A0A087X572_POEFO Loading...

N-alpha-acetyltransferase 80, NatH catalytic subunit

AlphaFold DB , UniProt , Accession A0A087X572, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 311 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	V	49.7	Very low	37.5	Very low	146 Å²	146	131.4 Å²	131.4	89%	0.885	63%	0.63	S	S	*	*				0	-48.7	0	-175.8	0	0	0	0	112.4	F3 L4 L5	V1-F3 PolarHBondContact O-N 2.96Å; V1-L4 PolarHBondContact O-N 3.44Å; V1-L5 HydrophobicContact CG1-CD1 4.02Å; V1-L5 PolarHBondContact O-N 3.01Å
2	L	40	Very low	37.7	Very low	156 Å²	156	131.4 Å²	131.4	82%	0.817	64%	0.635	S	S	*	*	H	α-helix	trans	-58.6	-39.5	176	-90.7	92.6	0	0	0	114.7	L4 L5 H6	L2-L4 VanDerWaalsContact C-N 3.33Å; L2-L4 PolarHBondContact O-N 3.22Å; L2-L5 PolarHBondContact O-N 2.78Å; L2-H6 PolarHBondContact O-N 2.68Å
3	F	33.3	Very low	37.6	Very low	186 Å²	186	130.8 Å²	130.8	82%	0.816	62%	0.623	S	S	*	*	H	α-helix	trans	-65.5	-33.3	178.1	-112.2	-93.2	0	0	0	113.5	V1 W7	V1-F3 PolarHBondContact O-N 2.96Å; F3-W7 WeakPolarHBondContact O-CB 3.46Å; F3-W7 PolarHBondContact O-N 3.06Å
4	L	37.2	Very low	37.8	Very low	121 Å²	121	128.5 Å²	128.5	63%	0.634	62%	0.615	S	S	*	*	H	α-helix	trans	-75.3	-29.2	176.2	-87.5	145	0	0	0	112.3	V1 L2 K8	V1-L4 PolarHBondContact O-N 3.44Å; L2-L4 VanDerWaalsContact C-N 3.33Å; L2-L4 PolarHBondContact O-N 3.22Å; L4-K8 WeakPolarHBondContact O-CB 3.44Å; L4-K8 WeakPolarHBondContact O-CG 3.21Å; L4-K8 PolarHBondContact O-N 2.88Å; L4-K8 VanDerWaalsContact O-N 3.1Å
5	L	36.8	Very low	37.5	Very low	99 Å²	99	127.3 Å²	127.3	52%	0.518	61%	0.609	S	S	.	*	H	α-helix	trans	-72.3	-43.1	170.3	-98.9	118.6	0	0	0	111.6	V1 L2 W7 K8 I9	V1-L5 HydrophobicContact CG1-CD1 4.02Å; V1-L5 PolarHBondContact O-N 3.01Å; L2-L5 PolarHBondContact O-N 2.78Å; L5-W7 VanDerWaalsContact C-N 3.34Å; L5-W7 PolarHBondContact O-N 2.83Å; L5-K8 PolarHBondContact O-N 3.34Å; L5-I9 WeakPolarHBondContact O-CB 3.46Å; L5-I9 WeakPolarHBondContact O-CD1 3.35Å; L5-I9 WeakPolarHBondContact O-CG1 3.36Å; L5-I9 PolarHBondContact O-N 3.48Å
6	H	36.2	Very low	37.6	Very low	112 Å²	112	122.3 Å²	122.3	52%	0.519	59%	0.594	S	S	.	*	H	α-helix	trans	-59.1	-45.8	174.6	-167.6	-88	0	0	0	111.3	L2 K8 I9 E10	L2-H6 PolarHBondContact O-N 2.68Å; H6-K8 PolarHBondContact O-N 3.44Å; H6-I9 PolarHBondContact O-N 3.4Å; H6-E10 IonicContact CE1-OE1 3.97Å; H6-E10 IonicContact CE1-OE2 3.14Å; H6-E10 PolarHBondContact CE1-OE2 3.5Å; H6-E10 IonicContact ND1-OE2 3.16Å; H6-E10 PolarHBondContact ND1-OE2 3.29Å; H6-E10 VanDerWaalsContact ND1-OE2 3.16Å; H6-E10 PolarHBondContact O-N 3.16Å
7	W	31.1	Very low	37.7	Very low	156 Å²	156	118.8 Å²	118.8	59%	0.591	58%	0.579	S	S	*	*	H	α-helix	trans	-65.4	-36.3	177.6	-169.9	-98.5	0	0	0	113.5	F3 L5 K11	F3-W7 WeakPolarHBondContact O-CB 3.46Å; F3-W7 PolarHBondContact O-N 3.06Å; L5-W7 VanDerWaalsContact C-N 3.34Å; L5-W7 PolarHBondContact O-N 2.83Å; W7-K11 WeakPolarHBondContact O-CB 3.17Å; W7-K11 WeakPolarHBondContact O-CG 3.31Å; W7-K11 PolarHBondContact O-N 2.96Å; W7-K11 VanDerWaalsContact O-N 3.1Å
8	K	32.9	Very low	37.5	Very low	145 Å²	145	115.5 Å²	115.5	63%	0.63	57%	0.569	S	S	*	*	H	α-helix	trans	-70	-38.1	173.6	-85.6	179.9	174	-179.9	0	111.9	L4 L5 H6 K11 L12	L4-K8 WeakPolarHBondContact O-CB 3.44Å; L4-K8 WeakPolarHBondContact O-CG 3.21Å; L4-K8 PolarHBondContact O-N 2.88Å; L4-K8 VanDerWaalsContact O-N 3.1Å; L5-K8 PolarHBondContact O-N 3.34Å; H6-K8 PolarHBondContact O-N 3.44Å; K8-K11 PolarHBondContact O-N 3.2Å; K8-L12 WeakPolarHBondContact O-CD1 3.3Å; K8-L12 PolarHBondContact O-N 3.33Å
9	I	42.3	Very low	37.4	Very low	108 Å²	108	113.4 Å²	113.4	55%	0.554	56%	0.561	S	S	*	*	H	α-helix	trans	-70.4	-41.8	178.4	-68.1	165.8	0	0	0	110.9	L5 H6 K11 L12 Y13	L5-I9 WeakPolarHBondContact O-CB 3.46Å; L5-I9 WeakPolarHBondContact O-CD1 3.35Å; L5-I9 WeakPolarHBondContact O-CG1 3.36Å; L5-I9 PolarHBondContact O-N 3.48Å; H6-I9 PolarHBondContact O-N 3.4Å; I9-K11 VanDerWaalsContact C-N 3.34Å; I9-K11 PolarHBondContact O-N 3.44Å; I9-L12 PolarHBondContact O-N 3.42Å; I9-Y13 VanDerWaalsContact O-CB 3.31Å; I9-Y13 WeakPolarHBondContact O-CB 3.46Å; I9-Y13 PolarHBondContact O-N 3.49Å
10	E	38.3	Very low	37.6	Very low	85 Å²	85	112.6 Å²	112.6	40%	0.397	56%	0.557	S	S	.	*	H	α-helix	trans	-61.3	-40.4	172	-89.2	-176.6	127.5	0	0	112	H6 Y13 I14	H6-E10 IonicContact CE1-OE1 3.97Å; H6-E10 IonicContact CE1-OE2 3.14Å; H6-E10 PolarHBondContact CE1-OE2 3.5Å; H6-E10 IonicContact ND1-OE2 3.16Å; H6-E10 PolarHBondContact ND1-OE2 3.29Å; H6-E10 VanDerWaalsContact ND1-OE2 3.16Å; H6-E10 PolarHBondContact O-N 3.16Å; E10-Y13 PolarHBondContact O-N 3.42Å; E10-I14 WeakPolarHBondContact O-CB 3.24Å; E10-I14 VanDerWaalsContact O-CG1 3.28Å; E10-I14 WeakPolarHBondContact O-CG1 3.35Å; E10-I14 PolarHBondContact O-N 3.38Å
11	K	34.4	Very low	37.5	Very low	131 Å²	131	113 Å²	113	57%	0.57	56%	0.561	S	S	*	*	H	α-helix	trans	-65.5	-37.8	174.5	-79.9	-169.2	174.4	-171	0	112.9	W7 K8 I9 Q15	W7-K11 WeakPolarHBondContact O-CB 3.17Å; W7-K11 WeakPolarHBondContact O-CG 3.31Å; W7-K11 PolarHBondContact O-N 2.96Å; W7-K11 VanDerWaalsContact O-N 3.1Å; K8-K11 PolarHBondContact O-N 3.2Å; I9-K11 VanDerWaalsContact C-N 3.34Å; I9-K11 PolarHBondContact O-N 3.44Å; K11-Q15 WeakPolarHBondContact O-CB 3.46Å; K11-Q15 PolarHBondContact O-N 3.11Å
12	L	40.7	Very low	36.7	Very low	132 Å²	132	109 Å²	109	69%	0.691	54%	0.537	S	S	*	.	H	α-helix	trans	-68.6	-34.5	173.3	-95.3	123.2	0	0	0	112.4	K8 I9 A16	K8-L12 WeakPolarHBondContact O-CD1 3.3Å; K8-L12 PolarHBondContact O-N 3.33Å; I9-L12 PolarHBondContact O-N 3.42Å; L12-A16 VanDerWaalsContact O-CB 3.27Å; L12-A16 WeakPolarHBondContact O-CB 2.92Å; L12-A16 PolarHBondContact O-N 3.01Å
13	Y	35.7	Very low	36.6	Very low	123 Å²	123	103.8 Å²	103.8	48%	0.482	51%	0.51	S	S	.	.	H	α-helix	trans	-72.8	-43.5	178.2	-169.1	-105.9	0	0	0	112.2	I9 E10 A16 L17	I9-Y13 VanDerWaalsContact O-CB 3.31Å; I9-Y13 WeakPolarHBondContact O-CB 3.46Å; I9-Y13 PolarHBondContact O-N 3.49Å; E10-Y13 PolarHBondContact O-N 3.42Å; Y13-A16 PolarHBondContact O-N 3.24Å; Y13-L17 HydrophobicContact CD1-CD1 3.68Å; Y13-L17 HydrophobicContact CE1-CD1 3.4Å; Y13-L17 VanDerWaalsContact CE1-CD1 3.4Å; Y13-L17 HydrophobicContact CE1-CG 4.37Å; Y13-L17 HydrophobicContact CG-CD1 4.47Å; Y13-L17 WeakPolarHBondContact O-CB 3.36Å; Y13-L17 WeakPolarHBondContact O-CG 3.37Å; Y13-L17 PolarHBondContact O-N 3.05Å
14	I	41	Very low	36.5	Very low	99 Å²	99	98.7 Å²	98.7	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-67.8	-36.9	173	-66	170.9	0	0	0	110.3	E10 L17 C18	E10-I14 WeakPolarHBondContact O-CB 3.24Å; E10-I14 VanDerWaalsContact O-CG1 3.28Å; E10-I14 WeakPolarHBondContact O-CG1 3.35Å; E10-I14 PolarHBondContact O-N 3.38Å; I14-L17 PolarHBondContact O-N 3.06Å; I14-C18 WeakPolarHBondContact O-CB 3.36Å; I14-C18 PolarHBondContact O-N 3.29Å; I14-C18 PolarHBondContact O-SG 3.17Å; I14-C18 VanDerWaalsContact O-SG 3.41Å
15	Q	33.1	Very low	36.2	Very low	111 Å²	111	101.1 Å²	101.1	52%	0.519	50%	0.503	S	S	.	.	H	α-helix	trans	-67.8	-34.6	173.8	-168.7	66.3	52.3	0	0	112.2	K11 N19	K11-Q15 WeakPolarHBondContact O-CB 3.46Å; K11-Q15 PolarHBondContact O-N 3.11Å; Q15-N19 PolarHBondContact NE2-OD1 3.2Å; Q15-N19 WeakPolarHBondContact O-CB 3.38Å; Q15-N19 PolarHBondContact O-N 3.09Å; Q15-N19 PolarHBondContact O-ND2 2.65Å
16	A	38.4	Very low	35.9	Very low	46 Å²	46	106.2 Å²	106.2	38%	0.38	52%	0.515	S	S	.	.	H	α-helix	trans	-72.5	-40.2	175.1	0	0	0	0	0	112.4	L12 Y13 N19 I20	L12-A16 VanDerWaalsContact O-CB 3.27Å; L12-A16 WeakPolarHBondContact O-CB 2.92Å; L12-A16 PolarHBondContact O-N 3.01Å; Y13-A16 PolarHBondContact O-N 3.24Å; A16-N19 PolarHBondContact O-N 3.04Å; A16-I20 WeakPolarHBondContact O-CB 3.24Å; A16-I20 VanDerWaalsContact O-CG1 3.3Å; A16-I20 WeakPolarHBondContact O-CG1 3.33Å; A16-I20 PolarHBondContact O-N 3.02Å
17	L	40.5	Very low	35.7	Very low	64 Å²	64	102.7 Å²	102.7	34%	0.335	51%	0.506	S	S	.	.	H	α-helix	trans	-68.7	-41.6	173.5	-72.8	172.9	0	0	0	111.7	Y13 I14 N19 I20 L21	Y13-L17 HydrophobicContact CD1-CD1 3.68Å; Y13-L17 HydrophobicContact CE1-CD1 3.4Å; Y13-L17 VanDerWaalsContact CE1-CD1 3.4Å; Y13-L17 HydrophobicContact CE1-CG 4.37Å; Y13-L17 HydrophobicContact CG-CD1 4.47Å; Y13-L17 WeakPolarHBondContact O-CB 3.36Å; Y13-L17 WeakPolarHBondContact O-CG 3.37Å; Y13-L17 PolarHBondContact O-N 3.05Å; I14-L17 PolarHBondContact O-N 3.06Å; L17-N19 VanDerWaalsContact C-N 3.32Å; L17-N19 PolarHBondContact O-N 3Å; L17-I20 PolarHBondContact O-N 3.31Å; L17-L21 WeakPolarHBondContact O-CB 3.48Å; L17-L21 PolarHBondContact O-N 3.13Å
18	C	33.7	Very low	36	Very low	59 Å²	59	102.9 Å²	102.9	40%	0.399	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-38.3	169.5	-81.6	0	0	0	0	111.1	I14 T22	I14-C18 WeakPolarHBondContact O-CB 3.36Å; I14-C18 PolarHBondContact O-N 3.29Å; I14-C18 PolarHBondContact O-SG 3.17Å; I14-C18 VanDerWaalsContact O-SG 3.41Å; C18-T22 WeakPolarHBondContact O-CA 3.48Å; C18-T22 WeakPolarHBondContact O-CB 3.43Å; C18-T22 PolarHBondContact O-N 2.82Å; C18-T22 PolarHBondContact O-OG1 3.46Å
19	N	35.9	Very low	36	Very low	76 Å²	76	101.2 Å²	101.2	41%	0.406	52%	0.515	S	S	.	.	H	α-helix	trans	-74.6	-27.3	176.4	-73.9	-14.2	0	0	0	112.5	Q15 A16 L17 I23 R112	Q15-N19 PolarHBondContact NE2-OD1 3.2Å; Q15-N19 WeakPolarHBondContact O-CB 3.38Å; Q15-N19 PolarHBondContact O-N 3.09Å; Q15-N19 PolarHBondContact O-ND2 2.65Å; A16-N19 PolarHBondContact O-N 3.04Å; L17-N19 VanDerWaalsContact C-N 3.32Å; L17-N19 PolarHBondContact O-N 3Å; N19-I23 WeakPolarHBondContact O-CD1 3.33Å; N19-I23 WeakPolarHBondContact O-CG1 3.44Å; N19-R112 PolarHBondContact O-NH2 3.27Å
20	I	41.7	Very low	35.5	Very low	96 Å²	96	102.5 Å²	102.5	49%	0.492	52%	0.523	S	S	.	.	H	α-helix	trans	-79.7	-37.7	175.8	-67.9	169.4	0	0	0	111.2	A16 L17 R112	A16-I20 WeakPolarHBondContact O-CB 3.24Å; A16-I20 VanDerWaalsContact O-CG1 3.3Å; A16-I20 WeakPolarHBondContact O-CG1 3.33Å; A16-I20 PolarHBondContact O-N 3.02Å; L17-I20 PolarHBondContact O-N 3.31Å; I20-R112 PolarHBondContact O-NH1 3.14Å
21	L	35.1	Very low	35.2	Very low	121 Å²	121	105.8 Å²	105.8	63%	0.634	54%	0.543	S	S	*	.	H	α-helix	trans	-82.1	-38.9	177.8	-70	160.8	0	0	0	113	L17 I23 S24 F25	L17-L21 WeakPolarHBondContact O-CB 3.48Å; L17-L21 PolarHBondContact O-N 3.13Å; L21-I23 VanDerWaalsContact C-N 3.35Å; L21-I23 PolarHBondContact O-N 3.18Å; L21-S24 PolarHBondContact O-N 2.94Å; L21-S24 VanDerWaalsContact O-N 3.16Å; L21-F25 PolarHBondContact O-N 3.21Å; L21-F25 VanDerWaalsContact O-N 3.17Å
22	T	32.9	Very low	34.9	Very low	64 Å²	64	106.9 Å²	106.9	39%	0.393	56%	0.555	S	S	.	*	H	α-helix	trans	-65.4	-32.1	-179.9	-59.1	0	0	0	0	113.1	C18 S24 F25 R26	C18-T22 WeakPolarHBondContact O-CA 3.48Å; C18-T22 WeakPolarHBondContact O-CB 3.43Å; C18-T22 PolarHBondContact O-N 2.82Å; C18-T22 PolarHBondContact O-OG1 3.46Å; T22-S24 VanDerWaalsContact C-N 3.31Å; T22-F25 WeakPolarHBondContact O-CB 3.48Å; T22-F25 PolarHBondContact O-N 3Å; T22-R26 PolarHBondContact O-N 2.94Å
23	I	36.6	Very low	34.6	Very low	46 Å²	46	105.6 Å²	105.6	24%	0.236	55%	0.554	C	S	.	*	H	α-helix	trans	-83	-10.4	179.3	-38.3	166.4	0	0	0	112	N19 L21 R112	N19-I23 WeakPolarHBondContact O-CD1 3.33Å; N19-I23 WeakPolarHBondContact O-CG1 3.44Å; L21-I23 VanDerWaalsContact C-N 3.35Å; L21-I23 PolarHBondContact O-N 3.18Å; I23-R112 VanDerWaalsContact CB-NH1 3.32Å; I23-R112 HydrophobicContact CG2-CB 4.1Å; I23-R112 VanDerWaalsContact CG2-CD 3.44Å; I23-R112 HydrophobicContact CG2-CG 4.23Å
24	S	32.3	Very low	34.3	Very low	79 Å²	79	107.3 Å²	107.3	55%	0.552	57%	0.572	S	S	*	*	H	α-helix	trans	-81.2	-23	158.9	-81.2	0	0	0	0	112.3	L21 T22	L21-S24 PolarHBondContact O-N 2.94Å; L21-S24 VanDerWaalsContact O-N 3.16Å; T22-S24 VanDerWaalsContact C-N 3.31Å
25	F	31.7	Very low	33.8	Very low	171 Å²	171	113.9 Å²	113.9	75%	0.75	59%	0.59	S	S	*	*	H	α-helix	trans	-87.4	-33.7	-174.2	-156.2	-101	0	0	0	114.1	L21 T22	L21-F25 PolarHBondContact O-N 3.21Å; L21-F25 VanDerWaalsContact O-N 3.17Å; T22-F25 WeakPolarHBondContact O-CB 3.48Å; T22-F25 PolarHBondContact O-N 3Å
26	R	28.8	Very low	33.7	Very low	206 Å²	206	117.9 Å²	117.9	78%	0.777	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-7.4	-174.2	-136	179.1	-169	166.2	3	115.6	T22	T22-R26 PolarHBondContact O-N 2.94Å
27	A	32.4	Very low	33.2	Very low	39 Å²	39	125.5 Å²	125.5	32%	0.322	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87	-8.1	-176.1	0	0	0	0	0	114.3	R111	A27-R111 HydrophobicContact CB-CB 4.23Å
28	Q	37	Very low	32.7	Very low	160 Å²	160	128.4 Å²	128.4	75%	0.748	65%	0.653	S	S	*	*	S	Bend	trans	-108.5	-6.6	-171.2	-137.2	77.3	26.5	0	0	114.6
29	T	32.6	Very low	32.5	Very low	109 Å²	109	133.8 Å²	133.8	67%	0.669	67%	0.67	S	S	*	*	S	Bend	trans	-90.5	-9.2	-175.9	53.4	0	0	0	0	115
30	D	33.8	Very low	32.1	Very low	135 Å²	135	134.7 Å²	134.7	72%	0.722	69%	0.688	S	S	*	*	S	Bend	trans	-117.4	120.1	174.7	-80	-39.4	0	0	0	110.8
31	L	30.2	Very low	31.6	Very low	155 Å²	155	137.6 Å²	137.6	81%	0.812	70%	0.703	S	S	*	*			trans	105.1	87.4	164.8	-53	172.1	0	0	0	116.9
32	N	29.8	Very low	31.3	Very low	154 Å²	154	137.9 Å²	137.9	82%	0.824	71%	0.71	S	S	*	*				-176	157.1	104	-129.9	7.5	0	0	0	108.9
33	P	34.1	Very low	31	Very low	105 Å²	105	141 Å²	141	68%	0.682	74%	0.735	S	S	*	*			cis	-140	144.8	17.6	37.2	-16.4	0	0	0	116.7
34	D	29.3	Very low	30.7	Very low	159 Å²	159	144.7 Å²	144.7	85%	0.85	76%	0.764	S	S	*	*			trans	-157.5	106.1	149.7	-113.4	-22.7	0	0	0	112.1
35	R	29.1	Very low	30.4	Very low	237 Å²	237	144.4 Å²	144.4	89%	0.894	77%	0.774	S	S	*	*			trans	162.2	97.6	130.1	-94.9	-176.4	166.2	-167.4	-0.8	111.6
36	H	32.5	Very low	30.3	Very low	194 Å²	194	148.4 Å²	148.4	90%	0.898	78%	0.784	S	S	*	*			trans	-71.7	118.8	139.4	-94.2	-79.3	0	0	0	108.6
37	R	28.2	Very low	30.2	Very low	206 Å²	206	141.5 Å²	141.5	78%	0.777	78%	0.777	S	S	*	*			trans	-166.7	93.2	144.8	-151.6	170.9	-168.4	177.4	5.3	111.5
38	S	29.3	Very low	30.1	Very low	126 Å²	126	147.3 Å²	147.3	88%	0.881	80%	0.803	S	S	*	*			trans	-78.9	127.7	162.2	-55.6	0	0	0	0	108.8
39	K	29.8	Very low	29.5	Very low	172 Å²	172	146.2 Å²	146.2	75%	0.748	80%	0.797	S	S	*	*			trans	-112.4	123.8	160.1	-80.8	-173.1	176.1	-177	0	107.8
40	A	27.2	Very low	29.4	Very low	94 Å²	94	152.7 Å²	152.7	78%	0.777	81%	0.81	S	S	*	*			trans	-73.7	149	164	0	0	0	0	0	110
41	L	30.9	Very low	29.1	Very low	157 Å²	157	151.9 Å²	151.9	82%	0.822	81%	0.805	S	S	*	*			trans	-161.8	107.1	152.6	-100	153.3	0	0	0	109.8
42	T	28.5	Very low	29.3	Very low	128 Å²	128	151.2 Å²	151.2	79%	0.785	81%	0.807	S	S	*	*			trans	15.7	132.3	141.4	61.7	0	0	0	0	121
43	S	27.2	Very low	29.3	Very low	129 Å²	129	150.6 Å²	150.6	90%	0.902	80%	0.8	S	S	*	*			trans	-154.5	127.5	139.7	170.6	0	0	0	0	110
44	S	29.3	Very low	29.6	Very low	123 Å²	123	151.5 Å²	151.5	86%	0.86	81%	0.805	S	S	*	*			trans	-109.3	142.2	-178.9	165.8	0	0	0	0	108.2
45	G	27.1	Very low	29.7	Very low	73 Å²	73	151 Å²	151	75%	0.753	80%	0.798	S	S	*	*			trans	174.8	90.9	169.9	0	0	0	0	0	114.5
46	R	29.3	Very low	29.6	Very low	256 Å²	256	147.7 Å²	147.7	97%	0.966	80%	0.798	S	S	*	*			trans	-52.1	155.5	152.3	-65.9	172	178.2	-131.6	-0.8	109.1
47	G	25.9	Very low	29.5	Very low	61 Å²	61	145.8 Å²	145.8	63%	0.629	79%	0.794	S	S	*	*			cis	158	167.5	11.4	0	0	0	0	0	107.4
48	N	30	Very low	30.1	Very low	160 Å²	160	141 Å²	141	86%	0.856	79%	0.79	S	S	*	*			trans	117	106.7	151.9	-53.9	-8.4	0	0	0	118
49	Q	26.1	Very low	30	Very low	137 Å²	137	142.5 Å²	142.5	64%	0.64	79%	0.787	S	S	*	*			trans	-40.4	144.9	148.4	-172.7	95.2	31.7	0	0	114.5	D51	Q49-D51 PolarHBondContact NE2-OD2 2.77Å
50	W	30.2	Very low	29.9	Very low	246 Å²	246	138.7 Å²	138.7	93%	0.932	78%	0.782	S	S	*	*			trans	-156.8	124.4	134.2	-76.2	106	0	0	0	110.5
51	D	28.1	Very low	30	Very low	117 Å²	117	141.3 Å²	141.3	63%	0.626	78%	0.779	S	S	*	*			trans	-71.7	161.5	165.2	-64.1	-74.6	0	0	0	111.4	Q49	Q49-D51 PolarHBondContact NE2-OD2 2.77Å
52	V	32.6	Very low	29.8	Very low	141 Å²	141	144 Å²	144	86%	0.855	78%	0.779	S	S	*	*			trans	168.1	123.4	132.7	159.2	0	0	0	0	110.2
53	E	30.3	Very low	29.8	Very low	141 Å²	141	141.5 Å²	141.5	66%	0.659	78%	0.779	S	S	*	*			trans	-85.2	160.3	165.8	-172.5	164.4	156.2	0	0	110.4	Q55	E53-Q55 WeakPolarHBondContact OE1-CG 3.47Å
54	P	41.3	Very low	30.1	Very low	124 Å²	124	144.4 Å²	144.4	81%	0.805	78%	0.778	S	S	*	*				-145.6	150.5	113.8	30.2	-11.5	0	0	0	115.3
55	Q	30.6	Very low	30.3	Very low	150 Å²	150	147.8 Å²	147.8	70%	0.701	78%	0.777	S	S	*	*			trans	-70.7	151.4	170.1	-57.6	176.4	-8.6	0	0	112.2	E53	E53-Q55 WeakPolarHBondContact OE1-CG 3.47Å
56	N	28.1	Very low	30.7	Very low	167 Å²	167	150.1 Å²	150.1	89%	0.893	78%	0.777	S	S	*	*			trans	-174.6	124.8	133.8	-94.3	-49.7	0	0	0	111.9
57	L	29.8	Very low	30.9	Very low	154 Å²	154	143.3 Å²	143.3	81%	0.806	77%	0.768	S	S	*	*			trans	-82.3	165.8	159.7	-99.1	156.9	0	0	0	108.5
58	P	40.7	Very low	31.4	Very low	106 Å²	106	147.5 Å²	147.5	69%	0.688	78%	0.775	S	S	*	*				-156.4	167.7	58	39.6	-17	0	0	0	119.6
59	N	27.5	Very low	31.9	Very low	156 Å²	156	147.6 Å²	147.6	83%	0.834	78%	0.775	S	S	*	*			trans	57.5	148.2	147.1	-74	-2.3	0	0	0	118.7
60	S	27.1	Very low	32.3	Very low	92 Å²	92	148.6 Å²	148.6	64%	0.643	79%	0.785	S	S	*	*			cis	-175.7	159.2	25.4	106.6	0	0	0	0	110.3
61	H	29.5	Very low	32.8	Very low	150 Å²	150	140.3 Å²	140.3	69%	0.694	78%	0.776	S	S	*	*			trans	74.6	120.5	145.3	-83.2	-117.1	0	0	0	124.1
62	Y	26.9	Very low	33.3	Very low	214 Å²	214	141.5 Å²	141.5	84%	0.839	78%	0.782	S	S	*	*			trans	72.2	125.8	131.2	-81.5	-119.3	0	0	0	121
63	G	28.8	Very low	34.2	Very low	75 Å²	75	141.2 Å²	141.2	77%	0.773	78%	0.78	S	S	*	*			trans	164.9	67.8	162.9	0	0	0	0	0	114.2	K65	G63-K65 PolarHBondContact O-N 2.63Å
64	E	33.7	Very low	34.9	Very low	190 Å²	190	142.8 Å²	142.8	89%	0.888	79%	0.788	S	S	*	*			trans	-63.8	122.6	160	-177.5	176.3	-178	0	0	109
65	K	32.1	Very low	35.2	Very low	194 Å²	194	144 Å²	144	84%	0.843	78%	0.781	S	S	*	*			trans	-150.5	109.9	160.9	-152	173.9	-174.2	179.4	0	110.9	G63	G63-K65 PolarHBondContact O-N 2.63Å
66	V	37.1	Very low	35.9	Very low	122 Å²	122	138.9 Å²	138.9	74%	0.739	76%	0.761	S	S	*	*			trans	-70.1	130	165.1	177.7	0	0	0	0	108.6
67	S	32.8	Very low	36.8	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	76%	0.76	S	S	*	*			trans	-149.5	127.5	155.3	53.9	0	0	0	0	110.6
68	L	37.2	Very low	37.5	Very low	149 Å²	149	139.9 Å²	139.9	78%	0.78	75%	0.753	S	S	*	*			trans	-69.8	159.7	177	-70.5	148.9	0	0	0	112.2
69	L	40.2	Very low	38	Very low	163 Å²	163	138.9 Å²	138.9	85%	0.853	74%	0.742	S	S	*	*			trans	76.3	102	159.4	-34.9	176.9	0	0	0	116.6
70	D	32.9	Very low	39.2	Very low	157 Å²	157	136.1 Å²	136.1	84%	0.84	73%	0.727	S	S	*	*				-167.3	140.8	99.1	-136.2	-17.6	0	0	0	110.3	D72	D70-D72 VanDerWaalsContact C-N 3.33Å; D70-D72 PolarHBondContact O-N 2.91Å
71	G	42	Very low	40.4	Very low	73 Å²	73	135 Å²	135	75%	0.753	72%	0.724	S	S	*	*			trans	-81.5	72.2	-173.5	0	0	0	0	0	112.4	V73	G71-V73 PolarHBondContact O-N 3Å
72	D	38	Very low	41.6	Very low	141 Å²	141	134.8 Å²	134.8	75%	0.754	72%	0.723	S	S	*	*			trans	-76.6	102.1	165	-82	-34	0	0	0	109.1	D70 Q74	D70-D72 VanDerWaalsContact C-N 3.33Å; D70-D72 PolarHBondContact O-N 2.91Å; D72-Q74 PolarHBondContact O-N 3.09Å
73	V	52.3	Low	43.2	Very low	135 Å²	135	127.6 Å²	127.6	82%	0.818	70%	0.697	S	S	*	*			trans	-64.9	85.6	161.9	177.9	0	0	0	0	106.9	G71 K75	G71-V73 PolarHBondContact O-N 3Å; V73-K75 PolarHBondContact O-N 3.41Å
74	Q	44.4	Very low	44.7	Very low	175 Å²	175	126.4 Å²	126.4	82%	0.818	68%	0.68	S	S	*	*			trans	-63.3	86.2	157.5	-68.3	-173.9	1.2	0	0	106.5	D72 S76	D72-Q74 PolarHBondContact O-N 3.09Å; Q74-S76 PolarHBondContact O-N 3.46Å
75	K	46.6	Very low	46.6	Very low	150 Å²	150	119.3 Å²	119.3	65%	0.652	66%	0.658	S	S	*	*			trans	-59.3	108.7	162.7	-171.1	159.6	-178	175.3	0	105.6	V73 K77	V73-K75 PolarHBondContact O-N 3.41Å; K75-K77 PolarHBondContact O-N 2.89Å
76	S	45.5	Very low	49.2	Very low	42 Å²	42	114.8 Å²	114.8	29%	0.294	64%	0.636	S	S	.	*			trans	-64.4	131.7	-167	84.2	0	0	0	0	108.1	Q74 H78 D79	Q74-S76 PolarHBondContact O-N 3.46Å; S76-H78 PolarHBondContact O-N 2.85Å; S76-H78 WeakPolarHBondContact OG-CB 3.37Å; S76-H78 PolarHBondContact OG-N 3.08Å; S76-D79 PolarHBondContact O-N 3.48Å; S76-D79 PolarHBondContact OG-N 3.36Å; S76-D79 PolarHBondContact OG-OD2 3.43Å
77	K	47.4	Very low	51.9	Low	197 Å²	197	111.8 Å²	111.8	86%	0.857	62%	0.615	S	S	*	*	H	α-helix	trans	-54.4	-10.5	168.8	-91.4	-179.7	172.8	177	0	113	K75	K75-K77 PolarHBondContact O-N 2.89Å
78	H	44.4	Very low	54.8	Low	144 Å²	144	107.5 Å²	107.5	67%	0.667	58%	0.582	S	S	*	*	H	α-helix	trans	-79	-35.7	179.1	-152.1	-83	0	0	0	112	S76 E82	S76-H78 PolarHBondContact O-N 2.85Å; S76-H78 WeakPolarHBondContact OG-CB 3.37Å; S76-H78 PolarHBondContact OG-N 3.08Å; H78-E82 PolarHBondContact O-N 3.47Å
79	D	52.2	Low	57.6	Low	86 Å²	86	101.4 Å²	101.4	46%	0.46	55%	0.551	S	S	.	*	H	α-helix	trans	-73.2	-34.7	-178.3	-59.6	-44.4	0	0	0	112.2	S76 A81 E82 E83	S76-D79 PolarHBondContact O-N 3.48Å; S76-D79 PolarHBondContact OG-N 3.36Å; S76-D79 PolarHBondContact OG-OD2 3.43Å; D79-A81 VanDerWaalsContact C-N 3.33Å; D79-A81 PolarHBondContact O-N 3.37Å; D79-E82 PolarHBondContact O-N 2.92Å; D79-E83 PolarHBondContact O-N 3.44Å
80	D	51.3	Low	60.3	Low	97 Å²	97	95.1 Å²	95.1	52%	0.519	52%	0.52	S	S	.	.	H	α-helix	trans	-72.3	-27.2	179.9	-65.6	-36.2	0	0	0	112.4
81	A	52.5	Low	63.4	Low	70 Å²	70	89.2 Å²	89.2	58%	0.579	49%	0.49	S	S	*	.	H	α-helix	trans	-77	-31	176.4	0	0	0	0	0	112.6	D79	D79-A81 VanDerWaalsContact C-N 3.33Å; D79-A81 PolarHBondContact O-N 3.37Å
82	E	56.2	Low	66.1	Low	144 Å²	144	85.8 Å²	85.8	67%	0.673	45%	0.454	S	S	*	.	H	α-helix	trans	-74.7	-37.8	-178.9	-155.5	176.9	-175.2	0	0	111.9	H78 D79 A84 G85	H78-E82 PolarHBondContact O-N 3.47Å; D79-E82 PolarHBondContact O-N 2.92Å; E82-A84 PolarHBondContact O-N 3.18Å; E82-G85 PolarHBondContact O-N 3.13Å
83	E	58.8	Low	68.9	Low	64 Å²	64	82.9 Å²	82.9	30%	0.299	44%	0.436	S	S	.	.	H	α-helix	trans	-73.3	-26.6	177.5	-164	69.1	-166.1	0	0	112.4	D79 G85 R86 G137 P138 R139	D79-E83 PolarHBondContact O-N 3.44Å; E83-G85 PolarHBondContact O-N 3.38Å; E83-R86 VanDerWaalsContact O-CB 3.31Å; E83-R86 WeakPolarHBondContact O-CB 3.03Å; E83-R86 PolarHBondContact O-N 3.03Å; E83-R86 WeakPolarHBondContact OE1-CD 3.36Å; E83-R86 IonicContact OE1-CZ 3.84Å; E83-R86 IonicContact OE1-NE 3.92Å; E83-R86 IonicContact OE1-NH1 2.96Å; E83-R86 PolarHBondContact OE1-NH1 3.45Å; E83-R86 IonicContact OE2-NH1 3.16Å; E83-R86 PolarHBondContact OE2-NH1 2.88Å; E83-R86 VanDerWaalsContact OE2-NH1 3.16Å; E83-G137 CarbonylContact O-C 3.59Å; E83-P138 HydrophobicContact CG-CB 4.04Å; E83-R139 IonicContact OE1-NH2 2.81Å
84	A	60	Low	70.9	Confident	49 Å²	49	79.1 Å²	79.1	41%	0.405	42%	0.424	S	S	.	.	H	α-helix	trans	-65.5	-26.5	176.2	0	0	0	0	0	113.4	E82	E82-A84 PolarHBondContact O-N 3.18Å
85	G	73.6	Confident	73.3	Confident	42 Å²	42	73.1 Å²	73.1	43%	0.433	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-7.5	176.9	0	0	0	0	0	114.4	E82 E83 I87	E82-G85 PolarHBondContact O-N 3.13Å; E83-G85 PolarHBondContact O-N 3.38Å; G85-I87 PolarHBondContact O-N 3.47Å
86	R	88.2	Confident	75.6	Confident	99 Å²	99	70.2 Å²	70.2	37%	0.374	39%	0.39	S	S	.	.			trans	-66.2	120	-169	-171.2	176.8	-169.7	154.3	10.7	112	E83 Q136 G137	E83-R86 VanDerWaalsContact O-CB 3.31Å; E83-R86 WeakPolarHBondContact O-CB 3.03Å; E83-R86 PolarHBondContact O-N 3.03Å; E83-R86 WeakPolarHBondContact OE1-CD 3.36Å; E83-R86 IonicContact OE1-CZ 3.84Å; E83-R86 IonicContact OE1-NE 3.92Å; E83-R86 IonicContact OE1-NH1 2.96Å; E83-R86 PolarHBondContact OE1-NH1 3.45Å; E83-R86 IonicContact OE2-NH1 3.16Å; E83-R86 PolarHBondContact OE2-NH1 2.88Å; E83-R86 VanDerWaalsContact OE2-NH1 3.16Å; R86-Q136 WeakPolarHBondContact O-CA 3.07Å; R86-G137 PolarHBondContact O-N 2.84Å
87	I	93.7	Very high	78	Confident	59 Å²	59	72.6 Å²	72.6	30%	0.303	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.4	174.1	-57.3	165.9	0	0	0	109	G85 L134 L135 Y177 V180	G85-I87 PolarHBondContact O-N 3.47Å; I87-L134 HydrophobicContact CG2-CD1 3.37Å; I87-L134 HydrophobicContact CG2-CD2 4.35Å; I87-L134 HydrophobicContact CG2-CG 3.92Å; I87-L135 WeakPolarHBondContact CA-O 3.38Å; I87-Y177 HydrophobicContact CD1-CD1 4.03Å; I87-Y177 HydrophobicContact CD1-CE1 3.58Å; I87-Y177 HydrophobicContact CG1-CE1 4.3Å; I87-V180 HydrophobicContact CG2-CG1 3.82Å
88	H	94.1	Very high	80.4	Confident	22 Å²	22	63.8 Å²	63.8	10%	0.102	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	162.1	173.5	64.2	-72.7	0	0	0	111.4	L135 E143	H88-L135 PolarHBondContact N-O 2.83Å; H88-L135 PolarHBondContact O-N 2.98Å; H88-E143 IonicContact CE1-OE1 3.06Å; H88-E143 PolarHBondContact CE1-OE1 2.9Å; H88-E143 IonicContact NE2-OE1 3.96Å; H88-E143 PolarHBondContact NE2-OE1 3Å
89	V	96.1	Very high	82.9	Confident	21 Å²	21	58 Å²	58	13%	0.127	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	135.3	177	170.7	0	0	0	0	110.7	L132 V133 L134 E184	V89-L132 HydrophobicContact CG1-CB 3.67Å; V89-L132 HydrophobicContact CG1-CD1 4.01Å; V89-L132 HydrophobicContact CG1-CD2 4.01Å; V89-L132 HydrophobicContact CG1-CG 4.1Å; V89-V133 WeakPolarHBondContact CA-O 3.13Å; V89-L134 HydrophobicContact CG2-CB 4.34Å; V89-L134 HydrophobicContact CG2-CD1 3.42Å; V89-L134 VanDerWaalsContact CG2-CD1 3.42Å; V89-E184 HydrophobicContact CB-CB 3.99Å; V89-E184 HydrophobicContact CG2-CB 3.38Å; V89-E184 HydrophobicContact CG2-CG 3.88Å
90	V	96.2	Very high	85.1	Confident	31 Å²	31	57.3 Å²	57.3	19%	0.188	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	149.2	175.4	-60.5	0	0	0	0	111.8	R95 L132 V133 L135	V90-R95 HydrophobicContact CG2-CG 4.02Å; V90-L132 WeakPolarHBondContact O-CA 3.5Å; V90-V133 HydrophobicContact CG2-CG2 3.55Å; V90-V133 PolarHBondContact N-O 3.38Å; V90-V133 VanDerWaalsContact N-O 3.09Å; V90-V133 WeakPolarHBondContact O-CG2 3.42Å; V90-V133 PolarHBondContact O-N 2.81Å; V90-L135 HydrophobicContact CG2-CD1 3.66Å; V90-L135 HydrophobicContact CG2-CG 4.36Å
91	P	98	Very high	87.3	Confident	33 Å²	33	55.5 Å²	55.5	21%	0.214	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	129.8	167.5	-17.8	31.6	0	0	0	111.2	H93 G94 V130 L132 Y188	P91-H93 WeakPolarHBondContact CB-CE1 3.34Å; P91-H93 PolarHBondContact O-N 2.64Å; P91-H93 VanDerWaalsContact O-N 3.13Å; P91-G94 PolarHBondContact O-N 2.9Å; P91-V130 HydrophobicContact CB-CG2 3.93Å; P91-L132 HydrophobicContact CB-CD2 4.47Å; P91-L132 HydrophobicContact CG-CD2 4.28Å; P91-Y188 HydrophobicContact CG-CE2 3.98Å
92	I	97.5	Very high	89.4	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-63.6	-22.6	-176.7	-156.1	171.4	0	0	0	113.3	G94 R95 L98 L99 C102 L121 C131 V133	I92-G94 PolarHBondContact O-N 2.96Å; I92-R95 CarbonylContact O-C 3.57Å; I92-R95 WeakPolarHBondContact O-CA 3.46Å; I92-R95 PolarHBondContact O-N 3.01Å; I92-L98 HydrophobicContact CG1-CB 4.45Å; I92-L99 HydrophobicContact CD1-CD2 4.03Å; I92-L99 HydrophobicContact CG1-CD2 4.21Å; I92-C102 HydrophobicContact CD1-CB 3.58Å; I92-L121 HydrophobicContact CD1-CB 4.34Å; I92-L121 HydrophobicContact CD1-CD1 4.05Å; I92-L121 HydrophobicContact CD1-CD2 4.01Å; I92-L121 HydrophobicContact CD1-CG 4.36Å; I92-C131 HydrophobicContact CB-CB 4.32Å; I92-C131 HydrophobicContact CG2-CB 3.48Å; I92-C131 VanDerWaalsContact CG2-CB 3.48Å; I92-C131 PolarHBondContact N-O 2.76Å; I92-V133 HydrophobicContact CB-CG1 4.31Å; I92-V133 HydrophobicContact CD1-CG1 3.95Å; I92-V133 HydrophobicContact CG1-CG1 4.17Å
93	H	97.1	Very high	91.4	Very high	80 Å²	80	45.3 Å²	45.3	37%	0.37	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-71.1	-14.9	177	56.9	-104.5	0	0	0	112.9	P91 S124 C125	P91-H93 WeakPolarHBondContact CB-CE1 3.34Å; P91-H93 PolarHBondContact O-N 2.64Å; P91-H93 VanDerWaalsContact O-N 3.13Å; H93-S124 WeakPolarHBondContact CB-O 3.1Å; H93-S124 PolarHBondContact ND1-OG 3.47Å; H93-C125 PolarHBondContact CE1-O 2.77Å; H93-C125 PolarHBondContact ND1-N 2.83Å
94	G	95.7	Very high	93.2	Very high	55 Å²	55	45.9 Å²	45.9	57%	0.567	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-88.2	-2.9	166.7	0	0	0	0	0	113.6	P91 I92	P91-G94 PolarHBondContact O-N 2.9Å; I92-G94 PolarHBondContact O-N 2.96Å
95	R	94.7	Very high	95	Very high	50 Å²	50	44.3 Å²	44.3	19%	0.189	26%	0.258	C	S	.	.			trans	-138.5	66.7	-175	-69.8	-61.8	-61.3	-85.7	2.7	111.6	V90 I92 D97 L98 E143	V90-R95 HydrophobicContact CG2-CG 4.02Å; I92-R95 CarbonylContact O-C 3.57Å; I92-R95 WeakPolarHBondContact O-CA 3.46Å; I92-R95 PolarHBondContact O-N 3.01Å; R95-D97 VanDerWaalsContact CA-OD1 3.24Å; R95-D97 WeakPolarHBondContact CA-OD1 3.34Å; R95-D97 IonicContact CZ-OD1 2.67Å; R95-D97 IonicContact CZ-OD2 2.68Å; R95-D97 IonicContact NE-OD1 3.33Å; R95-D97 PolarHBondContact NE-OD1 3.5Å; R95-D97 IonicContact NE-OD2 3.67Å; R95-D97 PolarHBondContact NE-OD2 3.36Å; R95-D97 IonicContact NH2-OD2 3.33Å; R95-D97 PolarHBondContact NH2-OD2 2.92Å; R95-D97 PolarHBondContact O-N 3.43Å; R95-L98 HydrophobicContact CB-CB 4.35Å; R95-L98 HydrophobicContact CB-CD1 3.81Å; R95-L98 HydrophobicContact CB-CG 4.09Å; R95-L98 HydrophobicContact CG-CD1 4.24Å; R95-L98 PolarHBondContact O-N 3.11Å; R95-E143 IonicContact CZ-OE2 2.88Å; R95-E143 IonicContact NH1-OE1 2.65Å; R95-E143 IonicContact NH1-OE2 3Å; R95-E143 PolarHBondContact NH1-OE2 3.21Å; R95-E143 IonicContact NH2-OE2 3.21Å; R95-E143 PolarHBondContact NH2-OE2 3.45Å
96	P	95.4	Very high	96	Very high	89 Å²	89	42.5 Å²	42.5	58%	0.578	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-61.9	-25.4	-178	26.4	-34.6	0	0	0	112.9	L98 L99	P96-L98 PolarHBondContact O-N 2.93Å; P96-L99 HydrophobicContact CB-CD1 4.29Å; P96-L99 WeakPolarHBondContact O-CB 3.26Å; P96-L99 WeakPolarHBondContact O-CG 3.26Å; P96-L99 PolarHBondContact O-N 2.9Å; P96-L99 VanDerWaalsContact O-N 3.16Å
97	D	95.4	Very high	96.3	Very high	91 Å²	91	38.8 Å²	38.8	49%	0.487	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-56.1	-29.9	171.9	58.4	-56.3	0	0	0	112.8	R95	R95-D97 VanDerWaalsContact CA-OD1 3.24Å; R95-D97 WeakPolarHBondContact CA-OD1 3.34Å; R95-D97 IonicContact CZ-OD1 2.67Å; R95-D97 IonicContact CZ-OD2 2.68Å; R95-D97 IonicContact NE-OD1 3.33Å; R95-D97 PolarHBondContact NE-OD1 3.5Å; R95-D97 IonicContact NE-OD2 3.67Å; R95-D97 PolarHBondContact NE-OD2 3.36Å; R95-D97 IonicContact NH2-OD2 3.33Å; R95-D97 PolarHBondContact NH2-OD2 2.92Å; R95-D97 PolarHBondContact O-N 3.43Å
98	L	96.4	Very high	96.3	Very high	13 Å²	13	38.2 Å²	38.2	7%	0.068	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-89.7	-1.6	-178.4	-61.4	179.6	0	0	0	114.1	I92 R95 P96 V100 C102 V133 L135	I92-L98 HydrophobicContact CG1-CB 4.45Å; R95-L98 HydrophobicContact CB-CB 4.35Å; R95-L98 HydrophobicContact CB-CD1 3.81Å; R95-L98 HydrophobicContact CB-CG 4.09Å; R95-L98 HydrophobicContact CG-CD1 4.24Å; R95-L98 PolarHBondContact O-N 3.11Å; P96-L98 PolarHBondContact O-N 2.93Å; L98-V100 PolarHBondContact O-N 3.45Å; L98-C102 WeakPolarHBondContact O-CB 3.36Å; L98-C102 PolarHBondContact O-N 2.81Å; L98-V133 HydrophobicContact CD1-CG2 4.01Å; L98-L135 HydrophobicContact CD1-CD1 3.84Å; L98-L135 HydrophobicContact CD1-CD2 3.77Å; L98-L135 HydrophobicContact CD1-CG 4.39Å
99	L	97.4	Very high	96.2	Very high	23 Å²	23	40.7 Å²	40.7	12%	0.12	24%	0.24	C	C	.	.	H	α-helix	trans	-59.3	-45.7	-177.8	-76	171.6	0	0	0	112.5	I92 P96 A103 L121 Q122	I92-L99 HydrophobicContact CD1-CD2 4.03Å; I92-L99 HydrophobicContact CG1-CD2 4.21Å; P96-L99 HydrophobicContact CB-CD1 4.29Å; P96-L99 WeakPolarHBondContact O-CB 3.26Å; P96-L99 WeakPolarHBondContact O-CG 3.26Å; P96-L99 PolarHBondContact O-N 2.9Å; P96-L99 VanDerWaalsContact O-N 3.16Å; L99-A103 VanDerWaalsContact O-CB 3.24Å; L99-A103 WeakPolarHBondContact O-CB 3.42Å; L99-A103 PolarHBondContact O-N 2.74Å; L99-L121 HydrophobicContact CD2-CB 3.62Å; L99-L121 WeakPolarHBondContact O-CD1 3.32Å; L99-Q122 HydrophobicContact CD1-CG 3.89Å; L99-Q122 HydrophobicContact CD2-CG 4.23Å
100	V	98.1	Very high	96	Very high	70 Å²	70	45 Å²	45	42%	0.424	25%	0.254	S	S	.	.	H	α-helix	trans	-72.2	-52	-178.7	175.6	0	0	0	0	111.1	L98 C102 A103 D104 V118	L98-V100 PolarHBondContact O-N 3.45Å; V100-C102 VanDerWaalsContact C-N 3.27Å; V100-C102 PolarHBondContact O-N 3.43Å; V100-A103 WeakPolarHBondContact O-CB 3.35Å; V100-A103 PolarHBondContact O-N 2.94Å; V100-D104 PolarHBondContact O-N 3.06Å; V100-V118 HydrophobicContact CG2-CG2 4.28Å
101	P	97.6	Very high	95.6	Very high	60 Å²	60	51.9 Å²	51.9	39%	0.39	28%	0.276	S	S	.	.	H	α-helix	trans	-54.5	-41	174.1	-27.4	34.1	0	0	0	113.7	D104 L105 L145	P101-D104 PolarHBondContact O-N 3.4Å; P101-L105 PolarHBondContact O-N 3.24Å; P101-L145 HydrophobicContact CB-CD2 4.05Å
102	C	98.1	Very high	95.1	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-70.9	-35	177.6	-171.6	0	0	0	0	112.6	I92 L98 V100 D104 L105 V106 L121 V133 L145	I92-C102 HydrophobicContact CD1-CB 3.58Å; L98-C102 WeakPolarHBondContact O-CB 3.36Å; L98-C102 PolarHBondContact O-N 2.81Å; V100-C102 VanDerWaalsContact C-N 3.27Å; V100-C102 PolarHBondContact O-N 3.43Å; C102-D104 VanDerWaalsContact C-N 3.3Å; C102-D104 PolarHBondContact O-N 3.29Å; C102-L105 PolarHBondContact O-N 3.16Å; C102-V106 WeakPolarHBondContact O-CG2 3.23Å; C102-V106 PolarHBondContact O-N 2.96Å; C102-L121 HydrophobicContact CB-CD1 3.93Å; C102-V133 HydrophobicContact CB-CG1 4.3Å; C102-L145 HydrophobicContact CB-CD2 3.88Å
103	A	97.4	Very high	94.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.5	-42.5	172.9	0	0	0	0	0	111.4	L99 V100 V106 N107 Q114 R117 V118 L121	L99-A103 VanDerWaalsContact O-CB 3.24Å; L99-A103 WeakPolarHBondContact O-CB 3.42Å; L99-A103 PolarHBondContact O-N 2.74Å; V100-A103 WeakPolarHBondContact O-CB 3.35Å; V100-A103 PolarHBondContact O-N 2.94Å; A103-V106 PolarHBondContact O-N 3.36Å; A103-N107 VanDerWaalsContact O-CB 3.3Å; A103-N107 WeakPolarHBondContact O-CB 3.4Å; A103-N107 PolarHBondContact O-N 2.97Å; A103-Q114 HydrophobicContact CB-CG 4.21Å; A103-R117 HydrophobicContact CB-CB 3.51Å; A103-V118 HydrophobicContact CB-CG2 3.67Å; A103-L121 HydrophobicContact CB-CD1 4.08Å
104	D	97.7	Very high	94.9	Very high	76 Å²	76	56.2 Å²	56.2	41%	0.406	30%	0.298	S	S	.	.	H	α-helix	trans	-67.3	-42.8	177.9	-65.5	-22.6	0	0	0	111.7	V100 P101 C102 V106 N107 S108 Q114	V100-D104 PolarHBondContact O-N 3.06Å; P101-D104 PolarHBondContact O-N 3.4Å; C102-D104 VanDerWaalsContact C-N 3.3Å; C102-D104 PolarHBondContact O-N 3.29Å; D104-V106 PolarHBondContact O-N 2.82Å; D104-N107 PolarHBondContact O-N 3.39Å; D104-S108 PolarHBondContact O-N 3.25Å; D104-Q114 PolarHBondContact OD1-NE2 2.82Å; D104-Q114 PolarHBondContact OD2-NE2 2.8Å
105	L	97.1	Very high	94.8	Very high	15 Å²	15	57.1 Å²	57.1	8%	0.079	30%	0.3	C	S	.	.	H	α-helix	trans	-54.3	-51.7	173.3	171.8	62	0	0	0	111.6	P101 C102 N107 S108 L145 H148 V167	P101-L105 PolarHBondContact O-N 3.24Å; C102-L105 PolarHBondContact O-N 3.16Å; L105-N107 PolarHBondContact O-N 3.42Å; L105-S108 WeakPolarHBondContact O-CB 3.5Å; L105-S108 PolarHBondContact O-N 2.89Å; L105-S108 PolarHBondContact O-OG 3.07Å; L105-L145 HydrophobicContact CB-CD2 4.37Å; L105-L145 HydrophobicContact CD2-CD1 4.47Å; L105-L145 HydrophobicContact CD2-CD2 4.05Å; L105-L145 HydrophobicContact CD2-CG 4.05Å; L105-H148 HydrophobicContact CD2-CB 4.17Å; L105-V167 HydrophobicContact CD1-CG2 4.34Å; L105-V167 HydrophobicContact CD2-CG1 4.32Å; L105-V167 HydrophobicContact CG-CG1 4.04Å
106	V	95.2	Very high	94.6	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.024	30%	0.304	C	S	.	.	H	α-helix	trans	-67.2	-37.7	-179.3	-180	0	0	0	0	111.4	C102 A103 D104 S108 E109 W110 R117 H148 V167	C102-V106 WeakPolarHBondContact O-CG2 3.23Å; C102-V106 PolarHBondContact O-N 2.96Å; A103-V106 PolarHBondContact O-N 3.36Å; D104-V106 PolarHBondContact O-N 2.82Å; V106-S108 VanDerWaalsContact C-N 3.25Å; V106-S108 PolarHBondContact O-N 3.14Å; V106-E109 PolarHBondContact O-N 3.22Å; V106-W110 HydrophobicContact CG1-CE3 4.05Å; V106-W110 HydrophobicContact CG1-CZ3 4.48Å; V106-W110 PolarHBondContact O-N 3.36Å; V106-R117 VanDerWaalsContact CG1-CZ 3.49Å; V106-R117 VanDerWaalsContact CG1-NH1 3.32Å; V106-H148 HydrophobicContact CG2-CB 4.26Å; V106-H148 WeakPolarHBondContact CG2-CD2 3.5Å; V106-V167 HydrophobicContact CG2-CG1 4.05Å
107	N	94.3	Very high	94.5	Very high	21 Å²	21	53.9 Å²	53.9	11%	0.112	28%	0.284	C	S	.	.	H	α-helix	trans	-65.9	-26.4	175.7	-89.1	-20.1	0	0	0	113.8	A103 D104 L105 E109 W110 R112 Q114 R117	A103-N107 VanDerWaalsContact O-CB 3.3Å; A103-N107 WeakPolarHBondContact O-CB 3.4Å; A103-N107 PolarHBondContact O-N 2.97Å; D104-N107 PolarHBondContact O-N 3.39Å; L105-N107 PolarHBondContact O-N 3.42Å; N107-E109 PolarHBondContact O-N 2.67Å; N107-W110 WeakPolarHBondContact CA-O 3.35Å; N107-W110 CarbonylContact O-C 3.56Å; N107-W110 PolarHBondContact OD1-O 2.87Å; N107-R112 PolarHBondContact ND2-O 2.89Å; N107-R112 WeakPolarHBondContact OD1-CB 3.1Å; N107-R112 PolarHBondContact OD1-N 2.73Å; N107-R112 PolarHBondContact OD1-O 3.18Å; N107-Q114 WeakPolarHBondContact ND2-CA 3.44Å; N107-R117 WeakPolarHBondContact ND2-CG 3.38Å; N107-R117 WeakPolarHBondContact OD1-CG 3.25Å; N107-R117 PolarHBondContact OD1-NE 3.04Å
108	S	93.5	Very high	94.5	Very high	48 Å²	48	50.8 Å²	50.8	34%	0.336	27%	0.268	S	S	.	.	H	α-helix	trans	-64.3	-26	176.8	82.8	0	0	0	0	112.9	D104 L105 V106 K170	D104-S108 PolarHBondContact O-N 3.25Å; L105-S108 WeakPolarHBondContact O-CB 3.5Å; L105-S108 PolarHBondContact O-N 2.89Å; L105-S108 PolarHBondContact O-OG 3.07Å; V106-S108 VanDerWaalsContact C-N 3.25Å; V106-S108 PolarHBondContact O-N 3.14Å; S108-K170 VanDerWaalsContact O-CE 3.25Å; S108-K170 WeakPolarHBondContact O-CE 3.35Å; S108-K170 PolarHBondContact O-NZ 3.39Å
109	E	91.6	Very high	94.4	Very high	74 Å²	74	55.4 Å²	55.4	35%	0.346	29%	0.289	S	S	.	.	H	α-helix	trans	-97.5	-45.3	177.1	-163.2	67	-171.4	0	0	111.6	V106 N107 V167 R173	V106-E109 PolarHBondContact O-N 3.22Å; N107-E109 PolarHBondContact O-N 2.67Å; E109-V167 HydrophobicContact CB-CG2 3.91Å; E109-V167 HydrophobicContact CG-CG2 4.34Å; E109-R173 IonicContact OE1-NH1 2.73Å; E109-R173 IonicContact OE2-CZ 3.9Å; E109-R173 IonicContact OE2-NH1 2.74Å; E109-R173 PolarHBondContact OE2-NH1 3.02Å; E109-R173 VanDerWaalsContact OE2-NH1 3.1Å; E109-R173 IonicContact OE2-NH2 3.01Å; E109-R173 PolarHBondContact OE2-NH2 3.09Å
110	W	90.9	Very high	94.1	Very high	112 Å²	112	56 Å²	56	42%	0.424	30%	0.295	S	S	.	.	S	Bend	trans	-126.1	102.6	-179.4	-57.9	-69	0	0	0	109.7	V106 N107 R112 R117 V166 V167	V106-W110 HydrophobicContact CG1-CE3 4.05Å; V106-W110 HydrophobicContact CG1-CZ3 4.48Å; V106-W110 PolarHBondContact O-N 3.36Å; N107-W110 WeakPolarHBondContact CA-O 3.35Å; N107-W110 CarbonylContact O-C 3.56Å; N107-W110 PolarHBondContact OD1-O 2.87Å; W110-R112 PolarHBondContact O-N 3.49Å; W110-R117 PolarHBondContact O-NH2 3.42Å; W110-V166 WeakPolarHBondContact CH2-O 3.37Å; W110-V167 HydrophobicContact CH2-CB 4.42Å; W110-V167 HydrophobicContact CZ3-CB 4.07Å; W110-V167 HydrophobicContact CZ3-CG1 4.5Å
111	R	88.3	Confident	94	Very high	174 Å²	174	52.9 Å²	52.9	66%	0.657	28%	0.276	S	S	*	.			trans	-63.8	124.1	-174.3	-68.3	-176.2	177	-174.7	-0.5	112.2	A27	A27-R111 HydrophobicContact CB-CB 4.23Å
112	R	87.2	Confident	93.9	Very high	57 Å²	57	55.6 Å²	55.6	22%	0.215	28%	0.283	C	S	.	.			trans	-143	177.9	166	-57.8	-78.9	-62.3	-167.8	5.7	109.1	N19 I20 I23 N107 W110 R117	N19-R112 PolarHBondContact O-NH2 3.27Å; I20-R112 PolarHBondContact O-NH1 3.14Å; I23-R112 VanDerWaalsContact CB-NH1 3.32Å; I23-R112 HydrophobicContact CG2-CB 4.1Å; I23-R112 VanDerWaalsContact CG2-CD 3.44Å; I23-R112 HydrophobicContact CG2-CG 4.23Å; N107-R112 PolarHBondContact ND2-O 2.89Å; N107-R112 WeakPolarHBondContact OD1-CB 3.1Å; N107-R112 PolarHBondContact OD1-N 2.73Å; N107-R112 PolarHBondContact OD1-O 3.18Å; W110-R112 PolarHBondContact O-N 3.49Å; R112-R117 HydrophobicContact CB-CG 4.45Å; R112-R117 VanDerWaalsContact CG-NH2 3.28Å
113	S	94	Very high	93.7	Very high	61 Å²	61	61.1 Å²	61.1	43%	0.427	31%	0.307	S	S	.	.			trans	-65.8	143.1	166.3	66.6	0	0	0	0	110.5	A115 A116 R117	S113-A115 VanDerWaalsContact C-N 3.29Å; S113-A115 PolarHBondContact O-N 2.91Å; S113-A116 PolarHBondContact O-N 3.3Å; S113-A116 WeakPolarHBondContact OG-CB 3.4Å; S113-A116 PolarHBondContact OG-N 2.87Å; S113-R117 PolarHBondContact O-N 3.09Å
114	Q	96	Very high	93.7	Very high	87 Å²	87	61.5 Å²	61.5	41%	0.407	31%	0.31	S	S	.	.	H	α-helix	trans	-57.3	-43.9	175.9	-170.3	-173.4	49.3	0	0	111.1	A103 D104 N107 A116 R117 V118	A103-Q114 HydrophobicContact CB-CG 4.21Å; D104-Q114 PolarHBondContact OD1-NE2 2.82Å; D104-Q114 PolarHBondContact OD2-NE2 2.8Å; N107-Q114 WeakPolarHBondContact ND2-CA 3.44Å; Q114-A116 VanDerWaalsContact C-N 3.31Å; Q114-A116 PolarHBondContact O-N 2.78Å; Q114-R117 WeakPolarHBondContact O-CB 3.49Å; Q114-R117 PolarHBondContact O-N 2.9Å; Q114-V118 HydrophobicContact CG-CG2 4.5Å; Q114-V118 WeakPolarHBondContact O-CG2 3.41Å; Q114-V118 PolarHBondContact O-N 3.48Å
115	A	94	Very high	93.5	Very high	74 Å²	74	60.1 Å²	60.1	61%	0.612	31%	0.306	S	S	*	.	H	α-helix	trans	-56.7	-40.7	176.3	0	0	0	0	0	113	S113 R117 V118 H119	S113-A115 VanDerWaalsContact C-N 3.29Å; S113-A115 PolarHBondContact O-N 2.91Å; A115-R117 VanDerWaalsContact C-N 3.34Å; A115-R117 PolarHBondContact O-N 2.9Å; A115-V118 PolarHBondContact O-N 3.05Å; A115-H119 VanDerWaalsContact O-CB 3.32Å; A115-H119 WeakPolarHBondContact O-CB 3.32Å; A115-H119 PolarHBondContact O-N 3.25Å
116	A	90.1	Very high	93.4	Very high	34 Å²	34	63 Å²	63	28%	0.281	33%	0.327	S	S	.	.	H	α-helix	trans	-67.2	-35.1	176.9	0	0	0	0	0	112.3	S113 Q114 S120	S113-A116 PolarHBondContact O-N 3.3Å; S113-A116 WeakPolarHBondContact OG-CB 3.4Å; S113-A116 PolarHBondContact OG-N 2.87Å; Q114-A116 VanDerWaalsContact C-N 3.31Å; Q114-A116 PolarHBondContact O-N 2.78Å; A116-S120 WeakPolarHBondContact O-CB 3.45Å; A116-S120 PolarHBondContact O-N 2.98Å
117	R	93.6	Very high	93.2	Very high	38 Å²	38	68.2 Å²	68.2	14%	0.143	35%	0.351	C	S	.	.	H	α-helix	trans	-67.9	-48.6	174.2	-69.4	-60.9	-179.3	-174.1	-4.5	111.7	A103 V106 N107 W110 R112 S113 Q114 A115 H119 S120 L121	A103-R117 HydrophobicContact CB-CB 3.51Å; V106-R117 VanDerWaalsContact CG1-CZ 3.49Å; V106-R117 VanDerWaalsContact CG1-NH1 3.32Å; N107-R117 WeakPolarHBondContact ND2-CG 3.38Å; N107-R117 WeakPolarHBondContact OD1-CG 3.25Å; N107-R117 PolarHBondContact OD1-NE 3.04Å; W110-R117 PolarHBondContact O-NH2 3.42Å; R112-R117 HydrophobicContact CB-CG 4.45Å; R112-R117 VanDerWaalsContact CG-NH2 3.28Å; S113-R117 PolarHBondContact O-N 3.09Å; Q114-R117 WeakPolarHBondContact O-CB 3.49Å; Q114-R117 PolarHBondContact O-N 2.9Å; A115-R117 VanDerWaalsContact C-N 3.34Å; A115-R117 PolarHBondContact O-N 2.9Å; R117-H119 VanDerWaalsContact C-N 3.32Å; R117-H119 PolarHBondContact O-N 2.86Å; R117-S120 WeakPolarHBondContact O-CB 3.35Å; R117-S120 PolarHBondContact O-N 3.38Å; R117-S120 VanDerWaalsContact O-N 3.09Å; R117-L121 WeakPolarHBondContact O-CG 3.48Å; R117-L121 PolarHBondContact O-N 3.2Å
118	V	96.4	Very high	93.1	Very high	25 Å²	25	68.3 Å²	68.3	15%	0.152	35%	0.35	C	S	.	.	H	α-helix	trans	-55.9	-49.1	176	171.7	0	0	0	0	110.1	V100 A103 Q114 A115 S120 L121 Q122	V100-V118 HydrophobicContact CG2-CG2 4.28Å; A103-V118 HydrophobicContact CB-CG2 3.67Å; Q114-V118 HydrophobicContact CG-CG2 4.5Å; Q114-V118 WeakPolarHBondContact O-CG2 3.41Å; Q114-V118 PolarHBondContact O-N 3.48Å; A115-V118 PolarHBondContact O-N 3.05Å; V118-S120 VanDerWaalsContact C-N 3.29Å; V118-S120 PolarHBondContact O-N 2.94Å; V118-L121 PolarHBondContact O-N 3.47Å; V118-L121 VanDerWaalsContact O-N 3.08Å; V118-Q122 HydrophobicContact CG1-CG 4.24Å; V118-Q122 WeakPolarHBondContact O-CG 3.25Å; V118-Q122 PolarHBondContact O-N 2.85Å
119	H	93.4	Very high	93.2	Very high	111 Å²	111	67.4 Å²	67.4	51%	0.514	34%	0.344	S	S	.	.	H	α-helix	trans	-59.7	-38.4	177.3	-179.7	-102.7	0	0	0	112.8	A115 R117	A115-H119 VanDerWaalsContact O-CB 3.32Å; A115-H119 WeakPolarHBondContact O-CB 3.32Å; A115-H119 PolarHBondContact O-N 3.25Å; R117-H119 VanDerWaalsContact C-N 3.32Å; R117-H119 PolarHBondContact O-N 2.86Å
120	S	91.8	Very high	93.5	Very high	34 Å²	34	63.9 Å²	63.9	24%	0.238	33%	0.327	C	S	.	.	H	α-helix	trans	-66.1	-39.7	174.8	176.8	0	0	0	0	112.7	A116 R117 V118 K123 R150	A116-S120 WeakPolarHBondContact O-CB 3.45Å; A116-S120 PolarHBondContact O-N 2.98Å; R117-S120 WeakPolarHBondContact O-CB 3.35Å; R117-S120 PolarHBondContact O-N 3.38Å; R117-S120 VanDerWaalsContact O-N 3.09Å; V118-S120 VanDerWaalsContact C-N 3.29Å; V118-S120 PolarHBondContact O-N 2.94Å; S120-K123 PolarHBondContact O-N 3.08Å; S120-R150 PolarHBondContact O-NH2 2.93Å; S120-R150 PolarHBondContact OG-NH1 3.19Å
121	L	95.1	Very high	93.8	Very high	6 Å²	6	58.6 Å²	58.6	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-69.9	-36.8	178	-69.2	168.8	0	0	0	111.8	I92 L99 C102 A103 R117 V118 K123 S124 C131	I92-L121 HydrophobicContact CD1-CB 4.34Å; I92-L121 HydrophobicContact CD1-CD1 4.05Å; I92-L121 HydrophobicContact CD1-CD2 4.01Å; I92-L121 HydrophobicContact CD1-CG 4.36Å; L99-L121 HydrophobicContact CD2-CB 3.62Å; L99-L121 WeakPolarHBondContact O-CD1 3.32Å; C102-L121 HydrophobicContact CB-CD1 3.93Å; A103-L121 HydrophobicContact CB-CD1 4.08Å; R117-L121 WeakPolarHBondContact O-CG 3.48Å; R117-L121 PolarHBondContact O-N 3.2Å; V118-L121 PolarHBondContact O-N 3.47Å; V118-L121 VanDerWaalsContact O-N 3.08Å; L121-K123 PolarHBondContact O-N 3.31Å; L121-S124 WeakPolarHBondContact O-CB 3.24Å; L121-S124 PolarHBondContact O-N 3.3Å; L121-C131 HydrophobicContact CD2-CB 4.01Å
122	Q	96.3	Very high	94.3	Very high	117 Å²	117	50.3 Å²	50.3	55%	0.547	28%	0.276	S	S	.	.	H	α-helix	trans	-62.7	-20.8	176.2	-76.6	173.6	-31.6	0	0	113.6	L99 V118 S124	L99-Q122 HydrophobicContact CD1-CG 3.89Å; L99-Q122 HydrophobicContact CD2-CG 4.23Å; V118-Q122 HydrophobicContact CG1-CG 4.24Å; V118-Q122 WeakPolarHBondContact O-CG 3.25Å; V118-Q122 PolarHBondContact O-N 2.85Å; Q122-S124 PolarHBondContact O-N 2.9Å
123	K	93.9	Very high	94.9	Very high	116 Å²	116	47.6 Å²	47.6	50%	0.504	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-10	171.4	-64.7	-177.8	179.6	-171.8	0	113.2	S120 L121 C125 P129	S120-K123 PolarHBondContact O-N 3.08Å; L121-K123 PolarHBondContact O-N 3.31Å; K123-C125 PolarHBondContact O-N 3.22Å; K123-P129 HydrophobicContact CB-CG 4.22Å; K123-P129 WeakPolarHBondContact O-CG 3.43Å
124	S	96.6	Very high	95	Very high	8 Å²	8	44.7 Å²	44.7	6%	0.056	25%	0.245	C	C	.	.			trans	-58.6	130.3	175.6	-173.9	0	0	0	0	110.2	H93 L121 Q122 P129 C131	H93-S124 WeakPolarHBondContact CB-O 3.1Å; H93-S124 PolarHBondContact ND1-OG 3.47Å; L121-S124 WeakPolarHBondContact O-CB 3.24Å; L121-S124 PolarHBondContact O-N 3.3Å; Q122-S124 PolarHBondContact O-N 2.9Å; S124-P129 CarbonylContact C-O 3.53Å; S124-P129 VanDerWaalsContact CA-O 3.25Å; S124-P129 WeakPolarHBondContact CA-O 3.32Å; S124-C131 PolarHBondContact OG-N 2.89Å
125	C	94.4	Very high	95.1	Very high	47 Å²	47	40.5 Å²	40.5	32%	0.318	23%	0.226	S	C	.	.			trans	-148	177.1	176.8	70.5	0	0	0	0	111.3	H93 K123 E127 P129	H93-C125 PolarHBondContact CE1-O 2.77Å; H93-C125 PolarHBondContact ND1-N 2.83Å; K123-C125 PolarHBondContact O-N 3.22Å; C125-E127 VanDerWaalsContact C-N 3.25Å; C125-E127 PolarHBondContact O-N 2.92Å; C125-E127 PolarHBondContact SG-N 2.88Å; C125-P129 PolarHBondContact N-O 3.16Å
126	S	94.4	Very high	95.1	Very high	74 Å²	74	38.2 Å²	38.2	52%	0.517	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.9	178.6	55.8	0	0	0	0	113.4	R192	S126-R192 PolarHBondContact O-NH1 3.24Å; S126-R192 PolarHBondContact O-NH2 2.77Å
127	E	91.6	Very high	95.1	Very high	114 Å²	114	36.8 Å²	36.8	53%	0.533	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	0.1	-172	-81.6	-53.1	127.7	0	0	116.5	C125 R153	C125-E127 VanDerWaalsContact C-N 3.25Å; C125-E127 PolarHBondContact O-N 2.92Å; C125-E127 PolarHBondContact SG-N 2.88Å; E127-R153 PolarHBondContact O-NE 3.2Å; E127-R153 VanDerWaalsContact O-NE 3.11Å; E127-R153 PolarHBondContact O-NH2 3.31Å; E127-R153 IonicContact OE2-NH2 3.2Å; E127-R153 PolarHBondContact OE2-NH2 3.11Å
128	F	92.6	Very high	94.6	Very high	23 Å²	23	37.3 Å²	37.3	10%	0.101	20%	0.199	C	C	.	.	S	Bend	trans	87.8	136.3	-169.7	-54.4	-80.4	0	0	0	114.9	V130 L151 R153 L161 F194	F128-V130 HydrophobicContact CD1-CB 4.41Å; F128-V130 HydrophobicContact CD1-CG1 3.63Å; F128-V130 HydrophobicContact CE1-CG1 3.49Å; F128-V130 VanDerWaalsContact CE1-CG1 3.49Å; F128-L151 HydrophobicContact CD1-CB 4.05Å; F128-L151 HydrophobicContact CE1-CB 3.83Å; F128-L151 HydrophobicContact CE1-CD1 4.4Å; F128-R153 HydrophobicContact CB-CG 3.88Å; F128-R153 HydrophobicContact CD2-CG 3.79Å; F128-R153 HydrophobicContact CG-CG 3.94Å; F128-L161 HydrophobicContact CD1-CD2 3.87Å; F128-L161 HydrophobicContact CD2-CD2 4.18Å; F128-L161 HydrophobicContact CE1-CD1 3.59Å; F128-L161 HydrophobicContact CE1-CD2 3.53Å; F128-L161 HydrophobicContact CE1-CG 4.21Å; F128-L161 HydrophobicContact CE2-CD2 3.9Å; F128-L161 HydrophobicContact CG-CD2 4.21Å; F128-L161 HydrophobicContact CZ-CD1 3.58Å; F128-L161 HydrophobicContact CZ-CD2 3.56Å; F128-L161 HydrophobicContact CZ-CG 4.22Å; F128-F194 HydrophobicContact CD2-CZ 4.14Å; F128-F194 HydrophobicContact CE2-CD2 4.41Å; F128-F194 HydrophobicContact CE2-CE1 4.38Å; F128-F194 AromaticContact CE2-CE2 3.33Å; F128-F194 HydrophobicContact CE2-CE2 3.33Å; F128-F194 AromaticContact CE2-CZ 3.31Å; F128-F194 HydrophobicContact CE2-CZ 3.31Å; F128-F194 HydrophobicContact CZ-CD2 4.18Å; F128-F194 AromaticContact CZ-CE2 3.5Å; F128-F194 HydrophobicContact CZ-CE2 3.5Å; F128-F194 VanDerWaalsContact CZ-CE2 3.5Å; F128-F194 AromaticContact CZ-CZ 3.82Å; F128-F194 HydrophobicContact CZ-CZ 3.82Å
129	P	95.3	Very high	93.7	Very high	30 Å²	30	42.4 Å²	42.4	20%	0.195	22%	0.216	C	C	.	.			cis	-68.3	147.9	2.8	28.3	-33.4	0	0	0	112.5	K123 S124 C125 L151 T152	K123-P129 HydrophobicContact CB-CG 4.22Å; K123-P129 WeakPolarHBondContact O-CG 3.43Å; S124-P129 CarbonylContact C-O 3.53Å; S124-P129 VanDerWaalsContact CA-O 3.25Å; S124-P129 WeakPolarHBondContact CA-O 3.32Å; C125-P129 PolarHBondContact N-O 3.16Å; P129-L151 CarbonylContact C-O 3.16Å; P129-L151 VanDerWaalsContact CA-O 3.25Å; P129-L151 WeakPolarHBondContact CA-O 3.37Å; P129-T152 HydrophobicContact CB-CG2 3.84Å
130	V	97.4	Very high	92.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.9	171.4	61.9	0	0	0	0	109.5	P91 F128 L132 R150 L151 Y188	P91-V130 HydrophobicContact CB-CG2 3.93Å; F128-V130 HydrophobicContact CD1-CB 4.41Å; F128-V130 HydrophobicContact CD1-CG1 3.63Å; F128-V130 HydrophobicContact CE1-CG1 3.49Å; F128-V130 VanDerWaalsContact CE1-CG1 3.49Å; V130-L132 HydrophobicContact CG2-CD2 4.01Å; V130-R150 WeakPolarHBondContact O-CA 3.36Å; V130-L151 HydrophobicContact CG1-CB 3.73Å; V130-L151 HydrophobicContact CG1-CD1 4.04Å; V130-L151 HydrophobicContact CG1-CG 4.41Å; V130-L151 PolarHBondContact N-O 3.09Å; V130-L151 PolarHBondContact O-N 3.07Å; V130-Y188 HydrophobicContact CG1-CE1 3.83Å; V130-Y188 HydrophobicContact CG2-CE1 4.5Å
131	C	98.2	Very high	91.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	117.9	174.9	-67.6	0	0	0	0	107.8	I92 L121 S124	I92-C131 HydrophobicContact CB-CB 4.32Å; I92-C131 HydrophobicContact CG2-CB 3.48Å; I92-C131 VanDerWaalsContact CG2-CB 3.48Å; I92-C131 PolarHBondContact N-O 2.76Å; L121-C131 HydrophobicContact CD2-CB 4.01Å; S124-C131 PolarHBondContact OG-N 2.89Å
132	L	98.6	Very high	91	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	145	177.5	-62.6	-178.8	0	0	0	109.6	V89 V90 P91 V130 H148 A149 L151 T185 Y188	V89-L132 HydrophobicContact CG1-CB 3.67Å; V89-L132 HydrophobicContact CG1-CD1 4.01Å; V89-L132 HydrophobicContact CG1-CD2 4.01Å; V89-L132 HydrophobicContact CG1-CG 4.1Å; V90-L132 WeakPolarHBondContact O-CA 3.5Å; P91-L132 HydrophobicContact CB-CD2 4.47Å; P91-L132 HydrophobicContact CG-CD2 4.28Å; V130-L132 HydrophobicContact CG2-CD2 4.01Å; L132-H148 WeakPolarHBondContact O-CA 3.44Å; L132-H148 PolarHBondContact O-ND1 2.84Å; L132-A149 PolarHBondContact N-O 3.3Å; L132-A149 PolarHBondContact O-N 2.9Å; L132-A149 VanDerWaalsContact O-N 3.09Å; L132-L151 HydrophobicContact CD1-CD1 3.88Å; L132-T185 HydrophobicContact CD1-CG2 4.22Å; L132-Y188 HydrophobicContact CD1-CD1 3.95Å; L132-Y188 HydrophobicContact CD1-CG 3.96Å; L132-Y188 HydrophobicContact CD2-CD1 4.23Å; L132-Y188 HydrophobicContact CD2-CD2 4.01Å; L132-Y188 HydrophobicContact CD2-CE1 4.15Å; L132-Y188 HydrophobicContact CD2-CE2 3.94Å; L132-Y188 HydrophobicContact CD2-CG 4.17Å
133	V	98.3	Very high	90.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	135.2	173	-68.8	0	0	0	0	110	V89 V90 I92 L98 C102 L135 L145 G147	V89-V133 WeakPolarHBondContact CA-O 3.13Å; V90-V133 HydrophobicContact CG2-CG2 3.55Å; V90-V133 PolarHBondContact N-O 3.38Å; V90-V133 VanDerWaalsContact N-O 3.09Å; V90-V133 WeakPolarHBondContact O-CG2 3.42Å; V90-V133 PolarHBondContact O-N 2.81Å; I92-V133 HydrophobicContact CB-CG1 4.31Å; I92-V133 HydrophobicContact CD1-CG1 3.95Å; I92-V133 HydrophobicContact CG1-CG1 4.17Å; L98-V133 HydrophobicContact CD1-CG2 4.01Å; C102-V133 HydrophobicContact CB-CG1 4.3Å; V133-L135 HydrophobicContact CG2-CD1 4.49Å; V133-L135 HydrophobicContact CG2-CD2 4.32Å; V133-L135 HydrophobicContact CG2-CG 4.29Å; V133-L145 HydrophobicContact CB-CD1 3.64Å; V133-L145 HydrophobicContact CG1-CD1 3.88Å; V133-G147 WeakPolarHBondContact CA-O 3.41Å
134	L	97.9	Very high	90.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	121.8	174.4	-172.6	72	0	0	0	108.7	I87 V89 L146 G147 Y177 V180 L181	I87-L134 HydrophobicContact CG2-CD1 3.37Å; I87-L134 HydrophobicContact CG2-CD2 4.35Å; I87-L134 HydrophobicContact CG2-CG 3.92Å; V89-L134 HydrophobicContact CG2-CB 4.34Å; V89-L134 HydrophobicContact CG2-CD1 3.42Å; V89-L134 VanDerWaalsContact CG2-CD1 3.42Å; L134-L146 HydrophobicContact CB-CB 4.31Å; L134-L146 HydrophobicContact CD2-CB 3.96Å; L134-L146 HydrophobicContact CD2-CD1 4.2Å; L134-L146 HydrophobicContact CG-CB 4.18Å; L134-L146 HydrophobicContact CG-CD1 4.38Å; L134-L146 PolarHBondContact O-N 3.25Å; L134-G147 PolarHBondContact N-O 2.93Å; L134-G147 PolarHBondContact O-N 3.29Å; L134-Y177 HydrophobicContact CD2-CD1 4.27Å; L134-V180 HydrophobicContact CD1-CG1 4.24Å; L134-L181 HydrophobicContact CB-CD1 4.22Å; L134-L181 HydrophobicContact CD2-CB 4.23Å
135	L	96.6	Very high	90.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	149.2	-178.3	-58.9	-178.3	0	0	0	110.5	I87 H88 V90 L98 V133 E143 R144 L145	I87-L135 WeakPolarHBondContact CA-O 3.38Å; H88-L135 PolarHBondContact N-O 2.83Å; H88-L135 PolarHBondContact O-N 2.98Å; V90-L135 HydrophobicContact CG2-CD1 3.66Å; V90-L135 HydrophobicContact CG2-CG 4.36Å; L98-L135 HydrophobicContact CD1-CD1 3.84Å; L98-L135 HydrophobicContact CD1-CD2 3.77Å; L98-L135 HydrophobicContact CD1-CG 4.39Å; V133-L135 HydrophobicContact CG2-CD1 4.49Å; V133-L135 HydrophobicContact CG2-CD2 4.32Å; V133-L135 HydrophobicContact CG2-CG 4.29Å; L135-E143 HydrophobicContact CB-CB 4.33Å; L135-E143 HydrophobicContact CD1-CB 4.31Å; L135-R144 WeakPolarHBondContact CA-O 3.06Å; L135-L145 HydrophobicContact CD2-CB 4.25Å; L135-L145 HydrophobicContact CD2-CD1 3.9Å
136	Q	94.5	Very high	90.8	Very high	26 Å²	26	46.7 Å²	46.7	12%	0.121	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135	170.3	174.3	179.3	53.9	0	0	110.4	R86 E143 R144 L146 Y177	R86-Q136 WeakPolarHBondContact O-CA 3.07Å; Q136-E143 WeakPolarHBondContact O-CA 3.37Å; Q136-R144 PolarHBondContact N-O 2.96Å; Q136-R144 PolarHBondContact O-N 3.27Å; Q136-L146 HydrophobicContact CB-CD1 3.56Å; Q136-L146 HydrophobicContact CB-CD2 4.44Å; Q136-L146 HydrophobicContact CB-CG 4.06Å; Q136-Y177 PolarHBondContact NE2-OH 3.29Å; Q136-Y177 PolarHBondContact OE1-OH 3.27Å
137	G	90.3	Very high	91	Very high	4 Å²	4	43.1 Å²	43.1	4%	0.041	22%	0.224	C	C	.	.	S	Bend	trans	120.9	180	176.4	0	0	0	0	0	113.2	E83 R86 R139	E83-G137 CarbonylContact O-C 3.59Å; R86-G137 PolarHBondContact O-N 2.84Å; G137-R139 PolarHBondContact O-N 2.91Å
138	P	83.3	Confident	91.3	Very high	48 Å²	48	37.9 Å²	37.9	31%	0.312	20%	0.199	S	C	.	.	S	Bend	trans	-69.8	127.4	-178.1	17.1	-13.4	0	0	0	110.5	E83 G140 T141 E143	E83-P138 HydrophobicContact CG-CB 4.04Å; P138-G140 PolarHBondContact O-N 3.31Å; P138-T141 PolarHBondContact O-N 2.88Å; P138-T141 PolarHBondContact O-OG1 2.68Å; P138-E143 WeakPolarHBondContact O-CG 3.13Å
139	R	77.3	Confident	91.6	Very high	133 Å²	133	36.8 Å²	36.8	50%	0.502	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	125.3	-174.9	-76.3	-171.7	-72.2	-98.5	-8.2	112.1	E83 G137 E143	E83-R139 IonicContact OE1-NH2 2.81Å; G137-R139 PolarHBondContact O-N 2.91Å; R139-E143 WeakPolarHBondContact CA-OE1 3.45Å
140	G	67.9	Low	91.7	Very high	65 Å²	65	36.8 Å²	36.8	67%	0.67	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.1	5.6	170.7	0	0	0	0	0	116.6	P138 E143	P138-G140 PolarHBondContact O-N 3.31Å; G140-E143 PolarHBondContact N-OE2 2.86Å; G140-E143 VanDerWaalsContact N-OE2 3.11Å
141	T	75.4	Confident	91.7	Very high	107 Å²	107	36.8 Å²	36.8	66%	0.656	19%	0.19	S	C	*	.	S	Bend	trans	-114.5	-86.8	176.7	19.4	0	0	0	0	111.7	P138	P138-T141 PolarHBondContact O-N 2.88Å; P138-T141 PolarHBondContact O-OG1 2.68Å
142	E	79.3	Confident	91.6	Very high	172 Å²	172	36.9 Å²	36.9	80%	0.804	19%	0.191	S	C	*	.	S	Bend	trans	-123.2	60.4	-176.6	-66.7	-169.1	170.1	0	0	111	R144	E142-R144 PolarHBondContact O-N 3.3Å
143	E	90.6	Very high	91.4	Very high	25 Å²	25	40.4 Å²	40.4	12%	0.117	20%	0.204	C	C	.	.			trans	-75	127.6	178.2	-71.2	164.9	119.9	0	0	111.2	H88 R95 L135 Q136 P138 R139 G140	H88-E143 IonicContact CE1-OE1 3.06Å; H88-E143 PolarHBondContact CE1-OE1 2.9Å; H88-E143 IonicContact NE2-OE1 3.96Å; H88-E143 PolarHBondContact NE2-OE1 3Å; R95-E143 IonicContact CZ-OE2 2.88Å; R95-E143 IonicContact NH1-OE1 2.65Å; R95-E143 IonicContact NH1-OE2 3Å; R95-E143 PolarHBondContact NH1-OE2 3.21Å; R95-E143 IonicContact NH2-OE2 3.21Å; R95-E143 PolarHBondContact NH2-OE2 3.45Å; L135-E143 HydrophobicContact CB-CB 4.33Å; L135-E143 HydrophobicContact CD1-CB 4.31Å; Q136-E143 WeakPolarHBondContact O-CA 3.37Å; P138-E143 WeakPolarHBondContact O-CG 3.13Å; R139-E143 WeakPolarHBondContact CA-OE1 3.45Å; G140-E143 PolarHBondContact N-OE2 2.86Å; G140-E143 VanDerWaalsContact N-OE2 3.11Å
144	R	93.3	Very high	91.1	Very high	130 Å²	130	40.5 Å²	40.5	49%	0.491	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	125.6	175.2	-169.2	-177.9	-57.5	100.9	9	110.1	L135 Q136 E142 L146	L135-R144 WeakPolarHBondContact CA-O 3.06Å; Q136-R144 PolarHBondContact N-O 2.96Å; Q136-R144 PolarHBondContact O-N 3.27Å; E142-R144 PolarHBondContact O-N 3.3Å; R144-L146 HydrophobicContact CB-CD2 4.47Å; R144-L146 HydrophobicContact CG-CD2 4.02Å; R144-L146 PolarHBondContact O-N 2.78Å
145	L	96.3	Very high	90.6	Very high	29 Å²	29	42.6 Å²	42.6	15%	0.152	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	114.3	171.4	178.7	63.7	0	0	0	111	P101 C102 L105 V133 L135	P101-L145 HydrophobicContact CB-CD2 4.05Å; C102-L145 HydrophobicContact CB-CD2 3.88Å; L105-L145 HydrophobicContact CB-CD2 4.37Å; L105-L145 HydrophobicContact CD2-CD1 4.47Å; L105-L145 HydrophobicContact CD2-CD2 4.05Å; L105-L145 HydrophobicContact CD2-CG 4.05Å; V133-L145 HydrophobicContact CB-CD1 3.64Å; V133-L145 HydrophobicContact CG1-CD1 3.88Å; L135-L145 HydrophobicContact CD2-CB 4.25Å; L135-L145 HydrophobicContact CD2-CD1 3.9Å
146	L	97.6	Very high	90.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-34.3	-177.2	-60	-176.9	0	0	0	113.2	L134 Q136 R144 V168 S169 E172 Y177	L134-L146 HydrophobicContact CB-CB 4.31Å; L134-L146 HydrophobicContact CD2-CB 3.96Å; L134-L146 HydrophobicContact CD2-CD1 4.2Å; L134-L146 HydrophobicContact CG-CB 4.18Å; L134-L146 HydrophobicContact CG-CD1 4.38Å; L134-L146 PolarHBondContact O-N 3.25Å; Q136-L146 HydrophobicContact CB-CD1 3.56Å; Q136-L146 HydrophobicContact CB-CD2 4.44Å; Q136-L146 HydrophobicContact CB-CG 4.06Å; R144-L146 HydrophobicContact CB-CD2 4.47Å; R144-L146 HydrophobicContact CG-CD2 4.02Å; R144-L146 PolarHBondContact O-N 2.78Å; L146-V168 WeakPolarHBondContact O-CA 3.43Å; L146-S169 PolarHBondContact O-N 2.81Å; L146-E172 HydrophobicContact CD2-CG 3.91Å; L146-Y177 HydrophobicContact CD1-CD1 3.68Å; L146-Y177 HydrophobicContact CD1-CD2 4.43Å; L146-Y177 HydrophobicContact CD1-CE1 3.49Å; L146-Y177 VanDerWaalsContact CD1-CE1 3.49Å; L146-Y177 HydrophobicContact CD1-CE2 4.26Å; L146-Y177 HydrophobicContact CD1-CG 4.14Å
147	G	98	Very high	89.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	168.2	-170.3	0	0	0	0	0	114.1	V133 L134 V167	V133-G147 WeakPolarHBondContact CA-O 3.41Å; L134-G147 PolarHBondContact N-O 2.93Å; L134-G147 PolarHBondContact O-N 3.29Å; G147-V167 CarbonylContact C-O 3.49Å; G147-V167 WeakPolarHBondContact CA-O 3.39Å
148	H	98.6	Very high	89.5	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.019	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	142.4	179.5	169.6	63.6	0	0	0	110.8	L105 V106 L132 S165 V166 V167	L105-H148 HydrophobicContact CD2-CB 4.17Å; V106-H148 HydrophobicContact CG2-CB 4.26Å; V106-H148 WeakPolarHBondContact CG2-CD2 3.5Å; L132-H148 WeakPolarHBondContact O-CA 3.44Å; L132-H148 PolarHBondContact O-ND1 2.84Å; H148-S165 PolarHBondContact CD2-O 2.77Å; H148-V166 CarbonylContact O-C 3.53Å; H148-V166 WeakPolarHBondContact O-CA 3.38Å; H148-V167 HydrophobicContact CB-CG1 3.93Å; H148-V167 PolarHBondContact N-O 2.95Å; H148-V167 PolarHBondContact O-N 3.21Å
149	A	98.3	Very high	90.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	149.3	166.8	0	0	0	0	0	109.7	L132 V166 L181	L132-A149 PolarHBondContact N-O 3.3Å; L132-A149 PolarHBondContact O-N 2.9Å; L132-A149 VanDerWaalsContact O-N 3.09Å; A149-V166 HydrophobicContact CB-CG2 4.26Å; A149-L181 HydrophobicContact CB-CD1 4.04Å; A149-L181 HydrophobicContact CB-CG 4.38Å
150	R	97.6	Very high	91	Very high	29 Å²	29	46.8 Å²	46.8	11%	0.109	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.1	175.2	-177.9	-177.3	-165.3	153.4	16.2	110.2	S120 V130 V163 E164	S120-R150 PolarHBondContact O-NH2 2.93Å; S120-R150 PolarHBondContact OG-NH1 3.19Å; V130-R150 WeakPolarHBondContact O-CA 3.36Å; R150-V163 CarbonylContact O-C 3.47Å; R150-V163 WeakPolarHBondContact O-CA 3.42Å; R150-E164 HydrophobicContact CB-CB 4.24Å; R150-E164 PolarHBondContact N-O 2.92Å; R150-E164 PolarHBondContact O-N 3.49Å
151	L	97.5	Very high	92.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131.9	172.8	-66.1	168.3	0	0	0	110.2	F128 P129 V130 L132 L161 F162 V163 T185 Y188 L197	F128-L151 HydrophobicContact CD1-CB 4.05Å; F128-L151 HydrophobicContact CE1-CB 3.83Å; F128-L151 HydrophobicContact CE1-CD1 4.4Å; P129-L151 CarbonylContact C-O 3.16Å; P129-L151 VanDerWaalsContact CA-O 3.25Å; P129-L151 WeakPolarHBondContact CA-O 3.37Å; V130-L151 HydrophobicContact CG1-CB 3.73Å; V130-L151 HydrophobicContact CG1-CD1 4.04Å; V130-L151 HydrophobicContact CG1-CG 4.41Å; V130-L151 PolarHBondContact N-O 3.09Å; V130-L151 PolarHBondContact O-N 3.07Å; L132-L151 HydrophobicContact CD1-CD1 3.88Å; L151-L161 HydrophobicContact CB-CD1 4.38Å; L151-L161 HydrophobicContact CD1-CD1 4.11Å; L151-L161 HydrophobicContact CD2-CB 4.12Å; L151-L161 HydrophobicContact CD2-CD1 4.17Å; L151-L161 HydrophobicContact CG-CD1 4.47Å; L151-F162 WeakPolarHBondContact CA-O 3.46Å; L151-V163 HydrophobicContact CD2-CG2 3.84Å; L151-T185 HydrophobicContact CD1-CG2 4.07Å; L151-T185 HydrophobicContact CD2-CG2 3.8Å; L151-T185 HydrophobicContact CG-CG2 4.1Å; L151-Y188 HydrophobicContact CD1-CD1 3.78Å; L151-Y188 HydrophobicContact CD1-CE1 4.17Å; L151-L197 HydrophobicContact CD2-CD2 4.06Å
152	T	95.6	Very high	93.4	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	153.3	174	44.6	0	0	0	0	109.2	P129 L161 F162 E164 S221	P129-T152 HydrophobicContact CB-CG2 3.84Å; T152-L161 CarbonylContact O-C 3.55Å; T152-L161 WeakPolarHBondContact O-CA 3.34Å; T152-F162 PolarHBondContact N-O 2.66Å; T152-F162 PolarHBondContact O-N 3.33Å; T152-F162 PolarHBondContact OG1-O 3.24Å; T152-E164 PolarHBondContact OG1-OE1 3.41Å; T152-S221 WeakPolarHBondContact CB-OG 3.38Å; T152-S221 PolarHBondContact OG1-OG 2.77Å
153	R	94.8	Very high	94.3	Very high	74 Å²	74	31.2 Å²	31.2	28%	0.279	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	149.9	174.8	-74.5	175.9	-176	-90.7	8.7	110.4	E127 F128 L161 K222	E127-R153 PolarHBondContact O-NE 3.2Å; E127-R153 VanDerWaalsContact O-NE 3.11Å; E127-R153 PolarHBondContact O-NH2 3.31Å; E127-R153 IonicContact OE2-NH2 3.2Å; E127-R153 PolarHBondContact OE2-NH2 3.11Å; F128-R153 HydrophobicContact CB-CG 3.88Å; F128-R153 HydrophobicContact CD2-CG 3.79Å; F128-R153 HydrophobicContact CG-CG 3.94Å; R153-L161 HydrophobicContact CG-CD2 4.26Å; R153-K222 HydrophobicContact CB-CB 4.15Å; R153-K222 HydrophobicContact CB-CD 3.7Å; R153-K222 HydrophobicContact CB-CG 3.99Å; R153-K222 WeakPolarHBondContact O-CB 3.36Å; R153-K222 WeakPolarHBondContact O-CG 3.31Å; R153-K222 PolarHBondContact O-N 3.46Å
154	V	91.6	Very high	94.3	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	138.1	170	-179.8	0	0	0	0	110.2	H157 S160 F162 V219 Q220 K222	V154-H157 HydrophobicContact CB-CB 4.1Å; V154-H157 HydrophobicContact CG1-CB 3.86Å; V154-S160 PolarHBondContact N-O 3.16Å; V154-F162 HydrophobicContact CG2-CB 3.98Å; V154-V219 HydrophobicContact CG1-CB 3.8Å; V154-V219 HydrophobicContact CG1-CG1 4.41Å; V154-V219 HydrophobicContact CG1-CG2 4.17Å; V154-V219 HydrophobicContact CG2-CG2 4.29Å; V154-Q220 CarbonylContact C-O 3.57Å; V154-Q220 WeakPolarHBondContact CA-O 3.3Å; V154-K222 WeakPolarHBondContact O-CE 3.45Å
155	V	87.8	Confident	94.3	Very high	43 Å²	43	27.8 Å²	27.8	26%	0.261	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	135.1	174.3	179.4	0	0	0	0	109.3	H157 Q220 K222 A227	V155-H157 PolarHBondContact O-CD2 3.23Å; V155-H157 VanDerWaalsContact O-CD2 3.31Å; V155-H157 PolarHBondContact O-N 2.94Å; V155-H157 VanDerWaalsContact O-N 3.11Å; V155-Q220 HydrophobicContact CB-CB 4.08Å; V155-Q220 HydrophobicContact CB-CG 4.27Å; V155-Q220 HydrophobicContact CG2-CB 4.1Å; V155-Q220 HydrophobicContact CG2-CG 3.82Å; V155-Q220 PolarHBondContact N-O 3.28Å; V155-K222 HydrophobicContact CB-CG 4.5Å; V155-K222 HydrophobicContact CG2-CB 4.5Å; V155-K222 HydrophobicContact CG2-CG 3.64Å; V155-A227 HydrophobicContact CG2-CB 4.45Å
156	G	85.6	Confident	94.3	Very high	75 Å²	75	27.7 Å²	27.7	77%	0.773	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.5	-6.4	178.7	0	0	0	0	0	115.6
157	H	84.5	Confident	94.3	Very high	97 Å²	97	28 Å²	28	45%	0.449	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	92.4	-178.5	-63.8	-87.1	0	0	0	111.1	V154 V155 S159 S160	V154-H157 HydrophobicContact CB-CB 4.1Å; V154-H157 HydrophobicContact CG1-CB 3.86Å; V155-H157 PolarHBondContact O-CD2 3.23Å; V155-H157 VanDerWaalsContact O-CD2 3.31Å; V155-H157 PolarHBondContact O-N 2.94Å; V155-H157 VanDerWaalsContact O-N 3.11Å; H157-S159 VanDerWaalsContact C-N 3.27Å; H157-S159 PolarHBondContact O-N 2.77Å; H157-S160 PolarHBondContact O-N 2.82Å
158	G	88.9	Confident	94.3	Very high	69 Å²	69	28.7 Å²	28.7	71%	0.711	19%	0.185	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	-24.9	-174.1	0	0	0	0	0	115.3
159	S	94.8	Very high	94.2	Very high	54 Å²	54	29.8 Å²	29.8	38%	0.378	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	8.5	-178.8	59.9	0	0	0	0	114.1	H157 K195 R196	H157-S159 VanDerWaalsContact C-N 3.27Å; H157-S159 PolarHBondContact O-N 2.77Å; S159-K195 PolarHBondContact O-N 2.86Å; S159-R196 PolarHBondContact O-N 3.24Å
160	S	96.5	Very high	94	Very high	5 Å²	5	35.4 Å²	35.4	4%	0.035	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.3	-175.4	-53.7	0	0	0	0	112.1	V154 H157 R196	V154-S160 PolarHBondContact N-O 3.16Å; H157-S160 PolarHBondContact O-N 2.82Å; S160-R196 WeakPolarHBondContact CA-O 3.25Å
161	L	97.7	Very high	93.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	152.1	170.7	-61.5	173.4	0	0	0	110.6	F128 L151 T152 R153 A189 F194 R196 L197 C198	F128-L161 HydrophobicContact CD1-CD2 3.87Å; F128-L161 HydrophobicContact CD2-CD2 4.18Å; F128-L161 HydrophobicContact CE1-CD1 3.59Å; F128-L161 HydrophobicContact CE1-CD2 3.53Å; F128-L161 HydrophobicContact CE1-CG 4.21Å; F128-L161 HydrophobicContact CE2-CD2 3.9Å; F128-L161 HydrophobicContact CG-CD2 4.21Å; F128-L161 HydrophobicContact CZ-CD1 3.58Å; F128-L161 HydrophobicContact CZ-CD2 3.56Å; F128-L161 HydrophobicContact CZ-CG 4.22Å; L151-L161 HydrophobicContact CB-CD1 4.38Å; L151-L161 HydrophobicContact CD1-CD1 4.11Å; L151-L161 HydrophobicContact CD2-CB 4.12Å; L151-L161 HydrophobicContact CD2-CD1 4.17Å; L151-L161 HydrophobicContact CG-CD1 4.47Å; T152-L161 CarbonylContact O-C 3.55Å; T152-L161 WeakPolarHBondContact O-CA 3.34Å; R153-L161 HydrophobicContact CG-CD2 4.26Å; L161-A189 HydrophobicContact CD1-CB 3.8Å; L161-F194 HydrophobicContact CD1-CB 4.16Å; L161-F194 HydrophobicContact CD1-CD1 4.06Å; L161-F194 HydrophobicContact CD1-CD2 3.8Å; L161-F194 HydrophobicContact CD1-CE1 4.45Å; L161-F194 HydrophobicContact CD1-CE2 4.23Å; L161-F194 HydrophobicContact CD1-CG 3.71Å; L161-F194 HydrophobicContact CD2-CD1 3.72Å; L161-F194 HydrophobicContact CD2-CD2 4.45Å; L161-F194 HydrophobicContact CD2-CE1 3.46Å; L161-F194 VanDerWaalsContact CD2-CE1 3.46Å; L161-F194 HydrophobicContact CD2-CE2 4.25Å; L161-F194 HydrophobicContact CD2-CG 4.21Å; L161-F194 HydrophobicContact CD2-CZ 3.76Å; L161-F194 HydrophobicContact CG-CB 4.25Å; L161-F194 HydrophobicContact CG-CD1 3.48Å; L161-F194 VanDerWaalsContact CG-CD1 3.48Å; L161-F194 HydrophobicContact CG-CD2 4.15Å; L161-F194 HydrophobicContact CG-CE1 3.81Å; L161-F194 HydrophobicContact CG-CE2 4.45Å; L161-F194 HydrophobicContact CG-CG 3.67Å; L161-F194 HydrophobicContact CG-CZ 4.29Å; L161-R196 PolarHBondContact N-O 3.28Å; L161-L197 HydrophobicContact CB-CD2 3.75Å; L161-L197 HydrophobicContact CD1-CD2 4.28Å; L161-L197 HydrophobicContact CG-CD2 4.49Å; L161-L197 CarbonylContact O-C 3.57Å; L161-L197 WeakPolarHBondContact O-CA 3.42Å; L161-C198 PolarHBondContact O-N 2.92Å
162	F	97.1	Very high	93.8	Very high	13 Å²	13	42.9 Å²	42.9	6%	0.057	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128	172.7	-164.3	-102.6	0	0	0	109.3	L151 T152 V154 E164 C198 T200 V219 W306	L151-F162 WeakPolarHBondContact CA-O 3.46Å; T152-F162 PolarHBondContact N-O 2.66Å; T152-F162 PolarHBondContact O-N 3.33Å; T152-F162 PolarHBondContact OG1-O 3.24Å; V154-F162 HydrophobicContact CG2-CB 3.98Å; F162-E164 HydrophobicContact CD1-CG 3.4Å; F162-E164 WeakPolarHBondContact CD1-OE1 3.49Å; F162-E164 HydrophobicContact CE1-CG 3.6Å; F162-C198 CarbonylContact C-O 3.5Å; F162-C198 VanDerWaalsContact CA-O 3.3Å; F162-C198 WeakPolarHBondContact CA-O 3.3Å; F162-C198 HydrophobicContact CD2-CB 3.81Å; F162-C198 WeakPolarHBondContact CD2-O 3.2Å; F162-C198 HydrophobicContact CE2-CB 4.36Å; F162-T200 HydrophobicContact CE2-CG2 4.33Å; F162-T200 HydrophobicContact CZ-CG2 3.87Å; F162-V219 HydrophobicContact CD2-CG2 3.65Å; F162-V219 HydrophobicContact CE2-CG2 3.98Å; F162-W306 HydrophobicContact CD2-CZ3 4.3Å; F162-W306 AromaticContact CE2-CE3 3.99Å; F162-W306 HydrophobicContact CE2-CE3 3.99Å; F162-W306 HydrophobicContact CE2-CH2 4.18Å; F162-W306 AromaticContact CE2-CZ3 3.36Å; F162-W306 HydrophobicContact CE2-CZ3 3.36Å; F162-W306 HydrophobicContact CZ-CH2 4.25Å; F162-W306 AromaticContact CZ-CZ3 3.84Å; F162-W306 HydrophobicContact CZ-CZ3 3.84Å
163	V	97.5	Very high	93.7	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.024	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.7	-179.5	-166	0	0	0	0	108.9	R150 L151 V166 M182 L197 C198 L199	R150-V163 CarbonylContact O-C 3.47Å; R150-V163 WeakPolarHBondContact O-CA 3.42Å; L151-V163 HydrophobicContact CD2-CG2 3.84Å; V163-V166 HydrophobicContact CG1-CG2 3.48Å; V163-V166 VanDerWaalsContact CG1-CG2 3.48Å; V163-M182 HydrophobicContact CG1-CE 4.48Å; V163-L197 HydrophobicContact CG2-CB 3.94Å; V163-L197 HydrophobicContact CG2-CD1 3.94Å; V163-L197 HydrophobicContact CG2-CD2 4.2Å; V163-L197 HydrophobicContact CG2-CG 4.26Å; V163-C198 PolarHBondContact N-O 2.9Å; V163-L199 HydrophobicContact CB-CB 4.18Å
164	E	91.6	Very high	93.7	Very high	44 Å²	44	48.5 Å²	48.5	21%	0.206	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	158.9	-176.4	-61.2	171.2	-169.5	0	0	110.4	R150 T152 F162 V166 S221	R150-E164 HydrophobicContact CB-CB 4.24Å; R150-E164 PolarHBondContact N-O 2.92Å; R150-E164 PolarHBondContact O-N 3.49Å; T152-E164 PolarHBondContact OG1-OE1 3.41Å; F162-E164 HydrophobicContact CD1-CG 3.4Å; F162-E164 WeakPolarHBondContact CD1-OE1 3.49Å; F162-E164 HydrophobicContact CE1-CG 3.6Å; E164-V166 VanDerWaalsContact C-N 3.26Å; E164-V166 PolarHBondContact O-N 2.82Å; E164-V166 VanDerWaalsContact O-N 3.16Å; E164-S221 WeakPolarHBondContact OE1-CB 3.33Å; E164-S221 PolarHBondContact OE1-OG 2.6Å
165	S	92.6	Very high	93.9	Very high	38 Å²	38	54.1 Å²	54.1	27%	0.266	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.1	36	169	-50.9	0	0	0	0	114.9	H148 V167	H148-S165 PolarHBondContact CD2-O 2.77Å; S165-V167 PolarHBondContact O-N 3.24Å
166	V	97.1	Very high	94.3	Very high	28 Å²	28	53.9 Å²	53.9	17%	0.17	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	116.4	178.1	-175	0	0	0	0	110.1	W110 H148 A149 V163 E164 L181 M182	W110-V166 WeakPolarHBondContact CH2-O 3.37Å; H148-V166 CarbonylContact O-C 3.53Å; H148-V166 WeakPolarHBondContact O-CA 3.38Å; A149-V166 HydrophobicContact CB-CG2 4.26Å; V163-V166 HydrophobicContact CG1-CG2 3.48Å; V163-V166 VanDerWaalsContact CG1-CG2 3.48Å; E164-V166 VanDerWaalsContact C-N 3.26Å; E164-V166 PolarHBondContact O-N 2.82Å; E164-V166 VanDerWaalsContact O-N 3.16Å; V166-L181 HydrophobicContact CG1-CD2 3.97Å; V166-M182 HydrophobicContact CG1-SD 3.93Å; V166-M182 HydrophobicContact CG2-SD 4.09Å
167	V	97.1	Very high	94.8	Very high	6 Å²	6	51.7 Å²	51.7	4%	0.036	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	140.6	-178.7	62.5	0	0	0	0	111.1	L105 V106 E109 W110 G147 H148 S165	L105-V167 HydrophobicContact CD1-CG2 4.34Å; L105-V167 HydrophobicContact CD2-CG1 4.32Å; L105-V167 HydrophobicContact CG-CG1 4.04Å; V106-V167 HydrophobicContact CG2-CG1 4.05Å; E109-V167 HydrophobicContact CB-CG2 3.91Å; E109-V167 HydrophobicContact CG-CG2 4.34Å; W110-V167 HydrophobicContact CH2-CB 4.42Å; W110-V167 HydrophobicContact CZ3-CB 4.07Å; W110-V167 HydrophobicContact CZ3-CG1 4.5Å; G147-V167 CarbonylContact C-O 3.49Å; G147-V167 WeakPolarHBondContact CA-O 3.39Å; H148-V167 HydrophobicContact CB-CG1 3.93Å; H148-V167 PolarHBondContact N-O 2.95Å; H148-V167 PolarHBondContact O-N 3.21Å; S165-V167 PolarHBondContact O-N 3.24Å
168	V	97.9	Very high	95.4	Very high	15 Å²	15	47.9 Å²	47.9	9%	0.091	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.8	167.7	176.4	0	0	0	0	108.2	L146 K170 E172 R173 L181	L146-V168 WeakPolarHBondContact O-CA 3.43Å; V168-K170 PolarHBondContact O-N 2.72Å; V168-E172 HydrophobicContact CG1-CB 4.07Å; V168-R173 HydrophobicContact CG1-CG 4.44Å; V168-R173 PolarHBondContact O-NE 2.93Å; V168-R173 VanDerWaalsContact O-NE 3.09Å; V168-R173 PolarHBondContact O-NH2 2.79Å; V168-R173 VanDerWaalsContact O-NH2 3.07Å; V168-L181 HydrophobicContact CG2-CD2 4.24Å
169	S	96.2	Very high	95.9	Very high	27 Å²	27	49.2 Å²	49.2	19%	0.189	27%	0.272	C	S	.	.			trans	-49.1	134.1	174.9	177.2	0	0	0	0	110.2	L146 Q171 E172 R173	L146-S169 PolarHBondContact O-N 2.81Å; S169-Q171 PolarHBondContact O-N 3.26Å; S169-E172 WeakPolarHBondContact O-CA 3.38Å; S169-E172 PolarHBondContact O-N 2.94Å; S169-R173 PolarHBondContact O-N 3.47Å
170	K	94.5	Very high	96	Very high	117 Å²	117	48.4 Å²	48.4	51%	0.509	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-56.6	-37.6	-173.7	-70.5	-177.9	-176.3	179	0	112.6	S108 V168 E172 R173	S108-K170 VanDerWaalsContact O-CE 3.25Å; S108-K170 WeakPolarHBondContact O-CE 3.35Å; S108-K170 PolarHBondContact O-NZ 3.39Å; V168-K170 PolarHBondContact O-N 2.72Å; K170-E172 PolarHBondContact O-N 3.44Å; K170-R173 PolarHBondContact O-N 2.92Å
171	Q	94.7	Very high	96.1	Very high	161 Å²	161	48.2 Å²	48.2	75%	0.752	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-69.8	-17.2	179.8	-61.3	171.4	11.5	0	0	113	S169 K175	S169-Q171 PolarHBondContact O-N 3.26Å; Q171-K175 WeakPolarHBondContact O-CE 3.35Å; Q171-K175 PolarHBondContact O-NZ 3.21Å
172	E	95	Very high	96.2	Very high	26 Å²	26	48.2 Å²	48.2	12%	0.121	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-107.9	0.8	-174.5	-57.4	-53.6	132.5	0	0	112.4	L146 V168 S169 K170 K175 Y177	L146-E172 HydrophobicContact CD2-CG 3.91Å; V168-E172 HydrophobicContact CG1-CB 4.07Å; S169-E172 WeakPolarHBondContact O-CA 3.38Å; S169-E172 PolarHBondContact O-N 2.94Å; K170-E172 PolarHBondContact O-N 3.44Å; E172-K175 IonicContact OE1-NZ 2.94Å; E172-K175 PolarHBondContact OE1-NZ 3.48Å; E172-K175 VanDerWaalsContact OE1-NZ 3.14Å; E172-K175 WeakPolarHBondContact OE2-CD 3.47Å; E172-K175 WeakPolarHBondContact OE2-CE 3.39Å; E172-K175 IonicContact OE2-NZ 3.18Å; E172-K175 PolarHBondContact OE2-NZ 3.04Å; E172-Y177 HydrophobicContact CB-CD2 3.77Å; E172-Y177 HydrophobicContact CB-CE2 3.99Å; E172-Y177 HydrophobicContact CG-CE2 4.5Å; E172-Y177 WeakPolarHBondContact O-CD2 3.3Å; E172-Y177 WeakPolarHBondContact OE2-CE2 3.4Å
173	R	94.1	Very high	96.2	Very high	105 Å²	105	51.7 Å²	51.7	40%	0.396	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	151.3	176.2	-66.4	179.1	-171.4	-179	2.8	110.9	E109 V168 S169 K170 K175	E109-R173 IonicContact OE1-NH1 2.73Å; E109-R173 IonicContact OE2-CZ 3.9Å; E109-R173 IonicContact OE2-NH1 2.74Å; E109-R173 PolarHBondContact OE2-NH1 3.02Å; E109-R173 VanDerWaalsContact OE2-NH1 3.1Å; E109-R173 IonicContact OE2-NH2 3.01Å; E109-R173 PolarHBondContact OE2-NH2 3.09Å; V168-R173 HydrophobicContact CG1-CG 4.44Å; V168-R173 PolarHBondContact O-NE 2.93Å; V168-R173 VanDerWaalsContact O-NE 3.09Å; V168-R173 PolarHBondContact O-NH2 2.79Å; V168-R173 VanDerWaalsContact O-NH2 3.07Å; S169-R173 PolarHBondContact O-N 3.47Å; K170-R173 PolarHBondContact O-N 2.92Å; R173-K175 PolarHBondContact O-N 3.04Å
174	G	94.4	Very high	96.3	Very high	89 Å²	89	54.2 Å²	54.2	92%	0.918	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	-7.6	-177.1	0	0	0	0	0	114.8
175	K	95.5	Very high	96.6	Very high	120 Å²	120	52.1 Å²	52.1	52%	0.522	28%	0.282	S	S	.	.	S	Bend	trans	-94	11.2	179.9	-54.1	179.4	-168.7	171.8	0	114.2	Q171 E172 R173 Y177	Q171-K175 WeakPolarHBondContact O-CE 3.35Å; Q171-K175 PolarHBondContact O-NZ 3.21Å; E172-K175 IonicContact OE1-NZ 2.94Å; E172-K175 PolarHBondContact OE1-NZ 3.48Å; E172-K175 VanDerWaalsContact OE1-NZ 3.14Å; E172-K175 WeakPolarHBondContact OE2-CD 3.47Å; E172-K175 WeakPolarHBondContact OE2-CE 3.39Å; E172-K175 IonicContact OE2-NZ 3.18Å; E172-K175 PolarHBondContact OE2-NZ 3.04Å; R173-K175 PolarHBondContact O-N 3.04Å; K175-Y177 HydrophobicContact CB-CD2 3.89Å; K175-Y177 HydrophobicContact CB-CE2 3.79Å; K175-Y177 HydrophobicContact CD-CE2 3.96Å; K175-Y177 PolarHBondContact O-N 3.41Å
176	G	96.4	Very high	96.9	Very high	39 Å²	39	50.9 Å²	50.9	40%	0.402	27%	0.272	S	S	.	.	S	Bend	trans	84.7	-8.1	179.7	0	0	0	0	0	116.2	G178 R179 V180	G176-G178 PolarHBondContact O-N 3.18Å; G176-R179 WeakPolarHBondContact O-CB 3.4Å; G176-R179 PolarHBondContact O-N 3.41Å; G176-V180 PolarHBondContact O-N 3.22Å
177	Y	97.7	Very high	97	Very high	29 Å²	29	52.9 Å²	52.9	11%	0.114	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-23	-177.8	-63.1	-58.4	0	0	0	115.4	I87 L134 Q136 L146 E172 K175 V180 L181	I87-Y177 HydrophobicContact CD1-CD1 4.03Å; I87-Y177 HydrophobicContact CD1-CE1 3.58Å; I87-Y177 HydrophobicContact CG1-CE1 4.3Å; L134-Y177 HydrophobicContact CD2-CD1 4.27Å; Q136-Y177 PolarHBondContact NE2-OH 3.29Å; Q136-Y177 PolarHBondContact OE1-OH 3.27Å; L146-Y177 HydrophobicContact CD1-CD1 3.68Å; L146-Y177 HydrophobicContact CD1-CD2 4.43Å; L146-Y177 HydrophobicContact CD1-CE1 3.49Å; L146-Y177 VanDerWaalsContact CD1-CE1 3.49Å; L146-Y177 HydrophobicContact CD1-CE2 4.26Å; L146-Y177 HydrophobicContact CD1-CG 4.14Å; E172-Y177 HydrophobicContact CB-CD2 3.77Å; E172-Y177 HydrophobicContact CB-CE2 3.99Å; E172-Y177 HydrophobicContact CG-CE2 4.5Å; E172-Y177 WeakPolarHBondContact O-CD2 3.3Å; E172-Y177 WeakPolarHBondContact OE2-CE2 3.4Å; K175-Y177 HydrophobicContact CB-CD2 3.89Å; K175-Y177 HydrophobicContact CB-CE2 3.79Å; K175-Y177 HydrophobicContact CD-CE2 3.96Å; K175-Y177 PolarHBondContact O-N 3.41Å; Y177-V180 PolarHBondContact O-N 2.98Å; Y177-L181 VanDerWaalsContact O-CB 3.23Å; Y177-L181 WeakPolarHBondContact O-CB 3.39Å; Y177-L181 PolarHBondContact O-N 3.38Å
178	G	97.1	Very high	97	Very high	17 Å²	17	54 Å²	54	18%	0.175	29%	0.285	C	S	.	.	H	α-helix	trans	-65.1	-39.5	172.5	0	0	0	0	0	112.4	G176 M182	G176-G178 PolarHBondContact O-N 3.18Å; G178-M182 WeakPolarHBondContact O-CG 3.42Å; G178-M182 PolarHBondContact O-N 3.01Å
179	R	98.1	Very high	97	Very high	96 Å²	96	53.2 Å²	53.2	36%	0.362	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-52.3	173.4	174.3	-170.6	-56.7	-82.9	2.4	109.9	G176 L181 M182 E183 H210 L211	G176-R179 WeakPolarHBondContact O-CB 3.4Å; G176-R179 PolarHBondContact O-N 3.41Å; R179-L181 VanDerWaalsContact C-N 3.33Å; R179-L181 PolarHBondContact O-N 2.82Å; R179-M182 PolarHBondContact O-N 2.84Å; R179-M182 VanDerWaalsContact O-N 3.07Å; R179-E183 WeakPolarHBondContact CD-OE1 3.38Å; R179-E183 VanDerWaalsContact CG-CD 3.48Å; R179-E183 HydrophobicContact CG-CG 4.28Å; R179-E183 WeakPolarHBondContact CG-OE1 3.45Å; R179-E183 WeakPolarHBondContact O-CG 3.32Å; R179-E183 PolarHBondContact O-N 3.05Å; R179-H210 PolarHBondContact NH2-CD2 3.19Å; R179-H210 PolarHBondContact NH2-NE2 2.89Å; R179-L211 HydrophobicContact CB-CD2 4.11Å; R179-L211 HydrophobicContact CG-CD2 3.79Å
180	V	98.2	Very high	97.1	Very high	38 Å²	38	56.5 Å²	56.5	23%	0.23	29%	0.291	C	S	.	.	H	α-helix	trans	-58.5	-44	-178.9	-177.8	0	0	0	0	111.5	I87 L134 G176 Y177 M182 E183 E184	I87-V180 HydrophobicContact CG2-CG1 3.82Å; L134-V180 HydrophobicContact CD1-CG1 4.24Å; G176-V180 PolarHBondContact O-N 3.22Å; Y177-V180 PolarHBondContact O-N 2.98Å; V180-M182 VanDerWaalsContact C-N 3.32Å; V180-M182 PolarHBondContact O-N 3.46Å; V180-E183 PolarHBondContact O-N 2.85Å; V180-E184 HydrophobicContact CG1-CG 4.36Å; V180-E184 WeakPolarHBondContact O-CB 3.37Å; V180-E184 WeakPolarHBondContact O-CG 3.32Å; V180-E184 PolarHBondContact O-N 2.83Å
181	L	98.5	Very high	97.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.2	-44.9	175.5	174.5	55.3	0	0	0	112	L134 A149 V166 V168 Y177 R179 T185	L134-L181 HydrophobicContact CB-CD1 4.22Å; L134-L181 HydrophobicContact CD2-CB 4.23Å; A149-L181 HydrophobicContact CB-CD1 4.04Å; A149-L181 HydrophobicContact CB-CG 4.38Å; V166-L181 HydrophobicContact CG1-CD2 3.97Å; V168-L181 HydrophobicContact CG2-CD2 4.24Å; Y177-L181 VanDerWaalsContact O-CB 3.23Å; Y177-L181 WeakPolarHBondContact O-CB 3.39Å; Y177-L181 PolarHBondContact O-N 3.38Å; R179-L181 VanDerWaalsContact C-N 3.33Å; R179-L181 PolarHBondContact O-N 2.82Å; L181-T185 VanDerWaalsContact O-CB 3.26Å; L181-T185 WeakPolarHBondContact O-CB 3.01Å; L181-T185 PolarHBondContact O-N 2.67Å; L181-T185 PolarHBondContact O-OG1 3.32Å
182	M	98.6	Very high	97.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-70.1	-44.3	-180	-70.9	-56.4	-57.2	0	0	111.7	V163 V166 G178 R179 V180 E184 T185 E186 L199 F207 Y208 L211 Y213	V163-M182 HydrophobicContact CG1-CE 4.48Å; V166-M182 HydrophobicContact CG1-SD 3.93Å; V166-M182 HydrophobicContact CG2-SD 4.09Å; G178-M182 WeakPolarHBondContact O-CG 3.42Å; G178-M182 PolarHBondContact O-N 3.01Å; R179-M182 PolarHBondContact O-N 2.84Å; R179-M182 VanDerWaalsContact O-N 3.07Å; V180-M182 VanDerWaalsContact C-N 3.32Å; V180-M182 PolarHBondContact O-N 3.46Å; M182-E184 PolarHBondContact O-N 2.94Å; M182-T185 WeakPolarHBondContact O-CB 3.4Å; M182-T185 PolarHBondContact O-N 3.1Å; M182-T185 VanDerWaalsContact O-N 3.14Å; M182-E186 VanDerWaalsContact O-CG 3.26Å; M182-E186 WeakPolarHBondContact O-CG 3.07Å; M182-E186 PolarHBondContact O-N 3.31Å; M182-L199 HydrophobicContact CE-CD2 4.36Å; M182-F207 HydrophobicContact CG-CE1 4.33Å; M182-F207 HydrophobicContact CG-CZ 4.36Å; M182-Y208 HydrophobicContact CE-CE1 4.14Å; M182-Y208 HydrophobicContact CG-CE1 4.46Å; M182-Y208 HydrophobicContact SD-CE1 4.14Å; M182-L211 HydrophobicContact CB-CD1 3.66Å; M182-L211 HydrophobicContact CG-CD1 3.74Å; M182-Y213 HydrophobicContact CE-CE2 3.95Å; M182-Y213 WeakPolarHBondContact CE-OH 3.35Å
183	E	98.4	Very high	97.5	Very high	87 Å²	87	55.7 Å²	55.7	41%	0.407	30%	0.295	S	S	.	.	H	α-helix	trans	-60.1	-43.6	176.8	-72.4	168.9	176.3	0	0	111.9	R179 V180 E186 L187	R179-E183 WeakPolarHBondContact CD-OE1 3.38Å; R179-E183 VanDerWaalsContact CG-CD 3.48Å; R179-E183 HydrophobicContact CG-CG 4.28Å; R179-E183 WeakPolarHBondContact CG-OE1 3.45Å; R179-E183 WeakPolarHBondContact O-CG 3.32Å; R179-E183 PolarHBondContact O-N 3.05Å; V180-E183 PolarHBondContact O-N 2.85Å; E183-E186 WeakPolarHBondContact O-CB 3.48Å; E183-E186 PolarHBondContact O-N 3.12Å; E183-L187 WeakPolarHBondContact O-CB 3.14Å; E183-L187 PolarHBondContact O-N 2.67Å
184	E	98.3	Very high	97.7	Very high	56 Å²	56	51.5 Å²	51.5	26%	0.262	28%	0.279	S	S	.	.	H	α-helix	trans	-67.9	-34.7	174.8	-75.3	-62	144.3	0	0	112.6	V89 V180 M182 L187 Y188	V89-E184 HydrophobicContact CB-CB 3.99Å; V89-E184 HydrophobicContact CG2-CB 3.38Å; V89-E184 HydrophobicContact CG2-CG 3.88Å; V180-E184 HydrophobicContact CG1-CG 4.36Å; V180-E184 WeakPolarHBondContact O-CB 3.37Å; V180-E184 WeakPolarHBondContact O-CG 3.32Å; V180-E184 PolarHBondContact O-N 2.83Å; M182-E184 PolarHBondContact O-N 2.94Å; E184-L187 PolarHBondContact O-N 2.98Å; E184-Y188 VanDerWaalsContact O-CB 3.24Å; E184-Y188 WeakPolarHBondContact O-CB 3.13Å; E184-Y188 PolarHBondContact O-N 2.66Å
185	T	98.4	Very high	97.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-42.9	174.2	-62.9	0	0	0	0	111.1	L132 L151 L181 M182 Y188 A189 L197	L132-T185 HydrophobicContact CD1-CG2 4.22Å; L151-T185 HydrophobicContact CD1-CG2 4.07Å; L151-T185 HydrophobicContact CD2-CG2 3.8Å; L151-T185 HydrophobicContact CG-CG2 4.1Å; L181-T185 VanDerWaalsContact O-CB 3.26Å; L181-T185 WeakPolarHBondContact O-CB 3.01Å; L181-T185 PolarHBondContact O-N 2.67Å; L181-T185 PolarHBondContact O-OG1 3.32Å; M182-T185 WeakPolarHBondContact O-CB 3.4Å; M182-T185 PolarHBondContact O-N 3.1Å; M182-T185 VanDerWaalsContact O-N 3.14Å; T185-Y188 PolarHBondContact O-N 3.25Å; T185-A189 PolarHBondContact O-N 3.38Å; T185-L197 HydrophobicContact CG2-CD1 4.28Å
186	E	98.6	Very high	98	Very high	12 Å²	12	52.1 Å²	52.1	6%	0.056	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-51.3	173.2	-69.3	171.7	-162	0	0	110.4	M182 E183 Y188 A189 K190 L197 K309 I311	M182-E186 VanDerWaalsContact O-CG 3.26Å; M182-E186 WeakPolarHBondContact O-CG 3.07Å; M182-E186 PolarHBondContact O-N 3.31Å; E183-E186 WeakPolarHBondContact O-CB 3.48Å; E183-E186 PolarHBondContact O-N 3.12Å; E186-Y188 VanDerWaalsContact C-N 3.31Å; E186-Y188 PolarHBondContact O-N 3.32Å; E186-A189 WeakPolarHBondContact O-CB 3.35Å; E186-A189 PolarHBondContact O-N 3.28Å; E186-A189 VanDerWaalsContact O-N 3.08Å; E186-K190 WeakPolarHBondContact O-CG 3.34Å; E186-K190 PolarHBondContact O-N 3.02Å; E186-L197 HydrophobicContact CB-CD1 4.39Å; E186-L197 HydrophobicContact CG-CD1 3.71Å; E186-K309 WeakPolarHBondContact OE1-CD 3.32Å; E186-K309 IonicContact OE1-NZ 3.38Å; E186-K309 PolarHBondContact OE1-NZ 3.11Å; E186-K309 WeakPolarHBondContact OE2-CE 3.46Å; E186-K309 IonicContact OE2-NZ 3.1Å; E186-K309 PolarHBondContact OE2-NZ 2.79Å; E186-I311 HydrophobicContact CB-CG2 4.02Å; E186-I311 HydrophobicContact CG-CG2 3.8Å
187	L	98.3	Very high	98.1	Very high	71 Å²	71	50.3 Å²	50.3	37%	0.372	24%	0.236	S	C	.	.	H	α-helix	trans	-60.3	-40.6	179.3	-172.4	64.8	0	0	0	111.9	E183 E184 A189 K190 R191	E183-L187 WeakPolarHBondContact O-CB 3.14Å; E183-L187 PolarHBondContact O-N 2.67Å; E184-L187 PolarHBondContact O-N 2.98Å; L187-A189 VanDerWaalsContact C-N 3.34Å; L187-A189 PolarHBondContact O-N 3.33Å; L187-K190 PolarHBondContact O-N 3.39Å; L187-R191 VanDerWaalsContact CG-NH1 3.26Å; L187-R191 WeakPolarHBondContact O-CG 3.1Å; L187-R191 PolarHBondContact O-N 2.84Å
188	Y	98.2	Very high	98.1	Very high	28 Å²	28	49.1 Å²	49.1	11%	0.11	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-43.5	173.5	-179.1	-86.7	0	0	0	112.2	P91 V130 L132 L151 E184 T185 E186 R192	P91-Y188 HydrophobicContact CG-CE2 3.98Å; V130-Y188 HydrophobicContact CG1-CE1 3.83Å; V130-Y188 HydrophobicContact CG2-CE1 4.5Å; L132-Y188 HydrophobicContact CD1-CD1 3.95Å; L132-Y188 HydrophobicContact CD1-CG 3.96Å; L132-Y188 HydrophobicContact CD2-CD1 4.23Å; L132-Y188 HydrophobicContact CD2-CD2 4.01Å; L132-Y188 HydrophobicContact CD2-CE1 4.15Å; L132-Y188 HydrophobicContact CD2-CE2 3.94Å; L132-Y188 HydrophobicContact CD2-CG 4.17Å; L151-Y188 HydrophobicContact CD1-CD1 3.78Å; L151-Y188 HydrophobicContact CD1-CE1 4.17Å; E184-Y188 VanDerWaalsContact O-CB 3.24Å; E184-Y188 WeakPolarHBondContact O-CB 3.13Å; E184-Y188 PolarHBondContact O-N 2.66Å; T185-Y188 PolarHBondContact O-N 3.25Å; E186-Y188 VanDerWaalsContact C-N 3.31Å; E186-Y188 PolarHBondContact O-N 3.32Å; Y188-R192 WeakPolarHBondContact O-CG 3.38Å; Y188-R192 PolarHBondContact OH-NH1 3Å
189	A	98.1	Very high	98	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-44.1	177.1	0	0	0	0	0	112.3	L161 T185 E186 L187 R191 R192 G193 F194 L197 I311	L161-A189 HydrophobicContact CD1-CB 3.8Å; T185-A189 PolarHBondContact O-N 3.38Å; E186-A189 WeakPolarHBondContact O-CB 3.35Å; E186-A189 PolarHBondContact O-N 3.28Å; E186-A189 VanDerWaalsContact O-N 3.08Å; L187-A189 VanDerWaalsContact C-N 3.34Å; L187-A189 PolarHBondContact O-N 3.33Å; A189-R191 PolarHBondContact O-N 2.98Å; A189-R192 CarbonylContact O-C 3.46Å; A189-R192 PolarHBondContact O-N 2.91Å; A189-G193 PolarHBondContact O-N 3.29Å; A189-F194 HydrophobicContact CB-CB 4.23Å; A189-F194 PolarHBondContact O-N 3.47Å; A189-F194 VanDerWaalsContact O-N 3.13Å; A189-L197 HydrophobicContact CB-CD2 3.83Å; A189-I311 HydrophobicContact CB-CD1 3.47Å; A189-I311 VanDerWaalsContact CB-CD1 3.47Å
190	K	98.2	Very high	97.8	Very high	95 Å²	95	46 Å²	46	41%	0.413	22%	0.219	S	C	.	.	H	α-helix	trans	-57.9	-46.8	176.8	-68.6	-172.7	-154.7	-141.4	0	111.7	E186 L187 R192 G193 I311	E186-K190 WeakPolarHBondContact O-CG 3.34Å; E186-K190 PolarHBondContact O-N 3.02Å; L187-K190 PolarHBondContact O-N 3.39Å; K190-R192 PolarHBondContact O-N 3.39Å; K190-R192 VanDerWaalsContact O-N 3.09Å; K190-G193 PolarHBondContact O-N 2.99Å; K190-I311 HydrophobicContact CD-CB 4.29Å; K190-I311 WeakPolarHBondContact CD-OXT 3.45Å; K190-I311 WeakPolarHBondContact CE-OXT 3.42Å; K190-I311 HydrophobicContact CG-CB 3.82Å; K190-I311 HydrophobicContact CG-CD1 3.91Å; K190-I311 HydrophobicContact CG-CG1 4.14Å; K190-I311 PolarHBondContact NZ-OXT 3.14Å
191	R	97.8	Very high	97.5	Very high	153 Å²	153	44.6 Å²	44.6	58%	0.577	21%	0.211	S	C	*	.	H	α-helix	trans	-58.4	-23.8	177.1	-76.1	-173.4	-64.5	-115	-3.2	113.3	L187 A189	L187-R191 VanDerWaalsContact CG-NH1 3.26Å; L187-R191 WeakPolarHBondContact O-CG 3.1Å; L187-R191 PolarHBondContact O-N 2.84Å; A189-R191 PolarHBondContact O-N 2.98Å
192	R	96.9	Very high	97.1	Very high	78 Å²	78	48 Å²	48	29%	0.294	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	10.4	178.2	-65.4	173.1	58.2	116.6	12.1	113.1	S126 Y188 A189 K190 F194	S126-R192 PolarHBondContact O-NH1 3.24Å; S126-R192 PolarHBondContact O-NH2 2.77Å; Y188-R192 WeakPolarHBondContact O-CG 3.38Å; Y188-R192 PolarHBondContact OH-NH1 3Å; A189-R192 CarbonylContact O-C 3.46Å; A189-R192 PolarHBondContact O-N 2.91Å; K190-R192 PolarHBondContact O-N 3.39Å; K190-R192 VanDerWaalsContact O-N 3.09Å; R192-F194 HydrophobicContact CB-CD2 3.86Å; R192-F194 HydrophobicContact CB-CE2 4Å
193	G	97.7	Very high	96.6	Very high	56 Å²	56	53 Å²	53	58%	0.577	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	11.8	175.5	0	0	0	0	0	115.2	A189 K190	A189-G193 PolarHBondContact O-N 3.29Å; K190-G193 PolarHBondContact O-N 2.99Å
194	F	98.2	Very high	96.5	Very high	17 Å²	17	53.7 Å²	53.7	8%	0.075	26%	0.256	C	S	.	.			trans	-82.7	144.7	173.9	-66.5	-88.5	0	0	0	110.5	F128 L161 A189 R192	F128-F194 HydrophobicContact CD2-CZ 4.14Å; F128-F194 HydrophobicContact CE2-CD2 4.41Å; F128-F194 HydrophobicContact CE2-CE1 4.38Å; F128-F194 AromaticContact CE2-CE2 3.33Å; F128-F194 HydrophobicContact CE2-CE2 3.33Å; F128-F194 AromaticContact CE2-CZ 3.31Å; F128-F194 HydrophobicContact CE2-CZ 3.31Å; F128-F194 HydrophobicContact CZ-CD2 4.18Å; F128-F194 AromaticContact CZ-CE2 3.5Å; F128-F194 HydrophobicContact CZ-CE2 3.5Å; F128-F194 VanDerWaalsContact CZ-CE2 3.5Å; F128-F194 AromaticContact CZ-CZ 3.82Å; F128-F194 HydrophobicContact CZ-CZ 3.82Å; L161-F194 HydrophobicContact CD1-CB 4.16Å; L161-F194 HydrophobicContact CD1-CD1 4.06Å; L161-F194 HydrophobicContact CD1-CD2 3.8Å; L161-F194 HydrophobicContact CD1-CE1 4.45Å; L161-F194 HydrophobicContact CD1-CE2 4.23Å; L161-F194 HydrophobicContact CD1-CG 3.71Å; L161-F194 HydrophobicContact CD2-CD1 3.72Å; L161-F194 HydrophobicContact CD2-CD2 4.45Å; L161-F194 HydrophobicContact CD2-CE1 3.46Å; L161-F194 VanDerWaalsContact CD2-CE1 3.46Å; L161-F194 HydrophobicContact CD2-CE2 4.25Å; L161-F194 HydrophobicContact CD2-CG 4.21Å; L161-F194 HydrophobicContact CD2-CZ 3.76Å; L161-F194 HydrophobicContact CG-CB 4.25Å; L161-F194 HydrophobicContact CG-CD1 3.48Å; L161-F194 VanDerWaalsContact CG-CD1 3.48Å; L161-F194 HydrophobicContact CG-CD2 4.15Å; L161-F194 HydrophobicContact CG-CE1 3.81Å; L161-F194 HydrophobicContact CG-CE2 4.45Å; L161-F194 HydrophobicContact CG-CG 3.67Å; L161-F194 HydrophobicContact CG-CZ 4.29Å; A189-F194 HydrophobicContact CB-CB 4.23Å; A189-F194 PolarHBondContact O-N 3.47Å; A189-F194 VanDerWaalsContact O-N 3.13Å; R192-F194 HydrophobicContact CB-CD2 3.86Å; R192-F194 HydrophobicContact CB-CE2 4Å
195	K	98.2	Very high	96.3	Very high	140 Å²	140	52 Å²	52	61%	0.609	25%	0.247	S	C	*	.			trans	-114.2	-8.7	-172	-58.5	-177.9	179.6	-177.6	0	113.2	S159 D310 I311	S159-K195 PolarHBondContact O-N 2.86Å; K195-D310 WeakPolarHBondContact O-CA 2.98Å; K195-I311 PolarHBondContact O-N 3.41Å
196	R	98.3	Very high	96.3	Very high	83 Å²	83	57.2 Å²	57.2	31%	0.313	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	136.6	-175.9	-179.1	173	-67.5	-177.6	-4.8	112	S159 S160 L161 H308 K309 D310	S159-R196 PolarHBondContact O-N 3.24Å; S160-R196 WeakPolarHBondContact CA-O 3.25Å; L161-R196 PolarHBondContact N-O 3.28Å; R196-H308 HydrophobicContact CG-CB 4.29Å; R196-K309 WeakPolarHBondContact CA-O 3.34Å; R196-D310 IonicContact CZ-OD1 3.41Å; R196-D310 IonicContact NE-OD1 3.16Å; R196-D310 PolarHBondContact NE-OD1 3.06Å; R196-D310 IonicContact NH2-OD1 2.77Å; R196-D310 PolarHBondContact NH2-OD1 3Å; R196-D310 IonicContact NH2-OD2 3.66Å; R196-D310 PolarHBondContact NH2-OD2 3.26Å; R196-D310 VanDerWaalsContact NH2-OD2 3.16Å
197	L	98.4	Very high	96.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.6	164.7	-63.4	-170.3	0	0	0	109.9	L151 L161 V163 T185 E186 A189 Y213 H308 K309 I311	L151-L197 HydrophobicContact CD2-CD2 4.06Å; L161-L197 HydrophobicContact CB-CD2 3.75Å; L161-L197 HydrophobicContact CD1-CD2 4.28Å; L161-L197 HydrophobicContact CG-CD2 4.49Å; L161-L197 CarbonylContact O-C 3.57Å; L161-L197 WeakPolarHBondContact O-CA 3.42Å; V163-L197 HydrophobicContact CG2-CB 3.94Å; V163-L197 HydrophobicContact CG2-CD1 3.94Å; V163-L197 HydrophobicContact CG2-CD2 4.2Å; V163-L197 HydrophobicContact CG2-CG 4.26Å; T185-L197 HydrophobicContact CG2-CD1 4.28Å; E186-L197 HydrophobicContact CB-CD1 4.39Å; E186-L197 HydrophobicContact CG-CD1 3.71Å; A189-L197 HydrophobicContact CB-CD2 3.83Å; L197-Y213 HydrophobicContact CB-CE1 4.19Å; L197-Y213 WeakPolarHBondContact CD1-OH 3.48Å; L197-H308 CarbonylContact O-C 3.54Å; L197-H308 WeakPolarHBondContact O-CA 3.26Å; L197-H308 WeakPolarHBondContact O-CB 3.49Å; L197-K309 PolarHBondContact N-O 3.29Å; L197-K309 PolarHBondContact O-N 2.81Å; L197-I311 HydrophobicContact CD2-CD1 4.11Å; L197-I311 HydrophobicContact CG-CD1 3.9Å; L197-I311 HydrophobicContact CG-CG1 4.49Å; L197-I311 HydrophobicContact CG-CG2 4.35Å
198	C	97.3	Very high	96.2	Very high	4 Å²	4	57.6 Å²	57.6	3%	0.027	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	148.5	173.2	-60.2	0	0	0	0	109.4	L161 F162 V163 V219 M307	L161-C198 PolarHBondContact O-N 2.92Å; F162-C198 CarbonylContact C-O 3.5Å; F162-C198 VanDerWaalsContact CA-O 3.3Å; F162-C198 WeakPolarHBondContact CA-O 3.3Å; F162-C198 HydrophobicContact CD2-CB 3.81Å; F162-C198 WeakPolarHBondContact CD2-O 3.2Å; F162-C198 HydrophobicContact CE2-CB 4.36Å; V163-C198 PolarHBondContact N-O 2.9Å; C198-V219 HydrophobicContact CB-CG2 3.7Å; C198-M307 CarbonylContact C-O 3.47Å; C198-M307 WeakPolarHBondContact CA-O 3.42Å
199	L	96	Very high	96.2	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	169.7	176	62.9	82.8	0	0	0	111.6	V163 M182 T201 Y208 Y213 M307	V163-L199 HydrophobicContact CB-CB 4.18Å; M182-L199 HydrophobicContact CE-CD2 4.36Å; L199-T201 HydrophobicContact CD1-CG2 4.5Å; L199-Y208 HydrophobicContact CD1-CD1 4.4Å; L199-Y208 HydrophobicContact CD1-CD2 3.83Å; L199-Y208 HydrophobicContact CD1-CE1 4.46Å; L199-Y208 HydrophobicContact CD1-CE2 3.9Å; L199-Y208 HydrophobicContact CD1-CG 4.1Å; L199-Y208 HydrophobicContact CD2-CD1 3.5Å; L199-Y208 HydrophobicContact CD2-CD2 4.4Å; L199-Y208 HydrophobicContact CD2-CE1 3.44Å; L199-Y208 VanDerWaalsContact CD2-CE1 3.44Å; L199-Y208 HydrophobicContact CD2-CE2 4.35Å; L199-Y208 HydrophobicContact CD2-CG 4Å; L199-Y213 HydrophobicContact CD2-CD1 3.8Å; L199-Y213 HydrophobicContact CD2-CE1 3.45Å; L199-Y213 VanDerWaalsContact CD2-CE1 3.45Å; L199-Y213 HydrophobicContact CD2-CG 4.5Å; L199-Y213 HydrophobicContact CG-CD1 4.15Å; L199-Y213 HydrophobicContact CG-CE1 4.06Å; L199-M307 HydrophobicContact CD1-CB 3.95Å; L199-M307 HydrophobicContact CD1-CG 4.33Å; L199-M307 HydrophobicContact CD1-SD 4.48Å; L199-M307 HydrophobicContact CG-CB 4.33Å; L199-M307 PolarHBondContact N-O 3.31Å; L199-M307 PolarHBondContact O-N 3.25Å
200	T	93.5	Very high	96.2	Very high	46 Å²	46	64.1 Å²	64.1	28%	0.282	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	145.3	168.4	52.9	0	0	0	0	111.1	F162 I304 F305 W306	F162-T200 HydrophobicContact CE2-CG2 4.33Å; F162-T200 HydrophobicContact CZ-CG2 3.87Å; T200-I304 HydrophobicContact CG2-CD1 3.93Å; T200-I304 HydrophobicContact CG2-CG1 4.26Å; T200-F305 CarbonylContact C-O 3.51Å; T200-F305 VanDerWaalsContact CA-O 3.25Å; T200-F305 WeakPolarHBondContact CA-O 3.42Å; T200-W306 HydrophobicContact CG2-CD2 3.35Å; T200-W306 VanDerWaalsContact CG2-CE2 3.43Å; T200-W306 HydrophobicContact CG2-CE3 3.46Å; T200-W306 VanDerWaalsContact CG2-CE3 3.46Å; T200-W306 HydrophobicContact CG2-CG 4.02Å; T200-W306 HydrophobicContact CG2-CH2 3.73Å; T200-W306 HydrophobicContact CG2-CZ2 3.64Å; T200-W306 HydrophobicContact CG2-CZ3 3.66Å
201	T	92.2	Very high	96.2	Very high	10 Å²	10	60.3 Å²	60.3	6%	0.061	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	151.5	172.3	-172.8	0	0	0	0	111.2	L199 K204 Q205 Y208 F305 M307	L199-T201 HydrophobicContact CD1-CG2 4.5Å; T201-K204 WeakPolarHBondContact OG1-CA 3.2Å; T201-K204 WeakPolarHBondContact OG1-CB 3.27Å; T201-K204 PolarHBondContact OG1-N 3.46Å; T201-Q205 HydrophobicContact CG2-CB 3.87Å; T201-Y208 HydrophobicContact CG2-CD2 4Å; T201-Y208 HydrophobicContact CG2-CE2 4.24Å; T201-F305 HydrophobicContact CG2-CB 4.04Å; T201-F305 PolarHBondContact N-O 3.21Å; T201-F305 PolarHBondContact O-N 3.28Å; T201-M307 HydrophobicContact CG2-SD 4.13Å
202	H	89.1	Confident	96.2	Very high	72 Å²	72	55 Å²	55	33%	0.333	28%	0.284	S	S	.	.	S	Bend	trans	-94	-35.7	173.9	-71.7	-74.1	0	0	0	112.2	D298 P303	H202-D298 IonicContact CE1-OD2 3.31Å; H202-D298 PolarHBondContact CE1-OD2 2.99Å; H202-D298 VanDerWaalsContact CE1-OD2 3.31Å; H202-D298 IonicContact NE2-OD2 3.71Å; H202-P303 PolarHBondContact ND1-O 2.83Å
203	D	89.4	Confident	96.2	Very high	103 Å²	103	51.6 Å²	51.6	55%	0.551	27%	0.271	S	S	*	.	S	Bend	trans	-143.6	2.1	-165.2	70.3	-37.5	0	0	0	114
204	K	94.5	Very high	96.3	Very high	103 Å²	103	52.7 Å²	52.7	45%	0.448	27%	0.267	S	S	.	.			trans	-112.7	17.5	-178.5	-53.5	-54.9	-178.6	-138.8	0	113.6	T201 H206 F207 Y208	T201-K204 WeakPolarHBondContact OG1-CA 3.2Å; T201-K204 WeakPolarHBondContact OG1-CB 3.27Å; T201-K204 PolarHBondContact OG1-N 3.46Å; K204-H206 VanDerWaalsContact C-N 3.26Å; K204-H206 PolarHBondContact O-N 3.46Å; K204-F207 HydrophobicContact CB-CB 4.35Å; K204-F207 WeakPolarHBondContact O-CB 3.42Å; K204-F207 PolarHBondContact O-N 3.38Å; K204-Y208 HydrophobicContact CB-CD2 4.12Å; K204-Y208 HydrophobicContact CB-CE2 3.82Å; K204-Y208 WeakPolarHBondContact O-CD2 3.2Å; K204-Y208 PolarHBondContact O-N 3.25Å; K204-Y208 VanDerWaalsContact O-N 3.12Å
205	Q	95.7	Very high	96.1	Very high	20 Å²	20	54 Å²	54	9%	0.093	27%	0.274	C	S	.	.	H	α-helix	trans	-58.7	-35.6	-178.3	67.7	-76	9.3	0	0	112.9	T201 Y208 A209 L291 F305 M307	T201-Q205 HydrophobicContact CG2-CB 3.87Å; Q205-Y208 PolarHBondContact O-N 3.1Å; Q205-A209 VanDerWaalsContact O-CB 3.25Å; Q205-A209 WeakPolarHBondContact O-CB 3.35Å; Q205-A209 PolarHBondContact O-N 3.42Å; Q205-L291 HydrophobicContact CB-CD2 4.06Å; Q205-L291 HydrophobicContact CG-CB 4.2Å; Q205-L291 HydrophobicContact CG-CD2 4.01Å; Q205-L291 WeakPolarHBondContact CG-O 3.38Å; Q205-L291 PolarHBondContact NE2-O 3.08Å; Q205-F305 HydrophobicContact CB-CB 4.18Å; Q205-F305 HydrophobicContact CB-CD1 4.46Å; Q205-F305 HydrophobicContact CB-CD2 4.23Å; Q205-F305 HydrophobicContact CB-CG 4.04Å; Q205-F305 HydrophobicContact CG-CD1 4.35Å; Q205-F305 HydrophobicContact CG-CD2 4.19Å; Q205-F305 HydrophobicContact CG-CE1 4.47Å; Q205-F305 HydrophobicContact CG-CE2 4.31Å; Q205-F305 HydrophobicContact CG-CG 4.22Å; Q205-F305 HydrophobicContact CG-CZ 4.45Å; Q205-M307 HydrophobicContact CB-CE 4.5Å; Q205-M307 HydrophobicContact CB-SD 3.84Å
206	H	97.4	Very high	95.8	Very high	109 Å²	109	48 Å²	48	51%	0.505	25%	0.25	S	C	.	.	H	α-helix	trans	-68.5	-36.4	175	-68.8	-75.8	0	0	0	113.1	K204 A209 H210	K204-H206 VanDerWaalsContact C-N 3.26Å; K204-H206 PolarHBondContact O-N 3.46Å; H206-A209 PolarHBondContact O-N 3.19Å; H206-H210 WeakPolarHBondContact O-CB 3.43Å; H206-H210 PolarHBondContact O-N 3.24Å
207	F	97.3	Very high	95.4	Very high	73 Å²	73	48.7 Å²	48.7	32%	0.32	26%	0.263	S	S	.	.	H	α-helix	trans	-61.8	-48.4	174.3	162.4	-97.9	0	0	0	110.5	M182 K204 H210 L211	M182-F207 HydrophobicContact CG-CE1 4.33Å; M182-F207 HydrophobicContact CG-CZ 4.36Å; K204-F207 HydrophobicContact CB-CB 4.35Å; K204-F207 WeakPolarHBondContact O-CB 3.42Å; K204-F207 PolarHBondContact O-N 3.38Å; F207-H210 PolarHBondContact O-N 3.44Å; F207-L211 HydrophobicContact CD1-CD1 4.45Å; F207-L211 HydrophobicContact CE1-CD1 3.74Å; F207-L211 HydrophobicContact CE2-CD1 4.09Å; F207-L211 HydrophobicContact CZ-CD1 3.53Å; F207-L211 HydrophobicContact CZ-CG 4.44Å; F207-L211 PolarHBondContact O-N 3.47Å
208	Y	98.1	Very high	94.9	Very high	19 Å²	19	50.3 Å²	50.3	8%	0.075	27%	0.274	C	S	.	.	H	α-helix	trans	-68.2	-37.6	178.4	-66.4	-66.4	0	0	0	112.4	M182 L199 T201 K204 Q205 H210 L211 G212 Y213 M307	M182-Y208 HydrophobicContact CE-CE1 4.14Å; M182-Y208 HydrophobicContact CG-CE1 4.46Å; M182-Y208 HydrophobicContact SD-CE1 4.14Å; L199-Y208 HydrophobicContact CD1-CD1 4.4Å; L199-Y208 HydrophobicContact CD1-CD2 3.83Å; L199-Y208 HydrophobicContact CD1-CE1 4.46Å; L199-Y208 HydrophobicContact CD1-CE2 3.9Å; L199-Y208 HydrophobicContact CD1-CG 4.1Å; L199-Y208 HydrophobicContact CD2-CD1 3.5Å; L199-Y208 HydrophobicContact CD2-CD2 4.4Å; L199-Y208 HydrophobicContact CD2-CE1 3.44Å; L199-Y208 VanDerWaalsContact CD2-CE1 3.44Å; L199-Y208 HydrophobicContact CD2-CE2 4.35Å; L199-Y208 HydrophobicContact CD2-CG 4Å; T201-Y208 HydrophobicContact CG2-CD2 4Å; T201-Y208 HydrophobicContact CG2-CE2 4.24Å; K204-Y208 HydrophobicContact CB-CD2 4.12Å; K204-Y208 HydrophobicContact CB-CE2 3.82Å; K204-Y208 WeakPolarHBondContact O-CD2 3.2Å; K204-Y208 PolarHBondContact O-N 3.25Å; K204-Y208 VanDerWaalsContact O-N 3.12Å; Q205-Y208 PolarHBondContact O-N 3.1Å; Y208-H210 VanDerWaalsContact C-N 3.28Å; Y208-H210 PolarHBondContact O-N 3.25Å; Y208-L211 CarbonylContact O-C 3.59Å; Y208-L211 WeakPolarHBondContact O-CA 3.49Å; Y208-L211 WeakPolarHBondContact O-CB 3.25Å; Y208-L211 PolarHBondContact O-N 3Å; Y208-G212 PolarHBondContact O-N 2.96Å; Y208-Y213 HydrophobicContact CD1-CD2 4.32Å; Y208-Y213 HydrophobicContact CD1-CE2 4.44Å; Y208-Y213 WeakPolarHBondContact O-CB 3.46Å; Y208-Y213 PolarHBondContact O-N 3.07Å; Y208-M307 HydrophobicContact CD2-SD 4.38Å; Y208-M307 HydrophobicContact CG-SD 4.46Å
209	A	97.8	Very high	94.4	Very high	32 Å²	32	51.5 Å²	51.5	26%	0.264	28%	0.281	S	S	.	.	H	α-helix	trans	-58.7	-41.3	174.2	0	0	0	0	0	111.9	Q205 H206 L211 G212 Y213 L291 M307	Q205-A209 VanDerWaalsContact O-CB 3.25Å; Q205-A209 WeakPolarHBondContact O-CB 3.35Å; Q205-A209 PolarHBondContact O-N 3.42Å; H206-A209 PolarHBondContact O-N 3.19Å; A209-L211 PolarHBondContact O-N 3.44Å; A209-G212 PolarHBondContact O-N 2.8Å; A209-Y213 WeakPolarHBondContact CA-O 3.46Å; A209-L291 HydrophobicContact CB-CD1 3.93Å; A209-L291 HydrophobicContact CB-CD2 4.11Å; A209-M307 HydrophobicContact CB-CE 4.27Å
210	H	97.8	Very high	93.8	Very high	132 Å²	132	52.1 Å²	52.1	61%	0.611	28%	0.284	S	S	*	.	H	α-helix	trans	-65.9	-22.7	174.8	-172.7	75.1	0	0	0	113.4	R179 H206 F207 Y208 G212	R179-H210 PolarHBondContact NH2-CD2 3.19Å; R179-H210 PolarHBondContact NH2-NE2 2.89Å; H206-H210 WeakPolarHBondContact O-CB 3.43Å; H206-H210 PolarHBondContact O-N 3.24Å; F207-H210 PolarHBondContact O-N 3.44Å; Y208-H210 VanDerWaalsContact C-N 3.28Å; Y208-H210 PolarHBondContact O-N 3.25Å; H210-G212 VanDerWaalsContact C-N 3.29Å
211	L	97.8	Very high	93.3	Very high	15 Å²	15	50.4 Å²	50.4	8%	0.079	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	2.8	170.7	-61.2	-178.3	0	0	0	113.2	R179 M182 F207 Y208 A209 Y213 K309	R179-L211 HydrophobicContact CB-CD2 4.11Å; R179-L211 HydrophobicContact CG-CD2 3.79Å; M182-L211 HydrophobicContact CB-CD1 3.66Å; M182-L211 HydrophobicContact CG-CD1 3.74Å; F207-L211 HydrophobicContact CD1-CD1 4.45Å; F207-L211 HydrophobicContact CE1-CD1 3.74Å; F207-L211 HydrophobicContact CE2-CD1 4.09Å; F207-L211 HydrophobicContact CZ-CD1 3.53Å; F207-L211 HydrophobicContact CZ-CG 4.44Å; F207-L211 PolarHBondContact O-N 3.47Å; Y208-L211 CarbonylContact O-C 3.59Å; Y208-L211 WeakPolarHBondContact O-CA 3.49Å; Y208-L211 WeakPolarHBondContact O-CB 3.25Å; Y208-L211 PolarHBondContact O-N 3Å; A209-L211 PolarHBondContact O-N 3.44Å; L211-Y213 HydrophobicContact CB-CD2 4.17Å; L211-Y213 HydrophobicContact CB-CE2 4.47Å; L211-K309 WeakPolarHBondContact O-CD 3.32Å; L211-K309 VanDerWaalsContact O-CE 3.32Å; L211-K309 WeakPolarHBondContact O-CE 3.34Å; L211-K309 PolarHBondContact O-NZ 2.93Å
212	G	98.3	Very high	92.6	Very high	43 Å²	43	55.6 Å²	55.6	44%	0.443	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	13.8	179.6	0	0	0	0	0	114.8	Y208 A209 H210	Y208-G212 PolarHBondContact O-N 2.96Å; A209-G212 PolarHBondContact O-N 2.8Å; H210-G212 VanDerWaalsContact C-N 3.29Å
213	Y	98.2	Very high	91.2	Very high	5 Å²	5	54.6 Å²	54.6	2%	0.02	31%	0.305	C	S	.	.			trans	-76.1	141.2	168.5	-74.3	-106.1	0	0	0	110.7	M182 L197 L199 Y208 A209 L211 M307 H308 K309	M182-Y213 HydrophobicContact CE-CE2 3.95Å; M182-Y213 WeakPolarHBondContact CE-OH 3.35Å; L197-Y213 HydrophobicContact CB-CE1 4.19Å; L197-Y213 WeakPolarHBondContact CD1-OH 3.48Å; L199-Y213 HydrophobicContact CD2-CD1 3.8Å; L199-Y213 HydrophobicContact CD2-CE1 3.45Å; L199-Y213 VanDerWaalsContact CD2-CE1 3.45Å; L199-Y213 HydrophobicContact CD2-CG 4.5Å; L199-Y213 HydrophobicContact CG-CD1 4.15Å; L199-Y213 HydrophobicContact CG-CE1 4.06Å; Y208-Y213 HydrophobicContact CD1-CD2 4.32Å; Y208-Y213 HydrophobicContact CD1-CE2 4.44Å; Y208-Y213 WeakPolarHBondContact O-CB 3.46Å; Y208-Y213 PolarHBondContact O-N 3.07Å; A209-Y213 WeakPolarHBondContact CA-O 3.46Å; L211-Y213 HydrophobicContact CB-CD2 4.17Å; L211-Y213 HydrophobicContact CB-CE2 4.47Å; Y213-M307 HydrophobicContact CD1-CB 4.3Å; Y213-H308 CarbonylContact C-O 3.51Å; Y213-H308 WeakPolarHBondContact CA-O 3.26Å; Y213-H308 VanDerWaalsContact CD1-C 3.48Å; Y213-K309 HydrophobicContact CD1-CB 3.64Å; Y213-K309 HydrophobicContact CD2-CB 3.9Å; Y213-K309 HydrophobicContact CD2-CD 3.85Å; Y213-K309 HydrophobicContact CD2-CG 4.49Å; Y213-K309 HydrophobicContact CE1-CB 3.66Å; Y213-K309 HydrophobicContact CE2-CB 3.92Å; Y213-K309 HydrophobicContact CE2-CD 3.71Å; Y213-K309 HydrophobicContact CE2-CG 4.49Å; Y213-K309 HydrophobicContact CG-CB 3.75Å
214	V	97.8	Very high	89.5	Confident	80 Å²	80	51.6 Å²	51.6	49%	0.485	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	156.8	175.4	-59.5	0	0	0	0	110.3	M307 H308	V214-M307 CarbonylContact O-C 3.49Å; V214-M307 WeakPolarHBondContact O-CA 3.4Å; V214-M307 WeakPolarHBondContact O-CB 3.5Å; V214-H308 WeakPolarHBondContact CG2-CE1 3.36Å; V214-H308 PolarHBondContact N-O 2.91Å; V214-H308 PolarHBondContact O-N 3.09Å
215	L	96	Very high	87.4	Confident	45 Å²	45	50.5 Å²	50.5	24%	0.236	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	147.5	176.6	-63.4	163.8	0	0	0	110.6	Q289 T290 L291 F305 W306 M307	L215-Q289 HydrophobicContact CB-CG 4.26Å; L215-Q289 HydrophobicContact CD1-CB 4.27Å; L215-Q289 HydrophobicContact CD1-CG 4.02Å; L215-Q289 WeakPolarHBondContact CD1-O 3.32Å; L215-Q289 HydrophobicContact CD2-CG 4.1Å; L215-Q289 HydrophobicContact CG-CG 4.35Å; L215-T290 WeakPolarHBondContact CD1-O 3.25Å; L215-L291 HydrophobicContact CD1-CD2 4.32Å; L215-L291 HydrophobicContact CD2-CD2 4.11Å; L215-L291 HydrophobicContact CG-CD2 4.24Å; L215-F305 HydrophobicContact CD2-CB 4.39Å; L215-F305 HydrophobicContact CD2-CD1 3.95Å; L215-W306 WeakPolarHBondContact CA-O 3.49Å; L215-M307 HydrophobicContact CD2-CG 4.29Å
216	S	91.4	Very high	84.9	Confident	14 Å²	14	54.1 Å²	54.1	10%	0.098	31%	0.314	C	S	.	.			trans	-145.1	168.5	-171.9	86.5	0	0	0	0	113.1	Q289 W306 M307 H308	S216-Q289 PolarHBondContact O-OE1 2.73Å; S216-W306 PolarHBondContact N-O 3.07Å; S216-W306 VanDerWaalsContact O-CB 3.26Å; S216-W306 WeakPolarHBondContact O-CB 3.48Å; S216-M307 PolarHBondContact OG-N 3.16Å; S216-H308 WeakPolarHBondContact CB-ND1 3.32Å
217	T	89.1	Confident	82.5	Confident	97 Å²	97	50.8 Å²	50.8	60%	0.595	31%	0.305	S	S	*	.			trans	-76.2	159.1	166.3	57.5	0	0	0	0	111.3
218	P	88.3	Confident	80.1	Confident	33 Å²	33	54.1 Å²	54.1	21%	0.214	33%	0.326	C	S	.	.			trans	-60.2	143.4	175.4	-25.1	34.2	0	0	0	113	Y296 W306	P218-Y296 VanDerWaalsContact CD-CE1 3.48Å; P218-Y296 WeakPolarHBondContact CD-OH 3.5Å; P218-Y296 HydrophobicContact CG-CD1 3.58Å; P218-Y296 HydrophobicContact CG-CD2 4.34Å; P218-Y296 HydrophobicContact CG-CE1 3.38Å; P218-Y296 HydrophobicContact CG-CE2 4.16Å; P218-Y296 HydrophobicContact CG-CG 4.08Å; P218-W306 VanDerWaalsContact CA-CD2 3.46Å; P218-W306 HydrophobicContact CB-CD2 3.96Å; P218-W306 HydrophobicContact CB-CE3 4.41Å; P218-W306 HydrophobicContact CB-CG 4.37Å; P218-W306 HydrophobicContact CB-CH2 4.33Å; P218-W306 HydrophobicContact CB-CZ2 3.86Å; P218-W306 HydrophobicContact CG-CD2 4.33Å; P218-W306 HydrophobicContact CG-CG 4.24Å
219	V	86.4	Confident	77.7	Confident	29 Å²	29	56 Å²	56	18%	0.176	34%	0.337	C	S	.	.			trans	-129.2	158.1	172.1	-59.4	0	0	0	0	110.4	V154 F162 C198 W306	V154-V219 HydrophobicContact CG1-CB 3.8Å; V154-V219 HydrophobicContact CG1-CG1 4.41Å; V154-V219 HydrophobicContact CG1-CG2 4.17Å; V154-V219 HydrophobicContact CG2-CG2 4.29Å; F162-V219 HydrophobicContact CD2-CG2 3.65Å; F162-V219 HydrophobicContact CE2-CG2 3.98Å; C198-V219 HydrophobicContact CB-CG2 3.7Å; V219-W306 HydrophobicContact CB-CZ3 4.4Å; V219-W306 HydrophobicContact CG2-CE3 4.19Å; V219-W306 HydrophobicContact CG2-CZ3 3.7Å; V219-W306 WeakPolarHBondContact O-CH2 3.11Å; V219-W306 WeakPolarHBondContact O-CZ3 2.91Å
220	Q	84.5	Confident	75.6	Confident	14 Å²	14	58.4 Å²	58.4	7%	0.065	35%	0.35	C	S	.	.			trans	-103.4	121.7	-178	-173.6	179.6	18	0	0	110.4	V154 V155 M226 L229 L234	V154-Q220 CarbonylContact C-O 3.57Å; V154-Q220 WeakPolarHBondContact CA-O 3.3Å; V155-Q220 HydrophobicContact CB-CB 4.08Å; V155-Q220 HydrophobicContact CB-CG 4.27Å; V155-Q220 HydrophobicContact CG2-CB 4.1Å; V155-Q220 HydrophobicContact CG2-CG 3.82Å; V155-Q220 PolarHBondContact N-O 3.28Å; Q220-M226 PolarHBondContact NE2-O 2.87Å; Q220-L229 PolarHBondContact NE2-O 3.25Å; Q220-L234 HydrophobicContact CB-CD1 4.18Å; Q220-L234 HydrophobicContact CG-CD1 3.67Å; Q220-L234 VanDerWaalsContact NE2-CD1 3.28Å
221	S	81.8	Confident	73.4	Confident	10 Å²	10	56.2 Å²	56.2	7%	0.07	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-74	131.5	172	169.6	0	0	0	0	110.4	T152 E164 G223 A224	T152-S221 WeakPolarHBondContact CB-OG 3.38Å; T152-S221 PolarHBondContact OG1-OG 2.77Å; E164-S221 WeakPolarHBondContact OE1-CB 3.33Å; E164-S221 PolarHBondContact OE1-OG 2.6Å; S221-G223 PolarHBondContact O-N 3.31Å; S221-G223 PolarHBondContact OG-N 3.35Å; S221-A224 PolarHBondContact O-N 2.85Å
222	K	77.3	Confident	71.3	Confident	119 Å²	119	57.3 Å²	57.3	52%	0.517	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.7	172.8	-71.5	-163.2	-174.7	-176.1	0	112.8	R153 V154 V155	R153-K222 HydrophobicContact CB-CB 4.15Å; R153-K222 HydrophobicContact CB-CD 3.7Å; R153-K222 HydrophobicContact CB-CG 3.99Å; R153-K222 WeakPolarHBondContact O-CB 3.36Å; R153-K222 WeakPolarHBondContact O-CG 3.31Å; R153-K222 PolarHBondContact O-N 3.46Å; V154-K222 WeakPolarHBondContact O-CE 3.45Å; V155-K222 HydrophobicContact CB-CG 4.5Å; V155-K222 HydrophobicContact CG2-CB 4.5Å; V155-K222 HydrophobicContact CG2-CG 3.64Å
223	G	60.6	Low	69.1	Low	52 Å²	52	59.8 Å²	59.8	54%	0.536	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-15	178.7	0	0	0	0	0	114.5	S221	S221-G223 PolarHBondContact O-N 3.31Å; S221-G223 PolarHBondContact OG-N 3.35Å
224	A	54.4	Low	67.1	Low	40 Å²	40	61.5 Å²	61.5	33%	0.331	37%	0.371	S	S	.	.	S	Bend	trans	-81.4	141.4	175.8	0	0	0	0	0	110.2	S221 M226 A227	S221-A224 PolarHBondContact O-N 2.85Å; A224-M226 HydrophobicContact CB-CB 4Å; A224-M226 HydrophobicContact CB-CG 4.42Å; A224-M226 PolarHBondContact O-N 3.48Å; A224-A227 VanDerWaalsContact O-CB 3.26Å; A224-A227 WeakPolarHBondContact O-CB 3.34Å; A224-A227 PolarHBondContact O-N 2.87Å
225	V	48.6	Very low	65	Low	80 Å²	80	61.3 Å²	61.3	49%	0.485	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-53.5	-23.7	169.3	-178.8	0	0	0	0	111.1	A227 L228	V225-A227 PolarHBondContact O-N 3.31Å; V225-A227 VanDerWaalsContact O-N 3.14Å; V225-L228 PolarHBondContact O-N 2.9Å
226	M	44.6	Very low	62.8	Low	95 Å²	95	67.1 Å²	67.1	47%	0.468	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-58.6	-17.1	171.3	-63.6	-56.2	-166.9	0	0	114.6	Q220 A224 L228 L229 L234	Q220-M226 PolarHBondContact NE2-O 2.87Å; A224-M226 HydrophobicContact CB-CB 4Å; A224-M226 HydrophobicContact CB-CG 4.42Å; A224-M226 PolarHBondContact O-N 3.48Å; M226-L228 PolarHBondContact O-N 3.41Å; M226-L229 PolarHBondContact O-N 2.76Å; M226-L229 HydrophobicContact SD-CD1 3.66Å; M226-L234 HydrophobicContact CB-CD2 4.2Å; M226-L234 HydrophobicContact CG-CD2 4.3Å; M226-L234 HydrophobicContact SD-CD2 4.17Å
227	A	46.6	Very low	60.8	Low	39 Å²	39	72.2 Å²	72.2	32%	0.322	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-57	-15.3	176.2	0	0	0	0	0	113.8	V155 A224 V225	V155-A227 HydrophobicContact CG2-CB 4.45Å; A224-A227 VanDerWaalsContact O-CB 3.26Å; A224-A227 WeakPolarHBondContact O-CB 3.34Å; A224-A227 PolarHBondContact O-N 2.87Å; V225-A227 PolarHBondContact O-N 3.31Å; V225-A227 VanDerWaalsContact O-N 3.14Å
228	L	46.4	Very low	58.6	Low	144 Å²	144	69.4 Å²	69.4	75%	0.754	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-87.5	-11.1	175.5	-58.7	177.6	0	0	0	113.8	V225 M226	V225-L228 PolarHBondContact O-N 2.9Å; M226-L228 PolarHBondContact O-N 3.41Å
229	L	47.8	Very low	56.4	Low	57 Å²	57	75.5 Å²	75.5	30%	0.298	41%	0.413	S	S	.	.	S	Bend	trans	-92.5	133.1	176.8	-64.7	179	0	0	0	110.5	Q220 M226 M233 L234 L237	Q220-L229 PolarHBondContact NE2-O 3.25Å; M226-L229 PolarHBondContact O-N 2.76Å; M226-L229 HydrophobicContact SD-CD1 3.66Å; L229-M233 HydrophobicContact CD2-CE 4.47Å; L229-L234 HydrophobicContact CD1-CD2 4.34Å; L229-L237 HydrophobicContact CD1-CD1 4.46Å
230	P	53.2	Low	54	Low	84 Å²	84	77.6 Å²	77.6	55%	0.545	43%	0.434	S	S	.	.			trans	-55.1	140	170.7	-24.9	33.6	0	0	0	111.7	G232 M233 L234	P230-G232 PolarHBondContact O-N 3.33Å; P230-M233 HydrophobicContact CG-SD 4.33Å; P230-M233 WeakPolarHBondContact O-CB 3.4Å; P230-M233 PolarHBondContact O-N 2.91Å; P230-L234 PolarHBondContact O-N 3.41Å
231	T	52.8	Low	51.8	Low	85 Å²	85	82.9 Å²	82.9	52%	0.521	47%	0.469	S	S	.	.	H	α-helix	trans	-54.6	-33.3	-176.5	-43.8	0	0	0	0	112.9	M233 L234 M235	T231-M233 VanDerWaalsContact C-N 3.26Å; T231-M233 PolarHBondContact O-N 2.82Å; T231-L234 PolarHBondContact O-N 3.16Å; T231-M235 WeakPolarHBondContact O-CG 3.13Å; T231-M235 PolarHBondContact O-N 2.84Å; T231-M235 VanDerWaalsContact O-N 3.09Å
232	G	53.5	Low	49.5	Very low	39 Å²	39	90 Å²	90	40%	0.402	51%	0.506	S	S	.	.	H	α-helix	trans	-67.9	-17.3	176.2	0	0	0	0	0	115.3	P230 R236	P230-G232 PolarHBondContact O-N 3.33Å; G232-R236 WeakPolarHBondContact O-CG 3.14Å; G232-R236 PolarHBondContact O-NH1 2.85Å; G232-R236 VanDerWaalsContact O-NH1 3.09Å
233	M	52.5	Low	47.6	Very low	95 Å²	95	88.8 Å²	88.8	47%	0.468	52%	0.519	S	S	.	.	H	α-helix	trans	-86.3	-36.3	171.2	-69.8	176.5	70.4	0	0	111.2	L229 P230 T231 M235 R236 L237	L229-M233 HydrophobicContact CD2-CE 4.47Å; P230-M233 HydrophobicContact CG-SD 4.33Å; P230-M233 WeakPolarHBondContact O-CB 3.4Å; P230-M233 PolarHBondContact O-N 2.91Å; T231-M233 VanDerWaalsContact C-N 3.26Å; T231-M233 PolarHBondContact O-N 2.82Å; M233-M235 VanDerWaalsContact C-N 3.34Å; M233-M235 PolarHBondContact O-N 3.33Å; M233-R236 WeakPolarHBondContact O-CB 3.19Å; M233-R236 PolarHBondContact O-N 3.42Å; M233-R236 VanDerWaalsContact O-N 3.1Å; M233-L237 WeakPolarHBondContact O-CG 3.38Å; M233-L237 PolarHBondContact O-N 3.1Å
234	L	55.4	Low	46.3	Very low	40 Å²	40	95.1 Å²	95.1	21%	0.209	54%	0.535	C	S	.	.	H	α-helix	trans	-62	-42.1	173.3	-69.3	177.9	0	0	0	112.2	Q220 M226 L229 P230 T231 R236 L237 S238	Q220-L234 HydrophobicContact CB-CD1 4.18Å; Q220-L234 HydrophobicContact CG-CD1 3.67Å; Q220-L234 VanDerWaalsContact NE2-CD1 3.28Å; M226-L234 HydrophobicContact CB-CD2 4.2Å; M226-L234 HydrophobicContact CG-CD2 4.3Å; M226-L234 HydrophobicContact SD-CD2 4.17Å; L229-L234 HydrophobicContact CD1-CD2 4.34Å; P230-L234 PolarHBondContact O-N 3.41Å; T231-L234 PolarHBondContact O-N 3.16Å; L234-R236 PolarHBondContact O-N 3.01Å; L234-L237 HydrophobicContact CD2-CD1 4.38Å; L234-L237 PolarHBondContact O-N 3Å; L234-L237 VanDerWaalsContact O-N 3.08Å; L234-S238 PolarHBondContact O-N 2.86Å; L234-S238 PolarHBondContact O-OG 3.26Å
235	M	53.8	Low	45.3	Very low	76 Å²	76	98 Å²	98	37%	0.374	56%	0.559	S	S	.	*	H	α-helix	trans	-62.9	-25.9	175	-69.8	-61.6	-69.3	0	0	113.1	T231 M233 S238 R239	T231-M235 WeakPolarHBondContact O-CG 3.13Å; T231-M235 PolarHBondContact O-N 2.84Å; T231-M235 VanDerWaalsContact O-N 3.09Å; M233-M235 VanDerWaalsContact C-N 3.34Å; M233-M235 PolarHBondContact O-N 3.33Å; M235-S238 WeakPolarHBondContact CA-OG 3.28Å; M235-S238 PolarHBondContact O-OG 2.79Å; M235-S238 VanDerWaalsContact O-OG 3.04Å; M235-R239 WeakPolarHBondContact O-CG 3.44Å
236	R	50.3	Low	44.3	Very low	167 Å²	167	101.5 Å²	101.5	63%	0.63	57%	0.574	S	S	*	*	H	α-helix	trans	-78.3	-34.4	173.4	-74.2	179.6	172.9	101.9	-9.6	112	G232 M233 L234 S238 R239	G232-R236 WeakPolarHBondContact O-CG 3.14Å; G232-R236 PolarHBondContact O-NH1 2.85Å; G232-R236 VanDerWaalsContact O-NH1 3.09Å; M233-R236 WeakPolarHBondContact O-CB 3.19Å; M233-R236 PolarHBondContact O-N 3.42Å; M233-R236 VanDerWaalsContact O-N 3.1Å; L234-R236 PolarHBondContact O-N 3.01Å; R236-S238 VanDerWaalsContact C-N 3.33Å; R236-R239 PolarHBondContact O-N 3.12Å
237	L	48.2	Very low	44	Very low	122 Å²	122	102.5 Å²	102.5	64%	0.639	59%	0.588	S	S	*	*	H	α-helix	trans	-73	-26	176.5	-65.9	169.6	0	0	0	112.7	L229 M233 L234 R239	L229-L237 HydrophobicContact CD1-CD1 4.46Å; M233-L237 WeakPolarHBondContact O-CG 3.38Å; M233-L237 PolarHBondContact O-N 3.1Å; L234-L237 HydrophobicContact CD2-CD1 4.38Å; L234-L237 PolarHBondContact O-N 3Å; L234-L237 VanDerWaalsContact O-N 3.08Å; L237-R239 VanDerWaalsContact C-N 3.32Å
238	S	44.7	Very low	43.3	Very low	37 Å²	37	106 Å²	106	26%	0.259	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.1	-6.4	173.3	62.1	0	0	0	0	114	L234 M235 R236	L234-S238 PolarHBondContact O-N 2.86Å; L234-S238 PolarHBondContact O-OG 3.26Å; M235-S238 WeakPolarHBondContact CA-OG 3.28Å; M235-S238 PolarHBondContact O-OG 2.79Å; M235-S238 VanDerWaalsContact O-OG 3.04Å; R236-S238 VanDerWaalsContact C-N 3.33Å
239	R	41.4	Very low	42.6	Very low	161 Å²	161	108.7 Å²	108.7	61%	0.608	62%	0.616	S	S	*	*	S	Bend	trans	-80.4	128.6	174.3	-77.6	170.1	-179.4	157.6	-0.2	108.5	M235 R236 L237	M235-R239 WeakPolarHBondContact O-CG 3.44Å; R236-R239 PolarHBondContact O-N 3.12Å; L237-R239 VanDerWaalsContact C-N 3.32Å
240	A	36.6	Very low	41.8	Very low	74 Å²	74	115.3 Å²	115.3	61%	0.612	65%	0.645	S	S	*	*			trans	-54.2	137.4	171.4	0	0	0	0	0	109.5	N242	A240-N242 PolarHBondContact O-N 2.83Å; A240-N242 VanDerWaalsContact O-N 3.09Å
241	P	36.8	Very low	40.5	Very low	124 Å²	124	117.7 Å²	117.7	81%	0.805	66%	0.658	S	S	*	*			trans	-68.3	107.2	162.2	13.3	-2.1	0	0	0	106.2	A243	P241-A243 PolarHBondContact O-N 3.11Å; P241-A243 VanDerWaalsContact O-N 3.11Å
242	N	33.5	Very low	39.8	Very low	159 Å²	159	118.9 Å²	118.9	85%	0.85	67%	0.668	S	S	*	*			trans	-61.3	117.5	161.4	-85.9	-4.3	0	0	0	106.7	A240 E244	A240-N242 PolarHBondContact O-N 2.83Å; A240-N242 VanDerWaalsContact O-N 3.09Å; N242-E244 PolarHBondContact O-N 3.42Å
243	A	37	Very low	38.5	Very low	94 Å²	94	123.2 Å²	123.2	78%	0.777	69%	0.687	S	S	*	*			trans	-63.8	117.5	171.1	0	0	0	0	0	108.5	P241	P241-A243 PolarHBondContact O-N 3.11Å; P241-A243 VanDerWaalsContact O-N 3.11Å
244	E	34	Very low	37.2	Very low	186 Å²	186	128.7 Å²	128.7	87%	0.869	70%	0.702	S	S	*	*			trans	-166.8	73.5	138	-105.5	176.5	-166.2	0	0	108.4	N242	N242-E244 PolarHBondContact O-N 3.42Å
245	A	34.2	Very low	35.8	Very low	101 Å²	101	133.3 Å²	133.3	84%	0.835	72%	0.724	S	S	*	*			trans	-109.7	86.2	154.3	0	0	0	0	0	106.1
246	N	27.9	Very low	34.6	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	74%	0.744	S	S	*	*			trans	-90.7	126	166.8	-105.1	-25.2	0	0	0	109.2
247	P	37.4	Very low	33.5	Very low	116 Å²	116	137.5 Å²	137.5	75%	0.753	76%	0.755	S	S	*	*			trans	-90.1	116.3	-175.9	33.7	-29.5	0	0	0	110.2
248	S	31.4	Very low	32.7	Very low	114 Å²	114	138.3 Å²	138.3	80%	0.797	76%	0.759	S	S	*	*			trans	-108	95.1	166.4	62.1	0	0	0	0	110.8
249	K	31.5	Very low	32	Very low	199 Å²	199	143.5 Å²	143.5	87%	0.865	78%	0.779	S	S	*	*			trans	36.5	109.9	137.8	-61.3	178.7	-179.2	178.3	0	117.5
250	Q	30.9	Very low	31.3	Very low	196 Å²	196	146.1 Å²	146.1	92%	0.916	79%	0.789	S	S	*	*			trans	-90.8	127.2	152.1	-69.8	178.9	-9.3	0	0	109.3
251	T	26.7	Very low	30.9	Very low	134 Å²	134	147.3 Å²	147.3	82%	0.822	79%	0.793	S	S	*	*			trans	-140.9	139	146.7	-10.8	0	0	0	0	107.6
252	P	38.5	Very low	30.6	Very low	111 Å²	111	146.8 Å²	146.8	72%	0.721	79%	0.792	S	S	*	*			trans	-92.5	162.7	-169.8	36.5	-28.6	0	0	0	111
253	T	24.9	Very low	30.4	Very low	130 Å²	130	146.4 Å²	146.4	80%	0.798	80%	0.795	S	S	*	*			trans	167.5	110.3	135.5	-64.6	0	0	0	0	111
254	R	26.4	Very low	30.2	Very low	209 Å²	209	150.2 Å²	150.2	79%	0.789	80%	0.802	S	S	*	*			trans	46.4	117.1	130.2	-146.4	-164.3	170.2	157.5	-1.6	120.7
255	M	25.4	Very low	30	Very low	138 Å²	138	145 Å²	145	68%	0.68	80%	0.798	S	S	*	*				158.6	136.8	109.8	-85.5	-171.3	-109.6	0	0	111.7
256	E	28.9	Very low	30	Very low	169 Å²	169	148.2 Å²	148.2	79%	0.79	80%	0.8	S	S	*	*			trans	27.8	134.5	140.8	-60.4	168.9	151.3	0	0	117.8
257	D	26.7	Very low	30.9	Very low	161 Å²	161	146.2 Å²	146.2	86%	0.861	80%	0.796	S	S	*	*				-170.1	158.2	63.1	-148.9	-2.9	0	0	0	112.4
258	L	32.5	Very low	30.7	Very low	139 Å²	139	146.1 Å²	146.1	73%	0.728	80%	0.798	S	S	*	*			trans	-108.1	154	178.3	-164.3	76	0	0	0	109.3
259	E	29	Very low	31.6	Very low	146 Å²	146	146 Å²	146	68%	0.682	79%	0.794	S	S	*	*			trans	86.2	140.1	169.9	-45.9	-140	153.6	0	0	115.2
260	R	28	Very low	31.6	Very low	216 Å²	216	142.1 Å²	142.1	82%	0.815	79%	0.792	S	S	*	*			cis	-170.5	154.9	23.7	-143.5	170.6	-147.9	-123.5	-0.8	110.9
261	S	27.8	Very low	32	Very low	99 Å²	99	139.3 Å²	139.3	69%	0.692	78%	0.783	S	S	*	*			trans	83.8	101.3	141.4	-160.2	0	0	0	0	122
262	C	29.1	Very low	32.3	Very low	114 Å²	114	141 Å²	141	77%	0.77	79%	0.787	S	S	*	*				28.9	130.6	122.8	-47.9	0	0	0	0	121.1
263	V	31.1	Very low	32.2	Very low	151 Å²	151	144.2 Å²	144.2	92%	0.915	79%	0.792	S	S	*	*				-166.9	143.8	114.9	-88.7	0	0	0	0	111.8
264	D	31.6	Very low	32.7	Very low	174 Å²	174	145 Å²	145	93%	0.93	79%	0.791	S	S	*	*			trans	-62.1	155.9	-176.4	-69.9	-65.8	0	0	0	116.9
265	G	30.2	Very low	33.2	Very low	77 Å²	77	140.7 Å²	140.7	79%	0.794	79%	0.79	S	S	*	*			trans	159.4	104.5	154.7	0	0	0	0	0	115.7
266	L	34.3	Very low	33.6	Very low	167 Å²	167	142 Å²	142	87%	0.874	80%	0.799	S	S	*	*			trans	-111	148	156.2	-143.7	87.8	0	0	0	106.6
267	P	45.8	Very low	33.8	Very low	111 Å²	111	139.6 Å²	139.6	72%	0.721	80%	0.801	S	S	*	*				-149.1	162.4	67	36.8	-15	0	0	0	118.1
268	S	33.2	Very low	34.2	Very low	113 Å²	113	138.2 Å²	138.2	79%	0.79	79%	0.793	S	S	*	*			trans	84.8	158.9	138.1	-93.2	0	0	0	0	122.9
269	P	51.5	Low	34.9	Very low	111 Å²	111	136.6 Å²	136.6	72%	0.721	79%	0.791	S	S	*	*				-121.5	164.4	-122.6	41.9	-29.1	0	0	0	114.6
270	S	30.8	Very low	35.6	Very low	118 Å²	118	135.6 Å²	135.6	83%	0.825	80%	0.797	S	S	*	*			trans	174.8	104	149.6	-77.7	0	0	0	0	108.1
271	N	39	Very low	36	Very low	137 Å²	137	132.6 Å²	132.6	73%	0.733	79%	0.792	S	S	*	*				65.9	86.8	93.3	-158.4	12.4	0	0	0	113.8
272	L	33.4	Very low	36.8	Very low	170 Å²	170	137.8 Å²	137.8	89%	0.89	80%	0.803	S	S	*	*			trans	-147.5	99.1	142.4	-81.5	-177.7	0	0	0	108	N274	L272-N274 PolarHBondContact O-N 2.85Å
273	Q	36.2	Very low	37.2	Very low	179 Å²	179	136 Å²	136	84%	0.836	79%	0.792	S	S	*	*			trans	-68	116.5	164	-72.8	171.2	-34.7	0	0	108.6
274	N	35	Very low	37.6	Very low	146 Å²	146	132.6 Å²	132.6	78%	0.781	79%	0.787	S	S	*	*			trans	-107.5	133	153.6	-100.4	37.2	0	0	0	107.8	L272 L276	L272-N274 PolarHBondContact O-N 2.85Å; N274-L276 PolarHBondContact O-N 3.41Å
275	P	38.7	Very low	38.3	Very low	118 Å²	118	129.8 Å²	129.8	77%	0.766	77%	0.772	S	S	*	*			trans	-66.9	124.5	-178	2.6	7.5	0	0	0	109.5	S277	P275-S277 PolarHBondContact O-N 3.04Å
276	L	32.5	Very low	39.5	Very low	166 Å²	166	130.9 Å²	130.9	87%	0.869	77%	0.765	S	S	*	*			trans	-52.2	113.4	160.2	-78.4	157.4	0	0	0	107.7	N274 L278	N274-L276 PolarHBondContact O-N 3.41Å; L276-L278 PolarHBondContact O-N 2.91Å
277	S	34.3	Very low	40.7	Very low	119 Å²	119	127.3 Å²	127.3	83%	0.832	75%	0.75	S	S	*	*			trans	-53.8	106.4	166.9	-42.7	0	0	0	0	107.5	P275	P275-S277 PolarHBondContact O-N 3.04Å
278	L	34.7	Very low	41.9	Very low	132 Å²	132	128.5 Å²	128.5	69%	0.691	75%	0.749	S	S	*	*			trans	-49.8	138.9	169.2	-77.6	130.4	0	0	0	108.4	L276	L276-L278 PolarHBondContact O-N 2.91Å
279	P	46.3	Very low	44.4	Very low	104 Å²	104	124.8 Å²	124.8	68%	0.675	72%	0.719	S	S	*	*			trans	-52	141.7	164	24.5	-32	0	0	0	107.5	Q281	P279-Q281 PolarHBondContact O-N 3.31Å
280	P	43.1	Very low	46.3	Very low	125 Å²	125	121.8 Å²	121.8	81%	0.812	70%	0.699	S	S	*	*			trans	-52.1	113.2	-175.9	19.9	-29.9	0	0	0	107.8	F282	P280-F282 PolarHBondContact O-N 2.84Å
281	Q	38	Very low	49.2	Very low	154 Å²	154	118.8 Å²	118.8	72%	0.72	67%	0.673	S	S	*	*			trans	-50.4	134.6	169	-70.4	-178.2	-41.9	0	0	105.6	P279 S283	P279-Q281 PolarHBondContact O-N 3.31Å; Q281-S283 PolarHBondContact O-N 3.13Å
282	F	43.4	Very low	51.6	Low	207 Å²	207	117.2 Å²	117.2	91%	0.908	67%	0.669	S	S	*	*			trans	-53.8	91.8	169.2	-88.7	-93.8	0	0	0	108.1	P280 G284	P280-F282 PolarHBondContact O-N 2.84Å; F282-G284 PolarHBondContact O-N 3.48Å
283	S	37.2	Very low	54.3	Low	77 Å²	77	115.6 Å²	115.6	54%	0.538	66%	0.656	S	S	.	*			trans	-64.1	113.7	154.8	42.3	0	0	0	0	104	Q281 D285	Q281-S283 PolarHBondContact O-N 3.13Å; S283-D285 PolarHBondContact O-N 3.31Å; S283-D285 PolarHBondContact OG-OD2 3.24Å; S283-D285 VanDerWaalsContact OG-OD2 3.07Å
284	G	41.4	Very low	56.7	Low	79 Å²	79	107.5 Å²	107.5	81%	0.814	62%	0.619	S	S	*	*			trans	-65.9	64.4	161.6	0	0	0	0	0	108.2	F282	F282-G284 PolarHBondContact O-N 3.48Å
285	D	45.8	Very low	59.2	Low	116 Å²	116	103.2 Å²	103.2	62%	0.62	60%	0.6	S	S	*	*			trans	-57.1	126.2	173.5	-75.7	-38.7	0	0	0	105.8	S283 V287	S283-D285 PolarHBondContact O-N 3.31Å; S283-D285 PolarHBondContact OG-OD2 3.24Å; S283-D285 VanDerWaalsContact OG-OD2 3.07Å; D285-V287 PolarHBondContact O-N 3.09Å
286	P	55.1	Low	61.4	Low	100 Å²	100	98.9 Å²	98.9	65%	0.649	57%	0.568	S	S	*	*			trans	-54.5	123.4	175.2	23	-30.4	0	0	0	105.5	I288	P286-I288 WeakPolarHBondContact O-CG1 3.48Å; P286-I288 PolarHBondContact O-N 2.87Å
287	V	59.1	Low	63.9	Low	92 Å²	92	95.9 Å²	95.9	56%	0.558	55%	0.545	S	S	*	.			trans	-62.3	95.3	173.1	170.4	0	0	0	0	105.9	D285 Q289 P295	D285-V287 PolarHBondContact O-N 3.09Å; V287-Q289 PolarHBondContact O-N 3.09Å; V287-P295 HydrophobicContact CG1-CB 3.98Å; V287-P295 HydrophobicContact CG1-CG 3.38Å
288	I	72.1	Confident	66.1	Low	135 Å²	135	91.7 Å²	91.7	69%	0.692	51%	0.513	S	S	*	.			trans	-72.6	101.6	-178.5	-61.3	175	0	0	0	106.3	P286 T290	P286-I288 WeakPolarHBondContact O-CG1 3.48Å; P286-I288 PolarHBondContact O-N 2.87Å; I288-T290 HydrophobicContact CG2-CG2 4.14Å
289	Q	83.9	Confident	68.1	Low	35 Å²	35	90.9 Å²	90.9	16%	0.164	53%	0.526	C	S	.	.			trans	-102.9	128.4	170.5	-163	-177.8	-8.4	0	0	107.7	L215 S216 V287 W306	L215-Q289 HydrophobicContact CB-CG 4.26Å; L215-Q289 HydrophobicContact CD1-CB 4.27Å; L215-Q289 HydrophobicContact CD1-CG 4.02Å; L215-Q289 WeakPolarHBondContact CD1-O 3.32Å; L215-Q289 HydrophobicContact CD2-CG 4.1Å; L215-Q289 HydrophobicContact CG-CG 4.35Å; S216-Q289 PolarHBondContact O-OE1 2.73Å; V287-Q289 PolarHBondContact O-N 3.09Å; Q289-W306 PolarHBondContact NE2-O 2.68Å
290	T	91.4	Very high	69.4	Low	49 Å²	49	93.8 Å²	93.8	30%	0.301	52%	0.523	S	S	.	.			trans	-117.5	176.6	172.9	68.4	0	0	0	0	109.3	L215 I288 T292 E293 F305	L215-T290 WeakPolarHBondContact CD1-O 3.25Å; I288-T290 HydrophobicContact CG2-CG2 4.14Å; T290-T292 PolarHBondContact O-N 3.25Å; T290-T292 PolarHBondContact OG1-N 3.03Å; T290-T292 PolarHBondContact OG1-OG1 3.1Å; T290-E293 PolarHBondContact N-O 3.47Å; T290-E293 PolarHBondContact OG1-N 3Å; T290-F305 VanDerWaalsContact O-CE1 3.29Å; T290-F305 WeakPolarHBondContact O-CE1 3.41Å
291	L	91.9	Very high	71.2	Confident	54 Å²	54	90.1 Å²	90.1	28%	0.283	51%	0.508	S	S	.	.	S	Bend	trans	-72.9	-7.6	173	-68.2	176.2	0	0	0	112.6	Q205 A209 L215 M307	Q205-L291 HydrophobicContact CB-CD2 4.06Å; Q205-L291 HydrophobicContact CG-CB 4.2Å; Q205-L291 HydrophobicContact CG-CD2 4.01Å; Q205-L291 WeakPolarHBondContact CG-O 3.38Å; Q205-L291 PolarHBondContact NE2-O 3.08Å; A209-L291 HydrophobicContact CB-CD1 3.93Å; A209-L291 HydrophobicContact CB-CD2 4.11Å; L215-L291 HydrophobicContact CD1-CD2 4.32Å; L215-L291 HydrophobicContact CD2-CD2 4.11Å; L215-L291 HydrophobicContact CG-CD2 4.24Å; L291-M307 HydrophobicContact CD2-CE 4.19Å
292	T	89.6	Confident	73.4	Confident	105 Å²	105	85.6 Å²	85.6	64%	0.644	49%	0.491	S	S	*	.	S	Bend	trans	-107.4	-27.4	176.9	53.6	0	0	0	0	112.3	T290	T290-T292 PolarHBondContact O-N 3.25Å; T290-T292 PolarHBondContact OG1-N 3.03Å; T290-T292 PolarHBondContact OG1-OG1 3.1Å
293	E	90.3	Very high	75.4	Confident	135 Å²	135	78.5 Å²	78.5	63%	0.631	47%	0.466	S	S	*	.			trans	-131.1	138.5	-174.2	-64.4	-179.6	-177.8	0	0	111.8	T290	T290-E293 PolarHBondContact N-O 3.47Å; T290-E293 PolarHBondContact OG1-N 3Å
294	T	86.6	Confident	77.9	Confident	9 Å²	9	75.7 Å²	75.7	6%	0.055	45%	0.445	C	S	.	.			trans	-137.9	144.7	178.6	171.5	0	0	0	0	108.9	Y296 R297 P303 I304 F305	T294-Y296 WeakPolarHBondContact OG1-CD2 3.29Å; T294-Y296 PolarHBondContact OG1-N 3.04Å; T294-Y296 VanDerWaalsContact OG1-N 3.12Å; T294-R297 PolarHBondContact O-NH1 2.97Å; T294-P303 HydrophobicContact CG2-CB 3.71Å; T294-I304 VanDerWaalsContact CG2-O 3.27Å; T294-I304 WeakPolarHBondContact CG2-O 3.39Å; T294-I304 PolarHBondContact OG1-O 3.17Å; T294-F305 HydrophobicContact CG2-CD1 4.03Å; T294-F305 HydrophobicContact CG2-CD2 4.4Å; T294-F305 HydrophobicContact CG2-CE1 3.82Å; T294-F305 HydrophobicContact CG2-CE2 4.22Å; T294-F305 HydrophobicContact CG2-CG 4.31Å; T294-F305 HydrophobicContact CG2-CZ 3.92Å
295	P	87.7	Confident	80.2	Confident	57 Å²	57	72.3 Å²	72.3	37%	0.37	41%	0.407	S	S	.	.	S	Bend	trans	-75.1	-17.6	170.7	37.9	-45.3	0	0	0	112	V287	V287-P295 HydrophobicContact CG1-CB 3.98Å; V287-P295 HydrophobicContact CG1-CG 3.38Å
296	Y	85.9	Confident	82.5	Confident	26 Å²	26	68.7 Å²	68.7	10%	0.102	39%	0.385	C	S	.	.			trans	-87.4	144.4	-169	-54	-61.3	0	0	0	110.6	P218 T294 P303 I304 W306	P218-Y296 VanDerWaalsContact CD-CE1 3.48Å; P218-Y296 WeakPolarHBondContact CD-OH 3.5Å; P218-Y296 HydrophobicContact CG-CD1 3.58Å; P218-Y296 HydrophobicContact CG-CD2 4.34Å; P218-Y296 HydrophobicContact CG-CE1 3.38Å; P218-Y296 HydrophobicContact CG-CE2 4.16Å; P218-Y296 HydrophobicContact CG-CG 4.08Å; T294-Y296 WeakPolarHBondContact OG1-CD2 3.29Å; T294-Y296 PolarHBondContact OG1-N 3.04Å; T294-Y296 VanDerWaalsContact OG1-N 3.12Å; Y296-P303 WeakPolarHBondContact O-CA 3.16Å; Y296-I304 PolarHBondContact O-N 2.96Å; Y296-I304 VanDerWaalsContact O-N 3.11Å; Y296-W306 AromaticContact CD2-CD1 3.57Å; Y296-W306 HydrophobicContact CD2-CG 4.43Å; Y296-W306 AromaticContact CG-CD1 3.76Å
297	R	84.6	Confident	84.5	Confident	104 Å²	104	63.9 Å²	63.9	39%	0.392	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-129.6	144.9	-179.3	-60.2	-65.8	-179.3	-93	-0.6	109.9	T294 G301 V302	T294-R297 PolarHBondContact O-NH1 2.97Å; R297-G301 VanDerWaalsContact CD-O 3.32Å; R297-G301 WeakPolarHBondContact CD-O 3.41Å; R297-V302 CarbonylContact C-O 3.58Å; R297-V302 VanDerWaalsContact CA-O 3.32Å; R297-V302 WeakPolarHBondContact CA-O 3.46Å
298	D	80.8	Confident	86.3	Confident	30 Å²	30	61.2 Å²	61.2	16%	0.16	34%	0.335	C	S	.	.			trans	-75.6	-179.1	167.3	76.8	-1.5	0	0	0	111.2	H202 R300 G301 V302	H202-D298 IonicContact CE1-OD2 3.31Å; H202-D298 PolarHBondContact CE1-OD2 2.99Å; H202-D298 VanDerWaalsContact CE1-OD2 3.31Å; H202-D298 IonicContact NE2-OD2 3.71Å; D298-R300 PolarHBondContact O-N 3.34Å; D298-R300 VanDerWaalsContact OD1-CA 3.32Å; D298-R300 WeakPolarHBondContact OD1-CA 3.27Å; D298-R300 WeakPolarHBondContact OD1-CB 3.49Å; D298-R300 PolarHBondContact OD1-N 3.02Å; D298-R300 IonicContact OD2-CZ 3.41Å; D298-R300 IonicContact OD2-NE 3.13Å; D298-R300 PolarHBondContact OD2-NE 2.74Å; D298-R300 VanDerWaalsContact OD2-NE 3.13Å; D298-R300 IonicContact OD2-NH2 2.84Å; D298-R300 PolarHBondContact OD2-NH2 2.67Å; D298-G301 PolarHBondContact O-N 2.88Å; D298-G301 PolarHBondContact OD1-N 2.93Å; D298-V302 PolarHBondContact N-O 2.75Å; D298-V302 WeakPolarHBondContact OD1-CB 3.44Å; D298-V302 PolarHBondContact OD1-N 3.47Å
299	A	75.3	Confident	87.6	Confident	115 Å²	115	56.8 Å²	56.8	95%	0.95	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-12	178.6	0	0	0	0	0	114.4
300	R	74.3	Confident	88.2	Confident	165 Å²	165	59.6 Å²	59.6	62%	0.623	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	3.6	175.9	-61.8	174.7	-66.3	-148.9	-2.2	112.3	D298 V302	D298-R300 PolarHBondContact O-N 3.34Å; D298-R300 VanDerWaalsContact OD1-CA 3.32Å; D298-R300 WeakPolarHBondContact OD1-CA 3.27Å; D298-R300 WeakPolarHBondContact OD1-CB 3.49Å; D298-R300 PolarHBondContact OD1-N 3.02Å; D298-R300 IonicContact OD2-CZ 3.41Å; D298-R300 IonicContact OD2-NE 3.13Å; D298-R300 PolarHBondContact OD2-NE 2.74Å; D298-R300 VanDerWaalsContact OD2-NE 3.13Å; D298-R300 IonicContact OD2-NH2 2.84Å; D298-R300 PolarHBondContact OD2-NH2 2.67Å; R300-V302 VanDerWaalsContact C-N 3.26Å; R300-V302 HydrophobicContact CB-CG2 4.03Å; R300-V302 PolarHBondContact O-N 3.18Å
301	G	81.7	Confident	88.5	Confident	48 Å²	48	59.3 Å²	59.3	50%	0.495	32%	0.324	S	S	.	.	S	Bend	trans	73.7	17.7	-174.2	0	0	0	0	0	113.2	R297 D298	R297-G301 VanDerWaalsContact CD-O 3.32Å; R297-G301 WeakPolarHBondContact CD-O 3.41Å; D298-G301 PolarHBondContact O-N 2.88Å; D298-G301 PolarHBondContact OD1-N 2.93Å
302	V	82.9	Confident	88.3	Confident	60 Å²	60	59.6 Å²	59.6	36%	0.364	33%	0.326	S	S	.	.			trans	-88.1	135.9	177.6	-178.2	0	0	0	0	109.4	R297 D298 R300 I304	R297-V302 CarbonylContact C-O 3.58Å; R297-V302 VanDerWaalsContact CA-O 3.32Å; R297-V302 WeakPolarHBondContact CA-O 3.46Å; D298-V302 PolarHBondContact N-O 2.75Å; D298-V302 WeakPolarHBondContact OD1-CB 3.44Å; D298-V302 PolarHBondContact OD1-N 3.47Å; R300-V302 VanDerWaalsContact C-N 3.26Å; R300-V302 HydrophobicContact CB-CG2 4.03Å; R300-V302 PolarHBondContact O-N 3.18Å; V302-I304 PolarHBondContact O-N 3.04Å
303	P	86.5	Confident	88.3	Confident	58 Å²	58	57.2 Å²	57.2	38%	0.377	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-50.5	135.1	174.3	-27.7	35.4	0	0	0	112.8	H202 T294 Y296	H202-P303 PolarHBondContact ND1-O 2.83Å; T294-P303 HydrophobicContact CG2-CB 3.71Å; Y296-P303 WeakPolarHBondContact O-CA 3.16Å
304	I	88.5	Confident	88.1	Confident	18 Å²	18	52.9 Å²	52.9	9%	0.092	29%	0.291	C	S	.	.			trans	-135.1	132.8	176.5	-165	171.1	0	0	0	110.1	T200 T294 Y296 V302	T200-I304 HydrophobicContact CG2-CD1 3.93Å; T200-I304 HydrophobicContact CG2-CG1 4.26Å; T294-I304 VanDerWaalsContact CG2-O 3.27Å; T294-I304 WeakPolarHBondContact CG2-O 3.39Å; T294-I304 PolarHBondContact OG1-O 3.17Å; Y296-I304 PolarHBondContact O-N 2.96Å; Y296-I304 VanDerWaalsContact O-N 3.11Å; V302-I304 PolarHBondContact O-N 3.04Å
305	F	89.9	Confident	88.2	Confident	7 Å²	7	55.5 Å²	55.5	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	118.8	179.4	-60.6	-89.7	0	0	0	109.1	T200 T201 Q205 L215 T290 T294 M307	T200-F305 CarbonylContact C-O 3.51Å; T200-F305 VanDerWaalsContact CA-O 3.25Å; T200-F305 WeakPolarHBondContact CA-O 3.42Å; T201-F305 HydrophobicContact CG2-CB 4.04Å; T201-F305 PolarHBondContact N-O 3.21Å; T201-F305 PolarHBondContact O-N 3.28Å; Q205-F305 HydrophobicContact CB-CB 4.18Å; Q205-F305 HydrophobicContact CB-CD1 4.46Å; Q205-F305 HydrophobicContact CB-CD2 4.23Å; Q205-F305 HydrophobicContact CB-CG 4.04Å; Q205-F305 HydrophobicContact CG-CD1 4.35Å; Q205-F305 HydrophobicContact CG-CD2 4.19Å; Q205-F305 HydrophobicContact CG-CE1 4.47Å; Q205-F305 HydrophobicContact CG-CE2 4.31Å; Q205-F305 HydrophobicContact CG-CG 4.22Å; Q205-F305 HydrophobicContact CG-CZ 4.45Å; L215-F305 HydrophobicContact CD2-CB 4.39Å; L215-F305 HydrophobicContact CD2-CD1 3.95Å; T290-F305 VanDerWaalsContact O-CE1 3.29Å; T290-F305 WeakPolarHBondContact O-CE1 3.41Å; T294-F305 HydrophobicContact CG2-CD1 4.03Å; T294-F305 HydrophobicContact CG2-CD2 4.4Å; T294-F305 HydrophobicContact CG2-CE1 3.82Å; T294-F305 HydrophobicContact CG2-CE2 4.22Å; T294-F305 HydrophobicContact CG2-CG 4.31Å; T294-F305 HydrophobicContact CG2-CZ 3.92Å; F305-M307 HydrophobicContact CB-CG 4.46Å
306	W	94	Very high	88.3	Confident	40 Å²	40	55.4 Å²	55.4	15%	0.152	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	131.8	166	-70.9	85.7	0	0	0	108.7	F162 T200 L215 S216 P218 V219 Q289 Y296	F162-W306 HydrophobicContact CD2-CZ3 4.3Å; F162-W306 AromaticContact CE2-CE3 3.99Å; F162-W306 HydrophobicContact CE2-CE3 3.99Å; F162-W306 HydrophobicContact CE2-CH2 4.18Å; F162-W306 AromaticContact CE2-CZ3 3.36Å; F162-W306 HydrophobicContact CE2-CZ3 3.36Å; F162-W306 HydrophobicContact CZ-CH2 4.25Å; F162-W306 AromaticContact CZ-CZ3 3.84Å; F162-W306 HydrophobicContact CZ-CZ3 3.84Å; T200-W306 HydrophobicContact CG2-CD2 3.35Å; T200-W306 VanDerWaalsContact CG2-CE2 3.43Å; T200-W306 HydrophobicContact CG2-CE3 3.46Å; T200-W306 VanDerWaalsContact CG2-CE3 3.46Å; T200-W306 HydrophobicContact CG2-CG 4.02Å; T200-W306 HydrophobicContact CG2-CH2 3.73Å; T200-W306 HydrophobicContact CG2-CZ2 3.64Å; T200-W306 HydrophobicContact CG2-CZ3 3.66Å; L215-W306 WeakPolarHBondContact CA-O 3.49Å; S216-W306 PolarHBondContact N-O 3.07Å; S216-W306 VanDerWaalsContact O-CB 3.26Å; S216-W306 WeakPolarHBondContact O-CB 3.48Å; P218-W306 VanDerWaalsContact CA-CD2 3.46Å; P218-W306 HydrophobicContact CB-CD2 3.96Å; P218-W306 HydrophobicContact CB-CE3 4.41Å; P218-W306 HydrophobicContact CB-CG 4.37Å; P218-W306 HydrophobicContact CB-CH2 4.33Å; P218-W306 HydrophobicContact CB-CZ2 3.86Å; P218-W306 HydrophobicContact CG-CD2 4.33Å; P218-W306 HydrophobicContact CG-CG 4.24Å; V219-W306 HydrophobicContact CB-CZ3 4.4Å; V219-W306 HydrophobicContact CG2-CE3 4.19Å; V219-W306 HydrophobicContact CG2-CZ3 3.7Å; V219-W306 WeakPolarHBondContact O-CH2 3.11Å; V219-W306 WeakPolarHBondContact O-CZ3 2.91Å; Q289-W306 PolarHBondContact NE2-O 2.68Å; Y296-W306 AromaticContact CD2-CD1 3.57Å; Y296-W306 HydrophobicContact CD2-CG 4.43Å; Y296-W306 AromaticContact CG-CD1 3.76Å
307	M	96.9	Very high	88.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	151.2	-179.6	-53.5	-173.6	77.5	0	0	110.6	C198 L199 T201 Q205 Y208 A209 Y213 V214 L215 S216 L291 F305	C198-M307 CarbonylContact C-O 3.47Å; C198-M307 WeakPolarHBondContact CA-O 3.42Å; L199-M307 HydrophobicContact CD1-CB 3.95Å; L199-M307 HydrophobicContact CD1-CG 4.33Å; L199-M307 HydrophobicContact CD1-SD 4.48Å; L199-M307 HydrophobicContact CG-CB 4.33Å; L199-M307 PolarHBondContact N-O 3.31Å; L199-M307 PolarHBondContact O-N 3.25Å; T201-M307 HydrophobicContact CG2-SD 4.13Å; Q205-M307 HydrophobicContact CB-CE 4.5Å; Q205-M307 HydrophobicContact CB-SD 3.84Å; Y208-M307 HydrophobicContact CD2-SD 4.38Å; Y208-M307 HydrophobicContact CG-SD 4.46Å; A209-M307 HydrophobicContact CB-CE 4.27Å; Y213-M307 HydrophobicContact CD1-CB 4.3Å; V214-M307 CarbonylContact O-C 3.49Å; V214-M307 WeakPolarHBondContact O-CA 3.4Å; V214-M307 WeakPolarHBondContact O-CB 3.5Å; L215-M307 HydrophobicContact CD2-CG 4.29Å; S216-M307 PolarHBondContact OG-N 3.16Å; L291-M307 HydrophobicContact CD2-CE 4.19Å; F305-M307 HydrophobicContact CB-CG 4.46Å
308	H	97.8	Very high	88.7	Confident	36 Å²	36	54 Å²	54	17%	0.167	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	160	171.9	74.4	-77.1	0	0	0	111.8	R196 L197 Y213 V214 S216	R196-H308 HydrophobicContact CG-CB 4.29Å; L197-H308 CarbonylContact O-C 3.54Å; L197-H308 WeakPolarHBondContact O-CA 3.26Å; L197-H308 WeakPolarHBondContact O-CB 3.49Å; Y213-H308 CarbonylContact C-O 3.51Å; Y213-H308 WeakPolarHBondContact CA-O 3.26Å; Y213-H308 VanDerWaalsContact CD1-C 3.48Å; V214-H308 WeakPolarHBondContact CG2-CE1 3.36Å; V214-H308 PolarHBondContact N-O 2.91Å; V214-H308 PolarHBondContact O-N 3.09Å; S216-H308 WeakPolarHBondContact CB-ND1 3.32Å
309	K	98.4	Very high	89.3	Confident	41 Å²	41	55.8 Å²	55.8	18%	0.178	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	131.4	170.7	-178.7	175.2	174.6	-174.4	0	108.6	E186 R196 L197 L211 Y213 I311	E186-K309 WeakPolarHBondContact OE1-CD 3.32Å; E186-K309 IonicContact OE1-NZ 3.38Å; E186-K309 PolarHBondContact OE1-NZ 3.11Å; E186-K309 WeakPolarHBondContact OE2-CE 3.46Å; E186-K309 IonicContact OE2-NZ 3.1Å; E186-K309 PolarHBondContact OE2-NZ 2.79Å; R196-K309 WeakPolarHBondContact CA-O 3.34Å; L197-K309 PolarHBondContact N-O 3.29Å; L197-K309 PolarHBondContact O-N 2.81Å; L211-K309 WeakPolarHBondContact O-CD 3.32Å; L211-K309 VanDerWaalsContact O-CE 3.32Å; L211-K309 WeakPolarHBondContact O-CE 3.34Å; L211-K309 PolarHBondContact O-NZ 2.93Å; Y213-K309 HydrophobicContact CD1-CB 3.64Å; Y213-K309 HydrophobicContact CD2-CB 3.9Å; Y213-K309 HydrophobicContact CD2-CD 3.85Å; Y213-K309 HydrophobicContact CD2-CG 4.49Å; Y213-K309 HydrophobicContact CE1-CB 3.66Å; Y213-K309 HydrophobicContact CE2-CB 3.92Å; Y213-K309 HydrophobicContact CE2-CD 3.71Å; Y213-K309 HydrophobicContact CE2-CG 4.49Å; Y213-K309 HydrophobicContact CG-CB 3.75Å; K309-I311 HydrophobicContact CG-CG2 4.27Å
310	D	98.2	Very high	90.5	Very high	94 Å²	94	50.9 Å²	50.9	50%	0.503	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	132.1	168.8	-69.2	-26	0	0	0	108.8	K195 R196	K195-D310 WeakPolarHBondContact O-CA 2.98Å; R196-D310 IonicContact CZ-OD1 3.41Å; R196-D310 IonicContact NE-OD1 3.16Å; R196-D310 PolarHBondContact NE-OD1 3.06Å; R196-D310 IonicContact NH2-OD1 2.77Å; R196-D310 PolarHBondContact NH2-OD1 3Å; R196-D310 IonicContact NH2-OD2 3.66Å; R196-D310 PolarHBondContact NH2-OD2 3.26Å; R196-D310 VanDerWaalsContact NH2-OD2 3.16Å
311	I	96.8	Very high	92	Very high	44 Å²	44	40.5 Å²	40.5	23%	0.226	24%	0.235	C	C	.	.			trans	-122.3	0	-170.2	53.8	158	0	0	0	110.9	E186 A189 K190 K195 L197 K309	E186-I311 HydrophobicContact CB-CG2 4.02Å; E186-I311 HydrophobicContact CG-CG2 3.8Å; A189-I311 HydrophobicContact CB-CD1 3.47Å; A189-I311 VanDerWaalsContact CB-CD1 3.47Å; K190-I311 HydrophobicContact CD-CB 4.29Å; K190-I311 WeakPolarHBondContact CD-OXT 3.45Å; K190-I311 WeakPolarHBondContact CE-OXT 3.42Å; K190-I311 HydrophobicContact CG-CB 3.82Å; K190-I311 HydrophobicContact CG-CD1 3.91Å; K190-I311 HydrophobicContact CG-CG1 4.14Å; K190-I311 PolarHBondContact NZ-OXT 3.14Å; K195-I311 PolarHBondContact O-N 3.41Å; L197-I311 HydrophobicContact CD2-CD1 4.11Å; L197-I311 HydrophobicContact CG-CD1 3.9Å; L197-I311 HydrophobicContact CG-CG1 4.49Å; L197-I311 HydrophobicContact CG-CG2 4.35Å; K309-I311 HydrophobicContact CG-CG2 4.27Å

Retrieved 311 of 311 residues in 231 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).