A0A077Z4K8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4K8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 304 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.9	Very low	23.3	Very low	244 Å²	244	142.4 Å²	142.4	100%	1.202	78%	0.775	S	S	*	*				0	97.9	0	-74.9	176.2	174.7	0	0	107.4
2	T	25.5	Very low	23.4	Very low	136 Å²	136	141 Å²	141	83%	0.834	78%	0.775	S	S	*	*			cis	-130.4	129.6	12.5	17.4	0	0	0	0	107.3
3	D	20	Very low	23.5	Very low	151 Å²	151	140.6 Å²	140.6	81%	0.807	77%	0.771	S	S	*	*			trans	-75.8	122.8	175.1	-84.3	-50.3	0	0	0	110.2
4	V	22.2	Very low	24.7	Very low	124 Å²	124	133.7 Å²	133.7	75%	0.752	73%	0.732	S	S	*	*			trans	-95.3	94.3	169	179.6	0	0	0	0	106.9	T6	V4-T6 PolarHBondContact O-N 3.31Å
5	H	21.5	Very low	25.5	Very low	177 Å²	177	135.8 Å²	135.8	82%	0.819	74%	0.735	S	S	*	*			trans	-75.5	102.4	166.7	-90.6	-46.2	0	0	0	109.5	K7	H5-K7 PolarHBondContact O-N 3.09Å
6	T	23.5	Very low	26.3	Very low	124 Å²	124	135.5 Å²	135.5	76%	0.761	73%	0.733	S	S	*	*			trans	-76.9	98.6	161.9	28.1	0	0	0	0	109.1	V4 T8	V4-T6 PolarHBondContact O-N 3.31Å; T6-T8 PolarHBondContact O-N 3.26Å
7	K	21	Very low	27.6	Very low	168 Å²	168	129.3 Å²	129.3	73%	0.73	70%	0.697	S	S	*	*			trans	-66.9	108.6	162.6	-104	-178.1	162	-156.9	0	108.8	H5 E9	H5-K7 PolarHBondContact O-N 3.09Å; K7-E9 IonicContact NZ-OE1 3.49Å; K7-E9 PolarHBondContact NZ-OE1 2.96Å; K7-E9 PolarHBondContact O-N 3.29Å
8	T	23.4	Very low	28.6	Very low	128 Å²	128	127.1 Å²	127.1	79%	0.785	69%	0.685	S	S	*	*			trans	-80.1	95	158.4	13.5	0	0	0	0	107.7	T6	T6-T8 PolarHBondContact O-N 3.26Å
9	E	22.5	Very low	29.3	Very low	136 Å²	136	121.1 Å²	121.1	64%	0.636	65%	0.654	S	S	*	*			trans	-79.9	122.7	164.8	-71.9	178.9	175.5	0	0	107.7	K7	K7-E9 IonicContact NZ-OE1 3.49Å; K7-E9 PolarHBondContact NZ-OE1 2.96Å; K7-E9 PolarHBondContact O-N 3.29Å
10	G	22.3	Very low	29.8	Very low	70 Å²	70	121.3 Å²	121.3	72%	0.722	65%	0.648	S	S	*	*			trans	-68.7	128	-179.3	0	0	0	0	0	110.3	T12	G10-T12 PolarHBondContact O-N 3.1Å
11	F	25.2	Very low	30.3	Very low	108 Å²	108	117.3 Å²	117.3	47%	0.474	63%	0.625	S	S	.	*			trans	-69.7	111.6	168.1	-78.5	-95.9	0	0	0	108.4
12	T	25.3	Very low	31	Very low	126 Å²	126	109.2 Å²	109.2	77%	0.773	58%	0.583	S	S	*	*			trans	-68.4	119.1	165.5	43.3	0	0	0	0	109.4	G10	G10-T12 PolarHBondContact O-N 3.1Å
13	D	24.8	Very low	31.6	Very low	136 Å²	136	104.7 Å²	104.7	73%	0.727	56%	0.556	S	S	*	*			trans	40.1	78.6	158.1	-56.1	-23.7	0	0	0	118.1	E15	D13-E15 VanDerWaalsContact C-N 3.35Å; D13-E15 HydrophobicContact CB-CG 4.36Å
14	L	39.2	Very low	32.6	Very low	44 Å²	44	100.8 Å²	100.8	23%	0.23	53%	0.532	C	S	.	.			trans	-93.7	69	151.2	-76.9	161.4	0	0	0	108.1	D16 F17 Q101	L14-D16 VanDerWaalsContact C-N 3.29Å; L14-F17 HydrophobicContact CB-CD2 4.41Å; L14-F17 HydrophobicContact CB-CE2 3.9Å; L14-F17 HydrophobicContact CD1-CE2 4.07Å; L14-F17 HydrophobicContact CD1-CZ 4.37Å; L14-F17 HydrophobicContact CD2-CE2 4.34Å; L14-F17 HydrophobicContact CD2-CZ 4.31Å; L14-F17 HydrophobicContact CG-CE2 4.34Å; L14-Q101 HydrophobicContact CB-CB 4.31Å; L14-Q101 HydrophobicContact CB-CG 4.43Å
15	E	36.8	Very low	33.7	Very low	165 Å²	165	98.7 Å²	98.7	77%	0.771	51%	0.514	S	S	*	.			trans	-76.5	-11.8	179.8	-71.7	-159	136.1	0	0	113.6	D13	D13-E15 VanDerWaalsContact C-N 3.35Å; D13-E15 HydrophobicContact CB-CG 4.36Å
16	D	39.5	Very low	34.6	Very low	131 Å²	131	97.6 Å²	97.6	70%	0.701	51%	0.51	S	S	*	.			trans	-108	37.4	-168.9	-70.5	-29.8	0	0	0	115.9	L14 N18	L14-D16 VanDerWaalsContact C-N 3.29Å; D16-N18 PolarHBondContact O-N 3.44Å
17	F	47.5	Very low	35.4	Very low	30 Å²	30	93.8 Å²	93.8	13%	0.132	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	101	162.5	-72	-61	0	0	0	110.2	L14 C19 E58 I68 Q101 L102 F129	L14-F17 HydrophobicContact CB-CD2 4.41Å; L14-F17 HydrophobicContact CB-CE2 3.9Å; L14-F17 HydrophobicContact CD1-CE2 4.07Å; L14-F17 HydrophobicContact CD1-CZ 4.37Å; L14-F17 HydrophobicContact CD2-CE2 4.34Å; L14-F17 HydrophobicContact CD2-CZ 4.31Å; L14-F17 HydrophobicContact CG-CE2 4.34Å; F17-C19 VanDerWaalsContact C-N 3.32Å; F17-C19 PolarHBondContact O-N 3.04Å; F17-E58 HydrophobicContact CE1-CB 4.24Å; F17-I68 HydrophobicContact CD1-CD1 3.47Å; F17-I68 VanDerWaalsContact CD1-CD1 3.47Å; F17-I68 HydrophobicContact CD1-CG1 4.46Å; F17-I68 HydrophobicContact CE1-CD1 3.34Å; F17-I68 HydrophobicContact CE1-CG1 4.38Å; F17-I68 HydrophobicContact CG-CD1 4.33Å; F17-I68 HydrophobicContact CZ-CD1 4.08Å; F17-Q101 HydrophobicContact CE2-CB 4.39Å; F17-L102 HydrophobicContact CE2-CD2 4.07Å; F17-L102 HydrophobicContact CZ-CD2 3.82Å; F17-F129 HydrophobicContact CE1-CE1 4.3Å; F17-F129 HydrophobicContact CE1-CZ 4.49Å; F17-F129 AromaticContact CZ-CE1 3.9Å; F17-F129 HydrophobicContact CZ-CE1 3.9Å; F17-F129 HydrophobicContact CZ-CZ 4.28Å
18	N	46	Very low	36.2	Very low	90 Å²	90	90.8 Å²	90.8	48%	0.481	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	84	165.3	-87.7	-44	0	0	0	109.2	D16 K20 I59	D16-N18 PolarHBondContact O-N 3.44Å; N18-K20 PolarHBondContact O-N 3.5Å; N18-I59 HydrophobicContact CB-CD1 3.6Å; N18-I59 HydrophobicContact CB-CG1 4.17Å
19	C	42.2	Very low	37	Very low	13 Å²	13	87.7 Å²	87.7	9%	0.088	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	118.5	164.4	-21.6	0	0	0	0	108.5	F17 Y21 A56 C92	F17-C19 VanDerWaalsContact C-N 3.32Å; F17-C19 PolarHBondContact O-N 3.04Å; C19-Y21 HydrophobicContact CB-CE2 3.82Å; C19-A56 HydrophobicContact CB-CB 4.48Å; C19-C92 HydrophobicContact CB-CB 4.3Å; C19-C92 WeakPolarHBondContact CB-SG 3.41Å; C19-C92 VanDerWaalsContact SG-CA 3.57Å; C19-C92 WeakPolarHBondContact SG-CB 3.31Å; C19-C92 CovalentContact SG-SG 2.03Å; C19-C92 PolarHBondContact SG-SG 2.86Å
20	K	38.8	Very low	37.6	Very low	124 Å²	124	84 Å²	84	54%	0.539	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.7	168.7	-70.9	-173	177.7	-179.2	0	108.2	N18 F55	N18-K20 PolarHBondContact O-N 3.5Å; K20-F55 PolarHBondContact N-O 3.14Å; K20-F55 PolarHBondContact O-N 3.23Å; K20-F55 VanDerWaalsContact O-O 3.08Å
21	Y	39.4	Very low	38.5	Very low	39 Å²	39	83.2 Å²	83.2	15%	0.153	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	114.9	170.1	-62.6	-74.7	0	0	0	108.2	C19 Q54 M91 W95	C19-Y21 HydrophobicContact CB-CE2 3.82Å; Y21-Q54 HydrophobicContact CD1-CB 4.39Å; Y21-Q54 HydrophobicContact CD1-CG 4.41Å; Y21-Q54 HydrophobicContact CE1-CB 4.42Å; Y21-M91 HydrophobicContact CD1-CE 3.54Å; Y21-M91 HydrophobicContact CD2-CB 3.83Å; Y21-M91 HydrophobicContact CD2-CE 3.68Å; Y21-M91 HydrophobicContact CD2-CG 4.35Å; Y21-M91 HydrophobicContact CD2-SD 3.59Å; Y21-M91 VanDerWaalsContact CD2-SD 3.59Å; Y21-M91 HydrophobicContact CE1-CE 3.83Å; Y21-M91 HydrophobicContact CE2-CB 3.17Å; Y21-M91 HydrophobicContact CE2-CE 3.92Å; Y21-M91 HydrophobicContact CE2-CG 4.14Å; Y21-M91 HydrophobicContact CE2-SD 3.96Å; Y21-M91 HydrophobicContact CG-CE 3.45Å; Y21-M91 VanDerWaalsContact CG-CE 3.45Å; Y21-M91 HydrophobicContact CG-SD 3.88Å; Y21-W95 HydrophobicContact CD1-CE3 4.26Å; Y21-W95 HydrophobicContact CD1-CH2 4.05Å; Y21-W95 AromaticContact CD1-CZ3 3.56Å; Y21-W95 HydrophobicContact CD1-CZ3 3.56Å; Y21-W95 HydrophobicContact CE1-CD2 4.24Å; Y21-W95 AromaticContact CE1-CE3 3.2Å; Y21-W95 HydrophobicContact CE1-CE3 3.2Å; Y21-W95 AromaticContact CE1-CH2 3.76Å; Y21-W95 HydrophobicContact CE1-CH2 3.76Å; Y21-W95 AromaticContact CE1-CZ3 2.91Å; Y21-W95 HydrophobicContact CE1-CZ3 2.91Å; Y21-W95 AromaticContact CZ-CE3 3.42Å; Y21-W95 VanDerWaalsContact CZ-CE3 3.42Å; Y21-W95 AromaticContact CZ-CZ3 3.6Å
22	H	43.6	Very low	39.2	Very low	73 Å²	73	78.1 Å²	78.1	34%	0.338	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	93.8	172.4	-73.4	-100	0	0	0	107.2	E25 C53	H22-E25 IonicContact CE1-OE1 3.97Å; H22-E25 IonicContact CG-OE1 2.75Å; H22-E25 IonicContact ND1-OE1 2.9Å; H22-E25 PolarHBondContact ND1-OE1 2.87Å; H22-C53 PolarHBondContact O-N 2.04Å
23	V	39	Very low	40.1	Very low	42 Å²	42	76.7 Å²	76.7	26%	0.255	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	103.2	176.5	-172.6	0	0	0	0	105.7	W84	V23-W84 HydrophobicContact CG1-CB 4.46Å; V23-W84 HydrophobicContact CG2-CB 4.35Å
24	H	40.7	Very low	40.9	Very low	68 Å²	68	74.1 Å²	74.1	32%	0.315	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	84.9	96.6	-177.2	-51.9	-78.9	0	0	0	116.1
25	E	46.5	Very low	40.9	Very low	80 Å²	80	80.6 Å²	80.6	37%	0.374	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	120.7	151.6	-79.9	174.9	-148	0	0	106.1	H22 F27	H22-E25 IonicContact CE1-OE1 3.97Å; H22-E25 IonicContact CG-OE1 2.75Å; H22-E25 IonicContact ND1-OE1 2.9Å; H22-E25 PolarHBondContact ND1-OE1 2.87Å; E25-F27 HydrophobicContact CB-CD1 4.24Å; E25-F27 HydrophobicContact CB-CD2 3.7Å; E25-F27 HydrophobicContact CB-CE1 3.91Å; E25-F27 HydrophobicContact CB-CE2 3.34Å; E25-F27 HydrophobicContact CB-CG 4.16Å; E25-F27 HydrophobicContact CB-CZ 3.47Å; E25-F27 VanDerWaalsContact CB-CZ 3.47Å; E25-F27 HydrophobicContact CG-CE2 4.37Å; E25-F27 HydrophobicContact CG-CZ 4.1Å; E25-F27 WeakPolarHBondContact O-CD2 3.04Å; E25-F27 PolarHBondContact O-N 2.88Å; E25-F27 WeakPolarHBondContact OE2-CE1 3.22Å; E25-F27 WeakPolarHBondContact OE2-CZ 3.03Å
26	E	38.4	Very low	41	Very low	155 Å²	155	73.8 Å²	73.8	72%	0.724	38%	0.376	S	S	*	.			trans	-66.1	91	161.9	-108.8	-173	161.8	0	0	105.8
27	F	40.6	Very low	40.8	Very low	43 Å²	43	69.9 Å²	69.9	19%	0.189	37%	0.367	C	S	.	.			trans	-82	126	174.8	-70.3	-73.8	0	0	0	109.2	E25 V31 L32	E25-F27 HydrophobicContact CB-CD1 4.24Å; E25-F27 HydrophobicContact CB-CD2 3.7Å; E25-F27 HydrophobicContact CB-CE1 3.91Å; E25-F27 HydrophobicContact CB-CE2 3.34Å; E25-F27 HydrophobicContact CB-CG 4.16Å; E25-F27 HydrophobicContact CB-CZ 3.47Å; E25-F27 VanDerWaalsContact CB-CZ 3.47Å; E25-F27 HydrophobicContact CG-CE2 4.37Å; E25-F27 HydrophobicContact CG-CZ 4.1Å; E25-F27 WeakPolarHBondContact O-CD2 3.04Å; E25-F27 PolarHBondContact O-N 2.88Å; E25-F27 WeakPolarHBondContact OE2-CE1 3.22Å; E25-F27 WeakPolarHBondContact OE2-CZ 3.03Å; F27-V31 HydrophobicContact CD1-CB 3.89Å; F27-V31 HydrophobicContact CD1-CG1 3.52Å; F27-V31 HydrophobicContact CE1-CG1 3.81Å; F27-L32 HydrophobicContact CB-CD1 3.74Å; F27-L32 HydrophobicContact CB-CD2 4.2Å; F27-L32 HydrophobicContact CB-CG 3.58Å; F27-L32 HydrophobicContact CD2-CD2 3.98Å; F27-L32 HydrophobicContact CD2-CG 4.31Å; F27-L32 HydrophobicContact CG-CD1 4.5Å; F27-L32 HydrophobicContact CG-CD2 4.12Å; F27-L32 HydrophobicContact CG-CG 4.01Å
28	D	38.3	Very low	40.4	Very low	106 Å²	106	70 Å²	70	57%	0.567	37%	0.369	S	S	*	.			trans	-57.5	139	154.4	-174.6	6.7	0	0	0	108.3	S30 V31 L32	D28-S30 PolarHBondContact O-N 2.85Å; D28-S30 PolarHBondContact OD2-OG 3Å; D28-V31 PolarHBondContact O-N 2.81Å; D28-L32 PolarHBondContact O-N 2.8Å
29	L	40.1	Very low	40.1	Very low	62 Å²	62	75.9 Å²	75.9	33%	0.325	39%	0.386	S	S	.	.	H	α-helix	trans	-52.4	-27.7	179	-88.7	153.4	0	0	0	111.7	L32 Q33 M49	L29-L32 PolarHBondContact O-N 3.17Å; L29-Q33 WeakPolarHBondContact O-CG 3.48Å; L29-Q33 PolarHBondContact O-N 3.12Å; L29-M49 HydrophobicContact CD2-CE 4.38Å
30	S	36.5	Very low	39.8	Very low	58 Å²	58	77.4 Å²	77.4	41%	0.406	40%	0.403	S	S	.	.	H	α-helix	trans	-61.3	-38.5	174	63.1	0	0	0	0	113.6	D28 Q33 A34	D28-S30 PolarHBondContact O-N 2.85Å; D28-S30 PolarHBondContact OD2-OG 3Å; S30-Q33 PolarHBondContact O-N 3.2Å; S30-A34 PolarHBondContact O-N 2.87Å
31	V	40.4	Very low	39.8	Very low	55 Å²	55	75.1 Å²	75.1	33%	0.333	40%	0.4	S	S	.	.	H	α-helix	trans	-75.2	-37.9	179.5	-176.9	0	0	0	0	110.8	F27 D28 Q33 A34 Y35	F27-V31 HydrophobicContact CD1-CB 3.89Å; F27-V31 HydrophobicContact CD1-CG1 3.52Å; F27-V31 HydrophobicContact CE1-CG1 3.81Å; D28-V31 PolarHBondContact O-N 2.81Å; V31-Q33 VanDerWaalsContact C-N 3.31Å; V31-Q33 PolarHBondContact O-N 3.23Å; V31-A34 PolarHBondContact O-N 3.37Å; V31-Y35 HydrophobicContact CG1-CD2 4.04Å; V31-Y35 PolarHBondContact O-N 3.42Å
32	L	40.7	Very low	39.8	Very low	1 Å²	1	79 Å²	79	1%	0.005	43%	0.43	C	S	.	.	H	α-helix	trans	-67.4	-31.4	174.2	-76.1	171.1	0	0	0	112.5	F27 D28 L29 C36 G37 L38 M49 V51	F27-L32 HydrophobicContact CB-CD1 3.74Å; F27-L32 HydrophobicContact CB-CD2 4.2Å; F27-L32 HydrophobicContact CB-CG 3.58Å; F27-L32 HydrophobicContact CD2-CD2 3.98Å; F27-L32 HydrophobicContact CD2-CG 4.31Å; F27-L32 HydrophobicContact CG-CD1 4.5Å; F27-L32 HydrophobicContact CG-CD2 4.12Å; F27-L32 HydrophobicContact CG-CG 4.01Å; D28-L32 PolarHBondContact O-N 2.8Å; L29-L32 PolarHBondContact O-N 3.17Å; L32-C36 HydrophobicContact CD2-CB 4.43Å; L32-C36 VanDerWaalsContact CD2-SG 3.59Å; L32-C36 CarbonylContact O-C 3.48Å; L32-C36 VanDerWaalsContact O-CA 3.28Å; L32-C36 WeakPolarHBondContact O-CA 3.43Å; L32-C36 WeakPolarHBondContact O-CB 3.5Å; L32-C36 PolarHBondContact O-N 3.5Å; L32-G37 PolarHBondContact O-N 2.95Å; L32-L38 HydrophobicContact CB-CB 4.43Å; L32-L38 HydrophobicContact CB-CD1 4Å; L32-L38 HydrophobicContact CD2-CD1 4.09Å; L32-L38 HydrophobicContact CG-CD1 4.43Å; L32-L38 PolarHBondContact O-N 3.06Å; L32-M49 HydrophobicContact CD1-CE 3.12Å; L32-V51 HydrophobicContact CD1-CG2 4.14Å
33	Q	42.6	Very low	39.7	Very low	96 Å²	96	86.6 Å²	86.6	45%	0.449	46%	0.456	S	S	.	.	H	α-helix	trans	-64.3	-44.8	170.9	-82.3	171.9	4	0	0	111.7	L29 S30 V31 G37 L38	L29-Q33 WeakPolarHBondContact O-CG 3.48Å; L29-Q33 PolarHBondContact O-N 3.12Å; S30-Q33 PolarHBondContact O-N 3.2Å; V31-Q33 VanDerWaalsContact C-N 3.31Å; V31-Q33 PolarHBondContact O-N 3.23Å; Q33-G37 PolarHBondContact O-N 3.18Å; Q33-L38 WeakPolarHBondContact CG-O 3.48Å
34	A	42.1	Very low	39.8	Very low	82 Å²	82	88.7 Å²	88.7	68%	0.678	47%	0.466	S	S	*	.	H	α-helix	trans	-71.1	-39.1	-177.3	0	0	0	0	0	113.5	S30 V31	S30-A34 PolarHBondContact O-N 2.87Å; V31-A34 PolarHBondContact O-N 3.37Å
35	Y	38.6	Very low	39.7	Very low	180 Å²	180	90 Å²	90	71%	0.706	49%	0.488	S	S	*	.	H	α-helix	trans	-98.4	-30.2	-176.3	-80.2	-83.8	0	0	0	114.5	V31 W120	V31-Y35 HydrophobicContact CG1-CD2 4.04Å; V31-Y35 PolarHBondContact O-N 3.42Å; Y35-W120 WeakPolarHBondContact O-CH2 3.15Å; Y35-W120 WeakPolarHBondContact O-CZ3 3.33Å
36	C	39.1	Very low	39.5	Very low	21 Å²	21	98.3 Å²	98.3	14%	0.142	52%	0.516	C	S	.	.	H	α-helix	trans	-115.2	1.2	-171.4	-48.1	0	0	0	0	113.6	L32 L38 W120	L32-C36 HydrophobicContact CD2-CB 4.43Å; L32-C36 VanDerWaalsContact CD2-SG 3.59Å; L32-C36 CarbonylContact O-C 3.48Å; L32-C36 VanDerWaalsContact O-CA 3.28Å; L32-C36 WeakPolarHBondContact O-CA 3.43Å; L32-C36 WeakPolarHBondContact O-CB 3.5Å; L32-C36 PolarHBondContact O-N 3.5Å; C36-L38 HydrophobicContact CB-CD1 3.62Å; C36-L38 HydrophobicContact CB-CG 3.91Å; C36-L38 PolarHBondContact O-N 3.04Å; C36-W120 HydrophobicContact CB-CD2 4.25Å; C36-W120 HydrophobicContact CB-CE3 3.63Å; C36-W120 HydrophobicContact CB-CZ3 4.09Å; C36-W120 VanDerWaalsContact SG-CZ3 3.51Å
37	G	36.9	Very low	40	Very low	50 Å²	50	93.2 Å²	93.2	52%	0.515	51%	0.505	S	S	.	.			trans	63.1	21.7	-178.9	0	0	0	0	0	114.4	L32 Q33 Y39	L32-G37 PolarHBondContact O-N 2.95Å; Q33-G37 PolarHBondContact O-N 3.18Å; G37-Y39 WeakPolarHBondContact O-CD2 3.29Å; G37-Y39 PolarHBondContact O-N 3.5Å; G37-Y39 VanDerWaalsContact O-N 3.1Å
38	L	38.6	Very low	40.7	Very low	32 Å²	32	95.9 Å²	95.9	17%	0.168	53%	0.529	C	S	.	.			trans	-81.5	87.6	-173.4	-77.6	164.5	0	0	0	111.8	L32 Q33 C36 G40 L119	L32-L38 HydrophobicContact CB-CB 4.43Å; L32-L38 HydrophobicContact CB-CD1 4Å; L32-L38 HydrophobicContact CD2-CD1 4.09Å; L32-L38 HydrophobicContact CG-CD1 4.43Å; L32-L38 PolarHBondContact O-N 3.06Å; Q33-L38 WeakPolarHBondContact CG-O 3.48Å; C36-L38 HydrophobicContact CB-CD1 3.62Å; C36-L38 HydrophobicContact CB-CG 3.91Å; C36-L38 PolarHBondContact O-N 3.04Å; L38-G40 PolarHBondContact O-N 3.19Å; L38-L119 HydrophobicContact CD1-CB 3.81Å; L38-L119 HydrophobicContact CD1-CD2 4.42Å; L38-L119 HydrophobicContact CD2-CB 4.08Å; L38-L119 HydrophobicContact CD2-CD2 4.1Å; L38-L119 VanDerWaalsContact CD2-O 3.31Å; L38-L119 WeakPolarHBondContact CD2-O 3.33Å
39	Y	40.2	Very low	41.9	Very low	214 Å²	214	92 Å²	92	84%	0.839	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-61.1	120.4	165.2	-63.8	-84	0	0	0	109.3	G37 T41	G37-Y39 WeakPolarHBondContact O-CD2 3.29Å; G37-Y39 PolarHBondContact O-N 3.5Å; G37-Y39 VanDerWaalsContact O-N 3.1Å; Y39-T41 PolarHBondContact O-N 2.56Å
40	G	35.6	Very low	43.2	Very low	44 Å²	44	91.9 Å²	91.9	45%	0.454	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-57.3	126	-176.9	0	0	0	0	0	110.8	L38	L38-G40 PolarHBondContact O-N 3.19Å
41	T	38.7	Very low	45	Very low	76 Å²	76	89.2 Å²	89.2	47%	0.466	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-67.4	139.2	167.7	47.9	0	0	0	0	109	Y39 W43	Y39-T41 PolarHBondContact O-N 2.56Å; T41-W43 PolarHBondContact O-N 2.75Å
42	P	39.1	Very low	46.8	Very low	121 Å²	121	87.8 Å²	87.8	79%	0.786	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	3.1	-168.9	-22.7	31.9	0	0	0	117.3
43	W	40.5	Very low	48.6	Very low	232 Å²	232	88 Å²	88	88%	0.879	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-1.2	-166.3	-80.1	68.5	0	0	0	115.8	T41	T41-W43 PolarHBondContact O-N 2.75Å
44	N	40.9	Very low	50.6	Low	86 Å²	86	84.2 Å²	84.2	46%	0.46	46%	0.462	S	S	.	.			trans	-124.7	41.7	-178.5	-75.9	-6.6	0	0	0	113.7	R46	N44-R46 PolarHBondContact O-N 3.32Å
45	A	39	Very low	52.2	Low	96 Å²	96	82.5 Å²	82.5	79%	0.793	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	6.6	-176.2	0	0	0	0	0	115.9
46	R	42.6	Very low	54.1	Low	255 Å²	255	74 Å²	74	96%	0.962	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.7	16.5	-179.7	-70.3	-167.2	-170.2	-177.9	3.4	116.9	N44	N44-R46 PolarHBondContact O-N 3.32Å
47	G	49.3	Very low	55.8	Low	47 Å²	47	74 Å²	74	49%	0.485	41%	0.407	S	S	.	.			trans	-129.8	127.4	-178.3	0	0	0	0	0	112.7
48	S	55.9	Low	57.5	Low	99 Å²	99	73.6 Å²	73.6	69%	0.692	39%	0.392	S	S	*	.			trans	-62.4	135.5	166.3	50.5	0	0	0	0	109.1
49	M	61.9	Low	59	Low	26 Å²	26	74.7 Å²	74.7	13%	0.128	40%	0.397	C	S	.	.			trans	-108.8	129.1	174	66.1	176.5	-166.1	0	0	109.4	L29 L32 V51 L119	L29-M49 HydrophobicContact CD2-CE 4.38Å; L32-M49 HydrophobicContact CD1-CE 3.12Å; M49-V51 HydrophobicContact CE-CG2 3.72Å; M49-V51 HydrophobicContact CG-CG2 3.99Å; M49-V51 PolarHBondContact O-N 3.37Å; M49-V51 HydrophobicContact SD-CG2 4.33Å; M49-L119 HydrophobicContact CE-CD1 3.74Å; M49-L119 HydrophobicContact CE-CD2 4.37Å; M49-L119 HydrophobicContact SD-CD1 4.33Å
50	I	68.9	Low	60.3	Low	59 Å²	59	67.6 Å²	67.6	30%	0.303	37%	0.374	S	S	.	.			trans	-78.9	121.3	173	-58	177	0	0	0	107.4	Q74 D75 T80	I50-Q74 WeakPolarHBondContact O-CA 3.42Å; I50-D75 HydrophobicContact CB-CB 4.35Å; I50-D75 HydrophobicContact CG2-CB 3.95Å; I50-D75 PolarHBondContact O-N 3.4Å; I50-T80 HydrophobicContact CD1-CG2 4.26Å
51	V	73	Confident	61.8	Low	1 Å²	1	76 Å²	76	1%	0.006	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.7	178.1	-177.7	0	0	0	0	109.3	L32 M49 C53 C72 Y73 L119	L32-V51 HydrophobicContact CD1-CG2 4.14Å; M49-V51 HydrophobicContact CE-CG2 3.72Å; M49-V51 HydrophobicContact CG-CG2 3.99Å; M49-V51 PolarHBondContact O-N 3.37Å; M49-V51 HydrophobicContact SD-CG2 4.33Å; V51-C53 VanDerWaalsContact CG1-SG 3.58Å; V51-C72 HydrophobicContact CG1-CB 3.99Å; V51-Y73 WeakPolarHBondContact CA-O 3.15Å; V51-L119 HydrophobicContact CB-CD1 4.48Å; V51-L119 HydrophobicContact CG1-CD1 3.96Å; V51-L119 HydrophobicContact CG2-CD1 3.69Å
52	Q	78	Confident	63.3	Low	25 Å²	25	81.5 Å²	81.5	12%	0.117	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	133.3	164.7	-72.8	-177	7.9	0	0	109	C72 Y73 D75	Q52-C72 VanDerWaalsContact O-CA 3.31Å; Q52-C72 WeakPolarHBondContact O-CA 3.43Å; Q52-Y73 HydrophobicContact CB-CD2 4.32Å; Q52-Y73 HydrophobicContact CB-CE1 4.34Å; Q52-Y73 HydrophobicContact CB-CE2 3.75Å; Q52-Y73 HydrophobicContact CG-CE2 4.37Å; Q52-Y73 PolarHBondContact N-O 3.42Å; Q52-Y73 PolarHBondContact O-N 2.76Å; Q52-Y73 PolarHBondContact OE1-OH 3.05Å; Q52-D75 HydrophobicContact CG-CB 4.1Å; Q52-D75 VanDerWaalsContact NE2-CG 3.27Å; Q52-D75 PolarHBondContact NE2-OD2 2.86Å
53	C	79.6	Confident	64.6	Low	6 Å²	6	78.4 Å²	78.4	4%	0.041	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150	177.8	-65.8	0	0	0	0	113.1	H22 V51 F55 L71 C72	H22-C53 PolarHBondContact O-N 2.04Å; V51-C53 VanDerWaalsContact CG1-SG 3.58Å; C53-F55 HydrophobicContact CB-CD2 4.03Å; C53-F55 HydrophobicContact CB-CE2 3.25Å; C53-F55 HydrophobicContact CB-CZ 3.65Å; C53-L71 CarbonylContact C-O 3.39Å; C53-L71 WeakPolarHBondContact CA-O 3.37Å; C53-C72 HydrophobicContact CB-CB 4.22Å; C53-C72 WeakPolarHBondContact CB-SG 3.48Å; C53-C72 WeakPolarHBondContact SG-CB 3.28Å; C53-C72 CovalentContact SG-SG 2.05Å; C53-C72 PolarHBondContact SG-SG 3.26Å
54	Q	83.5	Confident	65.8	Low	16 Å²	16	73.8 Å²	73.8	8%	0.075	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.6	171.7	-56.8	173.5	23.3	0	0	107.5	Y21 A70 L71 W95 L105 Q106	Y21-Q54 HydrophobicContact CD1-CB 4.39Å; Y21-Q54 HydrophobicContact CD1-CG 4.41Å; Y21-Q54 HydrophobicContact CE1-CB 4.42Å; Q54-A70 CarbonylContact O-C 3.58Å; Q54-A70 WeakPolarHBondContact O-CA 3.16Å; Q54-L71 HydrophobicContact CB-CB 4.31Å; Q54-L71 PolarHBondContact N-O 2.97Å; Q54-L71 PolarHBondContact O-N 3.2Å; Q54-W95 HydrophobicContact CG-CZ3 3.99Å; Q54-W95 VanDerWaalsContact OE1-CZ3 3.25Å; Q54-L105 HydrophobicContact CB-CD2 4.06Å; Q54-Q106 PolarHBondContact NE2-O 2.93Å
55	F	77.3	Confident	67.1	Low	46 Å²	46	72.1 Å²	72.1	20%	0.202	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.4	179.4	-60.6	-78.3	0	0	0	111.1	K20 C53 A69 A70 C72 W120	K20-F55 PolarHBondContact N-O 3.14Å; K20-F55 PolarHBondContact O-N 3.23Å; K20-F55 VanDerWaalsContact O-O 3.08Å; C53-F55 HydrophobicContact CB-CD2 4.03Å; C53-F55 HydrophobicContact CB-CE2 3.25Å; C53-F55 HydrophobicContact CB-CZ 3.65Å; F55-A69 WeakPolarHBondContact CA-O 3.38Å; F55-A70 HydrophobicContact CD1-CB 3.75Å; F55-A70 HydrophobicContact CE1-CB 3.86Å; F55-C72 VanDerWaalsContact CZ-SG 3.55Å; F55-W120 HydrophobicContact CE1-CE3 4.02Å; F55-W120 HydrophobicContact CE1-CH2 4.4Å; F55-W120 AromaticContact CE1-CZ3 3.77Å; F55-W120 HydrophobicContact CE1-CZ3 3.77Å; F55-W120 HydrophobicContact CZ-CZ3 4.36Å
56	A	77.6	Confident	68.8	Low	3 Å²	3	72 Å²	72	3%	0.025	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	136.3	163.1	0	0	0	0	0	108.3	C19 I68 A69 P103	C19-A56 HydrophobicContact CB-CB 4.48Å; A56-I68 VanDerWaalsContact C-CG1 3.43Å; A56-I68 HydrophobicContact CB-CD1 3.95Å; A56-I68 HydrophobicContact CB-CG1 3.76Å; A56-I68 WeakPolarHBondContact O-CG1 3.43Å; A56-I68 PolarHBondContact O-N 3.04Å; A56-A69 HydrophobicContact CB-CB 4.28Å; A56-A69 PolarHBondContact N-O 2.6Å; A56-A69 PolarHBondContact O-N 3.25Å; A56-A69 VanDerWaalsContact O-N 3.17Å; A56-P103 HydrophobicContact CB-CB 4Å; A56-P103 HydrophobicContact CB-CG 3.55Å
57	A	75.2	Confident	70.5	Confident	19 Å²	19	62.5 Å²	62.5	16%	0.157	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	146.1	178.9	0	0	0	0	0	110.4	R66	A57-R66 CarbonylContact C-O 3.41Å; A57-R66 WeakPolarHBondContact CA-O 3.46Å; A57-R66 WeakPolarHBondContact CB-O 3.48Å
58	E	72.4	Confident	72	Confident	43 Å²	43	60.9 Å²	60.9	20%	0.201	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	118.1	162.8	-178.6	-179	-171.4	0	0	107.3	F17 G65 R66 I68 S134 G135 S136	F17-E58 HydrophobicContact CE1-CB 4.24Å; E58-G65 CarbonylContact O-C 3.47Å; E58-G65 VanDerWaalsContact O-CA 3.27Å; E58-G65 WeakPolarHBondContact O-CA 3.32Å; E58-R66 PolarHBondContact N-O 2.77Å; E58-R66 PolarHBondContact O-N 2.81Å; E58-I68 HydrophobicContact CB-CG2 4.01Å; E58-S134 VanDerWaalsContact OE1-O 3.11Å; E58-G135 WeakPolarHBondContact OE1-CA 3.18Å; E58-S136 PolarHBondContact OE2-N 3.35Å; E58-S136 VanDerWaalsContact OE2-N 3.11Å; E58-S136 PolarHBondContact OE2-OG 3.12Å
59	I	69.4	Low	73.5	Confident	54 Å²	54	56.2 Å²	56.2	28%	0.277	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.3	178.9	-56.2	-171.2	0	0	0	108	N18	N18-I59 HydrophobicContact CB-CD1 3.6Å; N18-I59 HydrophobicContact CB-CG1 4.17Å
60	N	68.8	Low	74.8	Confident	65 Å²	65	55 Å²	55	35%	0.348	28%	0.279	S	S	.	.			trans	-76.2	170.1	175.1	73.7	14.1	0	0	0	111.3	Y62 G63 Q64	N60-Y62 PolarHBondContact O-N 3.24Å; N60-Y62 WeakPolarHBondContact OD1-CA 3.17Å; N60-Y62 WeakPolarHBondContact OD1-CB 3.49Å; N60-Y62 PolarHBondContact OD1-N 3.26Å; N60-G63 PolarHBondContact O-N 3.45Å; N60-G63 PolarHBondContact OD1-N 3.07Å; N60-Q64 PolarHBondContact N-O 3.12Å; N60-Q64 PolarHBondContact ND2-OE1 3.06Å; N60-Q64 WeakPolarHBondContact OD1-CB 3.15Å; N60-Q64 PolarHBondContact OD1-N 3.27Å; N60-Q64 PolarHBondContact OD1-O 2.57Å
61	Y	66.9	Low	75.7	Confident	220 Å²	220	52.1 Å²	52.1	86%	0.863	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-26.5	179.3	-176.6	-98.5	0	0	0	114	G63	Y61-G63 VanDerWaalsContact C-N 3.27Å; Y61-G63 PolarHBondContact O-N 2.99Å
62	Y	70.5	Confident	76.4	Confident	193 Å²	193	52.1 Å²	52.1	76%	0.757	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	4.6	178.6	-56.4	-72.1	0	0	0	113.7	N60 Q64	N60-Y62 PolarHBondContact O-N 3.24Å; N60-Y62 WeakPolarHBondContact OD1-CA 3.17Å; N60-Y62 WeakPolarHBondContact OD1-CB 3.49Å; N60-Y62 PolarHBondContact OD1-N 3.26Å; Y62-Q64 PolarHBondContact O-N 3.46Å
63	G	65.3	Low	76.7	Confident	56 Å²	56	51.5 Å²	51.5	58%	0.577	26%	0.261	S	S	*	.	S	Bend	trans	76.7	6.1	-177.1	0	0	0	0	0	114.1	N60 Y61 G65	N60-G63 PolarHBondContact O-N 3.45Å; N60-G63 PolarHBondContact OD1-N 3.07Å; Y61-G63 VanDerWaalsContact C-N 3.27Å; Y61-G63 PolarHBondContact O-N 2.99Å; G63-G65 PolarHBondContact O-N 3.01Å
64	Q	65.8	Low	76.8	Confident	135 Å²	135	55.6 Å²	55.6	63%	0.631	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-78.2	117.2	173.8	-59.6	176	-26.5	0	0	108.7	N60 Y62	N60-Q64 PolarHBondContact N-O 3.12Å; N60-Q64 PolarHBondContact ND2-OE1 3.06Å; N60-Q64 WeakPolarHBondContact OD1-CB 3.15Å; N60-Q64 PolarHBondContact OD1-N 3.27Å; N60-Q64 PolarHBondContact OD1-O 2.57Å; Y62-Q64 PolarHBondContact O-N 3.46Å
65	G	68.8	Low	76.3	Confident	51 Å²	51	55.7 Å²	55.7	53%	0.526	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.5	177.8	0	0	0	0	0	111.5	E58 G63	E58-G65 CarbonylContact O-C 3.47Å; E58-G65 VanDerWaalsContact O-CA 3.27Å; E58-G65 WeakPolarHBondContact O-CA 3.32Å; G63-G65 PolarHBondContact O-N 3.01Å
66	R	73.6	Confident	76	Confident	92 Å²	92	58.9 Å²	58.9	35%	0.347	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.5	163.1	175.9	172.1	172.4	178.7	-0.2	109.1	A57 E58 I68 S136 R137	A57-R66 CarbonylContact C-O 3.41Å; A57-R66 WeakPolarHBondContact CA-O 3.46Å; A57-R66 WeakPolarHBondContact CB-O 3.48Å; E58-R66 PolarHBondContact N-O 2.77Å; E58-R66 PolarHBondContact O-N 2.81Å; R66-I68 PolarHBondContact O-N 3.34Å; R66-S136 VanDerWaalsContact CD-OG 3.27Å; R66-S136 WeakPolarHBondContact CD-OG 3.24Å; R66-S136 VanDerWaalsContact CZ-OG 3.3Å; R66-S136 PolarHBondContact NE-OG 3.43Å; R66-S136 PolarHBondContact NH1-O 2.67Å; R66-S136 PolarHBondContact NH1-OG 3.27Å; R66-R137 VanDerWaalsContact NH2-C 3.25Å
67	V	78.5	Confident	75.3	Confident	57 Å²	57	62.3 Å²	62.3	35%	0.345	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	126.9	173.3	179.9	0	0	0	0	109	A70	V67-A70 HydrophobicContact CG1-CB 3.97Å
68	I	82	Confident	74.2	Confident	13 Å²	13	64.5 Å²	64.5	7%	0.067	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-23.1	177.1	57.3	152	0	0	0	111.9	F17 A56 E58 R66 P103 A124 F129	F17-I68 HydrophobicContact CD1-CD1 3.47Å; F17-I68 VanDerWaalsContact CD1-CD1 3.47Å; F17-I68 HydrophobicContact CD1-CG1 4.46Å; F17-I68 HydrophobicContact CE1-CD1 3.34Å; F17-I68 HydrophobicContact CE1-CG1 4.38Å; F17-I68 HydrophobicContact CG-CD1 4.33Å; F17-I68 HydrophobicContact CZ-CD1 4.08Å; A56-I68 VanDerWaalsContact C-CG1 3.43Å; A56-I68 HydrophobicContact CB-CD1 3.95Å; A56-I68 HydrophobicContact CB-CG1 3.76Å; A56-I68 WeakPolarHBondContact O-CG1 3.43Å; A56-I68 PolarHBondContact O-N 3.04Å; E58-I68 HydrophobicContact CB-CG2 4.01Å; R66-I68 PolarHBondContact O-N 3.34Å; I68-P103 HydrophobicContact CD1-CG 3.61Å; I68-P103 HydrophobicContact CG1-CG 4.34Å; I68-A124 WeakPolarHBondContact O-CA 3.36Å; I68-A124 WeakPolarHBondContact O-CB 3.33Å; I68-A124 PolarHBondContact O-N 2.97Å; I68-F129 HydrophobicContact CB-CZ 4.2Å; I68-F129 HydrophobicContact CD1-CZ 4.5Å; I68-F129 HydrophobicContact CG2-CZ 3.78Å
69	A	86.2	Confident	73.1	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	138.9	169.6	0	0	0	0	0	111.1	F55 A56 P103 L105 E122 A124	F55-A69 WeakPolarHBondContact CA-O 3.38Å; A56-A69 HydrophobicContact CB-CB 4.28Å; A56-A69 PolarHBondContact N-O 2.6Å; A56-A69 PolarHBondContact O-N 3.25Å; A56-A69 VanDerWaalsContact O-N 3.17Å; A69-P103 HydrophobicContact CB-CG 4.01Å; A69-L105 HydrophobicContact CB-CD1 4.22Å; A69-L105 HydrophobicContact CB-CD2 3.94Å; A69-L105 HydrophobicContact CB-CG 4.06Å; A69-E122 CarbonylContact C-O 3.42Å; A69-E122 WeakPolarHBondContact CA-O 3.49Å; A69-A124 HydrophobicContact CB-CB 4.21Å
70	A	88.6	Confident	72	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	137.9	174.4	0	0	0	0	0	111.3	Q54 F55 V67 L105 W120 E122	Q54-A70 CarbonylContact O-C 3.58Å; Q54-A70 WeakPolarHBondContact O-CA 3.16Å; F55-A70 HydrophobicContact CD1-CB 3.75Å; F55-A70 HydrophobicContact CE1-CB 3.86Å; V67-A70 HydrophobicContact CG1-CB 3.97Å; A70-L105 WeakPolarHBondContact O-CD1 3.4Å; A70-W120 HydrophobicContact CB-CD2 3.9Å; A70-W120 HydrophobicContact CB-CE3 4.31Å; A70-W120 HydrophobicContact CB-CG 4.33Å; A70-W120 HydrophobicContact CB-CZ2 4.07Å; A70-E122 HydrophobicContact CB-CB 4.33Å; A70-E122 PolarHBondContact N-O 3.29Å; A70-E122 PolarHBondContact O-N 2.86Å
71	L	88.2	Confident	70.7	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	124.8	168	169.6	63.8	0	0	0	107.8	C53 Q54 Y73 L105 L107 I118 W120 Y121	C53-L71 CarbonylContact C-O 3.39Å; C53-L71 WeakPolarHBondContact CA-O 3.37Å; Q54-L71 HydrophobicContact CB-CB 4.31Å; Q54-L71 PolarHBondContact N-O 2.97Å; Q54-L71 PolarHBondContact O-N 3.2Å; L71-Y73 HydrophobicContact CD1-CD1 3.95Å; L71-Y73 HydrophobicContact CD2-CD1 4Å; L71-Y73 HydrophobicContact CD2-CE1 3.82Å; L71-Y73 HydrophobicContact CG-CD1 3.75Å; L71-Y73 HydrophobicContact CG-CE1 4.01Å; L71-L105 HydrophobicContact CB-CB 4.37Å; L71-L105 HydrophobicContact CB-CD1 4.04Å; L71-L105 HydrophobicContact CB-CD2 3.91Å; L71-L105 HydrophobicContact CB-CG 4.33Å; L71-L105 HydrophobicContact CD2-CB 4.42Å; L71-L107 HydrophobicContact CD2-CG 4.07Å; L71-I118 HydrophobicContact CD1-CD1 4.27Å; L71-I118 HydrophobicContact CD1-CG2 3.67Å; L71-W120 CarbonylContact C-O 3.49Å; L71-W120 VanDerWaalsContact CA-O 3.28Å; L71-W120 WeakPolarHBondContact CA-O 3.18Å; L71-Y121 HydrophobicContact CD1-CD2 4.03Å
72	C	87.8	Confident	69.4	Low	0 Å²	0	62.8 Å²	62.8	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	135.1	168.7	-69.1	0	0	0	0	110.2	V51 Q52 C53 F55 I118 L119 W120	V51-C72 HydrophobicContact CG1-CB 3.99Å; Q52-C72 VanDerWaalsContact O-CA 3.31Å; Q52-C72 WeakPolarHBondContact O-CA 3.43Å; C53-C72 HydrophobicContact CB-CB 4.22Å; C53-C72 WeakPolarHBondContact CB-SG 3.48Å; C53-C72 WeakPolarHBondContact SG-CB 3.28Å; C53-C72 CovalentContact SG-SG 2.05Å; C53-C72 PolarHBondContact SG-SG 3.26Å; F55-C72 VanDerWaalsContact CZ-SG 3.55Å; C72-I118 WeakPolarHBondContact O-CG2 3.43Å; C72-L119 HydrophobicContact CB-CB 4.31Å; C72-L119 WeakPolarHBondContact O-CA 3.36Å; C72-L119 WeakPolarHBondContact O-CB 3.43Å; C72-L119 PolarHBondContact O-N 3.02Å; C72-W120 HydrophobicContact CB-CB 4.01Å; C72-W120 PolarHBondContact N-O 3.08Å; C72-W120 PolarHBondContact O-N 3.34Å; C72-W120 VanDerWaalsContact O-N 3.1Å
73	Y	85.4	Confident	67.9	Low	13 Å²	13	62.3 Å²	62.3	5%	0.051	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	156.6	178.7	57.2	-94	0	0	0	112	V51 Q52 L71 D75 P108 L111	V51-Y73 WeakPolarHBondContact CA-O 3.15Å; Q52-Y73 HydrophobicContact CB-CD2 4.32Å; Q52-Y73 HydrophobicContact CB-CE1 4.34Å; Q52-Y73 HydrophobicContact CB-CE2 3.75Å; Q52-Y73 HydrophobicContact CG-CE2 4.37Å; Q52-Y73 PolarHBondContact N-O 3.42Å; Q52-Y73 PolarHBondContact O-N 2.76Å; Q52-Y73 PolarHBondContact OE1-OH 3.05Å; L71-Y73 HydrophobicContact CD1-CD1 3.95Å; L71-Y73 HydrophobicContact CD2-CD1 4Å; L71-Y73 HydrophobicContact CD2-CE1 3.82Å; L71-Y73 HydrophobicContact CG-CD1 3.75Å; L71-Y73 HydrophobicContact CG-CE1 4.01Å; Y73-D75 PolarHBondContact O-N 3.48Å; Y73-P108 HydrophobicContact CE1-CG 4.17Å; Y73-P108 HydrophobicContact CE2-CG 3.92Å; Y73-L111 HydrophobicContact CD1-CD1 3.51Å; Y73-L111 HydrophobicContact CD2-CD1 3.59Å; Y73-L111 HydrophobicContact CE1-CD1 4.15Å; Y73-L111 HydrophobicContact CE2-CD1 4.22Å; Y73-L111 HydrophobicContact CG-CD1 3.19Å
74	Q	81.8	Confident	66.9	Low	92 Å²	92	67.5 Å²	67.5	43%	0.43	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	128.1	174.1	-174.8	176.8	0.6	0	0	110.1	I50 I76	I50-Q74 WeakPolarHBondContact O-CA 3.42Å; Q74-I76 PolarHBondContact O-N 2.91Å
75	D	73	Confident	65.7	Low	17 Å²	17	67.7 Å²	67.7	9%	0.091	36%	0.361	C	S	.	.			trans	-77.9	106.3	173.1	-169.7	-2.2	0	0	0	109.8	I50 Q52 Y73 S77	I50-D75 HydrophobicContact CB-CB 4.35Å; I50-D75 HydrophobicContact CG2-CB 3.95Å; I50-D75 PolarHBondContact O-N 3.4Å; Q52-D75 HydrophobicContact CG-CB 4.1Å; Q52-D75 VanDerWaalsContact NE2-CG 3.27Å; Q52-D75 PolarHBondContact NE2-OD2 2.86Å; Y73-D75 PolarHBondContact O-N 3.48Å; D75-S77 VanDerWaalsContact OD1-CB 3.32Å; D75-S77 WeakPolarHBondContact OD1-CB 3.38Å; D75-S77 PolarHBondContact OD1-N 3.26Å; D75-S77 PolarHBondContact OD1-OG 3.33Å
76	I	70	Confident	64.7	Low	114 Å²	114	67.7 Å²	67.7	59%	0.585	35%	0.353	S	S	*	.			trans	-90.3	-7	176	42.6	168.8	0	0	0	112.5	Q74 G78 Y110	Q74-I76 PolarHBondContact O-N 2.91Å; I76-G78 PolarHBondContact O-N 3.43Å; I76-Y110 HydrophobicContact CD1-CD1 4.43Å; I76-Y110 HydrophobicContact CD1-CD2 3.75Å; I76-Y110 HydrophobicContact CD1-CE1 4.15Å; I76-Y110 HydrophobicContact CD1-CE2 3.4Å; I76-Y110 VanDerWaalsContact CD1-CE2 3.4Å; I76-Y110 HydrophobicContact CD1-CG 4.26Å; I76-Y110 HydrophobicContact CG1-CE1 4.33Å; I76-Y110 HydrophobicContact CG1-CE2 3.86Å
77	S	63	Low	63.3	Low	75 Å²	75	71 Å²	71	52%	0.524	37%	0.372	S	S	.	.	S	Bend	trans	-72.2	-12	-174.9	71.5	0	0	0	0	113.1	D75 N79	D75-S77 VanDerWaalsContact OD1-CB 3.32Å; D75-S77 WeakPolarHBondContact OD1-CB 3.38Å; D75-S77 PolarHBondContact OD1-N 3.26Å; D75-S77 PolarHBondContact OD1-OG 3.33Å; S77-N79 PolarHBondContact O-N 3.09Å
78	G	52.1	Low	61.7	Low	64 Å²	64	69.5 Å²	69.5	66%	0.66	37%	0.368	S	S	*	.			trans	57.7	4	-178.3	0	0	0	0	0	113.7	I76 T80	I76-G78 PolarHBondContact O-N 3.43Å; G78-T80 PolarHBondContact O-N 2.87Å
79	N	50.1	Low	60.2	Low	83 Å²	83	71.4 Å²	71.4	44%	0.444	39%	0.391	S	S	.	.			trans	-97.4	82.8	-171.1	-165.3	-2	0	0	0	108.4	S77 N81 S82	S77-N79 PolarHBondContact O-N 3.09Å; N79-N81 PolarHBondContact O-N 3.1Å; N79-N81 WeakPolarHBondContact OD1-CB 3.35Å; N79-N81 PolarHBondContact OD1-N 2.97Å; N79-S82 PolarHBondContact O-N 2.75Å
80	T	46	Very low	58.7	Low	93 Å²	93	78.5 Å²	78.5	57%	0.571	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-10.5	173.1	47.6	0	0	0	0	113.4	I50 G78	I50-T80 HydrophobicContact CD1-CG2 4.26Å; G78-T80 PolarHBondContact O-N 2.87Å
81	N	40.5	Very low	57.2	Low	137 Å²	137	79.4 Å²	79.4	73%	0.733	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	0.1	-174.1	-70.3	-28.1	0	0	0	115.2	N79 R83	N79-N81 PolarHBondContact O-N 3.1Å; N79-N81 WeakPolarHBondContact OD1-CB 3.35Å; N79-N81 PolarHBondContact OD1-N 2.97Å; N81-R83 PolarHBondContact O-N 3.5Å
82	S	40.7	Very low	56	Low	33 Å²	33	80.2 Å²	80.2	23%	0.231	43%	0.434	C	S	.	.			trans	-82.6	66.1	170.3	73	0	0	0	0	111.1	N79 W84	N79-S82 PolarHBondContact O-N 2.75Å; S82-W84 VanDerWaalsContact O-CD1 3.28Å; S82-W84 PolarHBondContact O-N 3.14Å
83	R	39.4	Very low	55.1	Low	184 Å²	184	87.4 Å²	87.4	69%	0.694	47%	0.465	S	S	*	.			trans	-63.9	85.9	166.4	-165.2	-176.5	-157.4	-175.9	3.5	107.5	N81 Q85	N81-R83 PolarHBondContact O-N 3.5Å; R83-Q85 HydrophobicContact CG-CB 4.19Å; R83-Q85 HydrophobicContact CG-CG 3.86Å; R83-Q85 VanDerWaalsContact CZ-CD 3.41Å; R83-Q85 VanDerWaalsContact NH2-NE2 3.12Å; R83-Q85 PolarHBondContact O-N 3.37Å
84	W	44.6	Very low	54.6	Low	165 Å²	165	95 Å²	95	63%	0.625	50%	0.498	S	S	*	.			trans	-71.8	68.3	164	-62.6	99.4	0	0	0	107.7	V23 S82 S86	V23-W84 HydrophobicContact CG1-CB 4.46Å; V23-W84 HydrophobicContact CG2-CB 4.35Å; S82-W84 VanDerWaalsContact O-CD1 3.28Å; S82-W84 PolarHBondContact O-N 3.14Å; W84-S86 PolarHBondContact O-N 3.44Å
85	Q	40.6	Very low	54.6	Low	139 Å²	139	92.4 Å²	92.4	65%	0.65	49%	0.485	S	S	*	.			trans	-73.5	64.7	159.6	-98.7	-178.3	-20.5	0	0	107.7	R83	R83-Q85 HydrophobicContact CG-CB 4.19Å; R83-Q85 HydrophobicContact CG-CG 3.86Å; R83-Q85 VanDerWaalsContact CZ-CD 3.41Å; R83-Q85 VanDerWaalsContact NH2-NE2 3.12Å; R83-Q85 PolarHBondContact O-N 3.37Å
86	S	45.8	Very low	55.3	Low	51 Å²	51	95.7 Å²	95.7	36%	0.357	50%	0.496	S	S	.	.			trans	-97.6	130.1	175	-61.7	0	0	0	0	107.2	W84 G88 M91	W84-S86 PolarHBondContact O-N 3.44Å; S86-G88 PolarHBondContact O-N 2.79Å; S86-M91 VanDerWaalsContact CB-SD 3.52Å
87	Q	45.5	Very low	56.3	Low	162 Å²	162	90.2 Å²	90.2	76%	0.757	47%	0.468	S	S	*	.			trans	-57.8	114.9	178.6	-64	-170.5	-6.1	0	0	109.1	G89 E90	Q87-G89 PolarHBondContact O-N 3.44Å; Q87-E90 PolarHBondContact O-N 3.1Å
88	G	45.4	Very low	57.5	Low	25 Å²	25	88.5 Å²	88.5	26%	0.258	45%	0.454	S	S	.	.	H	α-helix	trans	-53.1	-26.4	-168.6	0	0	0	0	0	115.1	S86 M91 C92	S86-G88 PolarHBondContact O-N 2.79Å; G88-M91 PolarHBondContact O-N 3.36Å; G88-C92 PolarHBondContact O-N 3.02Å
89	G	49.2	Very low	59.2	Low	53 Å²	53	88.9 Å²	88.9	55%	0.546	46%	0.459	S	S	.	.	H	α-helix	trans	-64.8	-36	176.8	0	0	0	0	0	115.2	Q87	Q87-G89 PolarHBondContact O-N 3.44Å
90	E	55.3	Low	60.9	Low	148 Å²	148	85.9 Å²	85.9	69%	0.692	44%	0.443	S	S	*	.	H	α-helix	trans	-70.4	-35.8	177.2	-76.1	-162.8	145.6	0	0	111.8	Q87 K93 K94	Q87-E90 PolarHBondContact O-N 3.1Å; E90-K93 PolarHBondContact O-N 3.37Å; E90-K94 PolarHBondContact O-N 2.89Å; E90-K94 VanDerWaalsContact O-N 3.14Å
91	M	57.3	Low	62.6	Low	20 Å²	20	84.8 Å²	84.8	10%	0.099	43%	0.432	C	S	.	.	H	α-helix	trans	-68.4	-40.5	180	-69.6	172.4	72.2	0	0	111.4	Y21 S86 G88 K93 K94 W95	Y21-M91 HydrophobicContact CD1-CE 3.54Å; Y21-M91 HydrophobicContact CD2-CB 3.83Å; Y21-M91 HydrophobicContact CD2-CE 3.68Å; Y21-M91 HydrophobicContact CD2-CG 4.35Å; Y21-M91 HydrophobicContact CD2-SD 3.59Å; Y21-M91 VanDerWaalsContact CD2-SD 3.59Å; Y21-M91 HydrophobicContact CE1-CE 3.83Å; Y21-M91 HydrophobicContact CE2-CB 3.17Å; Y21-M91 HydrophobicContact CE2-CE 3.92Å; Y21-M91 HydrophobicContact CE2-CG 4.14Å; Y21-M91 HydrophobicContact CE2-SD 3.96Å; Y21-M91 HydrophobicContact CG-CE 3.45Å; Y21-M91 VanDerWaalsContact CG-CE 3.45Å; Y21-M91 HydrophobicContact CG-SD 3.88Å; S86-M91 VanDerWaalsContact CB-SD 3.52Å; G88-M91 PolarHBondContact O-N 3.36Å; M91-K93 VanDerWaalsContact C-N 3.27Å; M91-K93 PolarHBondContact O-N 2.94Å; M91-K94 PolarHBondContact O-N 3.19Å; M91-K94 VanDerWaalsContact O-N 3.14Å; M91-W95 HydrophobicContact CB-CD2 4.44Å; M91-W95 HydrophobicContact CE-CE3 4.42Å; M91-W95 HydrophobicContact CE-CH2 3Å; M91-W95 HydrophobicContact CE-CZ2 3.15Å; M91-W95 HydrophobicContact CE-CZ3 3.72Å; M91-W95 HydrophobicContact CG-CZ2 4.47Å; M91-W95 WeakPolarHBondContact O-CB 3.37Å; M91-W95 VanDerWaalsContact O-CG 3.26Å; M91-W95 PolarHBondContact O-N 2.85Å
92	C	62	Low	64.9	Low	17 Å²	17	78.5 Å²	78.5	12%	0.115	40%	0.398	C	S	.	.	H	α-helix	trans	-54	-43.8	174.7	-71.8	0	0	0	0	112.2	C19 G88 R96	C19-C92 HydrophobicContact CB-CB 4.3Å; C19-C92 WeakPolarHBondContact CB-SG 3.41Å; C19-C92 VanDerWaalsContact SG-CA 3.57Å; C19-C92 WeakPolarHBondContact SG-CB 3.31Å; C19-C92 CovalentContact SG-SG 2.03Å; C19-C92 PolarHBondContact SG-SG 2.86Å; G88-C92 PolarHBondContact O-N 3.02Å; C92-R96 WeakPolarHBondContact O-CG 3.23Å
93	K	69.8	Low	67.1	Low	151 Å²	151	77.4 Å²	77.4	66%	0.657	39%	0.39	S	S	*	.	H	α-helix	trans	-69.6	-40.8	179.3	-71	-177.7	179.6	177.1	0	111.9	E90 M91 W95	E90-K93 PolarHBondContact O-N 3.37Å; M91-K93 VanDerWaalsContact C-N 3.27Å; M91-K93 PolarHBondContact O-N 2.94Å; K93-W95 VanDerWaalsContact C-N 3.31Å; K93-W95 PolarHBondContact O-N 2.9Å
94	K	74.4	Confident	69.6	Low	171 Å²	171	69.9 Å²	69.9	74%	0.743	36%	0.363	S	S	*	.	H	α-helix	trans	-68.9	-31.1	-179.3	-170.9	177.4	178	177.8	0	112.3	E90 M91	E90-K94 PolarHBondContact O-N 2.89Å; E90-K94 VanDerWaalsContact O-N 3.14Å; M91-K94 PolarHBondContact O-N 3.19Å; M91-K94 VanDerWaalsContact O-N 3.14Å
95	W	81.9	Confident	71.8	Confident	39 Å²	39	62.4 Å²	62.4	15%	0.148	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	33	-171.9	-58.6	-3.1	0	0	0	111.8	Y21 Q54 M91 K93 P103 Q104 Q106	Y21-W95 HydrophobicContact CD1-CE3 4.26Å; Y21-W95 HydrophobicContact CD1-CH2 4.05Å; Y21-W95 AromaticContact CD1-CZ3 3.56Å; Y21-W95 HydrophobicContact CD1-CZ3 3.56Å; Y21-W95 HydrophobicContact CE1-CD2 4.24Å; Y21-W95 AromaticContact CE1-CE3 3.2Å; Y21-W95 HydrophobicContact CE1-CE3 3.2Å; Y21-W95 AromaticContact CE1-CH2 3.76Å; Y21-W95 HydrophobicContact CE1-CH2 3.76Å; Y21-W95 AromaticContact CE1-CZ3 2.91Å; Y21-W95 HydrophobicContact CE1-CZ3 2.91Å; Y21-W95 AromaticContact CZ-CE3 3.42Å; Y21-W95 VanDerWaalsContact CZ-CE3 3.42Å; Y21-W95 AromaticContact CZ-CZ3 3.6Å; Q54-W95 HydrophobicContact CG-CZ3 3.99Å; Q54-W95 VanDerWaalsContact OE1-CZ3 3.25Å; M91-W95 HydrophobicContact CB-CD2 4.44Å; M91-W95 HydrophobicContact CE-CE3 4.42Å; M91-W95 HydrophobicContact CE-CH2 3Å; M91-W95 HydrophobicContact CE-CZ2 3.15Å; M91-W95 HydrophobicContact CE-CZ3 3.72Å; M91-W95 HydrophobicContact CG-CZ2 4.47Å; M91-W95 WeakPolarHBondContact O-CB 3.37Å; M91-W95 VanDerWaalsContact O-CG 3.26Å; M91-W95 PolarHBondContact O-N 2.85Å; K93-W95 VanDerWaalsContact C-N 3.31Å; K93-W95 PolarHBondContact O-N 2.9Å; W95-P103 CarbonylContact O-C 3.56Å; W95-P103 WeakPolarHBondContact O-CA 3.5Å; W95-Q104 PolarHBondContact O-N 3.24Å; W95-Q106 HydrophobicContact CB-CG 4.35Å; W95-Q106 HydrophobicContact CD2-CB 4.38Å; W95-Q106 HydrophobicContact CD2-CG 3.34Å; W95-Q106 VanDerWaalsContact CE2-CG 3.42Å; W95-Q106 HydrophobicContact CE3-CB 4.33Å; W95-Q106 HydrophobicContact CE3-CG 3.66Å; W95-Q106 HydrophobicContact CG-CG 3.59Å; W95-Q106 HydrophobicContact CH2-CB 4.27Å; W95-Q106 HydrophobicContact CH2-CG 4.17Å; W95-Q106 HydrophobicContact CZ2-CB 4.31Å; W95-Q106 HydrophobicContact CZ2-CG 3.88Å; W95-Q106 HydrophobicContact CZ3-CB 4.25Å; W95-Q106 HydrophobicContact CZ3-CG 4.04Å
96	R	88.2	Confident	74.1	Confident	85 Å²	85	59.2 Å²	59.2	32%	0.321	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-85.6	142.1	174.8	-64.2	-179	173.9	168.5	-8.5	111	C92 L102	C92-R96 WeakPolarHBondContact O-CG 3.23Å; R96-L102 WeakPolarHBondContact CA-O 3.27Å
97	Y	91.1	Very high	76.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-62.4	134.7	165.3	-175.8	-101.8	0	0	0	109.3	G99 T100 L102 F154 G158 K159 Q244 T246	Y97-G99 PolarHBondContact O-N 3.4Å; Y97-T100 HydrophobicContact CD1-CG2 3.82Å; Y97-T100 PolarHBondContact O-N 3.07Å; Y97-T100 VanDerWaalsContact O-N 3.08Å; Y97-T100 PolarHBondContact O-OG1 3.27Å; Y97-L102 PolarHBondContact N-O 2.81Å; Y97-F154 HydrophobicContact CD1-CD1 4.2Å; Y97-F154 AromaticContact CD1-CE1 3.86Å; Y97-F154 HydrophobicContact CD1-CE1 3.86Å; Y97-F154 HydrophobicContact CD1-CE2 4.5Å; Y97-F154 HydrophobicContact CD1-CZ 4.03Å; Y97-F154 HydrophobicContact CD2-CB 3.87Å; Y97-F154 AromaticContact CD2-CD1 3.57Å; Y97-F154 HydrophobicContact CD2-CD1 3.57Å; Y97-F154 AromaticContact CD2-CD2 4Å; Y97-F154 HydrophobicContact CD2-CD2 4Å; Y97-F154 HydrophobicContact CD2-CE1 4.08Å; Y97-F154 HydrophobicContact CD2-CE2 4.46Å; Y97-F154 AromaticContact CD2-CG 3.51Å; Y97-F154 HydrophobicContact CD2-CG 3.51Å; Y97-F154 HydrophobicContact CD2-CZ 4.5Å; Y97-F154 HydrophobicContact CE1-CD1 4.37Å; Y97-F154 HydrophobicContact CE1-CE1 4.13Å; Y97-F154 HydrophobicContact CE2-CB 4.34Å; Y97-F154 AromaticContact CE2-CD1 3.79Å; Y97-F154 HydrophobicContact CE2-CD1 3.79Å; Y97-F154 HydrophobicContact CE2-CE1 4.36Å; Y97-F154 HydrophobicContact CE2-CG 4.12Å; Y97-F154 AromaticContact CG-CD1 3.8Å; Y97-F154 HydrophobicContact CG-CD1 3.8Å; Y97-F154 AromaticContact CG-CD2 3.92Å; Y97-F154 HydrophobicContact CG-CD2 3.92Å; Y97-F154 AromaticContact CG-CE1 3.82Å; Y97-F154 HydrophobicContact CG-CE1 3.82Å; Y97-F154 AromaticContact CG-CE2 3.95Å; Y97-F154 HydrophobicContact CG-CE2 3.95Å; Y97-F154 AromaticContact CG-CG 3.84Å; Y97-F154 HydrophobicContact CG-CG 3.84Å; Y97-F154 AromaticContact CG-CZ 3.9Å; Y97-F154 HydrophobicContact CG-CZ 3.9Å; Y97-G158 WeakPolarHBondContact OH-CA 3.29Å; Y97-K159 HydrophobicContact CE1-CB 4.33Å; Y97-K159 HydrophobicContact CE1-CG 3.96Å; Y97-K159 PolarHBondContact OH-N 3.37Å; Y97-Q244 PolarHBondContact OH-O 2.75Å; Y97-T246 HydrophobicContact CE2-CG2 3.83Å
98	P	88.6	Confident	78.4	Confident	38 Å²	38	51.3 Å²	51.3	25%	0.247	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	124.5	-169.4	-28.1	34.5	0	0	0	114.1	R243 Q244	P98-R243 WeakPolarHBondContact CD-O 3.42Å; P98-R243 HydrophobicContact CG-CB 3.64Å; P98-Q244 HydrophobicContact CB-CG 4.42Å
99	G	86.2	Confident	80.4	Confident	73 Å²	73	55.4 Å²	55.4	75%	0.753	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	20.2	178.8	0	0	0	0	0	114.5	Y97	Y97-G99 PolarHBondContact O-N 3.4Å
100	T	86.8	Confident	82.3	Confident	19 Å²	19	57.5 Å²	57.5	12%	0.117	29%	0.286	C	S	.	.	S	Bend	trans	-138.4	169.4	176.4	83	0	0	0	0	110.8	Y97 L102 L126	Y97-T100 HydrophobicContact CD1-CG2 3.82Å; Y97-T100 PolarHBondContact O-N 3.07Å; Y97-T100 VanDerWaalsContact O-N 3.08Å; Y97-T100 PolarHBondContact O-OG1 3.27Å; T100-L102 PolarHBondContact OG1-N 2.99Å; T100-L126 HydrophobicContact CG2-CD1 4.3Å; T100-L126 HydrophobicContact CG2-CD2 3.89Å
101	Q	82	Confident	84.1	Confident	70 Å²	70	50.8 Å²	50.8	33%	0.327	25%	0.254	S	S	.	.	S	Bend	trans	-90.2	-6	171.2	-59	-62	-14.7	0	0	112.7	L14 F17	L14-Q101 HydrophobicContact CB-CB 4.31Å; L14-Q101 HydrophobicContact CB-CG 4.43Å; F17-Q101 HydrophobicContact CE2-CB 4.39Å
102	L	87	Confident	85.8	Confident	6 Å²	6	53.4 Å²	53.4	3%	0.031	26%	0.263	C	S	.	.	S	Bend	trans	-78.2	142.6	-173.6	-64.2	179.8	0	0	0	111.5	F17 R96 Y97 T100 N125 L126 F129 F154	F17-L102 HydrophobicContact CE2-CD2 4.07Å; F17-L102 HydrophobicContact CZ-CD2 3.82Å; R96-L102 WeakPolarHBondContact CA-O 3.27Å; Y97-L102 PolarHBondContact N-O 2.81Å; T100-L102 PolarHBondContact OG1-N 2.99Å; L102-N125 WeakPolarHBondContact CD1-O 3.26Å; L102-L126 HydrophobicContact CD1-CD2 3.69Å; L102-L126 HydrophobicContact CD1-CG 4.28Å; L102-F129 HydrophobicContact CD1-CD2 3.62Å; L102-F129 HydrophobicContact CD1-CE2 3.94Å; L102-F129 HydrophobicContact CD1-CG 4.29Å; L102-F129 HydrophobicContact CD2-CD1 4.14Å; L102-F129 HydrophobicContact CD2-CD2 3.68Å; L102-F129 HydrophobicContact CD2-CE1 3.9Å; L102-F129 HydrophobicContact CD2-CE2 3.43Å; L102-F129 VanDerWaalsContact CD2-CE2 3.43Å; L102-F129 HydrophobicContact CD2-CG 4.02Å; L102-F129 HydrophobicContact CD2-CZ 3.53Å; L102-F129 HydrophobicContact CG-CD2 4.31Å; L102-F129 HydrophobicContact CG-CE2 4.35Å; L102-F154 HydrophobicContact CB-CE2 3.81Å; L102-F154 HydrophobicContact CB-CZ 4.21Å; L102-F154 HydrophobicContact CD1-CE2 4.34Å; L102-F154 HydrophobicContact CD1-CZ 4.01Å
103	P	87.8	Confident	87.2	Confident	10 Å²	10	54 Å²	54	7%	0.065	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-71.9	143.5	179.3	31.6	-36.2	0	0	0	111.4	A56 I68 A69 W95 A124 F154	A56-P103 HydrophobicContact CB-CB 4Å; A56-P103 HydrophobicContact CB-CG 3.55Å; I68-P103 HydrophobicContact CD1-CG 3.61Å; I68-P103 HydrophobicContact CG1-CG 4.34Å; A69-P103 HydrophobicContact CB-CG 4.01Å; W95-P103 CarbonylContact O-C 3.56Å; W95-P103 WeakPolarHBondContact O-CA 3.5Å; P103-A124 HydrophobicContact CG-CB 4.16Å; P103-A124 WeakPolarHBondContact O-CB 3.3Å; P103-F154 WeakPolarHBondContact O-CD2 3.45Å
104	Q	91.8	Very high	88.1	Confident	25 Å²	25	49.5 Å²	49.5	12%	0.117	25%	0.246	C	C	.	.			trans	-115.4	114.9	166.9	177.2	169.5	29.1	0	0	107.8	W95 Q106 T152 G153 F154	W95-Q104 PolarHBondContact O-N 3.24Å; Q104-Q106 PolarHBondContact O-NE2 3.38Å; Q104-T152 WeakPolarHBondContact CG-O 3.42Å; Q104-T152 PolarHBondContact NE2-O 3.38Å; Q104-G153 WeakPolarHBondContact CA-O 3.28Å; Q104-F154 HydrophobicContact CB-CD2 4.37Å; Q104-F154 HydrophobicContact CG-CB 4.14Å
105	L	91.5	Very high	88.9	Confident	9 Å²	9	47.5 Å²	47.5	5%	0.047	24%	0.244	C	C	.	.			trans	-60.5	139.9	-178.1	-63	161.9	0	0	0	110.4	Q54 A69 A70 L71 L107 Y121 P123 G153	Q54-L105 HydrophobicContact CB-CD2 4.06Å; A69-L105 HydrophobicContact CB-CD1 4.22Å; A69-L105 HydrophobicContact CB-CD2 3.94Å; A69-L105 HydrophobicContact CB-CG 4.06Å; A70-L105 WeakPolarHBondContact O-CD1 3.4Å; L71-L105 HydrophobicContact CB-CB 4.37Å; L71-L105 HydrophobicContact CB-CD1 4.04Å; L71-L105 HydrophobicContact CB-CD2 3.91Å; L71-L105 HydrophobicContact CB-CG 4.33Å; L71-L105 HydrophobicContact CD2-CB 4.42Å; L105-L107 HydrophobicContact CB-CD1 4.46Å; L105-Y121 HydrophobicContact CD1-CD2 4.29Å; L105-Y121 HydrophobicContact CD1-CE2 4.11Å; L105-P123 HydrophobicContact CD1-CB 4.15Å; L105-G153 PolarHBondContact N-O 3.19Å
106	Q	89.6	Confident	89.3	Confident	71 Å²	71	46.6 Å²	46.6	33%	0.332	25%	0.245	S	C	.	.			trans	-95.9	102.8	179.9	-61.9	-56.5	-61.2	0	0	109.9	Q54 W95 Q104	Q54-Q106 PolarHBondContact NE2-O 2.93Å; W95-Q106 HydrophobicContact CB-CG 4.35Å; W95-Q106 HydrophobicContact CD2-CB 4.38Å; W95-Q106 HydrophobicContact CD2-CG 3.34Å; W95-Q106 VanDerWaalsContact CE2-CG 3.42Å; W95-Q106 HydrophobicContact CE3-CB 4.33Å; W95-Q106 HydrophobicContact CE3-CG 3.66Å; W95-Q106 HydrophobicContact CG-CG 3.59Å; W95-Q106 HydrophobicContact CH2-CB 4.27Å; W95-Q106 HydrophobicContact CH2-CG 4.17Å; W95-Q106 HydrophobicContact CZ2-CB 4.31Å; W95-Q106 HydrophobicContact CZ2-CG 3.88Å; W95-Q106 HydrophobicContact CZ3-CB 4.25Å; W95-Q106 HydrophobicContact CZ3-CG 4.04Å; Q104-Q106 PolarHBondContact O-NE2 3.38Å
107	L	90.4	Very high	89.3	Confident	14 Å²	14	49.6 Å²	49.6	7%	0.073	26%	0.26	C	S	.	.			trans	-87.2	130.6	177	-65.9	90.9	0	0	0	110.7	L71 L105 L111 R112 I118 Y121 R151	L71-L107 HydrophobicContact CD2-CG 4.07Å; L105-L107 HydrophobicContact CB-CD1 4.46Å; L107-L111 HydrophobicContact CB-CB 4.49Å; L107-L111 HydrophobicContact CD2-CB 4.31Å; L107-R112 HydrophobicContact CB-CG 3.91Å; L107-I118 HydrophobicContact CD2-CD1 3.97Å; L107-Y121 HydrophobicContact CD1-CE2 4.13Å; L107-Y121 HydrophobicContact CD2-CE2 4.13Å; L107-R151 HydrophobicContact CD2-CB 3.63Å; L107-R151 HydrophobicContact CD2-CG 4.48Å
108	P	89.6	Confident	89.3	Confident	33 Å²	33	51 Å²	51	21%	0.214	27%	0.267	C	S	.	.			trans	-49.9	145.2	158.8	-24.9	32.6	0	0	0	111.3	Y73 Y110 L111 R112	Y73-P108 HydrophobicContact CE1-CG 4.17Å; Y73-P108 HydrophobicContact CE2-CG 3.92Å; P108-Y110 HydrophobicContact CB-CD1 3.58Å; P108-Y110 HydrophobicContact CB-CE1 3.24Å; P108-Y110 HydrophobicContact CG-CE1 3.97Å; P108-Y110 PolarHBondContact O-N 2.89Å; P108-Y110 VanDerWaalsContact O-N 3.14Å; P108-L111 HydrophobicContact CB-CG 4.5Å; P108-L111 HydrophobicContact CG-CD1 4.12Å; P108-L111 PolarHBondContact O-N 2.82Å; P108-R112 PolarHBondContact O-N 3.35Å
109	E	88.5	Confident	89.3	Confident	111 Å²	111	50.5 Å²	50.5	52%	0.519	26%	0.263	S	S	.	.	H	α-helix	trans	-56.2	-37.5	-173.3	-169.5	67.6	-169.1	0	0	112.4	L111 R112 K241	E109-L111 VanDerWaalsContact C-N 3.25Å; E109-L111 PolarHBondContact O-N 3.24Å; E109-R112 WeakPolarHBondContact O-CB 3.46Å; E109-R112 PolarHBondContact O-N 2.85Å; E109-R112 WeakPolarHBondContact OE2-CD 3.22Å; E109-R112 IonicContact OE2-CZ 2.97Å; E109-R112 VanDerWaalsContact OE2-CZ 3.29Å; E109-R112 IonicContact OE2-NE 3.51Å; E109-R112 PolarHBondContact OE2-NE 2.89Å; E109-R112 IonicContact OE2-NH1 3.27Å; E109-R112 PolarHBondContact OE2-NH1 2.8Å; E109-K241 IonicContact OE1-NZ 3.4Å
110	Y	88.5	Confident	89.4	Confident	98 Å²	98	49.6 Å²	49.6	38%	0.384	24%	0.236	S	C	.	.	H	α-helix	trans	-66.8	-21.8	178.1	71.1	-88.6	0	0	0	114.1	I76 P108 A116	I76-Y110 HydrophobicContact CD1-CD1 4.43Å; I76-Y110 HydrophobicContact CD1-CD2 3.75Å; I76-Y110 HydrophobicContact CD1-CE1 4.15Å; I76-Y110 HydrophobicContact CD1-CE2 3.4Å; I76-Y110 VanDerWaalsContact CD1-CE2 3.4Å; I76-Y110 HydrophobicContact CD1-CG 4.26Å; I76-Y110 HydrophobicContact CG1-CE1 4.33Å; I76-Y110 HydrophobicContact CG1-CE2 3.86Å; P108-Y110 HydrophobicContact CB-CD1 3.58Å; P108-Y110 HydrophobicContact CB-CE1 3.24Å; P108-Y110 HydrophobicContact CG-CE1 3.97Å; P108-Y110 PolarHBondContact O-N 2.89Å; P108-Y110 VanDerWaalsContact O-N 3.14Å; Y110-A116 WeakPolarHBondContact O-CB 3.46Å
111	L	92.5	Very high	89.7	Confident	6 Å²	6	51 Å²	51	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-92.6	-11.5	178.5	-65.3	-177.1	0	0	0	113.9	Y73 L107 P108 E109 S113 A116 I118 R151	Y73-L111 HydrophobicContact CD1-CD1 3.51Å; Y73-L111 HydrophobicContact CD2-CD1 3.59Å; Y73-L111 HydrophobicContact CE1-CD1 4.15Å; Y73-L111 HydrophobicContact CE2-CD1 4.22Å; Y73-L111 HydrophobicContact CG-CD1 3.19Å; L107-L111 HydrophobicContact CB-CB 4.49Å; L107-L111 HydrophobicContact CD2-CB 4.31Å; P108-L111 HydrophobicContact CB-CG 4.5Å; P108-L111 HydrophobicContact CG-CD1 4.12Å; P108-L111 PolarHBondContact O-N 2.82Å; E109-L111 VanDerWaalsContact C-N 3.25Å; E109-L111 PolarHBondContact O-N 3.24Å; L111-S113 VanDerWaalsContact C-N 3.28Å; L111-S113 PolarHBondContact O-N 2.88Å; L111-A116 HydrophobicContact CD2-CB 4.06Å; L111-I118 HydrophobicContact CB-CD1 4.23Å; L111-I118 HydrophobicContact CB-CG1 4.45Å; L111-I118 HydrophobicContact CD2-CG1 4.11Å; L111-R151 PolarHBondContact O-NH1 2.9Å
112	R	92.9	Very high	90.1	Very high	76 Å²	76	52 Å²	52	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-65	-34.4	175.9	-69.6	-172.6	177.6	179.4	-2.8	111.8	L107 P108 E109 R114 E150 R151	L107-R112 HydrophobicContact CB-CG 3.91Å; P108-R112 PolarHBondContact O-N 3.35Å; E109-R112 WeakPolarHBondContact O-CB 3.46Å; E109-R112 PolarHBondContact O-N 2.85Å; E109-R112 WeakPolarHBondContact OE2-CD 3.22Å; E109-R112 IonicContact OE2-CZ 2.97Å; E109-R112 VanDerWaalsContact OE2-CZ 3.29Å; E109-R112 IonicContact OE2-NE 3.51Å; E109-R112 PolarHBondContact OE2-NE 2.89Å; E109-R112 IonicContact OE2-NH1 3.27Å; E109-R112 PolarHBondContact OE2-NH1 2.8Å; R112-R114 PolarHBondContact O-N 3.1Å; R112-E150 HydrophobicContact CB-CB 4.16Å; R112-E150 CarbonylContact O-C 3.57Å; R112-E150 WeakPolarHBondContact O-CA 3.4Å; R112-R151 PolarHBondContact O-N 3.08Å
113	S	91.8	Very high	90.4	Very high	29 Å²	29	52.6 Å²	52.6	20%	0.203	25%	0.249	C	C	.	.	S	Bend	trans	-55.6	129.6	173.7	176.4	0	0	0	0	111.1	L111 D115 A116 R151 K304	L111-S113 VanDerWaalsContact C-N 3.28Å; L111-S113 PolarHBondContact O-N 2.88Å; S113-D115 PolarHBondContact O-N 2.73Å; S113-D115 VanDerWaalsContact O-N 3.16Å; S113-D115 PolarHBondContact OG-N 3.49Å; S113-D115 PolarHBondContact OG-OD2 3.12Å; S113-A116 VanDerWaalsContact O-CB 3.23Å; S113-A116 WeakPolarHBondContact O-CB 3.43Å; S113-A116 PolarHBondContact O-N 3.42Å; S113-R151 PolarHBondContact O-NH1 3.38Å; S113-K304 PolarHBondContact OG-NZ 2.76Å
114	R	89.7	Confident	90.6	Very high	56 Å²	56	52.1 Å²	52.1	21%	0.211	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-31.2	176.2	-76.7	-67.8	-153.2	-167.2	0.4	113.1	R112 A116 N147 R151 D247	R112-R114 PolarHBondContact O-N 3.1Å; R114-A116 PolarHBondContact O-N 3.5Å; R114-N147 PolarHBondContact NE-O 2.95Å; R114-N147 PolarHBondContact NH2-O 3.14Å; R114-N147 VanDerWaalsContact NH2-O 3.11Å; R114-R151 PolarHBondContact O-NH1 2.89Å; R114-R151 PolarHBondContact O-NH2 3.48Å; R114-D247 IonicContact CZ-OD2 3.71Å; R114-D247 IonicContact NH1-OD2 3.67Å; R114-D247 PolarHBondContact NH1-OD2 3.39Å; R114-D247 VanDerWaalsContact NH1-OD2 3.09Å; R114-D247 PolarHBondContact NH2-O 2.82Å; R114-D247 VanDerWaalsContact NH2-O 3.11Å; R114-D247 IonicContact NH2-OD2 2.84Å
115	D	89.8	Confident	90.6	Very high	129 Å²	129	51.6 Å²	51.6	69%	0.69	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-14	179.6	-45.3	-49.3	0	0	0	113	S113 K304	S113-D115 PolarHBondContact O-N 2.73Å; S113-D115 VanDerWaalsContact O-N 3.16Å; S113-D115 PolarHBondContact OG-N 3.49Å; S113-D115 PolarHBondContact OG-OD2 3.12Å; D115-K304 IonicContact OD2-NZ 3.75Å; D115-K304 PolarHBondContact OD2-NZ 2.96Å
116	A	90.7	Very high	90.6	Very high	21 Å²	21	52.8 Å²	52.8	17%	0.174	25%	0.25	C	C	.	.	S	Bend	trans	-69.4	136.5	178.3	0	0	0	0	0	110.9	Y110 L111 S113 R114 I118 R151	Y110-A116 WeakPolarHBondContact O-CB 3.46Å; L111-A116 HydrophobicContact CD2-CB 4.06Å; S113-A116 VanDerWaalsContact O-CB 3.23Å; S113-A116 WeakPolarHBondContact O-CB 3.43Å; S113-A116 PolarHBondContact O-N 3.42Å; R114-A116 PolarHBondContact O-N 3.5Å; A116-I118 PolarHBondContact O-N 3.26Å; A116-R151 PolarHBondContact O-NH1 2.99Å; A116-R151 PolarHBondContact O-NH2 3.16Å
117	K	89.7	Confident	90.5	Very high	148 Å²	148	52 Å²	52	64%	0.643	25%	0.246	S	C	*	.			trans	-74.3	121.5	174.6	-171.7	179.4	-179.2	-176.3	0	109.5
118	I	90.2	Very high	90.2	Very high	29 Å²	29	52 Å²	52	15%	0.149	25%	0.247	C	C	.	.			trans	-119.1	141.8	172.5	-60.3	-178	0	0	0	107.4	L71 C72 L107 L111 A116 W120 R151	L71-I118 HydrophobicContact CD1-CD1 4.27Å; L71-I118 HydrophobicContact CD1-CG2 3.67Å; C72-I118 WeakPolarHBondContact O-CG2 3.43Å; L107-I118 HydrophobicContact CD2-CD1 3.97Å; L111-I118 HydrophobicContact CB-CD1 4.23Å; L111-I118 HydrophobicContact CB-CG1 4.45Å; L111-I118 HydrophobicContact CD2-CG1 4.11Å; A116-I118 PolarHBondContact O-N 3.26Å; I118-W120 VanDerWaalsContact CG2-O 3.26Å; I118-W120 WeakPolarHBondContact CG2-O 3.22Å; I118-R151 VanDerWaalsContact CD1-CD 3.47Å
119	L	88	Confident	89.5	Confident	28 Å²	28	51.3 Å²	51.3	15%	0.147	24%	0.241	C	C	.	.	S	Bend	trans	-75.5	-46.8	-178.4	-61.8	175.4	0	0	0	110.6	L38 M49 V51 C72	L38-L119 HydrophobicContact CD1-CB 3.81Å; L38-L119 HydrophobicContact CD1-CD2 4.42Å; L38-L119 HydrophobicContact CD2-CB 4.08Å; L38-L119 HydrophobicContact CD2-CD2 4.1Å; L38-L119 VanDerWaalsContact CD2-O 3.31Å; L38-L119 WeakPolarHBondContact CD2-O 3.33Å; M49-L119 HydrophobicContact CE-CD1 3.74Å; M49-L119 HydrophobicContact CE-CD2 4.37Å; M49-L119 HydrophobicContact SD-CD1 4.33Å; V51-L119 HydrophobicContact CB-CD1 4.48Å; V51-L119 HydrophobicContact CG1-CD1 3.96Å; V51-L119 HydrophobicContact CG2-CD1 3.69Å; C72-L119 HydrophobicContact CB-CB 4.31Å; C72-L119 WeakPolarHBondContact O-CA 3.36Å; C72-L119 WeakPolarHBondContact O-CB 3.43Å; C72-L119 PolarHBondContact O-N 3.02Å
120	W	89.7	Confident	88.2	Confident	53 Å²	53	50.6 Å²	50.6	20%	0.201	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	131.5	173	-172.8	1.5	0	0	0	109.4	Y35 C36 F55 A70 L71 C72 I118 E122	Y35-W120 WeakPolarHBondContact O-CH2 3.15Å; Y35-W120 WeakPolarHBondContact O-CZ3 3.33Å; C36-W120 HydrophobicContact CB-CD2 4.25Å; C36-W120 HydrophobicContact CB-CE3 3.63Å; C36-W120 HydrophobicContact CB-CZ3 4.09Å; C36-W120 VanDerWaalsContact SG-CZ3 3.51Å; F55-W120 HydrophobicContact CE1-CE3 4.02Å; F55-W120 HydrophobicContact CE1-CH2 4.4Å; F55-W120 AromaticContact CE1-CZ3 3.77Å; F55-W120 HydrophobicContact CE1-CZ3 3.77Å; F55-W120 HydrophobicContact CZ-CZ3 4.36Å; A70-W120 HydrophobicContact CB-CD2 3.9Å; A70-W120 HydrophobicContact CB-CE3 4.31Å; A70-W120 HydrophobicContact CB-CG 4.33Å; A70-W120 HydrophobicContact CB-CZ2 4.07Å; L71-W120 CarbonylContact C-O 3.49Å; L71-W120 VanDerWaalsContact CA-O 3.28Å; L71-W120 WeakPolarHBondContact CA-O 3.18Å; C72-W120 HydrophobicContact CB-CB 4.01Å; C72-W120 PolarHBondContact N-O 3.08Å; C72-W120 PolarHBondContact O-N 3.34Å; C72-W120 VanDerWaalsContact O-N 3.1Å; I118-W120 VanDerWaalsContact CG2-O 3.26Å; I118-W120 WeakPolarHBondContact CG2-O 3.22Å; W120-E122 PolarHBondContact NE1-OE2 3.36Å; W120-E122 VanDerWaalsContact NE1-OE2 3.15Å
121	Y	92.1	Very high	86.6	Confident	49 Å²	49	48.8 Å²	48.8	19%	0.192	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	107.4	175.9	-179.4	-109.7	0	0	0	110.9	L71 L105 L107 P123 R151 G153 D247	L71-Y121 HydrophobicContact CD1-CD2 4.03Å; L105-Y121 HydrophobicContact CD1-CD2 4.29Å; L105-Y121 HydrophobicContact CD1-CE2 4.11Å; L107-Y121 HydrophobicContact CD1-CE2 4.13Å; L107-Y121 HydrophobicContact CD2-CE2 4.13Å; Y121-P123 HydrophobicContact CD1-CG 4.48Å; Y121-P123 HydrophobicContact CE1-CG 3.77Å; Y121-P123 HydrophobicContact CE2-CB 4.37Å; Y121-P123 HydrophobicContact CE2-CG 4.45Å; Y121-R151 HydrophobicContact CE1-CB 4.37Å; Y121-R151 HydrophobicContact CE1-CG 4.05Å; Y121-G153 WeakPolarHBondContact OH-CA 3.43Å; Y121-G153 PolarHBondContact OH-N 3.08Å; Y121-D247 WeakPolarHBondContact CE1-OD2 3.33Å; Y121-D247 PolarHBondContact OH-OD1 3.11Å; Y121-D247 PolarHBondContact OH-OD2 3.33Å
122	E	91	Very high	84.4	Confident	90 Å²	90	59 Å²	59	42%	0.421	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	89.8	-179.9	-174.1	166.6	-175.1	0	0	108.3	A69 A70 W120	A69-E122 CarbonylContact C-O 3.42Å; A69-E122 WeakPolarHBondContact CA-O 3.49Å; A70-E122 HydrophobicContact CB-CB 4.33Å; A70-E122 PolarHBondContact N-O 3.29Å; A70-E122 PolarHBondContact O-N 2.86Å; W120-E122 PolarHBondContact NE1-OE2 3.36Å; W120-E122 VanDerWaalsContact NE1-OE2 3.15Å
123	P	93.6	Very high	82.2	Confident	19 Å²	19	57.4 Å²	57.4	12%	0.123	29%	0.293	C	S	.	.			trans	-80.9	145.1	-178.8	31	-35.7	0	0	0	112.5	L105 Y121 S155	L105-P123 HydrophobicContact CD1-CB 4.15Å; Y121-P123 HydrophobicContact CD1-CG 4.48Å; Y121-P123 HydrophobicContact CE1-CG 3.77Å; Y121-P123 HydrophobicContact CE2-CB 4.37Å; Y121-P123 HydrophobicContact CE2-CG 4.45Å; P123-S155 PolarHBondContact O-OG 3.07Å; P123-S155 VanDerWaalsContact O-OG 3.06Å
124	A	91.4	Very high	80.5	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.008	32%	0.317	C	S	.	.			trans	-61.4	158.4	170.6	0	0	0	0	0	111.7	I68 A69 P103 F154 S155	I68-A124 WeakPolarHBondContact O-CA 3.36Å; I68-A124 WeakPolarHBondContact O-CB 3.33Å; I68-A124 PolarHBondContact O-N 2.97Å; A69-A124 HydrophobicContact CB-CB 4.21Å; P103-A124 HydrophobicContact CG-CB 4.16Å; P103-A124 WeakPolarHBondContact O-CB 3.3Å; A124-F154 HydrophobicContact CB-CD2 4.3Å; A124-F154 HydrophobicContact CB-CE2 3.94Å; A124-F154 WeakPolarHBondContact O-CD2 3.25Å; A124-S155 PolarHBondContact O-N 2.89Å; A124-S155 PolarHBondContact O-OG 3.32Å
125	N	92.5	Very high	79.1	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.07	32%	0.319	C	S	.	.			trans	-145.9	160.2	175.6	64.4	90	0	0	0	110.3	L102 E127 S128 F129 W144 S155	L102-N125 WeakPolarHBondContact CD1-O 3.26Å; N125-E127 WeakPolarHBondContact OD1-CA 3.44Å; N125-E127 WeakPolarHBondContact OD1-CB 3.29Å; N125-E127 PolarHBondContact OD1-N 2.84Å; N125-E127 VanDerWaalsContact OD1-N 3.16Å; N125-S128 PolarHBondContact ND2-OG 2.85Å; N125-S128 VanDerWaalsContact ND2-OG 3.11Å; N125-S128 WeakPolarHBondContact OD1-CB 3.23Å; N125-S128 PolarHBondContact OD1-N 2.9Å; N125-S128 PolarHBondContact OD1-OG 2.99Å; N125-F129 VanDerWaalsContact O-CD2 3.25Å; N125-F129 WeakPolarHBondContact O-CD2 3.13Å; N125-W144 HydrophobicContact CB-CH2 4.27Å; N125-W144 HydrophobicContact CB-CZ3 4.34Å; N125-S155 WeakPolarHBondContact CA-O 3.37Å; N125-S155 VanDerWaalsContact CB-O 3.24Å; N125-S155 WeakPolarHBondContact CB-O 3.16Å; N125-S155 WeakPolarHBondContact CB-OG 3.07Å
126	L	89.9	Confident	78	Confident	34 Å²	34	53.9 Å²	53.9	18%	0.178	29%	0.29	C	S	.	.	S	Bend	trans	-77.1	-29.8	179.2	-78	171.7	0	0	0	112.5	T100 L102 S128 F129 F154 G158	T100-L126 HydrophobicContact CG2-CD1 4.3Å; T100-L126 HydrophobicContact CG2-CD2 3.89Å; L102-L126 HydrophobicContact CD1-CD2 3.69Å; L102-L126 HydrophobicContact CD1-CG 4.28Å; L126-S128 PolarHBondContact O-N 2.94Å; L126-F129 CarbonylContact O-C 3.39Å; L126-F129 PolarHBondContact O-N 2.84Å; L126-F129 VanDerWaalsContact O-O 3.11Å; L126-F154 HydrophobicContact CG-CE1 4.35Å; L126-F154 HydrophobicContact CG-CZ 4.22Å; L126-G158 WeakPolarHBondContact CD1-O 3.25Å
127	E	88.8	Confident	77.1	Confident	55 Å²	55	59.2 Å²	59.2	26%	0.257	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-28	-175.7	-66.1	83.3	161.9	0	0	112.4	N125 F129 V139 W144 G156 M157 Y163	N125-E127 WeakPolarHBondContact OD1-CA 3.44Å; N125-E127 WeakPolarHBondContact OD1-CB 3.29Å; N125-E127 PolarHBondContact OD1-N 2.84Å; N125-E127 VanDerWaalsContact OD1-N 3.16Å; E127-F129 PolarHBondContact O-N 2.8Å; E127-V139 HydrophobicContact CB-CG1 4.32Å; E127-V139 HydrophobicContact CB-CG2 4.25Å; E127-W144 HydrophobicContact CB-CH2 4.15Å; E127-W144 HydrophobicContact CB-CZ2 4.16Å; E127-W144 HydrophobicContact CG-CH2 4.25Å; E127-W144 HydrophobicContact CG-CZ2 4.09Å; E127-G156 WeakPolarHBondContact OE1-CA 3.37Å; E127-G156 WeakPolarHBondContact OE2-CA 3.28Å; E127-M157 PolarHBondContact OE1-N 2.92Å; E127-Y163 PolarHBondContact OE1-OH 2.97Å
128	S	84	Confident	76.3	Confident	13 Å²	13	60.7 Å²	60.7	9%	0.091	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-20.3	171.9	-77.6	0	0	0	0	112.7	N125 L126 S136 R137	N125-S128 PolarHBondContact ND2-OG 2.85Å; N125-S128 VanDerWaalsContact ND2-OG 3.11Å; N125-S128 WeakPolarHBondContact OD1-CB 3.23Å; N125-S128 PolarHBondContact OD1-N 2.9Å; N125-S128 PolarHBondContact OD1-OG 2.99Å; L126-S128 PolarHBondContact O-N 2.94Å; S128-S136 CarbonylContact O-C 3.49Å; S128-S136 VanDerWaalsContact O-CA 3.26Å; S128-S136 WeakPolarHBondContact O-CA 3.48Å; S128-R137 WeakPolarHBondContact CA-O 3.4Å; S128-R137 VanDerWaalsContact CB-O 3.23Å; S128-R137 WeakPolarHBondContact CB-O 3.49Å; S128-R137 PolarHBondContact O-N 2.72Å; S128-R137 PolarHBondContact OG-O 2.81Å
129	F	75.1	Confident	75.7	Confident	19 Å²	19	61.7 Å²	61.7	8%	0.083	32%	0.323	C	S	.	.			trans	-116	88	-176.2	-62.4	-95.4	0	0	0	109.4	F17 I68 L102 N125 L126 E127	F17-F129 HydrophobicContact CE1-CE1 4.3Å; F17-F129 HydrophobicContact CE1-CZ 4.49Å; F17-F129 AromaticContact CZ-CE1 3.9Å; F17-F129 HydrophobicContact CZ-CE1 3.9Å; F17-F129 HydrophobicContact CZ-CZ 4.28Å; I68-F129 HydrophobicContact CB-CZ 4.2Å; I68-F129 HydrophobicContact CD1-CZ 4.5Å; I68-F129 HydrophobicContact CG2-CZ 3.78Å; L102-F129 HydrophobicContact CD1-CD2 3.62Å; L102-F129 HydrophobicContact CD1-CE2 3.94Å; L102-F129 HydrophobicContact CD1-CG 4.29Å; L102-F129 HydrophobicContact CD2-CD1 4.14Å; L102-F129 HydrophobicContact CD2-CD2 3.68Å; L102-F129 HydrophobicContact CD2-CE1 3.9Å; L102-F129 HydrophobicContact CD2-CE2 3.43Å; L102-F129 VanDerWaalsContact CD2-CE2 3.43Å; L102-F129 HydrophobicContact CD2-CG 4.02Å; L102-F129 HydrophobicContact CD2-CZ 3.53Å; L102-F129 HydrophobicContact CG-CD2 4.31Å; L102-F129 HydrophobicContact CG-CE2 4.35Å; N125-F129 VanDerWaalsContact O-CD2 3.25Å; N125-F129 WeakPolarHBondContact O-CD2 3.13Å; L126-F129 CarbonylContact O-C 3.39Å; L126-F129 PolarHBondContact O-N 2.84Å; L126-F129 VanDerWaalsContact O-O 3.11Å; E127-F129 PolarHBondContact O-N 2.8Å
130	N	61.4	Low	75.3	Confident	96 Å²	96	64.3 Å²	64.3	51%	0.513	35%	0.349	S	S	.	.			trans	-87.9	127.6	177.8	-143.2	1.4	0	0	0	109	Y132 S133	N130-Y132 PolarHBondContact O-N 2.99Å; N130-S133 PolarHBondContact O-N 3.3Å
131	G	53.1	Low	75	Confident	61 Å²	61	65 Å²	65	63%	0.629	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	7.4	-166.5	0	0	0	0	0	118.2
132	Y	46.1	Very low	74.4	Confident	219 Å²	219	68.2 Å²	68.2	86%	0.859	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-6.3	175.2	-64.6	-76.7	0	0	0	113.6	N130	N130-Y132 PolarHBondContact O-N 2.99Å
133	S	48.4	Very low	74.3	Confident	44 Å²	44	75.2 Å²	75.2	31%	0.308	41%	0.406	S	S	.	.			trans	-135	129.6	-178.7	-53.5	0	0	0	0	108.8	N130 G135 R137	N130-S133 PolarHBondContact O-N 3.3Å; S133-G135 PolarHBondContact O-N 2.9Å; S133-R137 PolarHBondContact OG-NH2 3.01Å
134	S	56.3	Low	74.2	Confident	102 Å²	102	76 Å²	76	71%	0.713	41%	0.407	S	S	*	.	S	Bend	trans	-61.2	-29.6	174.8	52.1	0	0	0	0	111.9	E58	E58-S134 VanDerWaalsContact OE1-O 3.11Å
135	G	59.1	Low	74.3	Confident	25 Å²	25	80.3 Å²	80.3	26%	0.258	43%	0.429	S	S	.	.	S	Bend	trans	-81	138.7	-179.5	0	0	0	0	0	114.8	E58 S133	E58-G135 WeakPolarHBondContact OE1-CA 3.18Å; S133-G135 PolarHBondContact O-N 2.9Å
136	S	65.9	Low	74.3	Confident	12 Å²	12	87.7 Å²	87.7	8%	0.084	46%	0.456	C	S	.	.			trans	-59	154.2	164.5	52.8	0	0	0	0	112.2	E58 R66 S128	E58-S136 PolarHBondContact OE2-N 3.35Å; E58-S136 VanDerWaalsContact OE2-N 3.11Å; E58-S136 PolarHBondContact OE2-OG 3.12Å; R66-S136 VanDerWaalsContact CD-OG 3.27Å; R66-S136 WeakPolarHBondContact CD-OG 3.24Å; R66-S136 VanDerWaalsContact CZ-OG 3.3Å; R66-S136 PolarHBondContact NE-OG 3.43Å; R66-S136 PolarHBondContact NH1-O 2.67Å; R66-S136 PolarHBondContact NH1-OG 3.27Å; S128-S136 CarbonylContact O-C 3.49Å; S128-S136 VanDerWaalsContact O-CA 3.26Å; S128-S136 WeakPolarHBondContact O-CA 3.48Å
137	R	71.8	Confident	74.6	Confident	133 Å²	133	86 Å²	86	50%	0.502	45%	0.447	S	S	.	.			trans	-126.6	147.8	173.8	-63	-176.2	-175.2	-177	1.6	110.1	R66 S128 S133	R66-R137 VanDerWaalsContact NH2-C 3.25Å; S128-R137 WeakPolarHBondContact CA-O 3.4Å; S128-R137 VanDerWaalsContact CB-O 3.23Å; S128-R137 WeakPolarHBondContact CB-O 3.49Å; S128-R137 PolarHBondContact O-N 2.72Å; S128-R137 PolarHBondContact OG-O 2.81Å; S133-R137 PolarHBondContact OG-NH2 3.01Å
138	E	73.9	Confident	74.8	Confident	179 Å²	179	88.3 Å²	88.3	84%	0.836	47%	0.465	S	S	*	.			trans	-69.5	135.2	171.1	-69.1	-176	-175.9	0	0	110
139	V	77.2	Confident	75.2	Confident	50 Å²	50	90 Å²	90	30%	0.303	47%	0.47	S	S	.	.			trans	-125.4	132.7	179.2	-179.5	0	0	0	0	108.3	E127 T141 W144	E127-V139 HydrophobicContact CB-CG1 4.32Å; E127-V139 HydrophobicContact CB-CG2 4.25Å; V139-T141 WeakPolarHBondContact O-CG2 3.15Å; V139-T141 PolarHBondContact O-N 3.23Å; V139-W144 HydrophobicContact CG1-CH2 4.16Å; V139-W144 HydrophobicContact CG1-CZ2 3.59Å
140	A	79.9	Confident	76.1	Confident	84 Å²	84	89.8 Å²	89.8	69%	0.694	47%	0.469	S	S	*	.			trans	-70.2	103.1	177.4	0	0	0	0	0	110.6
141	T	82.9	Confident	77.7	Confident	67 Å²	67	86.9 Å²	86.9	41%	0.411	45%	0.451	S	S	.	.			trans	-91.5	-6.2	-176.3	64.1	0	0	0	0	114	V139 R143 W144	V139-T141 WeakPolarHBondContact O-CG2 3.15Å; V139-T141 PolarHBondContact O-N 3.23Å; T141-R143 PolarHBondContact O-N 2.96Å; T141-R143 VanDerWaalsContact O-N 3.12Å; T141-W144 HydrophobicContact CG2-CD2 4.18Å; T141-W144 HydrophobicContact CG2-CE3 3.69Å; T141-W144 HydrophobicContact CG2-CH2 3.75Å; T141-W144 HydrophobicContact CG2-CZ2 4.21Å; T141-W144 HydrophobicContact CG2-CZ3 3.44Å; T141-W144 VanDerWaalsContact CG2-CZ3 3.44Å; T141-W144 WeakPolarHBondContact O-CB 3.4Å; T141-W144 PolarHBondContact O-N 2.97Å
142	T	80.7	Confident	79.8	Confident	117 Å²	117	84.7 Å²	84.7	72%	0.718	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.1	-171.5	51.8	0	0	0	0	114.2
143	R	87.4	Confident	82.1	Confident	237 Å²	237	74.2 Å²	74.2	89%	0.894	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-2.6	-179.7	-62.7	-173.9	-179.9	-173.2	0.5	113.8	T141	T141-R143 PolarHBondContact O-N 2.96Å; T141-R143 VanDerWaalsContact O-N 3.12Å
144	W	92.1	Very high	84.4	Confident	35 Å²	35	72.1 Å²	72.1	13%	0.133	37%	0.369	C	S	.	.	S	Bend	trans	-71.5	134.7	-178.7	-65.5	-8.5	0	0	0	110.8	N125 E127 V139 T141 R146 G156 Y163 N248	N125-W144 HydrophobicContact CB-CH2 4.27Å; N125-W144 HydrophobicContact CB-CZ3 4.34Å; E127-W144 HydrophobicContact CB-CH2 4.15Å; E127-W144 HydrophobicContact CB-CZ2 4.16Å; E127-W144 HydrophobicContact CG-CH2 4.25Å; E127-W144 HydrophobicContact CG-CZ2 4.09Å; V139-W144 HydrophobicContact CG1-CH2 4.16Å; V139-W144 HydrophobicContact CG1-CZ2 3.59Å; T141-W144 HydrophobicContact CG2-CD2 4.18Å; T141-W144 HydrophobicContact CG2-CE3 3.69Å; T141-W144 HydrophobicContact CG2-CH2 3.75Å; T141-W144 HydrophobicContact CG2-CZ2 4.21Å; T141-W144 HydrophobicContact CG2-CZ3 3.44Å; T141-W144 VanDerWaalsContact CG2-CZ3 3.44Å; T141-W144 WeakPolarHBondContact O-CB 3.4Å; T141-W144 PolarHBondContact O-N 2.97Å; W144-R146 PolarHBondContact O-N 3.47Å; W144-G156 VanDerWaalsContact CZ3-CA 3.41Å; W144-G156 VanDerWaalsContact CZ3-N 3.3Å; W144-Y163 HydrophobicContact CB-CE1 4.46Å; W144-Y163 AromaticContact CD2-CE1 3.99Å; W144-Y163 HydrophobicContact CD2-CE1 3.99Å; W144-Y163 AromaticContact CG-CE1 3.98Å; W144-Y163 HydrophobicContact CG-CE1 3.98Å; W144-N248 HydrophobicContact CB-CB 4.32Å; W144-N248 VanDerWaalsContact CB-ND2 3.35Å; W144-N248 WeakPolarHBondContact CB-ND2 3.27Å
145	I	93.2	Very high	86.2	Confident	92 Å²	92	67.8 Å²	67.8	47%	0.472	34%	0.339	S	S	.	.			trans	-55.2	138.7	170.9	-61.5	174.6	0	0	0	108	N248 W250	I145-N248 WeakPolarHBondContact O-CA 3.35Å; I145-N248 VanDerWaalsContact O-CB 3.27Å; I145-N248 WeakPolarHBondContact O-CB 3.41Å; I145-N248 PolarHBondContact O-ND2 3.44Å; I145-W250 HydrophobicContact CG2-CH2 3.82Å; I145-W250 HydrophobicContact CG2-CZ3 4.15Å
146	R	93.8	Very high	87.9	Confident	167 Å²	167	66.6 Å²	66.6	63%	0.63	33%	0.327	S	S	*	.			trans	-104.2	132.6	-178	-69.3	-176.9	-179.4	-174.1	-1.2	110.6	W144 T148 W250	W144-R146 PolarHBondContact O-N 3.47Å; R146-T148 PolarHBondContact O-N 2.79Å; R146-T148 VanDerWaalsContact O-N 3.14Å; R146-W250 WeakPolarHBondContact O-CH2 3.38Å
147	N	95.1	Very high	89.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.336	C	S	.	.			trans	-62.1	111.8	163.9	-172.9	-16.4	0	0	0	108.1	R114 Y149 E150 Y239 T246 D247 W250	R114-N147 PolarHBondContact NE-O 2.95Å; R114-N147 PolarHBondContact NH2-O 3.14Å; R114-N147 VanDerWaalsContact NH2-O 3.11Å; N147-Y149 VanDerWaalsContact C-N 3.35Å; N147-Y149 WeakPolarHBondContact OD1-CB 3.35Å; N147-Y149 PolarHBondContact OD1-N 2.99Å; N147-E150 PolarHBondContact OD1-N 3.47Å; N147-Y239 WeakPolarHBondContact ND2-CE2 3.4Å; N147-Y239 PolarHBondContact ND2-OH 3.33Å; N147-Y239 VanDerWaalsContact ND2-OH 3.09Å; N147-T246 PolarHBondContact ND2-O 2.9Å; N147-T246 VanDerWaalsContact ND2-O 3.08Å; N147-D247 WeakPolarHBondContact CB-O 3.47Å; N147-D247 PolarHBondContact N-O 3.09Å; N147-W250 HydrophobicContact CB-CD2 4.22Å; N147-W250 HydrophobicContact CB-CE3 3.52Å; N147-W250 HydrophobicContact CB-CZ3 3.77Å; N147-W250 VanDerWaalsContact N-CZ3 3.31Å
148	T	92.5	Very high	90.3	Very high	103 Å²	103	62.9 Å²	62.9	63%	0.632	32%	0.317	S	S	*	.	S	Bend	trans	-82.7	-15.9	-178.5	51.6	0	0	0	0	112.4	R146	R146-T148 PolarHBondContact O-N 2.79Å; R146-T148 VanDerWaalsContact O-N 3.14Å
149	Y	92.9	Very high	91.2	Very high	49 Å²	49	58.3 Å²	58.3	19%	0.192	30%	0.295	C	S	.	.	S	Bend	trans	-80.1	-45.3	-178.4	-62.3	-93.4	0	0	0	111.8	N147 Y239 A303	N147-Y149 VanDerWaalsContact C-N 3.35Å; N147-Y149 WeakPolarHBondContact OD1-CB 3.35Å; N147-Y149 PolarHBondContact OD1-N 2.99Å; Y149-Y239 HydrophobicContact CD1-CD2 4.11Å; Y149-Y239 AromaticContact CD1-CG 3.97Å; Y149-Y239 HydrophobicContact CD1-CG 3.97Å; Y149-Y239 AromaticContact CD2-CD2 3.24Å; Y149-Y239 HydrophobicContact CD2-CD2 3.24Å; Y149-Y239 AromaticContact CD2-CE2 3.87Å; Y149-Y239 HydrophobicContact CD2-CE2 3.87Å; Y149-Y239 AromaticContact CD2-CG 3.95Å; Y149-Y239 HydrophobicContact CD2-CG 3.95Å; Y149-Y239 HydrophobicContact CE1-CG 4.38Å; Y149-Y239 AromaticContact CE2-CD2 3.78Å; Y149-Y239 HydrophobicContact CE2-CD2 3.78Å; Y149-Y239 HydrophobicContact CE2-CG 4.37Å; Y149-Y239 AromaticContact CG-CD2 3.43Å; Y149-Y239 HydrophobicContact CG-CD2 3.43Å; Y149-Y239 VanDerWaalsContact CG-CD2 3.43Å; Y149-Y239 HydrophobicContact CG-CE2 4.04Å; Y149-Y239 AromaticContact CG-CG 3.74Å; Y149-Y239 HydrophobicContact CG-CG 3.74Å; Y149-A303 HydrophobicContact CE1-CB 4.01Å
150	E	94.4	Very high	92	Very high	14 Å²	14	56.2 Å²	56.2	7%	0.065	28%	0.282	C	S	.	.			trans	-154.8	159.5	-177.3	63.5	-176.6	159.5	0	0	114.3	R112 N147 T152 Y239 M301	R112-E150 HydrophobicContact CB-CB 4.16Å; R112-E150 CarbonylContact O-C 3.57Å; R112-E150 WeakPolarHBondContact O-CA 3.4Å; N147-E150 PolarHBondContact OD1-N 3.47Å; E150-T152 HydrophobicContact CG-CG2 3.99Å; E150-Y239 WeakPolarHBondContact CG-OH 3.06Å; E150-Y239 VanDerWaalsContact OE1-CE1 3.25Å; E150-Y239 WeakPolarHBondContact OE1-CE1 2.83Å; E150-Y239 VanDerWaalsContact OE1-CZ 3.23Å; E150-Y239 PolarHBondContact OE1-OH 2.84Å; E150-M301 HydrophobicContact CB-CE 4.12Å; E150-M301 VanDerWaalsContact CD-CE 3.41Å; E150-M301 HydrophobicContact CG-CE 3.8Å; E150-M301 WeakPolarHBondContact OE1-CE 3.37Å
151	R	95.8	Very high	92.6	Very high	34 Å²	34	55.9 Å²	55.9	13%	0.128	27%	0.272	C	S	.	.			trans	-81.3	133.3	152.9	-66.4	-175.6	-173.7	88.8	3.1	108.5	L107 L111 R112 S113 R114 A116 I118 Y121	L107-R151 HydrophobicContact CD2-CB 3.63Å; L107-R151 HydrophobicContact CD2-CG 4.48Å; L111-R151 PolarHBondContact O-NH1 2.9Å; R112-R151 PolarHBondContact O-N 3.08Å; S113-R151 PolarHBondContact O-NH1 3.38Å; R114-R151 PolarHBondContact O-NH1 2.89Å; R114-R151 PolarHBondContact O-NH2 3.48Å; A116-R151 PolarHBondContact O-NH1 2.99Å; A116-R151 PolarHBondContact O-NH2 3.16Å; I118-R151 VanDerWaalsContact CD1-CD 3.47Å; Y121-R151 HydrophobicContact CE1-CB 4.37Å; Y121-R151 HydrophobicContact CE1-CG 4.05Å
152	T	95.8	Very high	93.1	Very high	15 Å²	15	58.8 Å²	58.8	9%	0.092	28%	0.281	C	S	.	.			trans	-109.3	-8.7	-174	64.7	0	0	0	0	113.1	Q104 E150 F154 N245 T246 D247	Q104-T152 WeakPolarHBondContact CG-O 3.42Å; Q104-T152 PolarHBondContact NE2-O 3.38Å; E150-T152 HydrophobicContact CG-CG2 3.99Å; T152-F154 VanDerWaalsContact C-N 3.26Å; T152-F154 PolarHBondContact O-N 3.43Å; T152-F154 PolarHBondContact OG1-N 3.14Å; T152-F154 PolarHBondContact OG1-O 3.3Å; T152-N245 HydrophobicContact CG2-CB 4.26Å; T152-T246 VanDerWaalsContact CG2-C 3.42Å; T152-T246 WeakPolarHBondContact CG2-O 3.49Å; T152-T246 WeakPolarHBondContact OG1-CA 3.15Å; T152-D247 PolarHBondContact N-OD1 2.79Å; T152-D247 PolarHBondContact OG1-N 2.73Å; T152-D247 PolarHBondContact OG1-OD1 3.11Å
153	G	95.4	Very high	93.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.261	C	S	.	.	S	Bend	trans	78.2	7.9	-174.7	0	0	0	0	0	114.4	Q104 L105 Y121	Q104-G153 WeakPolarHBondContact CA-O 3.28Å; L105-G153 PolarHBondContact N-O 3.19Å; Y121-G153 WeakPolarHBondContact OH-CA 3.43Å; Y121-G153 PolarHBondContact OH-N 3.08Å
154	F	95.7	Very high	94.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.219	C	C	.	.			trans	-143.4	135.4	176.6	-158	-97.7	0	0	0	109.8	Y97 L102 P103 Q104 A124 L126 T152 T246 D247	Y97-F154 HydrophobicContact CD1-CD1 4.2Å; Y97-F154 AromaticContact CD1-CE1 3.86Å; Y97-F154 HydrophobicContact CD1-CE1 3.86Å; Y97-F154 HydrophobicContact CD1-CE2 4.5Å; Y97-F154 HydrophobicContact CD1-CZ 4.03Å; Y97-F154 HydrophobicContact CD2-CB 3.87Å; Y97-F154 AromaticContact CD2-CD1 3.57Å; Y97-F154 HydrophobicContact CD2-CD1 3.57Å; Y97-F154 AromaticContact CD2-CD2 4Å; Y97-F154 HydrophobicContact CD2-CD2 4Å; Y97-F154 HydrophobicContact CD2-CE1 4.08Å; Y97-F154 HydrophobicContact CD2-CE2 4.46Å; Y97-F154 AromaticContact CD2-CG 3.51Å; Y97-F154 HydrophobicContact CD2-CG 3.51Å; Y97-F154 HydrophobicContact CD2-CZ 4.5Å; Y97-F154 HydrophobicContact CE1-CD1 4.37Å; Y97-F154 HydrophobicContact CE1-CE1 4.13Å; Y97-F154 HydrophobicContact CE2-CB 4.34Å; Y97-F154 AromaticContact CE2-CD1 3.79Å; Y97-F154 HydrophobicContact CE2-CD1 3.79Å; Y97-F154 HydrophobicContact CE2-CE1 4.36Å; Y97-F154 HydrophobicContact CE2-CG 4.12Å; Y97-F154 AromaticContact CG-CD1 3.8Å; Y97-F154 HydrophobicContact CG-CD1 3.8Å; Y97-F154 AromaticContact CG-CD2 3.92Å; Y97-F154 HydrophobicContact CG-CD2 3.92Å; Y97-F154 AromaticContact CG-CE1 3.82Å; Y97-F154 HydrophobicContact CG-CE1 3.82Å; Y97-F154 AromaticContact CG-CE2 3.95Å; Y97-F154 HydrophobicContact CG-CE2 3.95Å; Y97-F154 AromaticContact CG-CG 3.84Å; Y97-F154 HydrophobicContact CG-CG 3.84Å; Y97-F154 AromaticContact CG-CZ 3.9Å; Y97-F154 HydrophobicContact CG-CZ 3.9Å; L102-F154 HydrophobicContact CB-CE2 3.81Å; L102-F154 HydrophobicContact CB-CZ 4.21Å; L102-F154 HydrophobicContact CD1-CE2 4.34Å; L102-F154 HydrophobicContact CD1-CZ 4.01Å; P103-F154 WeakPolarHBondContact O-CD2 3.45Å; Q104-F154 HydrophobicContact CB-CD2 4.37Å; Q104-F154 HydrophobicContact CG-CB 4.14Å; A124-F154 HydrophobicContact CB-CD2 4.3Å; A124-F154 HydrophobicContact CB-CE2 3.94Å; A124-F154 WeakPolarHBondContact O-CD2 3.25Å; L126-F154 HydrophobicContact CG-CE1 4.35Å; L126-F154 HydrophobicContact CG-CZ 4.22Å; T152-F154 VanDerWaalsContact C-N 3.26Å; T152-F154 PolarHBondContact O-N 3.43Å; T152-F154 PolarHBondContact OG1-N 3.14Å; T152-F154 PolarHBondContact OG1-O 3.3Å; F154-T246 HydrophobicContact CD1-CG2 3.91Å; F154-T246 CarbonylContact O-C 3.48Å; F154-T246 WeakPolarHBondContact O-CA 3.48Å; F154-T246 WeakPolarHBondContact O-CB 3.49Å; F154-D247 WeakPolarHBondContact O-CB 3.48Å; F154-D247 PolarHBondContact O-N 3.06Å
155	S	95.5	Very high	94.2	Very high	11 Å²	11	46.4 Å²	46.4	8%	0.077	23%	0.229	C	C	.	.			trans	-109.1	175.3	178.5	61.1	0	0	0	0	112.6	P123 A124 N125 N248	P123-S155 PolarHBondContact O-OG 3.07Å; P123-S155 VanDerWaalsContact O-OG 3.06Å; A124-S155 PolarHBondContact O-N 2.89Å; A124-S155 PolarHBondContact O-OG 3.32Å; N125-S155 WeakPolarHBondContact CA-O 3.37Å; N125-S155 VanDerWaalsContact CB-O 3.24Å; N125-S155 WeakPolarHBondContact CB-O 3.16Å; N125-S155 WeakPolarHBondContact CB-OG 3.07Å; S155-N248 WeakPolarHBondContact CB-OD1 3.35Å
156	G	94.7	Very high	94.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	79.4	-169.5	-175.7	0	0	0	0	0	112.6	E127 W144 G158 T246 N248	E127-G156 WeakPolarHBondContact OE1-CA 3.37Å; E127-G156 WeakPolarHBondContact OE2-CA 3.28Å; W144-G156 VanDerWaalsContact CZ3-CA 3.41Å; W144-G156 VanDerWaalsContact CZ3-N 3.3Å; G156-G158 VanDerWaalsContact C-N 3.34Å; G156-T246 VanDerWaalsContact O-CB 3.28Å; G156-T246 WeakPolarHBondContact O-CB 3.33Å; G156-T246 PolarHBondContact O-OG1 3.2Å; G156-N248 PolarHBondContact N-OD1 3.04Å
157	M	93.5	Very high	94.4	Very high	55 Å²	55	37.9 Å²	37.9	27%	0.271	19%	0.193	S	C	.	.			trans	-78.5	-22.3	-178	-168.6	175.1	67.4	0	0	112.4	E127 K159 L160 P161 Y163 A249	E127-M157 PolarHBondContact OE1-N 2.92Å; M157-K159 PolarHBondContact O-N 3.36Å; M157-L160 VanDerWaalsContact CG-O 3.29Å; M157-L160 WeakPolarHBondContact CG-O 3.4Å; M157-L160 PolarHBondContact O-N 2.87Å; M157-P161 VanDerWaalsContact SD-O 3.41Å; M157-Y163 HydrophobicContact CB-CD1 4.45Å; M157-Y163 HydrophobicContact CB-CD2 4.31Å; M157-Y163 HydrophobicContact CB-CE1 4.15Å; M157-Y163 HydrophobicContact CB-CE2 4.02Å; M157-Y163 HydrophobicContact CG-CD2 4.46Å; M157-Y163 HydrophobicContact SD-CD2 4.19Å; M157-Y163 HydrophobicContact SD-CE2 4.31Å; M157-A249 HydrophobicContact CG-CB 4.32Å
158	G	94	Very high	94.4	Very high	11 Å²	11	37.9 Å²	37.9	11%	0.113	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	-133.1	-177.3	0	0	0	0	0	111.7	Y97 L126 G156	Y97-G158 WeakPolarHBondContact OH-CA 3.29Å; L126-G158 WeakPolarHBondContact CD1-O 3.25Å; G156-G158 VanDerWaalsContact C-N 3.34Å
159	K	92.1	Very high	94.5	Very high	84 Å²	84	33 Å²	33	37%	0.365	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	10	176.4	-67.5	-69.6	-176.7	-178.9	0	113.1	Y97 M157	Y97-K159 HydrophobicContact CE1-CB 4.33Å; Y97-K159 HydrophobicContact CE1-CG 3.96Å; Y97-K159 PolarHBondContact OH-N 3.37Å; M157-K159 PolarHBondContact O-N 3.36Å
160	L	94.4	Very high	94.7	Very high	5 Å²	5	30.6 Å²	30.6	3%	0.026	15%	0.154	C	C	.	.	S	Bend	trans	-83.4	152.8	178	-62	178	0	0	0	110.9	M157 E162 W198 Q244 A249 L251	M157-L160 VanDerWaalsContact CG-O 3.29Å; M157-L160 WeakPolarHBondContact CG-O 3.4Å; M157-L160 PolarHBondContact O-N 2.87Å; L160-E162 PolarHBondContact O-N 3.19Å; L160-W198 HydrophobicContact CD2-CH2 3.84Å; L160-Q244 HydrophobicContact CD2-CB 4.06Å; L160-Q244 HydrophobicContact CG-CB 4.48Å; L160-A249 HydrophobicContact CB-CB 4.06Å; L160-A249 HydrophobicContact CD1-CB 3.67Å; L160-A249 VanDerWaalsContact CD1-O 3.32Å; L160-A249 WeakPolarHBondContact CD1-O 3.24Å; L160-A249 HydrophobicContact CG-CB 4.41Å; L160-L251 HydrophobicContact CD2-CD2 3.75Å; L160-L251 HydrophobicContact CD2-CG 4.49Å
161	P	91.8	Very high	94.8	Very high	77 Å²	77	30 Å²	30	50%	0.5	15%	0.151	S	C	.	.	S	Bend	trans	-62.9	-35.3	-179.1	-26.6	33.6	0	0	0	115.4	M157 N166 W198	M157-P161 VanDerWaalsContact SD-O 3.41Å; P161-N166 VanDerWaalsContact CD-OD1 3.25Å; P161-N166 WeakPolarHBondContact CD-OD1 3.32Å; P161-W198 HydrophobicContact CG-CH2 4.12Å; P161-W198 HydrophobicContact CG-CZ2 4.21Å
162	E	93.4	Very high	94.9	Very high	128 Å²	128	28.3 Å²	28.3	60%	0.598	15%	0.145	S	C	*	.	S	Bend	trans	-141.7	154.8	-170.5	-64.9	173.2	-163.7	0	0	111.8	L160 N166 A249	L160-E162 PolarHBondContact O-N 3.19Å; E162-N166 PolarHBondContact N-OD1 3.01Å; E162-N166 VanDerWaalsContact N-OD1 3.08Å; E162-N166 PolarHBondContact O-ND2 3.36Å; E162-A249 VanDerWaalsContact O-CB 3.29Å; E162-A249 WeakPolarHBondContact O-CB 3.18Å
163	Y	94.8	Very high	94.9	Very high	76 Å²	76	27.6 Å²	27.6	30%	0.298	14%	0.14	S	C	.	.	S	Bend	trans	-65.5	144.6	165.7	-75.1	-88.3	0	0	0	110.6	E127 W144 M157 N248	E127-Y163 PolarHBondContact OE1-OH 2.97Å; W144-Y163 HydrophobicContact CB-CE1 4.46Å; W144-Y163 AromaticContact CD2-CE1 3.99Å; W144-Y163 HydrophobicContact CD2-CE1 3.99Å; W144-Y163 AromaticContact CG-CE1 3.98Å; W144-Y163 HydrophobicContact CG-CE1 3.98Å; M157-Y163 HydrophobicContact CB-CD1 4.45Å; M157-Y163 HydrophobicContact CB-CD2 4.31Å; M157-Y163 HydrophobicContact CB-CE1 4.15Å; M157-Y163 HydrophobicContact CB-CE2 4.02Å; M157-Y163 HydrophobicContact CG-CD2 4.46Å; M157-Y163 HydrophobicContact SD-CD2 4.19Å; M157-Y163 HydrophobicContact SD-CE2 4.31Å; Y163-N248 HydrophobicContact CD1-CB 3.86Å; Y163-N248 HydrophobicContact CE1-CB 4.08Å
164	G	95.2	Very high	95	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.4	-149.7	-178.7	0	0	0	0	0	113.7	N166 N248 A249 W250	G164-N166 PolarHBondContact O-N 3.48Å; G164-N166 PolarHBondContact O-ND2 3.04Å; G164-N248 PolarHBondContact N-O 2.8Å; G164-A249 WeakPolarHBondContact O-CA 3.44Å; G164-W250 PolarHBondContact O-N 3.05Å
165	P	94.8	Very high	94.9	Very high	53 Å²	53	29.7 Å²	29.7	34%	0.344	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	120.6	-174.9	29.3	-33.3	0	0	0	112.7	W250 E252	P165-W250 CarbonylContact C-O 3.58Å; P165-W250 HydrophobicContact CB-CZ2 4.38Å; P165-E252 HydrophobicContact CB-CB 3.99Å; P165-E252 WeakPolarHBondContact CB-OE2 3.5Å
166	N	95.6	Very high	94.7	Very high	9 Å²	9	36.5 Å²	36.5	5%	0.048	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	118.4	175.7	-69.8	-103.5	0	0	0	109.5	P161 E162 G164 A168 W198 W250 L251 E252	P161-N166 VanDerWaalsContact CD-OD1 3.25Å; P161-N166 WeakPolarHBondContact CD-OD1 3.32Å; E162-N166 PolarHBondContact N-OD1 3.01Å; E162-N166 VanDerWaalsContact N-OD1 3.08Å; E162-N166 PolarHBondContact O-ND2 3.36Å; G164-N166 PolarHBondContact O-N 3.48Å; G164-N166 PolarHBondContact O-ND2 3.04Å; N166-A168 PolarHBondContact O-N 3.16Å; N166-W198 HydrophobicContact CB-CZ3 4Å; N166-W250 PolarHBondContact N-O 2.93Å; N166-L251 HydrophobicContact CB-CD2 4.02Å; N166-L251 WeakPolarHBondContact O-CA 3.35Å; N166-E252 PolarHBondContact O-N 2.87Å
167	K	94.9	Very high	94.3	Very high	71 Å²	71	38.1 Å²	38.1	31%	0.309	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	123.4	-169.9	-59.2	-57.5	-174.8	-172.8	0	112.7	V199 E252	K167-V199 HydrophobicContact CB-CG2 3.86Å; K167-V199 WeakPolarHBondContact CB-O 3.37Å; K167-V199 PolarHBondContact O-N 3.09Å; K167-V199 VanDerWaalsContact O-N 3.12Å; K167-E252 CarbonylContact C-O 3.49Å; K167-E252 VanDerWaalsContact CA-O 3.25Å; K167-E252 WeakPolarHBondContact CA-O 3.44Å; K167-E252 HydrophobicContact CD-CB 4.36Å; K167-E252 IonicContact NZ-OE1 3.09Å; K167-E252 PolarHBondContact NZ-OE1 3.28Å; K167-E252 IonicContact NZ-OE2 3.99Å; K167-E252 PolarHBondContact NZ-OE2 3.5Å
168	A	94.9	Very high	94	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	156.9	-179.1	0	0	0	0	0	112.8	N166 R196 F197 W198 L240 L251 E252 G253 A254	N166-A168 PolarHBondContact O-N 3.16Å; A168-R196 HydrophobicContact CB-CG 4.47Å; A168-F197 CarbonylContact C-O 3.53Å; A168-F197 WeakPolarHBondContact CA-O 3.15Å; A168-W198 HydrophobicContact CB-CE3 4.41Å; A168-L240 HydrophobicContact CB-CD1 4.1Å; A168-L251 HydrophobicContact CB-CD1 4.34Å; A168-L251 HydrophobicContact CB-CD2 4.35Å; A168-E252 PolarHBondContact N-O 2.9Å; A168-G253 VanDerWaalsContact O-CA 3.32Å; A168-G253 WeakPolarHBondContact O-CA 3.49Å; A168-A254 PolarHBondContact O-N 3.37Å
169	L	95.5	Very high	93.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.7	173.1	169.2	60.9	0	0	0	108.4	L171 R196 F197 V199 I204 I209 K212 I256	L169-L171 HydrophobicContact CD1-CD2 3.98Å; L169-L171 HydrophobicContact CD2-CD2 3.89Å; L169-L171 HydrophobicContact CG-CD2 3.88Å; L169-L171 HydrophobicContact CG-CG 4.37Å; L169-R196 WeakPolarHBondContact O-CA 3.02Å; L169-F197 HydrophobicContact CB-CB 4.48Å; L169-F197 PolarHBondContact N-O 3.43Å; L169-F197 PolarHBondContact O-N 3.1Å; L169-V199 HydrophobicContact CB-CG1 3.9Å; L169-I204 HydrophobicContact CB-CD1 4.47Å; L169-I204 HydrophobicContact CD1-CD1 4.27Å; L169-I204 HydrophobicContact CD1-CG2 4.17Å; L169-I204 HydrophobicContact CD2-CG2 4.22Å; L169-I209 HydrophobicContact CD2-CG1 4.28Å; L169-K212 HydrophobicContact CD2-CB 4.32Å; L169-K212 HydrophobicContact CD2-CG 4.04Å; L169-I256 HydrophobicContact CD1-CB 4.1Å; L169-I256 HydrophobicContact CD1-CG1 3.52Å
170	Y	96.8	Very high	93.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	132.2	166.3	-77	6.4	0	0	0	109.3	L194 P195 R196 L240 K241 N242 L251 A254 I255 I256 F299	Y170-L194 HydrophobicContact CD2-CB 4.1Å; Y170-L194 HydrophobicContact CD2-CD1 4.19Å; Y170-L194 HydrophobicContact CG-CB 4.14Å; Y170-P195 WeakPolarHBondContact CA-O 3.32Å; Y170-R196 HydrophobicContact CD1-CB 3.88Å; Y170-R196 HydrophobicContact CD1-CG 3.93Å; Y170-R196 HydrophobicContact CE1-CB 3.71Å; Y170-R196 HydrophobicContact CE1-CG 3.54Å; Y170-L240 HydrophobicContact CD1-CD1 4.13Å; Y170-L240 HydrophobicContact CD2-CD2 4.19Å; Y170-L240 HydrophobicContact CE1-CD1 4.25Å; Y170-L240 HydrophobicContact CE2-CB 4.12Å; Y170-L240 HydrophobicContact CG-CD1 4.3Å; Y170-L240 HydrophobicContact CG-CD2 4.5Å; Y170-K241 PolarHBondContact OH-O 3.49Å; Y170-N242 WeakPolarHBondContact OH-CB 3.33Å; Y170-N242 PolarHBondContact OH-ND2 3.24Å; Y170-L251 HydrophobicContact CE1-CD1 4.2Å; Y170-A254 PolarHBondContact N-O 2.87Å; Y170-I255 HydrophobicContact CD2-CG1 4.35Å; Y170-I255 WeakPolarHBondContact O-CA 3.34Å; Y170-I256 PolarHBondContact O-N 3.27Å; Y170-F299 HydrophobicContact CD2-CB 4.09Å; Y170-F299 HydrophobicContact CE2-CB 4.11Å
171	L	97.1	Very high	93.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.7	172.3	-61.4	-175.9	0	0	0	109.3	L169 I173 P195 F197 I209 K212 V213 I256 L258	L169-L171 HydrophobicContact CD1-CD2 3.98Å; L169-L171 HydrophobicContact CD2-CD2 3.89Å; L169-L171 HydrophobicContact CG-CD2 3.88Å; L169-L171 HydrophobicContact CG-CG 4.37Å; L171-I173 HydrophobicContact CB-CD1 4.11Å; L171-I173 HydrophobicContact CB-CG1 4.16Å; L171-I173 HydrophobicContact CD1-CD1 4.25Å; L171-P195 HydrophobicContact CB-CB 4.49Å; L171-P195 PolarHBondContact N-O 3.14Å; L171-P195 WeakPolarHBondContact O-CD 3.31Å; L171-F197 HydrophobicContact CB-CE2 4.48Å; L171-F197 HydrophobicContact CD1-CD2 4.06Å; L171-F197 HydrophobicContact CD1-CE2 3.51Å; L171-F197 HydrophobicContact CD1-CZ 4.21Å; L171-F197 HydrophobicContact CG-CD2 4.1Å; L171-F197 HydrophobicContact CG-CE2 3.87Å; L171-I209 HydrophobicContact CD2-CG2 4.4Å; L171-K212 HydrophobicContact CD1-CB 4.45Å; L171-V213 HydrophobicContact CD1-CG2 3.8Å; L171-I256 WeakPolarHBondContact CA-O 3.49Å; L171-I256 HydrophobicContact CD2-CB 4.18Å; L171-L258 HydrophobicContact CD1-CD1 4.42Å; L171-L258 HydrophobicContact CD2-CD1 4.2Å
172	L	97.3	Very high	93.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	103.2	161.8	176.6	64.7	0	0	0	107.3	T174 Y183 L194 Y235 I255 I256 H257 L258 P292 F295 A296	L172-T174 HydrophobicContact CD1-CG2 4.21Å; L172-T174 HydrophobicContact CD2-CG2 4.38Å; L172-T174 HydrophobicContact CG-CG2 4.01Å; L172-Y183 HydrophobicContact CD1-CD2 4.06Å; L172-Y183 HydrophobicContact CD1-CG 4.27Å; L172-L194 HydrophobicContact CB-CD1 4.31Å; L172-L194 HydrophobicContact CB-CD2 4.41Å; L172-L194 HydrophobicContact CD1-CD2 3.77Å; L172-Y235 HydrophobicContact CD2-CD2 4.27Å; L172-Y235 HydrophobicContact CD2-CE2 4.14Å; L172-I255 HydrophobicContact CB-CG2 4.48Å; L172-I256 PolarHBondContact N-O 3.46Å; L172-H257 CarbonylContact O-C 3.48Å; L172-H257 VanDerWaalsContact O-CA 3.28Å; L172-H257 WeakPolarHBondContact O-CA 3.47Å; L172-H257 PolarHBondContact O-CD2 3.05Å; L172-H257 VanDerWaalsContact O-CD2 3.3Å; L172-L258 PolarHBondContact O-N 3.14Å; L172-P292 HydrophobicContact CD2-CB 3.96Å; L172-P292 WeakPolarHBondContact CD2-O 3.5Å; L172-F295 HydrophobicContact CD1-CD1 4.23Å; L172-F295 HydrophobicContact CD1-CE1 4.34Å; L172-A296 HydrophobicContact CD2-CB 4.02Å
173	I	96.2	Very high	94	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.4	176.7	-64.1	157.9	0	0	0	107.7	L171 Y183 I184 L216 L258 F267 W283	L171-I173 HydrophobicContact CB-CD1 4.11Å; L171-I173 HydrophobicContact CB-CG1 4.16Å; L171-I173 HydrophobicContact CD1-CD1 4.25Å; I173-Y183 CarbonylContact O-C 3.49Å; I173-Y183 WeakPolarHBondContact O-CA 3.32Å; I173-I184 HydrophobicContact CB-CB 4.44Å; I173-I184 HydrophobicContact CB-CD1 3.85Å; I173-I184 HydrophobicContact CB-CG1 4.21Å; I173-I184 HydrophobicContact CD1-CD1 4.1Å; I173-I184 HydrophobicContact CG2-CD1 3.65Å; I173-I184 HydrophobicContact CG2-CG1 4.24Å; I173-I184 PolarHBondContact O-N 2.67Å; I173-L216 HydrophobicContact CD1-CD2 3.44Å; I173-L216 VanDerWaalsContact CD1-CD2 3.44Å; I173-L258 WeakPolarHBondContact CA-O 3.12Å; I173-L258 HydrophobicContact CG1-CB 4.15Å; I173-L258 HydrophobicContact CG1-CD1 4.18Å; I173-F267 HydrophobicContact CD1-CE1 3.87Å; I173-F267 HydrophobicContact CD1-CZ 3.84Å; I173-F267 HydrophobicContact CG1-CZ 4.4Å; I173-F267 HydrophobicContact CG2-CD2 4.04Å; I173-F267 HydrophobicContact CG2-CE2 3.59Å; I173-F267 HydrophobicContact CG2-CZ 3.92Å; I173-W283 HydrophobicContact CG2-CH2 4.16Å
174	T	95.8	Very high	94	Very high	2 Å²	2	31 Å²	31	1%	0.012	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	158.3	179	65.1	0	0	0	0	111.5	L172 T181 K182 H257 L258 H259 D260 P292	L172-T174 HydrophobicContact CD1-CG2 4.21Å; L172-T174 HydrophobicContact CD2-CG2 4.38Å; L172-T174 HydrophobicContact CG-CG2 4.01Å; T174-T181 HydrophobicContact CG2-CG2 4.35Å; T174-K182 CarbonylContact C-O 3.54Å; T174-K182 WeakPolarHBondContact CA-O 3.42Å; T174-K182 WeakPolarHBondContact CB-O 3.41Å; T174-H257 WeakPolarHBondContact CG2-NE2 3.5Å; T174-H257 PolarHBondContact OG1-NE2 2.92Å; T174-L258 PolarHBondContact N-O 2.95Å; T174-H259 PolarHBondContact O-ND1 2.84Å; T174-H259 PolarHBondContact OG1-ND1 3.28Å; T174-D260 PolarHBondContact O-N 3.26Å; T174-P292 HydrophobicContact CG2-CB 4.45Å
175	R	93.8	Very high	93.9	Very high	41 Å²	41	31 Å²	31	16%	0.155	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	151.6	166.3	72.3	-177.7	168.2	165.4	-3.7	109.9	K182 D260 W283	R175-K182 HydrophobicContact CG-CB 4.15Å; R175-K182 PolarHBondContact N-O 2.94Å; R175-K182 PolarHBondContact O-N 3.47Å; R175-D260 HydrophobicContact CB-CB 4.19Å; R175-W283 HydrophobicContact CB-CH2 3.83Å; R175-W283 HydrophobicContact CB-CZ3 3.94Å; R175-W283 HydrophobicContact CG-CD2 4.48Å; R175-W283 HydrophobicContact CG-CE3 3.91Å; R175-W283 HydrophobicContact CG-CH2 3.62Å; R175-W283 HydrophobicContact CG-CZ2 4.21Å; R175-W283 HydrophobicContact CG-CZ3 3.46Å; R175-W283 VanDerWaalsContact CG-CZ3 3.46Å; R175-W283 VanDerWaalsContact NE-CD2 3.34Å; R175-W283 VanDerWaalsContact NH2-CG 3.34Å
176	Y	91.5	Very high	93.9	Very high	155 Å²	155	29.2 Å²	29.2	61%	0.608	16%	0.16	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.1	169.7	-170.6	-104.9	0	0	0	109.8	G179	Y176-G179 VanDerWaalsContact OH-CA 3.28Å; Y176-G179 WeakPolarHBondContact OH-CA 3.27Å
177	S	87.3	Confident	93.5	Very high	33 Å²	33	31.9 Å²	31.9	23%	0.231	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	124.6	-177.5	171.7	0	0	0	0	110	G179 T180 K182	S177-G179 PolarHBondContact O-N 2.97Å; S177-T180 PolarHBondContact N-O 2.83Å; S177-T180 PolarHBondContact O-N 2.64Å; S177-T180 VanDerWaalsContact O-N 3.1Å; S177-T180 VanDerWaalsContact O-O 3.12Å; S177-T180 PolarHBondContact O-OG1 2.79Å; S177-K182 PolarHBondContact OG-NZ 3.01Å
178	S	86.5	Confident	92.8	Very high	114 Å²	114	32.6 Å²	32.6	80%	0.797	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	50.2	174.7	-52.4	0	0	0	0	113.3	T180	S178-T180 PolarHBondContact O-N 2.81Å
179	G	88.5	Confident	91.8	Very high	44 Å²	44	36.2 Å²	36.2	45%	0.454	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	-8.6	178.1	0	0	0	0	0	115.2	Y176 S177	Y176-G179 VanDerWaalsContact OH-CA 3.28Å; Y176-G179 WeakPolarHBondContact OH-CA 3.27Å; S177-G179 PolarHBondContact O-N 2.97Å
180	T	92.8	Very high	90.9	Very high	30 Å²	30	44.3 Å²	44.3	18%	0.184	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	145.7	-171.5	64.6	0	0	0	0	112.4	S177 S178	S177-T180 PolarHBondContact N-O 2.83Å; S177-T180 PolarHBondContact O-N 2.64Å; S177-T180 VanDerWaalsContact O-N 3.1Å; S177-T180 VanDerWaalsContact O-O 3.12Å; S177-T180 PolarHBondContact O-OG1 2.79Å; S178-T180 PolarHBondContact O-N 2.81Å
181	T	94.3	Very high	90.2	Very high	38 Å²	38	46.6 Å²	46.6	23%	0.233	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.6	168	-59.9	0	0	0	0	108.6	T174 L286	T174-T181 HydrophobicContact CG2-CG2 4.35Å; T181-L286 HydrophobicContact CG2-CB 4.25Å; T181-L286 HydrophobicContact CG2-CD2 4.09Å; T181-L286 WeakPolarHBondContact O-CB 3.2Å; T181-L286 PolarHBondContact O-N 2.74Å
182	K	95	Very high	89.8	Confident	49 Å²	49	50 Å²	50	21%	0.213	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	154.9	174.2	-61.7	176.1	-176.5	167.5	0	109.7	T174 R175 S177 W283 Q284 V285	T174-K182 CarbonylContact C-O 3.54Å; T174-K182 WeakPolarHBondContact CA-O 3.42Å; T174-K182 WeakPolarHBondContact CB-O 3.41Å; R175-K182 HydrophobicContact CG-CB 4.15Å; R175-K182 PolarHBondContact N-O 2.94Å; R175-K182 PolarHBondContact O-N 3.47Å; S177-K182 PolarHBondContact OG-NZ 3.01Å; K182-W283 HydrophobicContact CB-CB 4.44Å; K182-W283 HydrophobicContact CB-CD2 4.47Å; K182-W283 HydrophobicContact CB-CE3 3.71Å; K182-W283 HydrophobicContact CB-CZ3 4.39Å; K182-Q284 CarbonylContact C-O 3.45Å; K182-Q284 WeakPolarHBondContact CA-O 3.46Å; K182-Q284 WeakPolarHBondContact CB-O 3.32Å; K182-V285 HydrophobicContact CG-CG2 4.44Å
183	Y	95.2	Very high	89.6	Confident	12 Å²	12	50.3 Å²	50.3	5%	0.047	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	152.1	175.8	69.8	-74.4	0	0	0	112.2	L172 I173 V185 W283 Q284 L286 F295	L172-Y183 HydrophobicContact CD1-CD2 4.06Å; L172-Y183 HydrophobicContact CD1-CG 4.27Å; I173-Y183 CarbonylContact O-C 3.49Å; I173-Y183 WeakPolarHBondContact O-CA 3.32Å; Y183-V185 HydrophobicContact CD2-CG1 3.64Å; Y183-V185 HydrophobicContact CE2-CG1 3.07Å; Y183-W283 VanDerWaalsContact C-CE3 3.46Å; Y183-W283 CarbonylContact O-C 3.53Å; Y183-W283 WeakPolarHBondContact O-CA 3.34Å; Y183-Q284 HydrophobicContact CD1-CB 4.11Å; Y183-Q284 VanDerWaalsContact CD1-O 3.23Å; Y183-Q284 WeakPolarHBondContact CD1-O 2.86Å; Y183-Q284 HydrophobicContact CE1-CB 3.5Å; Y183-Q284 HydrophobicContact CE2-CB 4.39Å; Y183-Q284 PolarHBondContact N-O 3.46Å; Y183-Q284 PolarHBondContact O-N 2.89Å; Y183-L286 HydrophobicContact CD1-CB 4.01Å; Y183-L286 HydrophobicContact CD1-CD1 4.19Å; Y183-L286 HydrophobicContact CE1-CB 4.41Å; Y183-L286 HydrophobicContact CE1-CD1 4.28Å; Y183-F295 AromaticContact CD2-CE1 3.69Å; Y183-F295 HydrophobicContact CD2-CE1 3.69Å; Y183-F295 HydrophobicContact CD2-CZ 4.23Å; Y183-F295 HydrophobicContact CE1-CE1 4.35Å; Y183-F295 HydrophobicContact CE1-CZ 4.24Å; Y183-F295 HydrophobicContact CE2-CD1 4.46Å; Y183-F295 AromaticContact CE2-CE1 3.28Å; Y183-F295 HydrophobicContact CE2-CE1 3.28Å; Y183-F295 AromaticContact CE2-CZ 3.35Å; Y183-F295 HydrophobicContact CE2-CZ 3.35Å; Y183-F295 HydrophobicContact CG-CE1 4.35Å; Y183-F295 AromaticContact CZ-CE1 3.7Å; Y183-F295 AromaticContact CZ-CZ 3.39Å; Y183-F295 WeakPolarHBondContact OH-CZ 3.46Å
184	I	94.9	Very high	89.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.5	177.2	-58.7	175.7	0	0	0	109.7	I173 P195 F267 P271 Y281 S282 W283	I173-I184 HydrophobicContact CB-CB 4.44Å; I173-I184 HydrophobicContact CB-CD1 3.85Å; I173-I184 HydrophobicContact CB-CG1 4.21Å; I173-I184 HydrophobicContact CD1-CD1 4.1Å; I173-I184 HydrophobicContact CG2-CD1 3.65Å; I173-I184 HydrophobicContact CG2-CG1 4.24Å; I173-I184 PolarHBondContact O-N 2.67Å; I184-P195 HydrophobicContact CB-CG 4.31Å; I184-P195 HydrophobicContact CG2-CG 3.76Å; I184-P195 WeakPolarHBondContact O-CD 3.24Å; I184-F267 HydrophobicContact CD1-CB 4.08Å; I184-F267 HydrophobicContact CD1-CD1 3.93Å; I184-F267 HydrophobicContact CD1-CD2 4.31Å; I184-F267 HydrophobicContact CD1-CE1 4.48Å; I184-F267 HydrophobicContact CD1-CG 3.85Å; I184-P271 HydrophobicContact CD1-CB 4.43Å; I184-P271 HydrophobicContact CD1-CG 3.73Å; I184-P271 HydrophobicContact CG1-CG 4.16Å; I184-P271 HydrophobicContact CG2-CG 4.11Å; I184-Y281 HydrophobicContact CG2-CD1 4.04Å; I184-Y281 HydrophobicContact CG2-CG 4.47Å; I184-S282 WeakPolarHBondContact CA-O 3.23Å; I184-W283 HydrophobicContact CD1-CH2 3.9Å; I184-W283 HydrophobicContact CD1-CZ2 3.74Å; I184-W283 HydrophobicContact CD1-CZ3 4.49Å; I184-W283 HydrophobicContact CG1-CD2 3.9Å; I184-W283 HydrophobicContact CG1-CE3 3.88Å; I184-W283 HydrophobicContact CG1-CH2 3.61Å; I184-W283 HydrophobicContact CG1-CZ2 3.62Å; I184-W283 HydrophobicContact CG1-CZ3 3.72Å
185	V	94.2	Very high	89.5	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	148.8	170.3	-63.8	0	0	0	0	111.5	Y183 Q187 I192 S193 Y281 S282 Q284	Y183-V185 HydrophobicContact CD2-CG1 3.64Å; Y183-V185 HydrophobicContact CE2-CG1 3.07Å; V185-Q187 HydrophobicContact CG2-CG 4.01Å; V185-I192 HydrophobicContact CB-CB 4.45Å; V185-I192 HydrophobicContact CG1-CB 4.5Å; V185-S193 CarbonylContact C-O 3.56Å; V185-S193 WeakPolarHBondContact CA-O 3.37Å; V185-Y281 VanDerWaalsContact O-CA 3.22Å; V185-Y281 WeakPolarHBondContact O-CA 3.28Å; V185-Y281 WeakPolarHBondContact O-CD1 3.49Å; V185-S282 PolarHBondContact N-O 2.05Å; V185-S282 PolarHBondContact O-N 2.61Å; V185-Q284 HydrophobicContact CB-CG 4.41Å; V185-Q284 HydrophobicContact CG1-CB 4.35Å; V185-Q284 HydrophobicContact CG1-CG 3.98Å; V185-Q284 HydrophobicContact CG2-CG 3.51Å
186	E	93.2	Very high	89.5	Confident	16 Å²	16	49.3 Å²	49.3	8%	0.075	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	123.7	160.8	-169.5	170.5	145.3	0	0	108.4	S193 R279 Y281	E186-S193 PolarHBondContact N-O 3.45Å; E186-S193 PolarHBondContact O-N 2.83Å; E186-R279 WeakPolarHBondContact OE1-CD 3.36Å; E186-R279 IonicContact OE1-CZ 2.88Å; E186-R279 IonicContact OE1-NE 3.94Å; E186-R279 PolarHBondContact OE1-NE 2.84Å; E186-R279 IonicContact OE1-NH1 3.87Å; E186-R279 PolarHBondContact OE1-NH1 2.75Å; E186-R279 IonicContact OE2-CZ 3.2Å; E186-R279 IonicContact OE2-NE 2.6Å; E186-R279 IonicContact OE2-NH1 2.77Å; E186-R279 PolarHBondContact OE2-NH1 3.45Å; E186-Y281 HydrophobicContact CB-CD1 4.05Å; E186-Y281 HydrophobicContact CB-CE1 3.61Å; E186-Y281 HydrophobicContact CG-CD1 4.45Å; E186-Y281 HydrophobicContact CG-CE1 3.8Å; E186-Y281 PolarHBondContact OE2-OH 2.75Å; E186-Y281 VanDerWaalsContact OE2-OH 3.07Å
187	Q	87.1	Confident	89.6	Confident	65 Å²	65	42.2 Å²	42.2	30%	0.304	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.9	178.6	-64.9	-174.8	-34.4	0	0	110.5	V185 Q280 S282	V185-Q187 HydrophobicContact CG2-CG 4.01Å; Q187-Q280 PolarHBondContact N-O 3Å; Q187-S282 PolarHBondContact NE2-OG 2.95Å; Q187-S282 VanDerWaalsContact NE2-OG 3.16Å
188	T	80.2	Confident	89.8	Confident	86 Å²	86	45.2 Å²	45.2	53%	0.528	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	91.1	173.6	-53.5	0	0	0	0	109.4	N190 Y191	T188-N190 PolarHBondContact O-N 3.39Å; T188-Y191 PolarHBondContact N-O 3.14Å; T188-Y191 WeakPolarHBondContact O-CB 3.29Å; T188-Y191 PolarHBondContact O-N 3.49Å; T188-Y191 VanDerWaalsContact O-N 3.07Å
189	G	75.4	Confident	90.1	Very high	75 Å²	75	40.7 Å²	40.7	77%	0.773	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	-125.8	-170.6	0	0	0	0	0	110.9	Y191	G189-Y191 PolarHBondContact O-N 2.89Å
190	N	75.5	Confident	90	Very high	170 Å²	170	48.8 Å²	48.8	91%	0.909	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	14.2	177.8	-63.4	-16	0	0	0	113.7	T188	T188-N190 PolarHBondContact O-N 3.39Å
191	Y	83.1	Confident	89	Confident	48 Å²	48	53.5 Å²	53.5	19%	0.188	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.3	179	-175.4	-116.5	0	0	0	111.1	T188 G189 R243	T188-Y191 PolarHBondContact N-O 3.14Å; T188-Y191 WeakPolarHBondContact O-CB 3.29Å; T188-Y191 PolarHBondContact O-N 3.49Å; T188-Y191 VanDerWaalsContact O-N 3.07Å; G189-Y191 PolarHBondContact O-N 2.89Å; Y191-R243 HydrophobicContact CD1-CG 4.35Å; Y191-R243 HydrophobicContact CD2-CG 4.01Å; Y191-R243 VanDerWaalsContact CD2-CZ 3.48Å; Y191-R243 HydrophobicContact CE1-CG 4.09Å; Y191-R243 HydrophobicContact CE2-CG 3.74Å; Y191-R243 HydrophobicContact CG-CG 4.3Å
192	I	88.1	Confident	87.6	Confident	73 Å²	73	56.1 Å²	56.1	37%	0.374	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	138.5	170	61.9	172.3	0	0	0	109.5	V185	V185-I192 HydrophobicContact CB-CB 4.45Å; V185-I192 HydrophobicContact CG1-CB 4.5Å
193	S	92.3	Very high	86.9	Confident	6 Å²	6	58.3 Å²	58.3	4%	0.042	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	166.1	172	-150.9	0	0	0	0	110.7	V185 E186	V185-S193 CarbonylContact C-O 3.56Å; V185-S193 WeakPolarHBondContact CA-O 3.37Å; E186-S193 PolarHBondContact N-O 3.45Å; E186-S193 PolarHBondContact O-N 2.83Å
194	L	95.4	Very high	86.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.323	C	S	.	.			trans	-75	146.5	166.7	-64.5	179.9	0	0	0	109.5	Y170 L172 R196 I255 F295 F299	Y170-L194 HydrophobicContact CD2-CB 4.1Å; Y170-L194 HydrophobicContact CD2-CD1 4.19Å; Y170-L194 HydrophobicContact CG-CB 4.14Å; L172-L194 HydrophobicContact CB-CD1 4.31Å; L172-L194 HydrophobicContact CB-CD2 4.41Å; L172-L194 HydrophobicContact CD1-CD2 3.77Å; L194-R196 PolarHBondContact O-N 3.27Å; L194-R196 VanDerWaalsContact O-N 3.1Å; L194-I255 HydrophobicContact CD1-CG2 3.81Å; L194-F295 HydrophobicContact CD2-CE1 4.44Å; L194-F299 HydrophobicContact CD1-CB 4.22Å; L194-F299 HydrophobicContact CD1-CD2 3.79Å; L194-F299 HydrophobicContact CD1-CE2 4.32Å; L194-F299 HydrophobicContact CD1-CG 3.94Å; L194-F299 HydrophobicContact CD2-CD2 4.48Å; L194-F299 HydrophobicContact CD2-CE2 4.18Å; L194-F299 HydrophobicContact CD2-CZ 4.43Å; L194-F299 HydrophobicContact CG-CD1 4.18Å; L194-F299 HydrophobicContact CG-CD2 3.89Å; L194-F299 HydrophobicContact CG-CE1 4.28Å; L194-F299 HydrophobicContact CG-CE2 3.98Å; L194-F299 HydrophobicContact CG-CG 3.99Å; L194-F299 HydrophobicContact CG-CZ 4.17Å
195	P	94.9	Very high	86.4	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.337	C	S	.	.			trans	-46.6	119.6	170	-29.4	32.4	0	0	0	112.2	Y170 L171 I184 F197 L216 Y281	Y170-P195 WeakPolarHBondContact CA-O 3.32Å; L171-P195 HydrophobicContact CB-CB 4.49Å; L171-P195 PolarHBondContact N-O 3.14Å; L171-P195 WeakPolarHBondContact O-CD 3.31Å; I184-P195 HydrophobicContact CB-CG 4.31Å; I184-P195 HydrophobicContact CG2-CG 3.76Å; I184-P195 WeakPolarHBondContact O-CD 3.24Å; P195-F197 HydrophobicContact CB-CE2 3.97Å; P195-F197 HydrophobicContact CB-CZ 4.5Å; P195-L216 HydrophobicContact CB-CD1 4.47Å; P195-L216 HydrophobicContact CB-CD2 3.82Å; P195-L216 HydrophobicContact CG-CD2 3.93Å; P195-Y281 HydrophobicContact CB-CE1 3.94Å; P195-Y281 HydrophobicContact CG-CD1 4.05Å; P195-Y281 HydrophobicContact CG-CE1 3.95Å
196	R	93.4	Very high	86.3	Confident	22 Å²	22	63.8 Å²	63.8	8%	0.083	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.3	-171.3	175.8	-179.9	74.3	101.8	-8.1	112.4	A168 L169 Y170 L194 R279	A168-R196 HydrophobicContact CB-CG 4.47Å; L169-R196 WeakPolarHBondContact O-CA 3.02Å; Y170-R196 HydrophobicContact CD1-CB 3.88Å; Y170-R196 HydrophobicContact CD1-CG 3.93Å; Y170-R196 HydrophobicContact CE1-CB 3.71Å; Y170-R196 HydrophobicContact CE1-CG 3.54Å; L194-R196 PolarHBondContact O-N 3.27Å; L194-R196 VanDerWaalsContact O-N 3.1Å; R196-R279 PolarHBondContact O-NH1 3.32Å
197	F	93.9	Very high	86.3	Confident	5 Å²	5	67 Å²	67	2%	0.022	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.8	177.7	-57.1	-91.9	0	0	0	111.8	A168 L169 L171 P195 K212 K215 L216 H273	A168-F197 CarbonylContact C-O 3.53Å; A168-F197 WeakPolarHBondContact CA-O 3.15Å; L169-F197 HydrophobicContact CB-CB 4.48Å; L169-F197 PolarHBondContact N-O 3.43Å; L169-F197 PolarHBondContact O-N 3.1Å; L171-F197 HydrophobicContact CB-CE2 4.48Å; L171-F197 HydrophobicContact CD1-CD2 4.06Å; L171-F197 HydrophobicContact CD1-CE2 3.51Å; L171-F197 HydrophobicContact CD1-CZ 4.21Å; L171-F197 HydrophobicContact CG-CD2 4.1Å; L171-F197 HydrophobicContact CG-CE2 3.87Å; P195-F197 HydrophobicContact CB-CE2 3.97Å; P195-F197 HydrophobicContact CB-CZ 4.5Å; F197-K212 HydrophobicContact CB-CB 4.33Å; F197-K212 HydrophobicContact CB-CD 3.79Å; F197-K212 HydrophobicContact CB-CG 3.85Å; F197-K212 HydrophobicContact CD1-CB 3.89Å; F197-K212 HydrophobicContact CD1-CD 3.81Å; F197-K212 HydrophobicContact CD1-CG 4.11Å; F197-K212 HydrophobicContact CD2-CB 4.11Å; F197-K212 HydrophobicContact CE1-CB 4.21Å; F197-K212 WeakPolarHBondContact CE1-O 3.42Å; F197-K212 HydrophobicContact CE2-CB 4.47Å; F197-K212 HydrophobicContact CG-CB 3.82Å; F197-K212 HydrophobicContact CG-CD 3.96Å; F197-K212 HydrophobicContact CG-CG 3.89Å; F197-K215 HydrophobicContact CE1-CB 4.21Å; F197-L216 HydrophobicContact CZ-CB 4.09Å; F197-L216 HydrophobicContact CZ-CD1 4.5Å; F197-L216 HydrophobicContact CZ-CD2 4.39Å; F197-H273 AromaticContact CD1-NE2 3.54Å; F197-H273 AromaticContact CE1-CD2 3.59Å; F197-H273 AromaticContact CE1-NE2 3.18Å; F197-H273 WeakPolarHBondContact CE1-NE2 3.32Å
198	W	92.5	Very high	86.6	Confident	97 Å²	97	64.6 Å²	64.6	37%	0.367	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	138	169.8	-61.1	119.3	0	0	0	111.3	L160 P161 N166 A168 K212 L251	L160-W198 HydrophobicContact CD2-CH2 3.84Å; P161-W198 HydrophobicContact CG-CH2 4.12Å; P161-W198 HydrophobicContact CG-CZ2 4.21Å; N166-W198 HydrophobicContact CB-CZ3 4Å; A168-W198 HydrophobicContact CB-CE3 4.41Å; W198-K212 VanDerWaalsContact O-CE 3.26Å; W198-K212 WeakPolarHBondContact O-CE 3.42Å; W198-K212 PolarHBondContact O-NZ 2.69Å; W198-L251 HydrophobicContact CH2-CD2 3.76Å; W198-L251 HydrophobicContact CZ3-CD2 3.48Å; W198-L251 VanDerWaalsContact CZ3-CD2 3.48Å
199	V	93	Very high	87.3	Confident	18 Å²	18	60.5 Å²	60.5	11%	0.109	34%	0.335	C	S	.	.			trans	-129.5	138.4	176	-63.9	0	0	0	0	109.8	K167 L169 V208	K167-V199 HydrophobicContact CB-CG2 3.86Å; K167-V199 WeakPolarHBondContact CB-O 3.37Å; K167-V199 PolarHBondContact O-N 3.09Å; K167-V199 VanDerWaalsContact O-N 3.12Å; L169-V199 HydrophobicContact CB-CG1 3.9Å; V199-V208 HydrophobicContact CG1-CG1 4.08Å
200	K	85.4	Confident	88.2	Confident	215 Å²	215	59.6 Å²	59.6	94%	0.935	31%	0.309	S	S	*	.	S	Bend	trans	-88	-33.2	178.1	-64.6	-172.7	178	-173.5	0	112.6
201	K	71.7	Confident	89	Confident	129 Å²	129	56.6 Å²	56.6	56%	0.561	29%	0.286	S	S	*	.	S	Bend	trans	-87.9	144.3	-177	-65.4	-175.4	178.2	-177.7	0	110.3	T203	K201-T203 VanDerWaalsContact C-N 3.26Å; K201-T203 PolarHBondContact O-N 3.18Å
202	A	64.9	Low	89.5	Confident	92 Å²	92	55.8 Å²	55.8	76%	0.76	28%	0.283	S	S	*	.	S	Bend	trans	-65.5	-32.5	169.5	0	0	0	0	0	111.8
203	T	80.8	Confident	89.7	Confident	96 Å²	96	52.3 Å²	52.3	59%	0.589	27%	0.265	S	S	*	.			trans	-86.5	121.9	179.2	51.2	0	0	0	0	111.4	K201	K201-T203 VanDerWaalsContact C-N 3.26Å; K201-T203 PolarHBondContact O-N 3.18Å
204	I	87.9	Confident	89.7	Confident	30 Å²	30	55.9 Å²	55.9	15%	0.154	28%	0.281	C	S	.	.			trans	-100.6	92.3	174.3	-61	168.3	0	0	0	107.3	L169 I209 A254 I256	L169-I204 HydrophobicContact CB-CD1 4.47Å; L169-I204 HydrophobicContact CD1-CD1 4.27Å; L169-I204 HydrophobicContact CD1-CG2 4.17Å; L169-I204 HydrophobicContact CD2-CG2 4.22Å; I204-I209 HydrophobicContact CG2-CD1 3.95Å; I204-I209 HydrophobicContact CG2-CG1 3.68Å; I204-A254 HydrophobicContact CD1-CB 3.55Å; I204-I256 HydrophobicContact CG2-CG1 4.46Å
205	D	91.5	Very high	89.4	Confident	58 Å²	58	58 Å²	58	31%	0.31	29%	0.291	S	S	.	.			trans	-90.4	176	176.9	63.4	37.3	0	0	0	112.2	D207 V208 I209	D205-D207 VanDerWaalsContact C-N 3.26Å; D205-D207 PolarHBondContact O-N 2.89Å; D205-D207 WeakPolarHBondContact OD1-CA 3.36Å; D205-D207 WeakPolarHBondContact OD1-CB 3.43Å; D205-D207 PolarHBondContact OD1-N 2.7Å; D205-V208 PolarHBondContact O-N 3.14Å; D205-V208 WeakPolarHBondContact OD1-CG2 3.35Å; D205-V208 PolarHBondContact OD1-N 3.12Å; D205-I209 WeakPolarHBondContact O-CD1 3.36Å; D205-I209 VanDerWaalsContact O-CG1 3.29Å; D205-I209 WeakPolarHBondContact O-CG1 3.33Å; D205-I209 PolarHBondContact O-N 3.11Å; D205-I209 VanDerWaalsContact O-N 3.14Å
206	A	93.1	Very high	89.2	Confident	39 Å²	39	58 Å²	58	32%	0.322	29%	0.291	S	S	.	.	H	α-helix	trans	-59.7	-36.3	179.8	0	0	0	0	0	112.8	I209 K210 V229	A206-I209 PolarHBondContact O-N 2.97Å; A206-K210 VanDerWaalsContact O-CB 3.32Å; A206-K210 WeakPolarHBondContact O-CB 3.4Å; A206-K210 PolarHBondContact O-N 3.06Å; A206-V229 HydrophobicContact CB-CG1 3.6Å; A206-V229 WeakPolarHBondContact O-CG1 3.34Å
207	D	92.7	Very high	88.6	Confident	83 Å²	83	57.8 Å²	57.8	44%	0.444	29%	0.291	S	S	.	.	H	α-helix	trans	-72.2	-40.4	-177.3	169.9	55.7	0	0	0	111.5	D205 I209 K210 R211	D205-D207 VanDerWaalsContact C-N 3.26Å; D205-D207 PolarHBondContact O-N 2.89Å; D205-D207 WeakPolarHBondContact OD1-CA 3.36Å; D205-D207 WeakPolarHBondContact OD1-CB 3.43Å; D205-D207 PolarHBondContact OD1-N 2.7Å; D207-I209 PolarHBondContact O-N 2.91Å; D207-K210 PolarHBondContact O-N 3.25Å; D207-R211 WeakPolarHBondContact O-CG 3.37Å; D207-R211 PolarHBondContact O-N 3.27Å; D207-R211 IonicContact OD1-CZ 3.03Å; D207-R211 IonicContact OD1-NH1 3.7Å; D207-R211 PolarHBondContact OD1-NH1 2.65Å; D207-R211 IonicContact OD2-CZ 2.75Å; D207-R211 IonicContact OD2-NH1 3.73Å; D207-R211 PolarHBondContact OD2-NH1 2.71Å; D207-R211 IonicContact OD2-NH2 3.29Å; D207-R211 PolarHBondContact OD2-NH2 2.94Å
208	V	93.5	Very high	87.5	Confident	14 Å²	14	64 Å²	64	9%	0.085	32%	0.32	C	S	.	.	H	α-helix	trans	-57.5	-49.3	168.8	173.5	0	0	0	0	110.7	V199 D205 R211 K212	V199-V208 HydrophobicContact CG1-CG1 4.08Å; D205-V208 PolarHBondContact O-N 3.14Å; D205-V208 WeakPolarHBondContact OD1-CG2 3.35Å; D205-V208 PolarHBondContact OD1-N 3.12Å; V208-R211 PolarHBondContact O-N 3.23Å; V208-K212 WeakPolarHBondContact O-CG 3.48Å; V208-K212 PolarHBondContact O-N 3.09Å; V208-K212 VanDerWaalsContact O-N 3.08Å
209	I	94.7	Very high	87	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.5	-47.8	-178.2	-62.7	162.1	0	0	0	110.4	L169 L171 I204 D205 A206 D207 R211 K212 V213 V229 I256 L258	L169-I209 HydrophobicContact CD2-CG1 4.28Å; L171-I209 HydrophobicContact CD2-CG2 4.4Å; I204-I209 HydrophobicContact CG2-CD1 3.95Å; I204-I209 HydrophobicContact CG2-CG1 3.68Å; D205-I209 WeakPolarHBondContact O-CD1 3.36Å; D205-I209 VanDerWaalsContact O-CG1 3.29Å; D205-I209 WeakPolarHBondContact O-CG1 3.33Å; D205-I209 PolarHBondContact O-N 3.11Å; D205-I209 VanDerWaalsContact O-N 3.14Å; A206-I209 PolarHBondContact O-N 2.97Å; D207-I209 PolarHBondContact O-N 2.91Å; I209-R211 VanDerWaalsContact C-N 3.33Å; I209-R211 PolarHBondContact O-N 3.16Å; I209-K212 PolarHBondContact O-N 2.74Å; I209-V213 HydrophobicContact CG2-CG2 4.05Å; I209-V213 VanDerWaalsContact O-CG2 3.31Å; I209-V213 WeakPolarHBondContact O-CG2 3.26Å; I209-V213 PolarHBondContact O-N 3.44Å; I209-V229 HydrophobicContact CB-CG2 4.44Å; I209-V229 HydrophobicContact CG2-CG2 3.91Å; I209-I256 HydrophobicContact CD1-CG1 4.23Å; I209-I256 HydrophobicContact CD1-CG2 4.07Å; I209-L258 HydrophobicContact CG2-CD1 4.1Å; I209-L258 HydrophobicContact CG2-CD2 4.22Å
210	K	94.1	Very high	86.7	Confident	56 Å²	56	67 Å²	67	24%	0.243	33%	0.332	C	S	.	.	H	α-helix	trans	-52.8	-49.8	177.6	180	175.1	178	173.5	0	111.5	A206 D207 K212 V213 Q214 I225 N226 V229	A206-K210 VanDerWaalsContact O-CB 3.32Å; A206-K210 WeakPolarHBondContact O-CB 3.4Å; A206-K210 PolarHBondContact O-N 3.06Å; D207-K210 PolarHBondContact O-N 3.25Å; K210-K212 VanDerWaalsContact C-N 3.32Å; K210-K212 PolarHBondContact O-N 3.05Å; K210-V213 PolarHBondContact O-N 3.13Å; K210-Q214 WeakPolarHBondContact O-CB 3.25Å; K210-Q214 VanDerWaalsContact O-CG 3.28Å; K210-Q214 WeakPolarHBondContact O-CG 3.23Å; K210-Q214 PolarHBondContact O-N 2.84Å; K210-I225 HydrophobicContact CG-CG2 3.97Å; K210-N226 WeakPolarHBondContact CD-OD1 3.41Å; K210-N226 WeakPolarHBondContact CE-OD1 3.48Å; K210-N226 PolarHBondContact NZ-OD1 3.02Å; K210-V229 HydrophobicContact CB-CG2 4.22Å
211	R	91.8	Very high	86.8	Confident	108 Å²	108	61.1 Å²	61.1	41%	0.408	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-37.3	176.5	-76.8	-169.7	-66.3	-99.9	-13.1	113.4	D207 V208 I209 K215	D207-R211 WeakPolarHBondContact O-CG 3.37Å; D207-R211 PolarHBondContact O-N 3.27Å; D207-R211 IonicContact OD1-CZ 3.03Å; D207-R211 IonicContact OD1-NH1 3.7Å; D207-R211 PolarHBondContact OD1-NH1 2.65Å; D207-R211 IonicContact OD2-CZ 2.75Å; D207-R211 IonicContact OD2-NH1 3.73Å; D207-R211 PolarHBondContact OD2-NH1 2.71Å; D207-R211 IonicContact OD2-NH2 3.29Å; D207-R211 PolarHBondContact OD2-NH2 2.94Å; V208-R211 PolarHBondContact O-N 3.23Å; I209-R211 VanDerWaalsContact C-N 3.33Å; I209-R211 PolarHBondContact O-N 3.16Å; R211-K215 WeakPolarHBondContact O-CG 3.42Å; R211-K215 PolarHBondContact O-N 3.11Å
212	K	93.3	Very high	87.7	Confident	31 Å²	31	58.5 Å²	58.5	14%	0.135	31%	0.307	C	S	.	.	H	α-helix	trans	-72.6	-40.3	178.5	-64.5	-41.3	-170.1	167.3	0	111.8	L169 L171 F197 W198 V208 I209 K210 Q214 K215 L216	L169-K212 HydrophobicContact CD2-CB 4.32Å; L169-K212 HydrophobicContact CD2-CG 4.04Å; L171-K212 HydrophobicContact CD1-CB 4.45Å; F197-K212 HydrophobicContact CB-CB 4.33Å; F197-K212 HydrophobicContact CB-CD 3.79Å; F197-K212 HydrophobicContact CB-CG 3.85Å; F197-K212 HydrophobicContact CD1-CB 3.89Å; F197-K212 HydrophobicContact CD1-CD 3.81Å; F197-K212 HydrophobicContact CD1-CG 4.11Å; F197-K212 HydrophobicContact CD2-CB 4.11Å; F197-K212 HydrophobicContact CE1-CB 4.21Å; F197-K212 WeakPolarHBondContact CE1-O 3.42Å; F197-K212 HydrophobicContact CE2-CB 4.47Å; F197-K212 HydrophobicContact CG-CB 3.82Å; F197-K212 HydrophobicContact CG-CD 3.96Å; F197-K212 HydrophobicContact CG-CG 3.89Å; W198-K212 VanDerWaalsContact O-CE 3.26Å; W198-K212 WeakPolarHBondContact O-CE 3.42Å; W198-K212 PolarHBondContact O-NZ 2.69Å; V208-K212 WeakPolarHBondContact O-CG 3.48Å; V208-K212 PolarHBondContact O-N 3.09Å; V208-K212 VanDerWaalsContact O-N 3.08Å; I209-K212 PolarHBondContact O-N 2.74Å; K210-K212 VanDerWaalsContact C-N 3.32Å; K210-K212 PolarHBondContact O-N 3.05Å; K212-Q214 VanDerWaalsContact C-N 3.34Å; K212-Q214 PolarHBondContact O-N 3.17Å; K212-K215 HydrophobicContact CD-CD 4.38Å; K212-K215 WeakPolarHBondContact O-CB 3.42Å; K212-K215 PolarHBondContact O-N 2.75Å; K212-K215 VanDerWaalsContact O-N 3.12Å; K212-L216 PolarHBondContact O-N 2.79Å
213	V	93.3	Very high	88.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-42.8	175.3	176.1	0	0	0	0	111.1	L171 I209 K210 K215 L216 I225 L258 F267	L171-V213 HydrophobicContact CD1-CG2 3.8Å; I209-V213 HydrophobicContact CG2-CG2 4.05Å; I209-V213 VanDerWaalsContact O-CG2 3.31Å; I209-V213 WeakPolarHBondContact O-CG2 3.26Å; I209-V213 PolarHBondContact O-N 3.44Å; K210-V213 PolarHBondContact O-N 3.13Å; V213-K215 PolarHBondContact O-N 2.8Å; V213-L216 PolarHBondContact O-N 3.03Å; V213-I225 HydrophobicContact CB-CG2 4.07Å; V213-I225 HydrophobicContact CG1-CD1 4.18Å; V213-I225 HydrophobicContact CG1-CG1 4.07Å; V213-I225 HydrophobicContact CG1-CG2 3.85Å; V213-L258 HydrophobicContact CG2-CD1 3.25Å; V213-F267 HydrophobicContact CG1-CE1 3.94Å; V213-F267 HydrophobicContact CG1-CZ 3.71Å
214	Q	91.2	Very high	89.4	Confident	81 Å²	81	56 Å²	56	38%	0.379	28%	0.281	S	S	.	.	H	α-helix	trans	-59.1	-25.9	175.1	-75.4	174.3	-40.2	0	0	113.2	K210 K212 N217 I225	K210-Q214 WeakPolarHBondContact O-CB 3.25Å; K210-Q214 VanDerWaalsContact O-CG 3.28Å; K210-Q214 WeakPolarHBondContact O-CG 3.23Å; K210-Q214 PolarHBondContact O-N 2.84Å; K212-Q214 VanDerWaalsContact C-N 3.34Å; K212-Q214 PolarHBondContact O-N 3.17Å; Q214-N217 VanDerWaalsContact O-O 3.06Å; Q214-I225 HydrophobicContact CG-CD1 3.62Å
215	K	90.2	Very high	89.6	Confident	45 Å²	45	54.7 Å²	54.7	20%	0.196	28%	0.275	C	S	.	.	H	α-helix	trans	-79.8	-20.5	176.3	-70.2	170.8	175.8	-159.7	0	113.6	F197 R211 K212 V213 H273 S274 E275	F197-K215 HydrophobicContact CE1-CB 4.21Å; R211-K215 WeakPolarHBondContact O-CG 3.42Å; R211-K215 PolarHBondContact O-N 3.11Å; K212-K215 HydrophobicContact CD-CD 4.38Å; K212-K215 WeakPolarHBondContact O-CB 3.42Å; K212-K215 PolarHBondContact O-N 2.75Å; K212-K215 VanDerWaalsContact O-N 3.12Å; V213-K215 PolarHBondContact O-N 2.8Å; K215-H273 CarbonylContact O-C 3.47Å; K215-H273 VanDerWaalsContact O-CA 3.24Å; K215-H273 WeakPolarHBondContact O-CA 3.14Å; K215-S274 PolarHBondContact O-N 3.35Å; K215-S274 PolarHBondContact O-OG 2.97Å; K215-E275 HydrophobicContact CD-CG 4.15Å; K215-E275 WeakPolarHBondContact CD-OE2 3.18Å; K215-E275 VanDerWaalsContact CE-CD 3.43Å; K215-E275 WeakPolarHBondContact CE-OE1 3.48Å; K215-E275 WeakPolarHBondContact CE-OE2 3.42Å; K215-E275 HydrophobicContact CG-CG 4.44Å; K215-E275 IonicContact NZ-OE1 2.95Å; K215-E275 PolarHBondContact NZ-OE1 2.87Å; K215-E275 IonicContact NZ-OE2 2.56Å; K215-E275 PolarHBondContact NZ-OE2 3.42Å
216	L	90	Very high	89.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-90.7	-6.2	-179	-167.9	57.6	0	0	0	113.1	I173 P195 F197 K212 V213 P271 V272 Y281	I173-L216 HydrophobicContact CD1-CD2 3.44Å; I173-L216 VanDerWaalsContact CD1-CD2 3.44Å; P195-L216 HydrophobicContact CB-CD1 4.47Å; P195-L216 HydrophobicContact CB-CD2 3.82Å; P195-L216 HydrophobicContact CG-CD2 3.93Å; F197-L216 HydrophobicContact CZ-CB 4.09Å; F197-L216 HydrophobicContact CZ-CD1 4.5Å; F197-L216 HydrophobicContact CZ-CD2 4.39Å; K212-L216 PolarHBondContact O-N 2.79Å; V213-L216 PolarHBondContact O-N 3.03Å; L216-P271 HydrophobicContact CD1-CB 4.42Å; L216-P271 HydrophobicContact CG-CB 4.27Å; L216-P271 WeakPolarHBondContact O-CB 3.12Å; L216-V272 CarbonylContact C-O 2.96Å; L216-V272 WeakPolarHBondContact CA-O 3.21Å; L216-V272 PolarHBondContact O-N 2.74Å; L216-Y281 HydrophobicContact CD1-CD1 3.91Å; L216-Y281 HydrophobicContact CD1-CD2 3.96Å; L216-Y281 HydrophobicContact CD1-CE1 3.76Å; L216-Y281 HydrophobicContact CD1-CE2 3.84Å; L216-Y281 HydrophobicContact CD1-CG 4Å
217	N	82.4	Confident	89.7	Confident	16 Å²	16	56.1 Å²	56.1	9%	0.086	28%	0.279	C	S	.	.			trans	-133.6	150.2	-170	158.6	73.9	0	0	0	110.3	Q214 Y219 C220 C266 F267	Q214-N217 VanDerWaalsContact O-O 3.06Å; N217-Y219 VanDerWaalsContact CG-N 3.32Å; N217-Y219 PolarHBondContact ND2-N 2.77Å; N217-Y219 VanDerWaalsContact ND2-N 3.2Å; N217-Y219 PolarHBondContact OD1-N 2.94Å; N217-C220 WeakPolarHBondContact ND2-CA 3.24Å; N217-C220 WeakPolarHBondContact ND2-CB 3.42Å; N217-C220 PolarHBondContact ND2-N 2.54Å; N217-C220 PolarHBondContact OD1-N 3.09Å; N217-C220 PolarHBondContact OD1-SG 2.99Å; N217-C266 PolarHBondContact OD1-O 2.69Å; N217-C266 VanDerWaalsContact OD1-O 3.14Å; N217-F267 HydrophobicContact CB-CD1 3.77Å; N217-F267 HydrophobicContact CB-CE1 3.99Å
218	Q	70.3	Confident	89.8	Confident	135 Å²	135	52.4 Å²	52.4	63%	0.631	26%	0.259	S	S	*	.	S	Bend	trans	-107.9	-22.4	171.8	-166.6	171.7	10.7	0	0	113.5
219	Y	81	Confident	89.9	Confident	167 Å²	167	52 Å²	52	66%	0.655	26%	0.257	S	S	*	.	S	Bend	trans	-120.7	-25.6	-164.2	-54.5	-69.6	0	0	0	116.2	N217 N221	N217-Y219 VanDerWaalsContact CG-N 3.32Å; N217-Y219 PolarHBondContact ND2-N 2.77Å; N217-Y219 VanDerWaalsContact ND2-N 3.2Å; N217-Y219 PolarHBondContact OD1-N 2.94Å; Y219-N221 PolarHBondContact O-N 2.96Å
220	C	86.9	Confident	89.9	Confident	12 Å²	12	59.3 Å²	59.3	8%	0.081	29%	0.291	C	S	.	.			trans	-52.1	130.3	175.6	-58	0	0	0	0	112.5	N217 I225 C266	N217-C220 WeakPolarHBondContact ND2-CA 3.24Å; N217-C220 WeakPolarHBondContact ND2-CB 3.42Å; N217-C220 PolarHBondContact ND2-N 2.54Å; N217-C220 PolarHBondContact OD1-N 3.09Å; N217-C220 PolarHBondContact OD1-SG 2.99Å; C220-I225 HydrophobicContact CB-CD1 3.94Å; C220-I225 HydrophobicContact CB-CG1 3.78Å; C220-C266 HydrophobicContact CB-CB 3.67Å; C220-C266 WeakPolarHBondContact CB-SG 3.39Å; C220-C266 PolarHBondContact N-O 3.1Å; C220-C266 WeakPolarHBondContact SG-CB 3.28Å; C220-C266 PolarHBondContact SG-O 2.97Å; C220-C266 CovalentContact SG-SG 2.04Å; C220-C266 PolarHBondContact SG-SG 2.9Å
221	N	88.5	Confident	89.9	Confident	91 Å²	91	60.4 Å²	60.4	49%	0.487	30%	0.303	S	S	.	.			trans	-67.5	144.8	173.1	-71.3	-47.2	0	0	0	109.9	Y219 S223 E224 I225	Y219-N221 PolarHBondContact O-N 2.96Å; N221-S223 PolarHBondContact O-N 2.86Å; N221-S223 VanDerWaalsContact O-N 3.09Å; N221-E224 HydrophobicContact CB-CG 4.15Å; N221-E224 WeakPolarHBondContact CB-OE2 3.14Å; N221-E224 PolarHBondContact N-OE2 3.08Å; N221-E224 PolarHBondContact O-N 2.82Å; N221-I225 PolarHBondContact O-N 3.46Å
222	P	89.5	Confident	90.1	Very high	75 Å²	75	59.7 Å²	59.7	49%	0.487	30%	0.3	S	S	.	.	H	α-helix	trans	-55.2	-30.3	176.9	-28.2	35.5	0	0	0	114.1	N226	P222-N226 WeakPolarHBondContact O-CB 3.48Å; P222-N226 PolarHBondContact O-N 3.19Å; P222-N226 PolarHBondContact O-ND2 3.39Å; P222-N226 PolarHBondContact O-OD1 3.43Å
223	S	90.4	Very high	90.3	Very high	76 Å²	76	62.4 Å²	62.4	53%	0.531	31%	0.313	S	S	.	.	H	α-helix	trans	-66.3	-44.4	175.3	49.7	0	0	0	0	112.6	N221 I225 N226 V227	N221-S223 PolarHBondContact O-N 2.86Å; N221-S223 VanDerWaalsContact O-N 3.09Å; S223-I225 PolarHBondContact O-N 3.27Å; S223-N226 WeakPolarHBondContact O-CB 3.43Å; S223-N226 PolarHBondContact O-N 2.57Å; S223-V227 WeakPolarHBondContact O-CG2 3.25Å; S223-V227 PolarHBondContact O-N 3.21Å
224	E	91	Very high	90.4	Very high	58 Å²	58	68.9 Å²	68.9	27%	0.271	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-44.8	176.8	-63.5	169.3	143.7	0	0	110.6	N221 N226 V227 M228 C266	N221-E224 HydrophobicContact CB-CG 4.15Å; N221-E224 WeakPolarHBondContact CB-OE2 3.14Å; N221-E224 PolarHBondContact N-OE2 3.08Å; N221-E224 PolarHBondContact O-N 2.82Å; E224-N226 VanDerWaalsContact C-N 3.32Å; E224-N226 PolarHBondContact O-N 2.76Å; E224-V227 PolarHBondContact O-N 3.08Å; E224-M228 WeakPolarHBondContact O-CG 3.33Å; E224-M228 PolarHBondContact O-N 3.22Å; E224-C266 WeakPolarHBondContact OE2-CB 3.13Å
225	I	92.8	Very high	90.6	Very high	3 Å²	3	66.2 Å²	66.2	2%	0.015	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-42.4	175.1	-60.8	176.8	0	0	0	110.8	K210 V213 Q214 C220 N221 S223 V227 M228 V229	K210-I225 HydrophobicContact CG-CG2 3.97Å; V213-I225 HydrophobicContact CB-CG2 4.07Å; V213-I225 HydrophobicContact CG1-CD1 4.18Å; V213-I225 HydrophobicContact CG1-CG1 4.07Å; V213-I225 HydrophobicContact CG1-CG2 3.85Å; Q214-I225 HydrophobicContact CG-CD1 3.62Å; C220-I225 HydrophobicContact CB-CD1 3.94Å; C220-I225 HydrophobicContact CB-CG1 3.78Å; N221-I225 PolarHBondContact O-N 3.46Å; S223-I225 PolarHBondContact O-N 3.27Å; I225-V227 VanDerWaalsContact C-N 3.33Å; I225-V227 PolarHBondContact O-N 2.92Å; I225-M228 HydrophobicContact CB-CE 4.46Å; I225-M228 HydrophobicContact CG1-CE 4.06Å; I225-M228 PolarHBondContact O-N 2.03Å; I225-V229 HydrophobicContact CG2-CG2 4.1Å; I225-V229 WeakPolarHBondContact O-CB 3.42Å; I225-V229 VanDerWaalsContact O-CG2 3.23Å; I225-V229 WeakPolarHBondContact O-CG2 3.19Å; I225-V229 PolarHBondContact O-N 3.02Å
226	N	93.4	Very high	90.9	Very high	57 Å²	57	65 Å²	65	31%	0.305	32%	0.323	S	S	.	.	H	α-helix	trans	-59.4	-44.3	177.9	-73.5	-22.6	0	0	0	111.6	K210 P222 S223 E224 V229 Q230	K210-N226 WeakPolarHBondContact CD-OD1 3.41Å; K210-N226 WeakPolarHBondContact CE-OD1 3.48Å; K210-N226 PolarHBondContact NZ-OD1 3.02Å; P222-N226 WeakPolarHBondContact O-CB 3.48Å; P222-N226 PolarHBondContact O-N 3.19Å; P222-N226 PolarHBondContact O-ND2 3.39Å; P222-N226 PolarHBondContact O-OD1 3.43Å; S223-N226 WeakPolarHBondContact O-CB 3.43Å; S223-N226 PolarHBondContact O-N 2.57Å; E224-N226 VanDerWaalsContact C-N 3.32Å; E224-N226 PolarHBondContact O-N 2.76Å; N226-V229 PolarHBondContact O-N 2.94Å; N226-Q230 WeakPolarHBondContact O-CB 3.49Å; N226-Q230 VanDerWaalsContact O-CG 3.27Å; N226-Q230 WeakPolarHBondContact O-CG 3.46Å; N226-Q230 PolarHBondContact O-N 2.96Å
227	V	93	Very high	91	Very high	71 Å²	71	69.3 Å²	69.3	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-60.5	-51.2	177	173.4	0	0	0	0	110.3	S223 E224 I225 V229 Q230 T231	S223-V227 WeakPolarHBondContact O-CG2 3.25Å; S223-V227 PolarHBondContact O-N 3.21Å; E224-V227 PolarHBondContact O-N 3.08Å; I225-V227 VanDerWaalsContact C-N 3.33Å; I225-V227 PolarHBondContact O-N 2.92Å; V227-V229 VanDerWaalsContact C-N 3.26Å; V227-V229 PolarHBondContact O-N 3.29Å; V227-Q230 PolarHBondContact O-N 2.79Å; V227-Q230 VanDerWaalsContact O-N 3.09Å; V227-T231 PolarHBondContact O-N 3.22Å; V227-T231 PolarHBondContact O-OG1 3.02Å; V227-T231 VanDerWaalsContact O-OG1 3.1Å
228	M	94.5	Very high	91.6	Very high	5 Å²	5	69 Å²	69	3%	0.025	35%	0.35	C	S	.	.	H	α-helix	trans	-55.3	-42.6	177.7	-70.1	-168.3	-84.3	0	0	112.4	E224 I225 R232 L258 H259 D260 F267	E224-M228 WeakPolarHBondContact O-CG 3.33Å; E224-M228 PolarHBondContact O-N 3.22Å; I225-M228 HydrophobicContact CB-CE 4.46Å; I225-M228 HydrophobicContact CG1-CE 4.06Å; I225-M228 PolarHBondContact O-N 2.03Å; M228-R232 PolarHBondContact O-N 3.02Å; M228-R232 VanDerWaalsContact O-N 3.14Å; M228-L258 WeakPolarHBondContact O-CD2 3.34Å; M228-H259 WeakPolarHBondContact CG-O 3.43Å; M228-D260 HydrophobicContact SD-CB 4.03Å; M228-F267 HydrophobicContact CE-CE2 3.69Å; M228-F267 HydrophobicContact CE-CZ 3.92Å; M228-F267 HydrophobicContact SD-CE2 3.75Å; M228-F267 HydrophobicContact SD-CZ 4.22Å
229	V	95.6	Very high	92.8	Very high	6 Å²	6	62.6 Å²	62.6	4%	0.036	32%	0.319	C	S	.	.	H	α-helix	trans	-69.8	-38.6	179.2	171.8	0	0	0	0	111.1	A206 I209 K210 I225 N226 V227 R232	A206-V229 HydrophobicContact CB-CG1 3.6Å; A206-V229 WeakPolarHBondContact O-CG1 3.34Å; I209-V229 HydrophobicContact CB-CG2 4.44Å; I209-V229 HydrophobicContact CG2-CG2 3.91Å; K210-V229 HydrophobicContact CB-CG2 4.22Å; I225-V229 HydrophobicContact CG2-CG2 4.1Å; I225-V229 WeakPolarHBondContact O-CB 3.42Å; I225-V229 VanDerWaalsContact O-CG2 3.23Å; I225-V229 WeakPolarHBondContact O-CG2 3.19Å; I225-V229 PolarHBondContact O-N 3.02Å; N226-V229 PolarHBondContact O-N 2.94Å; V227-V229 VanDerWaalsContact C-N 3.26Å; V227-V229 PolarHBondContact O-N 3.29Å; V229-R232 VanDerWaalsContact O-CB 3.3Å; V229-R232 WeakPolarHBondContact O-CB 3.39Å; V229-R232 WeakPolarHBondContact O-CD 3.27Å; V229-R232 WeakPolarHBondContact O-CG 3.42Å; V229-R232 PolarHBondContact O-N 3.39Å; V229-R232 PolarHBondContact O-NH1 2.9Å
230	Q	94.5	Very high	93.5	Very high	153 Å²	153	54.6 Å²	54.6	72%	0.715	29%	0.288	S	S	*	.	H	α-helix	trans	-66.8	-38.8	177.9	-76.7	174.4	-12.1	0	0	112.1	N226 V227 R232	N226-Q230 WeakPolarHBondContact O-CB 3.49Å; N226-Q230 VanDerWaalsContact O-CG 3.27Å; N226-Q230 WeakPolarHBondContact O-CG 3.46Å; N226-Q230 PolarHBondContact O-N 2.96Å; V227-Q230 PolarHBondContact O-N 2.79Å; V227-Q230 VanDerWaalsContact O-N 3.09Å; Q230-R232 VanDerWaalsContact C-N 3.3Å; Q230-R232 PolarHBondContact O-N 2.84Å
231	T	94.8	Very high	93.9	Very high	79 Å²	79	56.8 Å²	56.8	49%	0.485	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	9.4	179.3	63.3	0	0	0	0	113.6	V227	V227-T231 PolarHBondContact O-N 3.22Å; V227-T231 PolarHBondContact O-OG1 3.02Å; V227-T231 VanDerWaalsContact O-OG1 3.1Å
232	R	96.3	Very high	94.1	Very high	92 Å²	92	53.4 Å²	53.4	35%	0.347	28%	0.278	S	S	.	.			trans	-56.3	150	-177.9	72.3	-174.2	177.9	-71.4	-0.4	112.2	M228 V229 Q230 I256 H257 L258	M228-R232 PolarHBondContact O-N 3.02Å; M228-R232 VanDerWaalsContact O-N 3.14Å; V229-R232 VanDerWaalsContact O-CB 3.3Å; V229-R232 WeakPolarHBondContact O-CB 3.39Å; V229-R232 WeakPolarHBondContact O-CD 3.27Å; V229-R232 WeakPolarHBondContact O-CG 3.42Å; V229-R232 PolarHBondContact O-N 3.39Å; V229-R232 PolarHBondContact O-NH1 2.9Å; Q230-R232 VanDerWaalsContact C-N 3.3Å; Q230-R232 PolarHBondContact O-N 2.84Å; R232-I256 HydrophobicContact CB-CG2 3.98Å; R232-I256 HydrophobicContact CG-CG2 4.47Å; R232-H257 WeakPolarHBondContact CA-O 3.41Å; R232-L258 HydrophobicContact CB-CD2 3.6Å
233	Q	96.6	Very high	94.2	Very high	88 Å²	88	55.7 Å²	55.7	41%	0.411	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	134.4	172.1	-63.5	-179.2	-32.2	0	0	110.2	Y235 H257	Q233-Y235 HydrophobicContact CB-CD1 3.92Å; Q233-Y235 HydrophobicContact CB-CE1 3.43Å; Q233-Y235 VanDerWaalsContact CB-CE1 3.43Å; Q233-Y235 HydrophobicContact CG-CE1 4.32Å; Q233-Y235 VanDerWaalsContact OE1-CZ 3.3Å; Q233-Y235 PolarHBondContact OE1-OH 2.94Å; Q233-H257 HydrophobicContact CB-CB 4.33Å; Q233-H257 PolarHBondContact N-O 2.9Å; Q233-H257 PolarHBondContact O-N 2.81Å
234	K	95.5	Very high	94.4	Very high	136 Å²	136	54.1 Å²	54.1	59%	0.591	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	111.7	174.2	-176.4	-176.7	-67.7	-176.1	0	108.3	V237 I256	K234-V237 HydrophobicContact CD-CG2 3.6Å; K234-V237 HydrophobicContact CG-CG2 4.01Å; K234-I256 HydrophobicContact CB-CD1 3.96Å; K234-I256 HydrophobicContact CG-CD1 3.9Å
235	Y	96.2	Very high	94.6	Very high	25 Å²	25	51.4 Å²	51.4	10%	0.098	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-25.7	-175.9	-73.1	-11.3	0	0	0	113.6	L172 Q233 I255 H257 P292 R293 A296	L172-Y235 HydrophobicContact CD2-CD2 4.27Å; L172-Y235 HydrophobicContact CD2-CE2 4.14Å; Q233-Y235 HydrophobicContact CB-CD1 3.92Å; Q233-Y235 HydrophobicContact CB-CE1 3.43Å; Q233-Y235 VanDerWaalsContact CB-CE1 3.43Å; Q233-Y235 HydrophobicContact CG-CE1 4.32Å; Q233-Y235 VanDerWaalsContact OE1-CZ 3.3Å; Q233-Y235 PolarHBondContact OE1-OH 2.94Å; Y235-I255 PolarHBondContact N-O 2.79Å; Y235-H257 HydrophobicContact CD1-CB 4.4Å; Y235-H257 HydrophobicContact CD2-CB 3.56Å; Y235-H257 HydrophobicContact CE1-CB 4.13Å; Y235-H257 HydrophobicContact CE2-CB 3.23Å; Y235-H257 AromaticContact CE2-CG 3.44Å; Y235-H257 VanDerWaalsContact CE2-CG 3.44Å; Y235-H257 AromaticContact CE2-ND1 3.85Å; Y235-H257 HydrophobicContact CG-CB 4.15Å; Y235-H257 AromaticContact CZ-CG 3.61Å; Y235-H257 AromaticContact CZ-ND1 3.53Å; Y235-H257 PolarHBondContact OH-ND1 3.37Å; Y235-P292 HydrophobicContact CE2-CB 3.94Å; Y235-R293 HydrophobicContact CD1-CB 4.21Å; Y235-R293 HydrophobicContact CD1-CG 4.07Å; Y235-R293 HydrophobicContact CD2-CB 4.15Å; Y235-R293 HydrophobicContact CE1-CB 4.08Å; Y235-R293 HydrophobicContact CE1-CG 4.36Å; Y235-R293 HydrophobicContact CE2-CB 4Å; Y235-R293 HydrophobicContact CG-CB 4.24Å; Y235-R293 HydrophobicContact CG-CG 4.15Å; Y235-A296 HydrophobicContact CD2-CB 3.7Å; Y235-A296 HydrophobicContact CG-CB 4.38Å
236	H	95.2	Very high	94.8	Very high	19 Å²	19	51.3 Å²	51.3	9%	0.088	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	149.8	179.8	-178.5	63.2	0	0	0	111.4	Y239 A254 I255 M301	H236-Y239 PolarHBondContact NE2-O 3.32Å; H236-A254 VanDerWaalsContact O-CA 3.24Å; H236-A254 WeakPolarHBondContact O-CA 3.36Å; H236-A254 WeakPolarHBondContact O-CB 3.43Å; H236-I255 HydrophobicContact CB-CB 3.94Å; H236-I255 HydrophobicContact CB-CD1 3.77Å; H236-I255 HydrophobicContact CB-CG1 3.82Å; H236-I255 PolarHBondContact N-O 2.8Å; H236-I255 PolarHBondContact O-N 2.9Å; H236-M301 PolarHBondContact CE1-O 2.96Å; H236-M301 VanDerWaalsContact CE1-O 3.27Å
237	V	93.7	Very high	95	Very high	92 Å²	92	48.9 Å²	48.9	56%	0.558	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	133.6	164.8	-177.7	0	0	0	0	108.5	K234 G253 A254	K234-V237 HydrophobicContact CD-CG2 3.6Å; K234-V237 HydrophobicContact CG-CG2 4.01Å; V237-G253 CarbonylContact C-O 3.59Å; V237-G253 VanDerWaalsContact CA-O 3.24Å; V237-G253 WeakPolarHBondContact CA-O 3.43Å; V237-A254 HydrophobicContact CG2-CB 4.17Å
238	G	94.1	Very high	95.2	Very high	9 Å²	9	46 Å²	46	9%	0.093	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.9	-142.3	177.9	0	0	0	0	0	110.9	L240 E252 G253	G238-L240 PolarHBondContact O-N 3.17Å; G238-E252 CarbonylContact O-C 3.56Å; G238-E252 VanDerWaalsContact O-CA 3.31Å; G238-E252 WeakPolarHBondContact O-CA 3.35Å; G238-E252 WeakPolarHBondContact O-CG 3.42Å; G238-G253 PolarHBondContact N-O 3.39Å; G238-G253 PolarHBondContact O-N 3.38Å
239	Y	95.8	Very high	95.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	134.6	-178.7	-171.5	-89.1	0	0	0	111.7	N147 Y149 E150 H236 K241 N245 W250 G300 M301	N147-Y239 WeakPolarHBondContact ND2-CE2 3.4Å; N147-Y239 PolarHBondContact ND2-OH 3.33Å; N147-Y239 VanDerWaalsContact ND2-OH 3.09Å; Y149-Y239 HydrophobicContact CD1-CD2 4.11Å; Y149-Y239 AromaticContact CD1-CG 3.97Å; Y149-Y239 HydrophobicContact CD1-CG 3.97Å; Y149-Y239 AromaticContact CD2-CD2 3.24Å; Y149-Y239 HydrophobicContact CD2-CD2 3.24Å; Y149-Y239 AromaticContact CD2-CE2 3.87Å; Y149-Y239 HydrophobicContact CD2-CE2 3.87Å; Y149-Y239 AromaticContact CD2-CG 3.95Å; Y149-Y239 HydrophobicContact CD2-CG 3.95Å; Y149-Y239 HydrophobicContact CE1-CG 4.38Å; Y149-Y239 AromaticContact CE2-CD2 3.78Å; Y149-Y239 HydrophobicContact CE2-CD2 3.78Å; Y149-Y239 HydrophobicContact CE2-CG 4.37Å; Y149-Y239 AromaticContact CG-CD2 3.43Å; Y149-Y239 HydrophobicContact CG-CD2 3.43Å; Y149-Y239 VanDerWaalsContact CG-CD2 3.43Å; Y149-Y239 HydrophobicContact CG-CE2 4.04Å; Y149-Y239 AromaticContact CG-CG 3.74Å; Y149-Y239 HydrophobicContact CG-CG 3.74Å; E150-Y239 WeakPolarHBondContact CG-OH 3.06Å; E150-Y239 VanDerWaalsContact OE1-CE1 3.25Å; E150-Y239 WeakPolarHBondContact OE1-CE1 2.83Å; E150-Y239 VanDerWaalsContact OE1-CZ 3.23Å; E150-Y239 PolarHBondContact OE1-OH 2.84Å; H236-Y239 PolarHBondContact NE2-O 3.32Å; Y239-K241 HydrophobicContact CE1-CG 4.33Å; Y239-N245 WeakPolarHBondContact CE1-ND2 3.27Å; Y239-N245 PolarHBondContact OH-ND2 2.94Å; Y239-W250 HydrophobicContact CD2-CB 4.22Å; Y239-W250 AromaticContact CD2-CD1 3.41Å; Y239-W250 VanDerWaalsContact CD2-CD1 3.41Å; Y239-W250 AromaticContact CD2-CG 3.92Å; Y239-W250 HydrophobicContact CD2-CG 3.92Å; Y239-W250 HydrophobicContact CE2-CB 3.45Å; Y239-W250 VanDerWaalsContact CE2-CB 3.45Å; Y239-W250 AromaticContact CE2-CD1 3.53Å; Y239-W250 HydrophobicContact CE2-CD2 4.45Å; Y239-W250 AromaticContact CE2-CG 3.52Å; Y239-W250 HydrophobicContact CE2-CG 3.52Å; Y239-G300 WeakPolarHBondContact O-CA 3.35Å; Y239-M301 HydrophobicContact CD1-CB 4Å; Y239-M301 HydrophobicContact CD1-CE 3.35Å; Y239-M301 HydrophobicContact CD1-CG 4.16Å; Y239-M301 HydrophobicContact CE1-CE 3.16Å; Y239-M301 HydrophobicContact CG-CB 4.44Å; Y239-M301 HydrophobicContact CG-CE 4.15Å; Y239-M301 PolarHBondContact N-O 3.26Å; Y239-M301 PolarHBondContact O-N 3.2Å
240	L	95.9	Very high	95.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	121.1	176.6	-61.2	175.9	0	0	0	109.1	A168 Y170 G238 N242 N245 L251 I255	A168-L240 HydrophobicContact CB-CD1 4.1Å; Y170-L240 HydrophobicContact CD1-CD1 4.13Å; Y170-L240 HydrophobicContact CD2-CD2 4.19Å; Y170-L240 HydrophobicContact CE1-CD1 4.25Å; Y170-L240 HydrophobicContact CE2-CB 4.12Å; Y170-L240 HydrophobicContact CG-CD1 4.3Å; Y170-L240 HydrophobicContact CG-CD2 4.5Å; G238-L240 PolarHBondContact O-N 3.17Å; L240-N242 PolarHBondContact O-N 3.49Å; L240-N245 PolarHBondContact O-ND2 2.94Å; L240-L251 HydrophobicContact CB-CB 3.88Å; L240-L251 PolarHBondContact N-O 3.46Å; L240-I255 HydrophobicContact CD2-CD1 4.11Å; L240-I255 HydrophobicContact CD2-CG1 3.64Å
241	K	94.3	Very high	95.5	Very high	57 Å²	57	39 Å²	39	25%	0.248	18%	0.184	C	C	.	.			trans	-65.3	128.7	176.1	-64.9	-168	-177.6	-174.2	0	109.3	E109 Y170 Y239 F299 M301	E109-K241 IonicContact OE1-NZ 3.4Å; Y170-K241 PolarHBondContact OH-O 3.49Å; Y239-K241 HydrophobicContact CE1-CG 4.33Å; K241-F299 PolarHBondContact N-O 3Å; K241-M301 HydrophobicContact CD-CG 4.3Å; K241-M301 HydrophobicContact CG-CG 4.12Å
242	N	93.5	Very high	95.5	Very high	21 Å²	21	37.2 Å²	37.2	11%	0.112	17%	0.17	C	C	.	.			trans	-153.5	144.7	175.8	-163.6	-77.4	0	0	0	110	Y170 L240 Q244 N245 L251	Y170-N242 WeakPolarHBondContact OH-CB 3.33Å; Y170-N242 PolarHBondContact OH-ND2 3.24Å; L240-N242 PolarHBondContact O-N 3.49Å; N242-Q244 PolarHBondContact O-N 3.06Å; N242-Q244 WeakPolarHBondContact OD1-CB 3.46Å; N242-Q244 WeakPolarHBondContact OD1-CG 3.44Å; N242-Q244 PolarHBondContact OD1-N 2.78Å; N242-N245 PolarHBondContact N-ND2 2.88Å; N242-N245 WeakPolarHBondContact O-CB 3.43Å; N242-N245 PolarHBondContact O-N 3.33Å; N242-L251 HydrophobicContact CB-CD1 3.66Å; N242-L251 HydrophobicContact CB-CG 4.15Å
243	R	91.5	Very high	95.4	Very high	123 Å²	123	33.3 Å²	33.3	46%	0.464	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.9	176.4	-72	-172.4	167.5	-173.1	3.6	113.8	P98 Y191 N245	P98-R243 WeakPolarHBondContact CD-O 3.42Å; P98-R243 HydrophobicContact CG-CB 3.64Å; Y191-R243 HydrophobicContact CD1-CG 4.35Å; Y191-R243 HydrophobicContact CD2-CG 4.01Å; Y191-R243 VanDerWaalsContact CD2-CZ 3.48Å; Y191-R243 HydrophobicContact CE1-CG 4.09Å; Y191-R243 HydrophobicContact CE2-CG 3.74Å; Y191-R243 HydrophobicContact CG-CG 4.3Å; R243-N245 VanDerWaalsContact C-N 3.34Å
244	Q	93.8	Very high	95.4	Very high	42 Å²	42	29.3 Å²	29.3	20%	0.196	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-8.4	176.4	-61.6	-176.3	-41.2	0	0	113.1	Y97 P98 L160 N242	Y97-Q244 PolarHBondContact OH-O 2.75Å; P98-Q244 HydrophobicContact CB-CG 4.42Å; L160-Q244 HydrophobicContact CD2-CB 4.06Å; L160-Q244 HydrophobicContact CG-CB 4.48Å; N242-Q244 PolarHBondContact O-N 3.06Å; N242-Q244 WeakPolarHBondContact OD1-CB 3.46Å; N242-Q244 WeakPolarHBondContact OD1-CG 3.44Å; N242-Q244 PolarHBondContact OD1-N 2.78Å
245	N	96.3	Very high	95.4	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.011	11%	0.112	C	C	.	.			trans	-63.2	142.9	174.1	-65.9	-10.3	0	0	0	109.6	T152 Y239 L240 N242 R243 W250 L251	T152-N245 HydrophobicContact CG2-CB 4.26Å; Y239-N245 WeakPolarHBondContact CE1-ND2 3.27Å; Y239-N245 PolarHBondContact OH-ND2 2.94Å; L240-N245 PolarHBondContact O-ND2 2.94Å; N242-N245 PolarHBondContact N-ND2 2.88Å; N242-N245 WeakPolarHBondContact O-CB 3.43Å; N242-N245 PolarHBondContact O-N 3.33Å; R243-N245 VanDerWaalsContact C-N 3.34Å; N245-W250 HydrophobicContact CB-CB 4.19Å; N245-W250 WeakPolarHBondContact OD1-CA 3.13Å; N245-L251 PolarHBondContact OD1-N 3.34Å
246	T	97.4	Very high	95.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.108	C	C	.	.			trans	-124.2	178.6	177.3	73.8	0	0	0	0	109.6	Y97 N147 T152 F154 G156 N248 A249	Y97-T246 HydrophobicContact CE2-CG2 3.83Å; N147-T246 PolarHBondContact ND2-O 2.9Å; N147-T246 VanDerWaalsContact ND2-O 3.08Å; T152-T246 VanDerWaalsContact CG2-C 3.42Å; T152-T246 WeakPolarHBondContact CG2-O 3.49Å; T152-T246 WeakPolarHBondContact OG1-CA 3.15Å; F154-T246 HydrophobicContact CD1-CG2 3.91Å; F154-T246 CarbonylContact O-C 3.48Å; F154-T246 WeakPolarHBondContact O-CA 3.48Å; F154-T246 WeakPolarHBondContact O-CB 3.49Å; G156-T246 VanDerWaalsContact O-CB 3.28Å; G156-T246 WeakPolarHBondContact O-CB 3.33Å; G156-T246 PolarHBondContact O-OG1 3.2Å; T246-N248 PolarHBondContact O-N 3.14Å; T246-N248 PolarHBondContact OG1-N 3.05Å; T246-N248 VanDerWaalsContact OG1-N 3.08Å; T246-A249 PolarHBondContact N-O 3.01Å; T246-A249 PolarHBondContact OG1-N 3.12Å; T246-A249 PolarHBondContact OG1-O 3.45Å
247	D	97	Very high	95.6	Very high	7 Å²	7	21.6 Å²	21.6	4%	0.037	11%	0.107	C	C	.	.	S	Bend	trans	-67.7	-10.5	172.4	-83.5	36.5	0	0	0	113.2	R114 Y121 N147 T152 F154	R114-D247 IonicContact CZ-OD2 3.71Å; R114-D247 IonicContact NH1-OD2 3.67Å; R114-D247 PolarHBondContact NH1-OD2 3.39Å; R114-D247 VanDerWaalsContact NH1-OD2 3.09Å; R114-D247 PolarHBondContact NH2-O 2.82Å; R114-D247 VanDerWaalsContact NH2-O 3.11Å; R114-D247 IonicContact NH2-OD2 2.84Å; Y121-D247 WeakPolarHBondContact CE1-OD2 3.33Å; Y121-D247 PolarHBondContact OH-OD1 3.11Å; Y121-D247 PolarHBondContact OH-OD2 3.33Å; N147-D247 WeakPolarHBondContact CB-O 3.47Å; N147-D247 PolarHBondContact N-O 3.09Å; T152-D247 PolarHBondContact N-OD1 2.79Å; T152-D247 PolarHBondContact OG1-N 2.73Å; T152-D247 PolarHBondContact OG1-OD1 3.11Å; F154-D247 WeakPolarHBondContact O-CB 3.48Å; F154-D247 PolarHBondContact O-N 3.06Å
248	N	97.3	Very high	95.8	Very high	11 Å²	11	17.2 Å²	17.2	6%	0.059	8%	0.081	C	C	.	.	S	Bend	trans	-133.9	-8.2	-173	-50.4	102.4	0	0	0	114.8	W144 I145 S155 G156 Y163 G164 T246	W144-N248 HydrophobicContact CB-CB 4.32Å; W144-N248 VanDerWaalsContact CB-ND2 3.35Å; W144-N248 WeakPolarHBondContact CB-ND2 3.27Å; I145-N248 WeakPolarHBondContact O-CA 3.35Å; I145-N248 VanDerWaalsContact O-CB 3.27Å; I145-N248 WeakPolarHBondContact O-CB 3.41Å; I145-N248 PolarHBondContact O-ND2 3.44Å; S155-N248 WeakPolarHBondContact CB-OD1 3.35Å; G156-N248 PolarHBondContact N-OD1 3.04Å; Y163-N248 HydrophobicContact CD1-CB 3.86Å; Y163-N248 HydrophobicContact CE1-CB 4.08Å; G164-N248 PolarHBondContact N-O 2.8Å; T246-N248 PolarHBondContact O-N 3.14Å; T246-N248 PolarHBondContact OG1-N 3.05Å; T246-N248 VanDerWaalsContact OG1-N 3.08Å
249	A	97.1	Very high	95.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	134	175.6	0	0	0	0	0	109.6	M157 L160 E162 G164 T246	M157-A249 HydrophobicContact CG-CB 4.32Å; L160-A249 HydrophobicContact CB-CB 4.06Å; L160-A249 HydrophobicContact CD1-CB 3.67Å; L160-A249 VanDerWaalsContact CD1-O 3.32Å; L160-A249 WeakPolarHBondContact CD1-O 3.24Å; L160-A249 HydrophobicContact CG-CB 4.41Å; E162-A249 VanDerWaalsContact O-CB 3.29Å; E162-A249 WeakPolarHBondContact O-CB 3.18Å; G164-A249 WeakPolarHBondContact O-CA 3.44Å; T246-A249 PolarHBondContact N-O 3.01Å; T246-A249 PolarHBondContact OG1-N 3.12Å; T246-A249 PolarHBondContact OG1-O 3.45Å
250	W	97.2	Very high	95.7	Very high	15 Å²	15	19.6 Å²	19.6	6%	0.057	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	163.1	-177.5	59.9	92.5	0	0	0	112.1	I145 R146 N147 G164 P165 N166 Y239 N245	I145-W250 HydrophobicContact CG2-CH2 3.82Å; I145-W250 HydrophobicContact CG2-CZ3 4.15Å; R146-W250 WeakPolarHBondContact O-CH2 3.38Å; N147-W250 HydrophobicContact CB-CD2 4.22Å; N147-W250 HydrophobicContact CB-CE3 3.52Å; N147-W250 HydrophobicContact CB-CZ3 3.77Å; N147-W250 VanDerWaalsContact N-CZ3 3.31Å; G164-W250 PolarHBondContact O-N 3.05Å; P165-W250 CarbonylContact C-O 3.58Å; P165-W250 HydrophobicContact CB-CZ2 4.38Å; N166-W250 PolarHBondContact N-O 2.93Å; Y239-W250 HydrophobicContact CD2-CB 4.22Å; Y239-W250 AromaticContact CD2-CD1 3.41Å; Y239-W250 VanDerWaalsContact CD2-CD1 3.41Å; Y239-W250 AromaticContact CD2-CG 3.92Å; Y239-W250 HydrophobicContact CD2-CG 3.92Å; Y239-W250 HydrophobicContact CE2-CB 3.45Å; Y239-W250 VanDerWaalsContact CE2-CB 3.45Å; Y239-W250 AromaticContact CE2-CD1 3.53Å; Y239-W250 HydrophobicContact CE2-CD2 4.45Å; Y239-W250 AromaticContact CE2-CG 3.52Å; Y239-W250 HydrophobicContact CE2-CG 3.52Å; N245-W250 HydrophobicContact CB-CB 4.19Å; N245-W250 WeakPolarHBondContact OD1-CA 3.13Å
251	L	96	Very high	95.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	137.5	173.3	-60	-169.5	0	0	0	111.9	L160 N166 A168 Y170 W198 L240 N242 N245	L160-L251 HydrophobicContact CD2-CD2 3.75Å; L160-L251 HydrophobicContact CD2-CG 4.49Å; N166-L251 HydrophobicContact CB-CD2 4.02Å; N166-L251 WeakPolarHBondContact O-CA 3.35Å; A168-L251 HydrophobicContact CB-CD1 4.34Å; A168-L251 HydrophobicContact CB-CD2 4.35Å; Y170-L251 HydrophobicContact CE1-CD1 4.2Å; W198-L251 HydrophobicContact CH2-CD2 3.76Å; W198-L251 HydrophobicContact CZ3-CD2 3.48Å; W198-L251 VanDerWaalsContact CZ3-CD2 3.48Å; L240-L251 HydrophobicContact CB-CB 3.88Å; L240-L251 PolarHBondContact N-O 3.46Å; N242-L251 HydrophobicContact CB-CD1 3.66Å; N242-L251 HydrophobicContact CB-CG 4.15Å; N245-L251 PolarHBondContact OD1-N 3.34Å
252	E	95.2	Very high	94.7	Very high	43 Å²	43	23 Å²	23	20%	0.201	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	143.3	173.1	-158.1	-160.9	135.1	0	0	110.2	P165 N166 K167 A168 G238	P165-E252 HydrophobicContact CB-CB 3.99Å; P165-E252 WeakPolarHBondContact CB-OE2 3.5Å; N166-E252 PolarHBondContact O-N 2.87Å; K167-E252 CarbonylContact C-O 3.49Å; K167-E252 VanDerWaalsContact CA-O 3.25Å; K167-E252 WeakPolarHBondContact CA-O 3.44Å; K167-E252 HydrophobicContact CD-CB 4.36Å; K167-E252 IonicContact NZ-OE1 3.09Å; K167-E252 PolarHBondContact NZ-OE1 3.28Å; K167-E252 IonicContact NZ-OE2 3.99Å; K167-E252 PolarHBondContact NZ-OE2 3.5Å; A168-E252 PolarHBondContact N-O 2.9Å; G238-E252 CarbonylContact O-C 3.56Å; G238-E252 VanDerWaalsContact O-CA 3.31Å; G238-E252 WeakPolarHBondContact O-CA 3.35Å; G238-E252 WeakPolarHBondContact O-CG 3.42Å
253	G	94.7	Very high	93.7	Very high	10 Å²	10	30.2 Å²	30.2	10%	0.103	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.9	-143.8	175.5	0	0	0	0	0	111.9	A168 V237 G238	A168-G253 VanDerWaalsContact O-CA 3.32Å; A168-G253 WeakPolarHBondContact O-CA 3.49Å; V237-G253 CarbonylContact C-O 3.59Å; V237-G253 VanDerWaalsContact CA-O 3.24Å; V237-G253 WeakPolarHBondContact CA-O 3.43Å; G238-G253 PolarHBondContact N-O 3.39Å; G238-G253 PolarHBondContact O-N 3.38Å
254	A	95	Very high	92.8	Very high	3 Å²	3	35.6 Å²	35.6	3%	0.025	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	152	-172.5	0	0	0	0	0	113.4	A168 Y170 I204 H236 V237 I256	A168-A254 PolarHBondContact O-N 3.37Å; Y170-A254 PolarHBondContact N-O 2.87Å; I204-A254 HydrophobicContact CD1-CB 3.55Å; H236-A254 VanDerWaalsContact O-CA 3.24Å; H236-A254 WeakPolarHBondContact O-CA 3.36Å; H236-A254 WeakPolarHBondContact O-CB 3.43Å; V237-A254 HydrophobicContact CG2-CB 4.17Å; A254-I256 HydrophobicContact CB-CD1 4.02Å; A254-I256 HydrophobicContact CB-CG1 4.26Å
255	I	97.3	Very high	92.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	112.7	162.7	-50	175.6	0	0	0	107.5	Y170 L172 L194 Y235 H236 L240 A296 F299	Y170-I255 HydrophobicContact CD2-CG1 4.35Å; Y170-I255 WeakPolarHBondContact O-CA 3.34Å; L172-I255 HydrophobicContact CB-CG2 4.48Å; L194-I255 HydrophobicContact CD1-CG2 3.81Å; Y235-I255 PolarHBondContact N-O 2.79Å; H236-I255 HydrophobicContact CB-CB 3.94Å; H236-I255 HydrophobicContact CB-CD1 3.77Å; H236-I255 HydrophobicContact CB-CG1 3.82Å; H236-I255 PolarHBondContact N-O 2.8Å; H236-I255 PolarHBondContact O-N 2.9Å; L240-I255 HydrophobicContact CD2-CD1 4.11Å; L240-I255 HydrophobicContact CD2-CG1 3.64Å; I255-A296 WeakPolarHBondContact CD1-O 3.31Å; I255-A296 HydrophobicContact CG2-CB 3.92Å; I255-F299 HydrophobicContact CD1-CB 3.93Å
256	I	97.4	Very high	91.7	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.9	179.7	-56.9	-59.4	0	0	0	108.7	L169 Y170 L171 L172 I204 I209 R232 K234 A254 L258	L169-I256 HydrophobicContact CD1-CB 4.1Å; L169-I256 HydrophobicContact CD1-CG1 3.52Å; Y170-I256 PolarHBondContact O-N 3.27Å; L171-I256 WeakPolarHBondContact CA-O 3.49Å; L171-I256 HydrophobicContact CD2-CB 4.18Å; L172-I256 PolarHBondContact N-O 3.46Å; I204-I256 HydrophobicContact CG2-CG1 4.46Å; I209-I256 HydrophobicContact CD1-CG1 4.23Å; I209-I256 HydrophobicContact CD1-CG2 4.07Å; R232-I256 HydrophobicContact CB-CG2 3.98Å; R232-I256 HydrophobicContact CG-CG2 4.47Å; K234-I256 HydrophobicContact CB-CD1 3.96Å; K234-I256 HydrophobicContact CG-CD1 3.9Å; A254-I256 HydrophobicContact CB-CD1 4.02Å; A254-I256 HydrophobicContact CB-CG1 4.26Å; I256-L258 HydrophobicContact CG2-CD2 4.12Å; I256-L258 HydrophobicContact CG2-CG 4.41Å
257	H	97.8	Very high	91.3	Very high	16 Å²	16	34.8 Å²	34.8	7%	0.074	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	131.4	172.4	175.3	-120	0	0	0	111	L172 T174 R232 Q233 Y235	L172-H257 CarbonylContact O-C 3.48Å; L172-H257 VanDerWaalsContact O-CA 3.28Å; L172-H257 WeakPolarHBondContact O-CA 3.47Å; L172-H257 PolarHBondContact O-CD2 3.05Å; L172-H257 VanDerWaalsContact O-CD2 3.3Å; T174-H257 WeakPolarHBondContact CG2-NE2 3.5Å; T174-H257 PolarHBondContact OG1-NE2 2.92Å; R232-H257 WeakPolarHBondContact CA-O 3.41Å; Q233-H257 HydrophobicContact CB-CB 4.33Å; Q233-H257 PolarHBondContact N-O 2.9Å; Q233-H257 PolarHBondContact O-N 2.81Å; Y235-H257 HydrophobicContact CD1-CB 4.4Å; Y235-H257 HydrophobicContact CD2-CB 3.56Å; Y235-H257 HydrophobicContact CE1-CB 4.13Å; Y235-H257 HydrophobicContact CE2-CB 3.23Å; Y235-H257 AromaticContact CE2-CG 3.44Å; Y235-H257 VanDerWaalsContact CE2-CG 3.44Å; Y235-H257 AromaticContact CE2-ND1 3.85Å; Y235-H257 HydrophobicContact CG-CB 4.15Å; Y235-H257 AromaticContact CZ-CG 3.61Å; Y235-H257 AromaticContact CZ-ND1 3.53Å; Y235-H257 PolarHBondContact OH-ND1 3.37Å
258	L	96.8	Very high	90.7	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.2	173.3	-56.7	174.2	0	0	0	107.4	L171 L172 I173 T174 I209 V213 M228 R232 I256	L171-L258 HydrophobicContact CD1-CD1 4.42Å; L171-L258 HydrophobicContact CD2-CD1 4.2Å; L172-L258 PolarHBondContact O-N 3.14Å; I173-L258 WeakPolarHBondContact CA-O 3.12Å; I173-L258 HydrophobicContact CG1-CB 4.15Å; I173-L258 HydrophobicContact CG1-CD1 4.18Å; T174-L258 PolarHBondContact N-O 2.95Å; I209-L258 HydrophobicContact CG2-CD1 4.1Å; I209-L258 HydrophobicContact CG2-CD2 4.22Å; V213-L258 HydrophobicContact CG2-CD1 3.25Å; M228-L258 WeakPolarHBondContact O-CD2 3.34Å; R232-L258 HydrophobicContact CB-CD2 3.6Å; I256-L258 HydrophobicContact CG2-CD2 4.12Å; I256-L258 HydrophobicContact CG2-CG 4.41Å
259	H	95.2	Very high	90.1	Very high	53 Å²	53	38.9 Å²	38.9	25%	0.245	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.6	177.4	-170.8	56	0	0	0	109.4	T174 M228 N261	T174-H259 PolarHBondContact O-ND1 2.84Å; T174-H259 PolarHBondContact OG1-ND1 3.28Å; M228-H259 WeakPolarHBondContact CG-O 3.43Å; H259-N261 PolarHBondContact CD2-OD1 3.33Å; H259-N261 PolarHBondContact NE2-OD1 3.34Å; H259-N261 PolarHBondContact O-N 3.45Å
260	D	93	Very high	89.7	Confident	6 Å²	6	47.2 Å²	47.2	3%	0.032	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	101.9	175.4	-177.5	4	0	0	0	109.5	T174 R175 M228 S262 G265 C266 F267	T174-D260 PolarHBondContact O-N 3.26Å; R175-D260 HydrophobicContact CB-CB 4.19Å; M228-D260 HydrophobicContact SD-CB 4.03Å; D260-S262 VanDerWaalsContact OD1-CB 3.29Å; D260-S262 WeakPolarHBondContact OD1-CB 3.11Å; D260-S262 PolarHBondContact OD1-N 3.15Å; D260-S262 PolarHBondContact OD1-OG 2.76Å; D260-G265 WeakPolarHBondContact OD2-CA 3.38Å; D260-C266 PolarHBondContact OD2-N 2.76Å; D260-F267 HydrophobicContact CB-CD2 4.3Å; D260-F267 HydrophobicContact CB-CE2 4.23Å; D260-F267 WeakPolarHBondContact OD2-CD2 3.07Å
261	N	86.5	Confident	89.3	Confident	102 Å²	102	46.8 Å²	46.8	55%	0.545	23%	0.234	S	C	.	.			trans	-89.7	4	177.3	-75.9	-32	0	0	0	113.2	H259	H259-N261 PolarHBondContact CD2-OD1 3.33Å; H259-N261 PolarHBondContact NE2-OD1 3.34Å; H259-N261 PolarHBondContact O-N 3.45Å
262	S	81.9	Confident	88.7	Confident	27 Å²	27	50.4 Å²	50.4	19%	0.189	26%	0.256	C	S	.	.			trans	-69.3	139.9	-179.4	64.3	0	0	0	0	110.8	D260 R264 G265 C266	D260-S262 VanDerWaalsContact OD1-CB 3.29Å; D260-S262 WeakPolarHBondContact OD1-CB 3.11Å; D260-S262 PolarHBondContact OD1-N 3.15Å; D260-S262 PolarHBondContact OD1-OG 2.76Å; S262-R264 PolarHBondContact O-N 2.81Å; S262-G265 PolarHBondContact O-N 2.8Å; S262-G265 VanDerWaalsContact O-N 3.12Å; S262-G265 WeakPolarHBondContact OG-CA 3.46Å; S262-G265 PolarHBondContact OG-N 2.78Å; S262-G265 VanDerWaalsContact OG-N 3.12Å; S262-C266 PolarHBondContact OG-N 2.96Å
263	D	72.4	Confident	88.3	Confident	171 Å²	171	48.6 Å²	48.6	91%	0.914	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.3	-174.6	-65.7	-28.1	0	0	0	113.7
264	R	74	Confident	87.7	Confident	236 Å²	236	52.2 Å²	52.2	89%	0.891	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-3.9	-177.6	-62.2	-171.4	179.2	-155.7	0	114.6	S262	S262-R264 PolarHBondContact O-N 2.81Å
265	G	79.8	Confident	87.1	Confident	10 Å²	10	57.7 Å²	57.7	10%	0.103	30%	0.296	C	S	.	.			trans	70.9	101.1	-171.6	0	0	0	0	0	112.3	D260 S262 F267 G268	D260-G265 WeakPolarHBondContact OD2-CA 3.38Å; S262-G265 PolarHBondContact O-N 2.8Å; S262-G265 VanDerWaalsContact O-N 3.12Å; S262-G265 WeakPolarHBondContact OG-CA 3.46Å; S262-G265 PolarHBondContact OG-N 2.78Å; S262-G265 VanDerWaalsContact OG-N 3.12Å; G265-F267 VanDerWaalsContact C-N 3.29Å; G265-F267 PolarHBondContact O-N 2.84Å; G265-G268 PolarHBondContact O-N 3.49Å
266	C	87.4	Confident	86.4	Confident	14 Å²	14	59.8 Å²	59.8	10%	0.095	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-20.4	-167.6	75.2	0	0	0	0	113.5	N217 C220 E224 D260 S262 G268	N217-C266 PolarHBondContact OD1-O 2.69Å; N217-C266 VanDerWaalsContact OD1-O 3.14Å; C220-C266 HydrophobicContact CB-CB 3.67Å; C220-C266 WeakPolarHBondContact CB-SG 3.39Å; C220-C266 PolarHBondContact N-O 3.1Å; C220-C266 WeakPolarHBondContact SG-CB 3.28Å; C220-C266 PolarHBondContact SG-O 2.97Å; C220-C266 CovalentContact SG-SG 2.04Å; C220-C266 PolarHBondContact SG-SG 2.9Å; E224-C266 WeakPolarHBondContact OE2-CB 3.13Å; D260-C266 PolarHBondContact OD2-N 2.76Å; S262-C266 PolarHBondContact OG-N 2.96Å; C266-G268 PolarHBondContact O-N 2.83Å
267	F	89.1	Confident	85.5	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.018	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-10.7	176.6	-67.5	-90.2	0	0	0	114	I173 I184 V213 N217 M228 D260 G265 P271 W283	I173-F267 HydrophobicContact CD1-CE1 3.87Å; I173-F267 HydrophobicContact CD1-CZ 3.84Å; I173-F267 HydrophobicContact CG1-CZ 4.4Å; I173-F267 HydrophobicContact CG2-CD2 4.04Å; I173-F267 HydrophobicContact CG2-CE2 3.59Å; I173-F267 HydrophobicContact CG2-CZ 3.92Å; I184-F267 HydrophobicContact CD1-CB 4.08Å; I184-F267 HydrophobicContact CD1-CD1 3.93Å; I184-F267 HydrophobicContact CD1-CD2 4.31Å; I184-F267 HydrophobicContact CD1-CE1 4.48Å; I184-F267 HydrophobicContact CD1-CG 3.85Å; V213-F267 HydrophobicContact CG1-CE1 3.94Å; V213-F267 HydrophobicContact CG1-CZ 3.71Å; N217-F267 HydrophobicContact CB-CD1 3.77Å; N217-F267 HydrophobicContact CB-CE1 3.99Å; M228-F267 HydrophobicContact CE-CE2 3.69Å; M228-F267 HydrophobicContact CE-CZ 3.92Å; M228-F267 HydrophobicContact SD-CE2 3.75Å; M228-F267 HydrophobicContact SD-CZ 4.22Å; D260-F267 HydrophobicContact CB-CD2 4.3Å; D260-F267 HydrophobicContact CB-CE2 4.23Å; D260-F267 WeakPolarHBondContact OD2-CD2 3.07Å; G265-F267 VanDerWaalsContact C-N 3.29Å; G265-F267 PolarHBondContact O-N 2.84Å; F267-P271 HydrophobicContact CB-CG 4.13Å; F267-W283 HydrophobicContact CB-CZ2 4.12Å
268	G	84.7	Confident	84.8	Confident	17 Å²	17	69.4 Å²	69.4	18%	0.175	38%	0.379	C	S	.	.			trans	69	-179	-173.6	0	0	0	0	0	113.8	G265 C266 W283	G265-G268 PolarHBondContact O-N 3.49Å; C266-G268 PolarHBondContact O-N 2.83Å; G268-W283 PolarHBondContact O-NE1 3.24Å
269	P	84.4	Confident	84.3	Confident	86 Å²	86	71.3 Å²	71.3	56%	0.558	39%	0.386	S	S	*	.	S	Bend	trans	-73.3	-28.9	-178.7	27.4	-33.5	0	0	0	113.8	W283	P269-W283 VanDerWaalsContact O-CD1 3.32Å
270	Y	87.3	Confident	84	Confident	175 Å²	175	75 Å²	75	69%	0.686	40%	0.403	S	S	*	.	S	Bend	trans	-131.7	87.4	-179.6	-58	-74	0	0	0	109.2
271	P	89	Confident	84.1	Confident	6 Å²	6	75.1 Å²	75.1	4%	0.039	40%	0.403	C	S	.	.			trans	-57.5	147.4	177.6	-20.5	31.1	0	0	0	111.2	I184 L216 F267 Y281	I184-P271 HydrophobicContact CD1-CB 4.43Å; I184-P271 HydrophobicContact CD1-CG 3.73Å; I184-P271 HydrophobicContact CG1-CG 4.16Å; I184-P271 HydrophobicContact CG2-CG 4.11Å; L216-P271 HydrophobicContact CD1-CB 4.42Å; L216-P271 HydrophobicContact CG-CB 4.27Å; L216-P271 WeakPolarHBondContact O-CB 3.12Å; F267-P271 HydrophobicContact CB-CG 4.13Å; P271-Y281 WeakPolarHBondContact O-CB 3.31Å
272	V	84.8	Confident	84.3	Confident	76 Å²	76	70.9 Å²	70.9	46%	0.461	38%	0.381	S	S	.	.			trans	-120.9	131.4	-176.5	-179.2	0	0	0	0	109.5	L216	L216-V272 CarbonylContact C-O 2.96Å; L216-V272 WeakPolarHBondContact CA-O 3.21Å; L216-V272 PolarHBondContact O-N 2.74Å
273	H	85.7	Confident	84.9	Confident	6 Å²	6	71 Å²	71	3%	0.028	38%	0.378	C	S	.	.			trans	-88.5	107.3	173.2	-168.1	-57.8	0	0	0	110.8	F197 K215 E275 V276 Y281	F197-H273 AromaticContact CD1-NE2 3.54Å; F197-H273 AromaticContact CE1-CD2 3.59Å; F197-H273 AromaticContact CE1-NE2 3.18Å; F197-H273 WeakPolarHBondContact CE1-NE2 3.32Å; K215-H273 CarbonylContact O-C 3.47Å; K215-H273 VanDerWaalsContact O-CA 3.24Å; K215-H273 WeakPolarHBondContact O-CA 3.14Å; H273-E275 PolarHBondContact ND1-N 3.16Å; H273-E275 PolarHBondContact O-N 3.38Å; H273-E275 VanDerWaalsContact O-N 3.1Å; H273-V276 PolarHBondContact ND1-N 3.37Å; H273-V276 CarbonylContact O-C 3.41Å; H273-V276 PolarHBondContact O-N 3.47Å; H273-Y281 HydrophobicContact CB-CE2 3.58Å
274	S	82.4	Confident	85.9	Confident	85 Å²	85	66.2 Å²	66.2	59%	0.594	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-28	-172.5	61.3	0	0	0	0	114.6	K215	K215-S274 PolarHBondContact O-N 3.35Å; K215-S274 PolarHBondContact O-OG 2.97Å
275	E	82.8	Confident	86.9	Confident	119 Å²	119	58.6 Å²	58.6	56%	0.556	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.4	177.7	-47.3	-175.1	135.1	0	0	114.7	K215 H273	K215-E275 HydrophobicContact CD-CG 4.15Å; K215-E275 WeakPolarHBondContact CD-OE2 3.18Å; K215-E275 VanDerWaalsContact CE-CD 3.43Å; K215-E275 WeakPolarHBondContact CE-OE1 3.48Å; K215-E275 WeakPolarHBondContact CE-OE2 3.42Å; K215-E275 HydrophobicContact CG-CG 4.44Å; K215-E275 IonicContact NZ-OE1 2.95Å; K215-E275 PolarHBondContact NZ-OE1 2.87Å; K215-E275 IonicContact NZ-OE2 2.56Å; K215-E275 PolarHBondContact NZ-OE2 3.42Å; H273-E275 PolarHBondContact ND1-N 3.16Å; H273-E275 PolarHBondContact O-N 3.38Å; H273-E275 VanDerWaalsContact O-N 3.1Å
276	V	82.5	Confident	87.6	Confident	43 Å²	43	58.4 Å²	58.4	26%	0.261	33%	0.326	S	S	.	.			trans	-141	75	-172.7	-166	0	0	0	0	109	H273 T278 R279	H273-V276 PolarHBondContact ND1-N 3.37Å; H273-V276 CarbonylContact O-C 3.41Å; H273-V276 PolarHBondContact O-N 3.47Å; V276-T278 PolarHBondContact O-N 3.42Å; V276-R279 HydrophobicContact CB-CG 4.23Å; V276-R279 HydrophobicContact CG1-CB 4.5Å; V276-R279 HydrophobicContact CG1-CG 3.7Å; V276-R279 PolarHBondContact O-N 3.44Å
277	A	78.8	Confident	87.8	Confident	94 Å²	94	60.7 Å²	60.7	78%	0.777	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.8	-175.9	0	0	0	0	0	114	R279	A277-R279 VanDerWaalsContact C-N 3.28Å; A277-R279 PolarHBondContact O-N 2.94Å
278	T	82.7	Confident	87.8	Confident	127 Å²	127	67.6 Å²	67.6	78%	0.779	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-15.4	177.9	54.8	0	0	0	0	113.6	V276	V276-T278 PolarHBondContact O-N 3.42Å
279	R	85.5	Confident	88.2	Confident	41 Å²	41	74.8 Å²	74.8	16%	0.155	41%	0.405	C	S	.	.			trans	-83.2	132.3	178.7	-70.3	179.9	-176.9	-164.9	16.5	110.7	E186 R196 V276 A277 Y281	E186-R279 WeakPolarHBondContact OE1-CD 3.36Å; E186-R279 IonicContact OE1-CZ 2.88Å; E186-R279 IonicContact OE1-NE 3.94Å; E186-R279 PolarHBondContact OE1-NE 2.84Å; E186-R279 IonicContact OE1-NH1 3.87Å; E186-R279 PolarHBondContact OE1-NH1 2.75Å; E186-R279 IonicContact OE2-CZ 3.2Å; E186-R279 IonicContact OE2-NE 2.6Å; E186-R279 IonicContact OE2-NH1 2.77Å; E186-R279 PolarHBondContact OE2-NH1 3.45Å; R196-R279 PolarHBondContact O-NH1 3.32Å; V276-R279 HydrophobicContact CB-CG 4.23Å; V276-R279 HydrophobicContact CG1-CB 4.5Å; V276-R279 HydrophobicContact CG1-CG 3.7Å; V276-R279 PolarHBondContact O-N 3.44Å; A277-R279 VanDerWaalsContact C-N 3.28Å; A277-R279 PolarHBondContact O-N 2.94Å; R279-Y281 HydrophobicContact CB-CE2 3.58Å; R279-Y281 WeakPolarHBondContact CD-OH 3.26Å
280	Q	90.4	Very high	88.7	Confident	131 Å²	131	72.6 Å²	72.6	61%	0.612	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.8	179.1	-65.2	179.6	-6.8	0	0	110	Q187	Q187-Q280 PolarHBondContact N-O 3Å
281	Y	93.1	Very high	89	Confident	7 Å²	7	67.4 Å²	67.4	3%	0.027	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	141.1	179	-59.1	-88.2	0	0	0	111.1	I184 V185 E186 P195 L216 P271 H273 R279	I184-Y281 HydrophobicContact CG2-CD1 4.04Å; I184-Y281 HydrophobicContact CG2-CG 4.47Å; V185-Y281 VanDerWaalsContact O-CA 3.22Å; V185-Y281 WeakPolarHBondContact O-CA 3.28Å; V185-Y281 WeakPolarHBondContact O-CD1 3.49Å; E186-Y281 HydrophobicContact CB-CD1 4.05Å; E186-Y281 HydrophobicContact CB-CE1 3.61Å; E186-Y281 HydrophobicContact CG-CD1 4.45Å; E186-Y281 HydrophobicContact CG-CE1 3.8Å; E186-Y281 PolarHBondContact OE2-OH 2.75Å; E186-Y281 VanDerWaalsContact OE2-OH 3.07Å; P195-Y281 HydrophobicContact CB-CE1 3.94Å; P195-Y281 HydrophobicContact CG-CD1 4.05Å; P195-Y281 HydrophobicContact CG-CE1 3.95Å; L216-Y281 HydrophobicContact CD1-CD1 3.91Å; L216-Y281 HydrophobicContact CD1-CD2 3.96Å; L216-Y281 HydrophobicContact CD1-CE1 3.76Å; L216-Y281 HydrophobicContact CD1-CE2 3.84Å; L216-Y281 HydrophobicContact CD1-CG 4Å; P271-Y281 WeakPolarHBondContact O-CB 3.31Å; H273-Y281 HydrophobicContact CB-CE2 3.58Å; R279-Y281 HydrophobicContact CB-CE2 3.58Å; R279-Y281 WeakPolarHBondContact CD-OH 3.26Å
282	S	92.5	Very high	89.3	Confident	13 Å²	13	68.6 Å²	68.6	9%	0.091	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	161.3	175.3	87.1	0	0	0	0	110.6	I184 V185 Q187 Q284	I184-S282 WeakPolarHBondContact CA-O 3.23Å; V185-S282 PolarHBondContact N-O 2.05Å; V185-S282 PolarHBondContact O-N 2.61Å; Q187-S282 PolarHBondContact NE2-OG 2.95Å; Q187-S282 VanDerWaalsContact NE2-OG 3.16Å; S282-Q284 PolarHBondContact OG-NE2 2.9Å
283	W	92.8	Very high	89.8	Confident	29 Å²	29	70.4 Å²	70.4	11%	0.11	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	137.8	166.7	-68.4	90.9	0	0	0	110.4	I173 R175 K182 Y183 I184 F267 G268 P269	I173-W283 HydrophobicContact CG2-CH2 4.16Å; R175-W283 HydrophobicContact CB-CH2 3.83Å; R175-W283 HydrophobicContact CB-CZ3 3.94Å; R175-W283 HydrophobicContact CG-CD2 4.48Å; R175-W283 HydrophobicContact CG-CE3 3.91Å; R175-W283 HydrophobicContact CG-CH2 3.62Å; R175-W283 HydrophobicContact CG-CZ2 4.21Å; R175-W283 HydrophobicContact CG-CZ3 3.46Å; R175-W283 VanDerWaalsContact CG-CZ3 3.46Å; R175-W283 VanDerWaalsContact NE-CD2 3.34Å; R175-W283 VanDerWaalsContact NH2-CG 3.34Å; K182-W283 HydrophobicContact CB-CB 4.44Å; K182-W283 HydrophobicContact CB-CD2 4.47Å; K182-W283 HydrophobicContact CB-CE3 3.71Å; K182-W283 HydrophobicContact CB-CZ3 4.39Å; Y183-W283 VanDerWaalsContact C-CE3 3.46Å; Y183-W283 CarbonylContact O-C 3.53Å; Y183-W283 WeakPolarHBondContact O-CA 3.34Å; I184-W283 HydrophobicContact CD1-CH2 3.9Å; I184-W283 HydrophobicContact CD1-CZ2 3.74Å; I184-W283 HydrophobicContact CD1-CZ3 4.49Å; I184-W283 HydrophobicContact CG1-CD2 3.9Å; I184-W283 HydrophobicContact CG1-CE3 3.88Å; I184-W283 HydrophobicContact CG1-CH2 3.61Å; I184-W283 HydrophobicContact CG1-CZ2 3.62Å; I184-W283 HydrophobicContact CG1-CZ3 3.72Å; F267-W283 HydrophobicContact CB-CZ2 4.12Å; G268-W283 PolarHBondContact O-NE1 3.24Å; P269-W283 VanDerWaalsContact O-CD1 3.32Å
284	Q	94	Very high	90.3	Very high	72 Å²	72	73.6 Å²	73.6	34%	0.336	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	153.2	171.4	-67.1	-64.9	-20.2	0	0	109.6	K182 Y183 V185 S282	K182-Q284 CarbonylContact C-O 3.45Å; K182-Q284 WeakPolarHBondContact CA-O 3.46Å; K182-Q284 WeakPolarHBondContact CB-O 3.32Å; Y183-Q284 HydrophobicContact CD1-CB 4.11Å; Y183-Q284 VanDerWaalsContact CD1-O 3.23Å; Y183-Q284 WeakPolarHBondContact CD1-O 2.86Å; Y183-Q284 HydrophobicContact CE1-CB 3.5Å; Y183-Q284 HydrophobicContact CE2-CB 4.39Å; Y183-Q284 PolarHBondContact N-O 3.46Å; Y183-Q284 PolarHBondContact O-N 2.89Å; V185-Q284 HydrophobicContact CB-CG 4.41Å; V185-Q284 HydrophobicContact CG1-CB 4.35Å; V185-Q284 HydrophobicContact CG1-CG 3.98Å; V185-Q284 HydrophobicContact CG2-CG 3.51Å; S282-Q284 PolarHBondContact OG-NE2 2.9Å
285	V	94.6	Very high	90.9	Very high	75 Å²	75	70.8 Å²	70.8	46%	0.455	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	127.6	175.7	178.8	0	0	0	0	108.9	K182	K182-V285 HydrophobicContact CG-CG2 4.44Å
286	L	94.7	Very high	91.5	Very high	6 Å²	6	65.1 Å²	65.1	3%	0.031	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-76.1	127.7	171.6	-171.2	70.6	0	0	0	108.6	T181 Y183 H288 T290 P292 F295	T181-L286 HydrophobicContact CG2-CB 4.25Å; T181-L286 HydrophobicContact CG2-CD2 4.09Å; T181-L286 WeakPolarHBondContact O-CB 3.2Å; T181-L286 PolarHBondContact O-N 2.74Å; Y183-L286 HydrophobicContact CD1-CB 4.01Å; Y183-L286 HydrophobicContact CD1-CD1 4.19Å; Y183-L286 HydrophobicContact CE1-CB 4.41Å; Y183-L286 HydrophobicContact CE1-CD1 4.28Å; L286-H288 PolarHBondContact O-N 2.93Å; L286-T290 HydrophobicContact CD1-CG2 3.95Å; L286-T290 HydrophobicContact CG-CG2 4.03Å; L286-P292 HydrophobicContact CD2-CB 4.34Å; L286-P292 HydrophobicContact CD2-CG 3.77Å; L286-F295 HydrophobicContact CD1-CB 3.68Å; L286-F295 HydrophobicContact CD1-CD1 3.63Å; L286-F295 HydrophobicContact CD1-CD2 3.87Å; L286-F295 HydrophobicContact CD1-CE1 4.23Å; L286-F295 HydrophobicContact CD1-CE2 4.44Å; L286-F295 HydrophobicContact CD1-CG 3.43Å; L286-F295 VanDerWaalsContact CD1-CG 3.43Å
287	P	92.6	Very high	92	Very high	62 Å²	62	69.2 Å²	69.2	40%	0.403	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-57.8	135.6	178.6	-24.8	34.1	0	0	0	112.1	I289 T290	P287-I289 HydrophobicContact CB-CG1 3.96Å; P287-I289 PolarHBondContact O-N 3.28Å; P287-I289 VanDerWaalsContact O-N 3.09Å; P287-T290 HydrophobicContact CB-CG2 4.26Å; P287-T290 HydrophobicContact CG-CG2 4.46Å; P287-T290 WeakPolarHBondContact O-CG2 2.95Å; P287-T290 PolarHBondContact O-N 3Å; P287-T290 VanDerWaalsContact O-N 3.1Å
288	H	89.5	Confident	92.7	Very high	149 Å²	149	68.6 Å²	68.6	69%	0.69	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.2	-179.6	-63.6	-68.1	0	0	0	114	L286 T290	L286-H288 PolarHBondContact O-N 2.93Å; H288-T290 VanDerWaalsContact C-N 3.26Å; H288-T290 PolarHBondContact O-N 3.19Å
289	I	93.1	Very high	93.2	Very high	168 Å²	168	63.3 Å²	63.3	86%	0.862	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-0.7	178.3	62.5	168.4	0	0	0	113.7	P287	P287-I289 HydrophobicContact CB-CG1 3.96Å; P287-I289 PolarHBondContact O-N 3.28Å; P287-I289 VanDerWaalsContact O-N 3.09Å
290	T	93.5	Very high	93.6	Very high	41 Å²	41	61.7 Å²	61.7	25%	0.252	31%	0.311	S	S	.	.	S	Bend	trans	-132.8	150.3	-178.9	-163.2	0	0	0	0	112	L286 P287 H288 F295	L286-T290 HydrophobicContact CD1-CG2 3.95Å; L286-T290 HydrophobicContact CG-CG2 4.03Å; P287-T290 HydrophobicContact CB-CG2 4.26Å; P287-T290 HydrophobicContact CG-CG2 4.46Å; P287-T290 WeakPolarHBondContact O-CG2 2.95Å; P287-T290 PolarHBondContact O-N 3Å; P287-T290 VanDerWaalsContact O-N 3.1Å; H288-T290 VanDerWaalsContact C-N 3.26Å; H288-T290 PolarHBondContact O-N 3.19Å; T290-F295 HydrophobicContact CG2-CB 4.07Å
291	T	94.4	Very high	93.5	Very high	65 Å²	65	57.2 Å²	57.2	40%	0.399	29%	0.291	S	S	.	.			trans	-88	155.3	171.6	73.6	0	0	0	0	110.2	R293 D294 F295	T291-R293 PolarHBondContact O-N 3.49Å; T291-R293 VanDerWaalsContact O-N 3.12Å; T291-R293 PolarHBondContact OG1-N 3.31Å; T291-D294 PolarHBondContact O-N 3.37Å; T291-D294 VanDerWaalsContact O-N 3.14Å; T291-D294 PolarHBondContact OG1-N 2.88Å; T291-D294 VanDerWaalsContact OG1-N 3.09Å; T291-D294 PolarHBondContact OG1-OD2 3.1Å; T291-F295 WeakPolarHBondContact O-CB 3.39Å; T291-F295 PolarHBondContact O-N 3.27Å
292	P	95.2	Very high	92.7	Very high	32 Å²	32	61.4 Å²	61.4	21%	0.208	32%	0.321	C	S	.	.	H	α-helix	trans	-52.4	-33.9	171.6	-29	35.8	0	0	0	113.2	L172 T174 Y235 L286 A296	L172-P292 HydrophobicContact CD2-CB 3.96Å; L172-P292 WeakPolarHBondContact CD2-O 3.5Å; T174-P292 HydrophobicContact CG2-CB 4.45Å; Y235-P292 HydrophobicContact CE2-CB 3.94Å; L286-P292 HydrophobicContact CD2-CB 4.34Å; L286-P292 HydrophobicContact CD2-CG 3.77Å; P292-A296 VanDerWaalsContact O-CB 3.27Å; P292-A296 WeakPolarHBondContact O-CB 3.17Å; P292-A296 PolarHBondContact O-N 2.82Å
293	R	96.1	Very high	91.3	Very high	114 Å²	114	64 Å²	64	43%	0.43	34%	0.343	S	S	.	.	H	α-helix	trans	-68	-47.9	177.6	-178.6	-177.7	-71.3	-154.7	-0.2	112.1	Y235 T291 A296 R297	Y235-R293 HydrophobicContact CD1-CB 4.21Å; Y235-R293 HydrophobicContact CD1-CG 4.07Å; Y235-R293 HydrophobicContact CD2-CB 4.15Å; Y235-R293 HydrophobicContact CE1-CB 4.08Å; Y235-R293 HydrophobicContact CE1-CG 4.36Å; Y235-R293 HydrophobicContact CE2-CB 4Å; Y235-R293 HydrophobicContact CG-CB 4.24Å; Y235-R293 HydrophobicContact CG-CG 4.15Å; T291-R293 PolarHBondContact O-N 3.49Å; T291-R293 VanDerWaalsContact O-N 3.12Å; T291-R293 PolarHBondContact OG1-N 3.31Å; R293-A296 WeakPolarHBondContact O-CB 3.28Å; R293-A296 PolarHBondContact O-N 3.21Å; R293-R297 WeakPolarHBondContact O-CG 3.06Å; R293-R297 PolarHBondContact O-N 3.27Å; R293-R297 VanDerWaalsContact O-N 3.16Å
294	D	94.9	Very high	89.5	Confident	72 Å²	72	72.8 Å²	72.8	39%	0.385	38%	0.382	S	S	.	.	H	α-helix	trans	-69.6	-38.9	-178.7	-60.3	-40.6	0	0	0	111.1	T291 R297	T291-D294 PolarHBondContact O-N 3.37Å; T291-D294 VanDerWaalsContact O-N 3.14Å; T291-D294 PolarHBondContact OG1-N 2.88Å; T291-D294 VanDerWaalsContact OG1-N 3.09Å; T291-D294 PolarHBondContact OG1-OD2 3.1Å; D294-R297 WeakPolarHBondContact O-CB 3.48Å; D294-R297 PolarHBondContact O-N 3.49Å; D294-R297 IonicContact OD1-NH1 2.76Å
295	F	95	Very high	89.3	Confident	26 Å²	26	72.8 Å²	72.8	11%	0.114	38%	0.384	C	S	.	.	H	α-helix	trans	-59.9	-46.4	171.6	-179	-105.6	0	0	0	112.2	L172 Y183 L194 L286 T290 T291 R297 T298 F299	L172-F295 HydrophobicContact CD1-CD1 4.23Å; L172-F295 HydrophobicContact CD1-CE1 4.34Å; Y183-F295 AromaticContact CD2-CE1 3.69Å; Y183-F295 HydrophobicContact CD2-CE1 3.69Å; Y183-F295 HydrophobicContact CD2-CZ 4.23Å; Y183-F295 HydrophobicContact CE1-CE1 4.35Å; Y183-F295 HydrophobicContact CE1-CZ 4.24Å; Y183-F295 HydrophobicContact CE2-CD1 4.46Å; Y183-F295 AromaticContact CE2-CE1 3.28Å; Y183-F295 HydrophobicContact CE2-CE1 3.28Å; Y183-F295 AromaticContact CE2-CZ 3.35Å; Y183-F295 HydrophobicContact CE2-CZ 3.35Å; Y183-F295 HydrophobicContact CG-CE1 4.35Å; Y183-F295 AromaticContact CZ-CE1 3.7Å; Y183-F295 AromaticContact CZ-CZ 3.39Å; Y183-F295 WeakPolarHBondContact OH-CZ 3.46Å; L194-F295 HydrophobicContact CD2-CE1 4.44Å; L286-F295 HydrophobicContact CD1-CB 3.68Å; L286-F295 HydrophobicContact CD1-CD1 3.63Å; L286-F295 HydrophobicContact CD1-CD2 3.87Å; L286-F295 HydrophobicContact CD1-CE1 4.23Å; L286-F295 HydrophobicContact CD1-CE2 4.44Å; L286-F295 HydrophobicContact CD1-CG 3.43Å; L286-F295 VanDerWaalsContact CD1-CG 3.43Å; T290-F295 HydrophobicContact CG2-CB 4.07Å; T291-F295 WeakPolarHBondContact O-CB 3.39Å; T291-F295 PolarHBondContact O-N 3.27Å; F295-R297 PolarHBondContact O-N 2.88Å; F295-T298 WeakPolarHBondContact O-CB 3.37Å; F295-T298 WeakPolarHBondContact O-CG2 3.47Å; F295-T298 PolarHBondContact O-N 3.47Å; F295-T298 PolarHBondContact O-OG1 3.43Å; F295-F299 HydrophobicContact CD1-CE2 4.26Å; F295-F299 AromaticContact CE1-CE2 3.63Å; F295-F299 HydrophobicContact CE1-CE2 3.63Å; F295-F299 HydrophobicContact CE1-CZ 4.33Å; F295-F299 HydrophobicContact CE2-CE2 4.22Å; F295-F299 AromaticContact CZ-CE2 3.6Å; F295-F299 HydrophobicContact CZ-CE2 3.6Å; F295-F299 HydrophobicContact CZ-CZ 4Å
296	A	94.9	Very high	89	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-56.6	-38.7	176.3	0	0	0	0	0	112.6	L172 Y235 I255 P292 R293 T298 F299	L172-A296 HydrophobicContact CD2-CB 4.02Å; Y235-A296 HydrophobicContact CD2-CB 3.7Å; Y235-A296 HydrophobicContact CG-CB 4.38Å; I255-A296 WeakPolarHBondContact CD1-O 3.31Å; I255-A296 HydrophobicContact CG2-CB 3.92Å; P292-A296 VanDerWaalsContact O-CB 3.27Å; P292-A296 WeakPolarHBondContact O-CB 3.17Å; P292-A296 PolarHBondContact O-N 2.82Å; R293-A296 WeakPolarHBondContact O-CB 3.28Å; R293-A296 PolarHBondContact O-N 3.21Å; A296-T298 PolarHBondContact O-N 2.9Å; A296-F299 WeakPolarHBondContact O-CB 2.98Å; A296-F299 PolarHBondContact O-N 3.44Å
297	R	93	Very high	88.7	Confident	130 Å²	130	76.4 Å²	76.4	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-64.1	-20	179.3	-73.4	169.3	169.6	179.6	-10.2	113.4	R293 D294 F295 F299 G300	R293-R297 WeakPolarHBondContact O-CG 3.06Å; R293-R297 PolarHBondContact O-N 3.27Å; R293-R297 VanDerWaalsContact O-N 3.16Å; D294-R297 WeakPolarHBondContact O-CB 3.48Å; D294-R297 PolarHBondContact O-N 3.49Å; D294-R297 IonicContact OD1-NH1 2.76Å; F295-R297 PolarHBondContact O-N 2.88Å; R297-F299 PolarHBondContact O-N 3.47Å; R297-G300 PolarHBondContact O-N 3.24Å; R297-G300 VanDerWaalsContact O-N 3.13Å; R297-G300 VanDerWaalsContact O-O 3.07Å
298	T	93.5	Very high	88.5	Confident	80 Å²	80	77.2 Å²	77.2	49%	0.491	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.9	172.3	71.9	0	0	0	0	113.1	F295 A296	F295-T298 WeakPolarHBondContact O-CB 3.37Å; F295-T298 WeakPolarHBondContact O-CG2 3.47Å; F295-T298 PolarHBondContact O-N 3.47Å; F295-T298 PolarHBondContact O-OG1 3.43Å; A296-T298 PolarHBondContact O-N 2.9Å
299	F	94.8	Very high	88.4	Confident	17 Å²	17	72.8 Å²	72.8	8%	0.075	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	0.6	176.3	-62.9	-87.8	0	0	0	113.5	Y170 L194 K241 I255 F295 A296 R297	Y170-F299 HydrophobicContact CD2-CB 4.09Å; Y170-F299 HydrophobicContact CE2-CB 4.11Å; L194-F299 HydrophobicContact CD1-CB 4.22Å; L194-F299 HydrophobicContact CD1-CD2 3.79Å; L194-F299 HydrophobicContact CD1-CE2 4.32Å; L194-F299 HydrophobicContact CD1-CG 3.94Å; L194-F299 HydrophobicContact CD2-CD2 4.48Å; L194-F299 HydrophobicContact CD2-CE2 4.18Å; L194-F299 HydrophobicContact CD2-CZ 4.43Å; L194-F299 HydrophobicContact CG-CD1 4.18Å; L194-F299 HydrophobicContact CG-CD2 3.89Å; L194-F299 HydrophobicContact CG-CE1 4.28Å; L194-F299 HydrophobicContact CG-CE2 3.98Å; L194-F299 HydrophobicContact CG-CG 3.99Å; L194-F299 HydrophobicContact CG-CZ 4.17Å; K241-F299 PolarHBondContact N-O 3Å; I255-F299 HydrophobicContact CD1-CB 3.93Å; F295-F299 HydrophobicContact CD1-CE2 4.26Å; F295-F299 AromaticContact CE1-CE2 3.63Å; F295-F299 HydrophobicContact CE1-CE2 3.63Å; F295-F299 HydrophobicContact CE1-CZ 4.33Å; F295-F299 HydrophobicContact CE2-CE2 4.22Å; F295-F299 AromaticContact CZ-CE2 3.6Å; F295-F299 HydrophobicContact CZ-CE2 3.6Å; F295-F299 HydrophobicContact CZ-CZ 4Å; A296-F299 WeakPolarHBondContact O-CB 2.98Å; A296-F299 PolarHBondContact O-N 3.44Å; R297-F299 PolarHBondContact O-N 3.47Å
300	G	93.6	Very high	88.1	Confident	7 Å²	7	66.4 Å²	66.4	7%	0.072	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	162.3	178.8	0	0	0	0	0	112.3	Y239 R297	Y239-G300 WeakPolarHBondContact O-CA 3.35Å; R297-G300 PolarHBondContact O-N 3.24Å; R297-G300 VanDerWaalsContact O-N 3.13Å; R297-G300 VanDerWaalsContact O-O 3.07Å
301	M	88.9	Confident	87.7	Confident	37 Å²	37	68.2 Å²	68.2	18%	0.182	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.4	158.7	-64.9	-165.1	-72.9	0	0	108.8	E150 H236 Y239 K241	E150-M301 HydrophobicContact CB-CE 4.12Å; E150-M301 VanDerWaalsContact CD-CE 3.41Å; E150-M301 HydrophobicContact CG-CE 3.8Å; E150-M301 WeakPolarHBondContact OE1-CE 3.37Å; H236-M301 PolarHBondContact CE1-O 2.96Å; H236-M301 VanDerWaalsContact CE1-O 3.27Å; Y239-M301 HydrophobicContact CD1-CB 4Å; Y239-M301 HydrophobicContact CD1-CE 3.35Å; Y239-M301 HydrophobicContact CD1-CG 4.16Å; Y239-M301 HydrophobicContact CE1-CE 3.16Å; Y239-M301 HydrophobicContact CG-CB 4.44Å; Y239-M301 HydrophobicContact CG-CE 4.15Å; Y239-M301 PolarHBondContact N-O 3.26Å; Y239-M301 PolarHBondContact O-N 3.2Å; K241-M301 HydrophobicContact CD-CG 4.3Å; K241-M301 HydrophobicContact CG-CG 4.12Å
302	S	75.8	Confident	87.2	Confident	95 Å²	95	68.5 Å²	68.5	66%	0.664	35%	0.353	S	S	*	.			trans	-69.2	147.7	167.5	-60.6	0	0	0	0	108.9	K304	S302-K304 PolarHBondContact O-N 2.77Å
303	A	62.7	Low	86.5	Confident	68 Å²	68	71.5 Å²	71.5	56%	0.562	37%	0.366	S	S	*	.			trans	-57.5	137.8	163.9	0	0	0	0	0	108.4	Y149	Y149-A303 HydrophobicContact CE1-CB 4.01Å
304	K	55.4	Low	85.7	Confident	212 Å²	212	67.6 Å²	67.6	92%	0.922	36%	0.36	S	S	*	.			trans	-64.6	0	167	-68.7	-171.3	-173.9	-177.4	0	109.8	S113 D115 S302	S113-K304 PolarHBondContact OG-NZ 2.76Å; D115-K304 IonicContact OD2-NZ 3.75Å; D115-K304 PolarHBondContact OD2-NZ 2.96Å; S302-K304 PolarHBondContact O-N 2.77Å

Retrieved 304 of 304 residues in 627.1 ms (Link to these results)

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