Q500 PolarHBondContact ND2-O 3.19Å; N496-Q500 VanDerWaalsContact ND2-O 3.11Å; N496-Q500 WeakPolarHBondContact OD1-CA 3.09Å; N496-Q500 WeakPolarHBondContact OD1-CB 3.11Å; N496-Q500 PolarHBondContact OD1-N 3.49Å; N496-Q500 PolarHBondContact OD1-O 2.82Å; N496-Q500 VanDerWaalsContact OD1-O 3.07Å; F498-Q500 HydrophobicContact CB-CG 4.49Å; F498-Q500 PolarHBondContact O-N 2.86Å; F498-Q500 VanDerWaalsContact O-N 3.12Å
501	M	36.9	Very low	46.5	Very low	72 Å²	72	76.9 Å²	76.9	36%	0.355	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-85.8	148.3	159.5	-65.9	176.6	173.1	0	0	108.2	V495 D503 S505	V495-M501 HydrophobicContact CG1-CE 4.4Å; V495-M501 HydrophobicContact CG1-CG 4.05Å; V495-M501 HydrophobicContact CG2-CE 3.74Å; M501-D503 PolarHBondContact O-N 3.21Å; M501-S505 VanDerWaalsContact CB-OG 3.27Å; M501-S505 WeakPolarHBondContact CB-OG 3.07Å
502	S	38.4	Very low	45.5	Very low	12 Å²	12	76.8 Å²	76.8	8%	0.084	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-57.5	140	177.2	55.5	0	0	0	0	110.8	K492 D504 S505	K492-S502 PolarHBondContact O-OG 3.05Å; S502-D504 PolarHBondContact O-N 2.79Å; S502-S505 WeakPolarHBondContact O-CB 3.3Å; S502-S505 PolarHBondContact O-N 3.28Å; S502-S505 PolarHBondContact O-OG 2.84Å
503	D	47.1	Very low	44.9	Very low	135 Å²	135	76.7 Å²	76.7	72%	0.722	41%	0.407	S	S	*	.	H	α-helix	trans	-48.2	-32.6	-179.3	-66.5	-30.9	0	0	0	113.3	M501 S505 F506 Q507	M501-D503 PolarHBondContact O-N 3.21Å; D503-S505 PolarHBondContact O-N 3.45Å; D503-S505 VanDerWaalsContact O-N 3.16Å; D503-F506 WeakPolarHBondContact O-CB 3.37Å; D503-F506 PolarHBondContact O-N 2.86Å; D503-Q507 PolarHBondContact O-N 2.79Å
504	D	43.9	Very low	44.6	Very low	91 Å²	91	77.2 Å²	77.2	49%	0.487	41%	0.407	S	S	.	.	H	α-helix	trans	-53.5	-34.6	175	-62.4	-12.2	0	0	0	113	K492 S502 S508	K492-D504 IonicContact NZ-OD2 3.02Å; K492-D504 PolarHBondContact NZ-OD2 3.01Å; S502-D504 PolarHBondContact O-N 2.79Å; D504-S508 PolarHBondContact O-N 3.3Å
505	S	39	Very low	44	Very low	21 Å²	21	79.5 Å²	79.5	15%	0.147	43%	0.426	C	S	.	.	H	α-helix	trans	-82.3	-25	179.4	67.5	0	0	0	0	113.1	M501 S502 D503 Q507 S508 K509	M501-S505 VanDerWaalsContact CB-OG 3.27Å; M501-S505 WeakPolarHBondContact CB-OG 3.07Å; S502-S505 WeakPolarHBondContact O-CB 3.3Å; S502-S505 PolarHBondContact O-N 3.28Å; S502-S505 PolarHBondContact O-OG 2.84Å; D503-S505 PolarHBondContact O-N 3.45Å; D503-S505 VanDerWaalsContact O-N 3.16Å; S505-Q507 VanDerWaalsContact C-N 3.3Å; S505-S508 WeakPolarHBondContact CA-OG 3.48Å; S505-S508 PolarHBondContact O-N 3.27Å; S505-S508 PolarHBondContact O-OG 2.79Å; S505-S508 VanDerWaalsContact O-OG 3.12Å; S505-K509 WeakPolarHBondContact O-CB 3.19Å; S505-K509 PolarHBondContact O-N 3.06Å
506	F	40.4	Very low	43.6	Very low	157 Å²	157	79.7 Å²	79.7	69%	0.689	43%	0.429	S	S	*	.	H	α-helix	trans	-66.2	-39.5	171.9	-128	-84.8	0	0	0	109.8	D503 S510	D503-F506 WeakPolarHBondContact O-CB 3.37Å; D503-F506 PolarHBondContact O-N 2.86Å; F506-S510 WeakPolarHBondContact O-CB 3.2Å; F506-S510 PolarHBondContact O-N 2.91Å; F506-S510 PolarHBondContact O-OG 3.35Å; F506-S510 VanDerWaalsContact O-OG 3.13Å
507	Q	38.9	Very low	43	Very low	137 Å²	137	85.6 Å²	85.6	64%	0.64	46%	0.455	S	S	*	.	H	α-helix	trans	-66	-44	173.2	-77.3	-172.5	-9.4	0	0	112.3	D503 S505 K509 S510 T511	D503-Q507 PolarHBondContact O-N 2.79Å; S505-Q507 VanDerWaalsContact C-N 3.3Å; Q507-K509 PolarHBondContact O-N 2.84Å; Q507-S510 WeakPolarHBondContact CA-OG 3.39Å; Q507-S510 PolarHBondContact O-N 3.06Å; Q507-S510 PolarHBondContact O-OG 2.88Å; Q507-T511 WeakPolarHBondContact O-CB 3.46Å; Q507-T511 PolarHBondContact O-N 2.04Å; Q507-T511 PolarHBondContact O-OG1 3.34Å
508	S	44.2	Very low	42.5	Very low	71 Å²	71	87.8 Å²	87.8	50%	0.497	47%	0.469	S	S	.	.	H	α-helix	trans	-66.4	-39.8	179	72.1	0	0	0	0	112.4	D504 S505 T511 S512	D504-S508 PolarHBondContact O-N 3.3Å; S505-S508 WeakPolarHBondContact CA-OG 3.48Å; S505-S508 PolarHBondContact O-N 3.27Å; S505-S508 PolarHBondContact O-OG 2.79Å; S505-S508 VanDerWaalsContact O-OG 3.12Å; S508-T511 PolarHBondContact O-N 3.12Å; S508-S512 PolarHBondContact O-N 3.13Å; S508-S512 PolarHBondContact O-OG 3Å; S508-S512 VanDerWaalsContact O-OG 3.13Å
509	K	38.9	Very low	42.5	Very low	126 Å²	126	86.3 Å²	86.3	55%	0.548	47%	0.472	S	S	.	.	H	α-helix	trans	-66	-43.4	175.3	-116.1	179.3	-178.8	177.9	0	112.7	S505 Q507 T511 S512 D513	S505-K509 WeakPolarHBondContact O-CB 3.19Å; S505-K509 PolarHBondContact O-N 3.06Å; Q507-K509 PolarHBondContact O-N 2.84Å; K509-T511 PolarHBondContact O-N 2.98Å; K509-S512 VanDerWaalsContact CA-OG 3.28Å; K509-S512 WeakPolarHBondContact CA-OG 3.27Å; K509-S512 PolarHBondContact O-N 2.76Å; K509-S512 PolarHBondContact O-OG 3.28Å; K509-D513 WeakPolarHBondContact O-CB 3.42Å; K509-D513 VanDerWaalsContact O-CG 3.28Å; K509-D513 PolarHBondContact O-N 2.82Å
510	S	42.2	Very low	42.6	Very low	59 Å²	59	86.2 Å²	86.2	41%	0.413	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-35.2	174.7	68.9	0	0	0	0	111.7	F506 Q507 V514	F506-S510 WeakPolarHBondContact O-CB 3.2Å; F506-S510 PolarHBondContact O-N 2.91Å; F506-S510 PolarHBondContact O-OG 3.35Å; F506-S510 VanDerWaalsContact O-OG 3.13Å; Q507-S510 WeakPolarHBondContact CA-OG 3.39Å; Q507-S510 PolarHBondContact O-N 3.06Å; Q507-S510 PolarHBondContact O-OG 2.88Å; S510-V514 WeakPolarHBondContact O-CB 3.25Å; S510-V514 WeakPolarHBondContact O-CG2 3.33Å; S510-V514 PolarHBondContact O-N 3.11Å
511	T	42	Very low	42.7	Very low	85 Å²	85	88.7 Å²	88.7	52%	0.521	49%	0.49	S	S	.	.	H	α-helix	trans	-71.7	-39	177.1	-50.4	0	0	0	0	111.6	Q507 S508 K509 V514 T515	Q507-T511 WeakPolarHBondContact O-CB 3.46Å; Q507-T511 PolarHBondContact O-N 2.04Å; Q507-T511 PolarHBondContact O-OG1 3.34Å; S508-T511 PolarHBondContact O-N 3.12Å; K509-T511 PolarHBondContact O-N 2.98Å; T511-V514 PolarHBondContact O-N 3.15Å; T511-T515 PolarHBondContact O-N 3.4Å; T511-T515 PolarHBondContact O-OG1 2.99Å
512	S	45.4	Very low	43.1	Very low	54 Å²	54	87.5 Å²	87.5	38%	0.378	50%	0.496	S	S	.	.	H	α-helix	trans	-69.4	-35.5	175	53.7	0	0	0	0	112.9	S508 K509 T515 S516	S508-S512 PolarHBondContact O-N 3.13Å; S508-S512 PolarHBondContact O-OG 3Å; S508-S512 VanDerWaalsContact O-OG 3.13Å; K509-S512 VanDerWaalsContact CA-OG 3.28Å; K509-S512 WeakPolarHBondContact CA-OG 3.27Å; K509-S512 PolarHBondContact O-N 2.76Å; K509-S512 PolarHBondContact O-OG 3.28Å; S512-T515 VanDerWaalsContact CA-OG1 3.29Å; S512-T515 WeakPolarHBondContact CA-OG1 3.45Å; S512-T515 PolarHBondContact O-N 2.84Å; S512-T515 PolarHBondContact O-OG1 2.66Å; S512-S516 WeakPolarHBondContact O-CB 3.37Å; S512-S516 PolarHBondContact O-N 3.14Å; S512-S516 PolarHBondContact O-OG 3.13Å
513	D	46.4	Very low	43.3	Very low	99 Å²	99	95.2 Å²	95.2	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-71.3	-37.7	175.7	-71	-14.5	0	0	0	110.4	K509 S516 F517	K509-D513 WeakPolarHBondContact O-CB 3.42Å; K509-D513 VanDerWaalsContact O-CG 3.28Å; K509-D513 PolarHBondContact O-N 2.82Å; D513-S516 WeakPolarHBondContact CA-OG 3.31Å; D513-S516 PolarHBondContact O-OG 2.9Å; D513-F517 WeakPolarHBondContact O-CB 3.43Å; D513-F517 PolarHBondContact O-N 3.04Å
514	V	46	Very low	43.1	Very low	85 Å²	85	93 Å²	93	52%	0.515	52%	0.523	S	S	.	.	H	α-helix	trans	-67.8	-38.9	173.6	171.4	0	0	0	0	112.1	S510 T511 N518	S510-V514 WeakPolarHBondContact O-CB 3.25Å; S510-V514 WeakPolarHBondContact O-CG2 3.33Å; S510-V514 PolarHBondContact O-N 3.11Å; T511-V514 PolarHBondContact O-N 3.15Å; V514-N518 WeakPolarHBondContact O-CB 3.1Å; V514-N518 PolarHBondContact O-N 2.92Å
515	T	44.1	Very low	43	Very low	87 Å²	87	97.6 Å²	97.6	53%	0.534	54%	0.539	S	S	.	.	H	α-helix	trans	-72	-38.3	177.1	33.7	0	0	0	0	112.7	T511 S512 N518 S519	T511-T515 PolarHBondContact O-N 3.4Å; T511-T515 PolarHBondContact O-OG1 2.99Å; S512-T515 VanDerWaalsContact CA-OG1 3.29Å; S512-T515 WeakPolarHBondContact CA-OG1 3.45Å; S512-T515 PolarHBondContact O-N 2.84Å; S512-T515 PolarHBondContact O-OG1 2.66Å; T515-N518 PolarHBondContact O-N 3.5Å; T515-S519 WeakPolarHBondContact O-CB 3.37Å; T515-S519 PolarHBondContact O-N 3.38Å
516	S	45	Very low	43	Very low	67 Å²	67	104.5 Å²	104.5	47%	0.469	57%	0.573	S	S	.	*	H	α-helix	trans	-67.5	-38.7	173.3	61.2	0	0	0	0	112	S512 D513 S519 A520	S512-S516 WeakPolarHBondContact O-CB 3.37Å; S512-S516 PolarHBondContact O-N 3.14Å; S512-S516 PolarHBondContact O-OG 3.13Å; D513-S516 WeakPolarHBondContact CA-OG 3.31Å; D513-S516 PolarHBondContact O-OG 2.9Å; S516-S519 PolarHBondContact O-N 3.05Å; S516-A520 PolarHBondContact O-N 2.91Å
517	F	41.8	Very low	42.8	Very low	130 Å²	130	104.1 Å²	104.1	57%	0.57	60%	0.599	S	S	*	*	H	α-helix	trans	-66.1	-38.3	175.4	-157.9	-94.9	0	0	0	112.5	D513 A520 K521	D513-F517 WeakPolarHBondContact O-CB 3.43Å; D513-F517 PolarHBondContact O-N 3.04Å; F517-A520 PolarHBondContact O-N 2.87Å; F517-K521 HydrophobicContact CE1-CD 4.3Å; F517-K521 PolarHBondContact O-N 3.09Å; F517-K521 VanDerWaalsContact O-N 3.13Å
518	N	41.8	Very low	43	Very low	102 Å²	102	102.5 Å²	102.5	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-70.4	-36.1	174.8	-78.4	-16.4	0	0	0	112.7	V514 T515 K521 G522	V514-N518 WeakPolarHBondContact O-CB 3.1Å; V514-N518 PolarHBondContact O-N 2.92Å; T515-N518 PolarHBondContact O-N 3.5Å; N518-K521 PolarHBondContact O-N 3.15Å; N518-G522 PolarHBondContact O-N 3.49Å
519	S	45.3	Very low	42.9	Very low	75 Å²	75	104.1 Å²	104.1	52%	0.524	60%	0.602	S	S	.	*	H	α-helix	trans	-66.7	-36.6	174.8	-166.4	0	0	0	0	112.1	T515 S516 G522 K523	T515-S519 WeakPolarHBondContact O-CB 3.37Å; T515-S519 PolarHBondContact O-N 3.38Å; S516-S519 PolarHBondContact O-N 3.05Å; S519-G522 PolarHBondContact O-N 3.3Å; S519-K523 PolarHBondContact O-N 3.24Å
520	A	45.7	Very low	43.1	Very low	66 Å²	66	102.9 Å²	102.9	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-66.9	-40.2	174.8	0	0	0	0	0	112.6	S516 F517 K523	S516-A520 PolarHBondContact O-N 2.91Å; F517-A520 PolarHBondContact O-N 2.87Å; A520-K523 PolarHBondContact O-N 3.17Å
521	K	44.4	Very low	43.2	Very low	132 Å²	132	105.5 Å²	105.5	57%	0.574	62%	0.616	S	S	*	*	H	α-helix	trans	-69.4	-30.8	175.1	-94.6	-176.6	176.7	178.3	0	113.6	F517 N518 K523 S524	F517-K521 HydrophobicContact CE1-CD 4.3Å; F517-K521 PolarHBondContact O-N 3.09Å; F517-K521 VanDerWaalsContact O-N 3.13Å; N518-K521 PolarHBondContact O-N 3.15Å; K521-K523 VanDerWaalsContact C-N 3.31Å; K521-K523 PolarHBondContact O-N 3.45Å; K521-S524 PolarHBondContact O-N 2.77Å
522	G	43.9	Very low	43.3	Very low	47 Å²	47	106.8 Å²	106.8	49%	0.485	62%	0.622	S	S	.	*	H	α-helix	trans	-64.2	-34.5	175.7	0	0	0	0	0	113.1	N518 S519	N518-G522 PolarHBondContact O-N 3.49Å; S519-G522 PolarHBondContact O-N 3.3Å
523	K	43.4	Very low	43.1	Very low	173 Å²	173	110.3 Å²	110.3	75%	0.752	64%	0.638	S	S	*	*	H	α-helix	trans	-81.4	-17.5	-179.8	-72.8	-173.1	176.6	-177.6	0	114.6	S519 A520 K521	S519-K523 PolarHBondContact O-N 3.24Å; A520-K523 PolarHBondContact O-N 3.17Å; K521-K523 VanDerWaalsContact C-N 3.31Å; K521-K523 PolarHBondContact O-N 3.45Å
524	S	43.4	Very low	42.9	Very low	88 Å²	88	111.1 Å²	111.1	62%	0.615	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-1.4	179.5	107.1	0	0	0	0	114.5	K521	K521-S524 PolarHBondContact O-N 2.77Å
525	K	41.8	Very low	42.7	Very low	189 Å²	189	113.1 Å²	113.1	82%	0.822	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	5.2	177.2	-86.2	-168	174.2	-172.8	0	114.2
526	L	37.6	Very low	42.5	Very low	166 Å²	166	115.3 Å²	115.3	87%	0.869	67%	0.666	S	S	*	*			trans	-124.1	13.8	-179.6	-102.5	150.4	0	0	0	113.5
527	A	36.5	Very low	42.3	Very low	148 Å²	148	119.6 Å²	119.6	100%	1.223	68%	0.684	S	S	*	*			trans	-116	0	160.7	0	0	0	0	0	107.3

Retrieved 527 of 527 residues in 1018 ms (Link to these results)

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