A0A075B5K2_MOUSE Loading...

Immunoglobulin kappa chain variable 9-124

AlphaFold DB , UniProt , Accession A0A075B5K2, Species MOUSE (Mus musculus, Mouse), Gene Igkv9-124, Length 95 aa.

						>A0A075B5K2_MOUSE|A0A075B5K2|Igkv9-124
DIQMTQSPSSLSASLGERVSLTCRASQEISGYLSWLQQKPDGTIKRLIYAASTLDSGVPKRFSGSRSGSDYSLTISSLESEDFADYYCLQYASYP
					

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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	D	87.8	Confident	96.3	Very high	166 Å²	166	87.5 Å²	87.5	89%	0.888	51%	0.508	S	S	*	.				0	146	0	-171.1	27.3	0	0	0	109.4
2	I	94.5	Very high	96.4	Very high	13 Å²	13	90.1 Å²	90.1	7%	0.067	53%	0.534	C	S	.	.			trans	-94.2	114.7	-179.2	-63.6	166.6	0	0	0	107.9	M4 A25 Q27 I29 Q90 A92	I2-M4 HydrophobicContact CG2-SD 3.99Å; I2-A25 HydrophobicContact CG2-CB 4.33Å; I2-Q27 HydrophobicContact CG1-CG 4.09Å; I2-I29 HydrophobicContact CD1-CG2 3.79Å; I2-I29 HydrophobicContact CG1-CG2 4.5Å; I2-I29 HydrophobicContact CG2-CG2 3.96Å; I2-Q90 HydrophobicContact CB-CG 4.16Å; I2-Q90 HydrophobicContact CG2-CB 4.46Å; I2-Q90 HydrophobicContact CG2-CG 3.94Å; I2-A92 HydrophobicContact CD1-CB 3.96Å
3	Q	96.3	Very high	96.4	Very high	137 Å²	137	85.5 Å²	85.5	64%	0.64	51%	0.512	S	S	*	.			trans	-87.2	138.4	177.3	-63.1	-176	-32.5	0	0	110.6	A25 S26	Q3-A25 CarbonylContact O-C 3.58Å; Q3-A25 WeakPolarHBondContact O-CA 3.49Å; Q3-S26 PolarHBondContact N-OG 2.89Å; Q3-S26 PolarHBondContact O-N 2.7Å
4	M	97.1	Very high	96.5	Very high	54 Å²	54	84.6 Å²	84.6	27%	0.266	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125.2	179.2	-59.1	-58.3	-77.7	0	0	109.3	I2 C23 A25 I29 L33 C88 Q90	I2-M4 HydrophobicContact CG2-SD 3.99Å; M4-C23 WeakPolarHBondContact CE-SG 3.3Å; M4-A25 HydrophobicContact CE-CB 4.38Å; M4-A25 HydrophobicContact SD-CB 3.71Å; M4-I29 HydrophobicContact CE-CD1 4.12Å; M4-I29 HydrophobicContact SD-CD1 4.33Å; M4-L33 HydrophobicContact CE-CD1 3.43Å; M4-L33 VanDerWaalsContact CE-CD1 3.43Å; M4-C88 HydrophobicContact CE-CB 4.43Å; M4-Q90 HydrophobicContact CE-CB 3.99Å; M4-Q90 HydrophobicContact CG-CB 4.3Å; M4-Q90 HydrophobicContact CG-CG 4.05Å; M4-Q90 HydrophobicContact SD-CB 3.78Å; M4-Q90 HydrophobicContact SD-CG 4.01Å
5	T	98.4	Very high	96.6	Very high	94 Å²	94	86.3 Å²	86.3	58%	0.577	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.7	179.4	-53.1	0	0	0	0	109.9	C23 R24	T5-C23 CarbonylContact O-C 3.58Å; T5-C23 VanDerWaalsContact O-CA 3.31Å; T5-C23 WeakPolarHBondContact O-CA 3.25Å; T5-R24 PolarHBondContact N-O 3.45Å; T5-R24 PolarHBondContact O-N 2.86Å
6	Q	98.5	Very high	96.7	Very high	69 Å²	69	83.7 Å²	83.7	32%	0.322	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	149.5	178	-78.6	-179.5	-122.8	0	0	112.8	T22 C23 Y86 Y87 C88	Q6-T22 VanDerWaalsContact CA-O 3.3Å; Q6-T22 WeakPolarHBondContact CA-O 3.21Å; Q6-C23 HydrophobicContact CG-CB 4.01Å; Q6-Y86 PolarHBondContact NE2-O 3.07Å; Q6-Y87 VanDerWaalsContact OE1-CA 3.31Å; Q6-C88 VanDerWaalsContact CD-SG 3.59Å; Q6-C88 HydrophobicContact CG-CB 4.49Å; Q6-C88 WeakPolarHBondContact CG-SG 3.21Å; Q6-C88 PolarHBondContact OE1-SG 2.91Å; Q6-C88 VanDerWaalsContact OE1-SG 3.34Å
7	S	98.4	Very high	96.8	Very high	66 Å²	66	84.4 Å²	84.4	46%	0.462	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	147	175.6	176.8	0	0	0	0	111.8	T22	S7-T22 PolarHBondContact N-O 3.44Å; S7-T22 PolarHBondContact O-N 2.79Å; S7-T22 PolarHBondContact O-OG1 3.43Å
8	P	98.4	Very high	96.9	Very high	52 Å²	52	89.7 Å²	89.7	34%	0.338	52%	0.519	S	S	.	.			cis	-69.5	167.7	-14.5	33	-36.9	0	0	0	111.5	S10 L11 L21	P8-S10 VanDerWaalsContact C-N 3.27Å; P8-S10 PolarHBondContact O-N 3.25Å; P8-L11 HydrophobicContact CG-CB 3.99Å; P8-L11 HydrophobicContact CG-CD1 4.37Å; P8-L21 HydrophobicContact CG-CD2 4.46Å
9	S	96.7	Very high	97	Very high	128 Å²	128	85.9 Å²	85.9	90%	0.895	50%	0.497	S	S	*	.	S	Bend	trans	-68.3	-28	174	52.5	0	0	0	0	113
10	S	97	Very high	97.1	Very high	96 Å²	96	84.2 Å²	84.2	67%	0.671	49%	0.49	S	S	*	.			trans	-149.6	143.9	174.2	60.8	0	0	0	0	109.3	P8	P8-S10 VanDerWaalsContact C-N 3.27Å; P8-S10 PolarHBondContact O-N 3.25Å
11	L	96.7	Very high	97.1	Very high	88 Å²	88	81.4 Å²	81.4	46%	0.461	47%	0.473	S	S	.	.			trans	-132.9	135.3	176.6	-177.5	65.6	0	0	0	108.9	P8 V19 L21	P8-L11 HydrophobicContact CG-CB 3.99Å; P8-L11 HydrophobicContact CG-CD1 4.37Å; L11-V19 HydrophobicContact CD2-CB 3.58Å; L11-V19 HydrophobicContact CD2-CG1 3.69Å; L11-V19 HydrophobicContact CG-CG1 4.43Å; L11-L21 HydrophobicContact CD2-CD2 4.41Å
12	S	96.6	Very high	97.7	Very high	118 Å²	118	76.7 Å²	76.7	83%	0.825	45%	0.45	S	S	*	.			trans	-116.7	134	172.3	-57.8	0	0	0	0	108.8
13	A	97	Very high	97.8	Very high	30 Å²	30	76.1 Å²	76.1	25%	0.248	45%	0.447	C	S	.	.			trans	-152.3	159.1	-179.3	0	0	0	0	0	109.7	E17 V19 L78	A13-E17 WeakPolarHBondContact CA-OE2 3.16Å; A13-E17 HydrophobicContact CB-CB 4.35Å; A13-E17 WeakPolarHBondContact CB-OE2 3.4Å; A13-V19 HydrophobicContact CB-CG1 3.37Å; A13-L78 HydrophobicContact CB-CD2 3.99Å
14	S	98	Very high	98	Very high	74 Å²	74	76.6 Å²	76.6	52%	0.517	44%	0.443	S	S	.	.			trans	-82.4	155.6	175.7	-54.3	0	0	0	0	111.1	G16 E17	S14-G16 PolarHBondContact O-N 2.93Å; S14-E17 PolarHBondContact N-OE2 3Å; S14-E17 VanDerWaalsContact O-CB 3.3Å; S14-E17 WeakPolarHBondContact O-CB 3.28Å; S14-E17 PolarHBondContact O-N 3.09Å; S14-E17 VanDerWaalsContact O-N 3.09Å
15	L	98.2	Very high	98	Very high	110 Å²	110	74.1 Å²	74.1	58%	0.576	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	138.7	172.7	-63.6	178.8	0	0	0	110.7	E17 L78 F83	L15-E17 PolarHBondContact O-N 2.96Å; L15-L78 WeakPolarHBondContact CA-O 3.42Å; L15-F83 HydrophobicContact CD2-CE2 3.89Å; L15-F83 HydrophobicContact CD2-CZ 3.96Å
16	G	98.4	Very high	98	Very high	44 Å²	44	72.9 Å²	72.9	45%	0.454	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	-12	-175.6	0	0	0	0	0	114.8	S14 L78	S14-G16 PolarHBondContact O-N 2.93Å; G16-L78 PolarHBondContact N-O 2.95Å
17	E	98.5	Very high	97.9	Very high	95 Å²	95	74.8 Å²	74.8	44%	0.444	44%	0.436	S	S	.	.			trans	-73.6	153.8	175.2	-67.7	-174.1	148.4	0	0	111.7	A13 S14 L15 L78	A13-E17 WeakPolarHBondContact CA-OE2 3.16Å; A13-E17 HydrophobicContact CB-CB 4.35Å; A13-E17 WeakPolarHBondContact CB-OE2 3.4Å; S14-E17 PolarHBondContact N-OE2 3Å; S14-E17 VanDerWaalsContact O-CB 3.3Å; S14-E17 WeakPolarHBondContact O-CB 3.28Å; S14-E17 PolarHBondContact O-N 3.09Å; S14-E17 VanDerWaalsContact O-N 3.09Å; L15-E17 PolarHBondContact O-N 2.96Å; E17-L78 WeakPolarHBondContact O-CB 3.2Å; E17-L78 PolarHBondContact O-N 2.89Å
18	R	98.5	Very high	97.7	Very high	181 Å²	181	77.8 Å²	77.8	68%	0.683	44%	0.442	S	S	*	.			trans	-82.6	127	172.1	178.2	179	-177.2	158.2	2.5	109.5	T74 I75	R18-T74 HydrophobicContact CG-CG2 4.03Å; R18-I75 WeakPolarHBondContact CA-O 3.3Å
19	V	98.3	Very high	97.7	Very high	17 Å²	17	75.6 Å²	75.6	10%	0.103	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	149.5	172.4	-65.3	0	0	0	0	111.3	L11 A13 T74 I75 L78	L11-V19 HydrophobicContact CD2-CB 3.58Å; L11-V19 HydrophobicContact CD2-CG1 3.69Å; L11-V19 HydrophobicContact CG-CG1 4.43Å; A13-V19 HydrophobicContact CB-CG1 3.37Å; V19-T74 WeakPolarHBondContact O-CA 3.37Å; V19-I75 HydrophobicContact CG2-CB 3.6Å; V19-I75 HydrophobicContact CG2-CD1 3.8Å; V19-I75 HydrophobicContact CG2-CG1 3.8Å; V19-I75 PolarHBondContact N-O 2.8Å; V19-I75 PolarHBondContact O-N 3.5Å; V19-L78 HydrophobicContact CG1-CD2 4.37Å; V19-L78 HydrophobicContact CG2-CD1 4.06Å
20	S	98.3	Very high	97.6	Very high	52 Å²	52	72 Å²	72	36%	0.364	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	133.2	177.2	-167.7	0	0	0	0	110.6	L73	S20-L73 CarbonylContact C-O 3.43Å; S20-L73 VanDerWaalsContact CA-O 3.3Å; S20-L73 WeakPolarHBondContact CA-O 3.44Å
21	L	98.5	Very high	97.6	Very high	25 Å²	25	68.2 Å²	68.2	13%	0.131	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.3	171.5	-58	177.5	0	0	0	108.5	P8 L11 W35 S72 L73 Y86	P8-L21 HydrophobicContact CG-CD2 4.46Å; L11-L21 HydrophobicContact CD2-CD2 4.41Å; L21-W35 HydrophobicContact CB-CH2 4.28Å; L21-W35 HydrophobicContact CB-CZ3 4.34Å; L21-S72 CarbonylContact O-C 3.16Å; L21-S72 WeakPolarHBondContact O-CA 3.39Å; L21-S72 WeakPolarHBondContact O-CB 3.29Å; L21-L73 HydrophobicContact CB-CB 4.49Å; L21-L73 HydrophobicContact CD1-CD2 4.45Å; L21-L73 PolarHBondContact N-O 2.96Å; L21-L73 PolarHBondContact O-N 2.82Å; L21-Y86 VanDerWaalsContact CD1-CB 3.41Å; L21-Y86 HydrophobicContact CD1-CD1 4.48Å; L21-Y86 HydrophobicContact CD1-CD2 4.02Å; L21-Y86 HydrophobicContact CD1-CG 3.74Å
22	T	98.6	Very high	97.7	Very high	67 Å²	67	70 Å²	70	41%	0.411	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	152.1	174.5	62.7	0	0	0	0	111.1	Q6 S7 Y71	Q6-T22 VanDerWaalsContact CA-O 3.3Å; Q6-T22 WeakPolarHBondContact CA-O 3.21Å; S7-T22 PolarHBondContact N-O 3.44Å; S7-T22 PolarHBondContact O-N 2.79Å; S7-T22 PolarHBondContact O-OG1 3.43Å; T22-Y71 CarbonylContact C-O 3.54Å; T22-Y71 VanDerWaalsContact CA-O 3.32Å; T22-Y71 WeakPolarHBondContact CA-O 3.49Å
23	C	98.5	Very high	97.7	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.007	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	129.9	172.7	176.2	0	0	0	0	109	M4 T5 Q6 W35 Y71 C88	M4-C23 WeakPolarHBondContact CE-SG 3.3Å; T5-C23 CarbonylContact O-C 3.58Å; T5-C23 VanDerWaalsContact O-CA 3.31Å; T5-C23 WeakPolarHBondContact O-CA 3.25Å; Q6-C23 HydrophobicContact CG-CB 4.01Å; C23-W35 HydrophobicContact CB-CH2 3.57Å; C23-W35 HydrophobicContact CB-CZ2 3.8Å; C23-W35 HydrophobicContact CB-CZ3 4.43Å; C23-Y71 PolarHBondContact N-O 3.02Å; C23-Y71 WeakPolarHBondContact O-CA 3.37Å; C23-Y71 WeakPolarHBondContact O-CB 3.44Å; C23-Y71 WeakPolarHBondContact O-CD2 3.09Å; C23-Y71 PolarHBondContact O-N 3.22Å; C23-C88 HydrophobicContact CB-CB 3.5Å; C23-C88 WeakPolarHBondContact CB-SG 3.44Å; C23-C88 WeakPolarHBondContact SG-CB 3.31Å; C23-C88 CovalentContact SG-SG 2.02Å; C23-C88 PolarHBondContact SG-SG 2.68Å
24	R	98.5	Very high	97.8	Very high	148 Å²	148	63.5 Å²	63.5	56%	0.558	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.3	178.6	-177.2	170.8	-178.8	172.3	3.1	109.8	T5 D70	T5-R24 PolarHBondContact N-O 3.45Å; T5-R24 PolarHBondContact O-N 2.86Å; R24-D70 WeakPolarHBondContact CB-OD1 3.36Å; R24-D70 VanDerWaalsContact CD-OD1 3.32Å; R24-D70 WeakPolarHBondContact CD-OD1 3.4Å; R24-D70 VanDerWaalsContact CG-OD1 3.28Å; R24-D70 WeakPolarHBondContact CG-OD1 3.36Å; R24-D70 IonicContact NE-OD1 3.93Å
25	A	98.1	Very high	97.8	Very high	1 Å²	1	60 Å²	60	1%	0.008	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	148.1	169.1	0	0	0	0	0	110.1	I2 Q3 M4 Q27 I29 S69 Y71	I2-A25 HydrophobicContact CG2-CB 4.33Å; Q3-A25 CarbonylContact O-C 3.58Å; Q3-A25 WeakPolarHBondContact O-CA 3.49Å; M4-A25 HydrophobicContact CE-CB 4.38Å; M4-A25 HydrophobicContact SD-CB 3.71Å; A25-Q27 WeakPolarHBondContact CB-O 3.18Å; A25-Q27 PolarHBondContact O-N 2.86Å; A25-Q27 VanDerWaalsContact O-N 3.16Å; A25-I29 HydrophobicContact CB-CD1 4Å; A25-I29 HydrophobicContact CB-CG1 4.15Å; A25-I29 HydrophobicContact CB-CG2 4.26Å; A25-S69 PolarHBondContact N-O 2.79Å; A25-S69 WeakPolarHBondContact O-CB 3.29Å; A25-Y71 HydrophobicContact CB-CE2 4.15Å
26	S	97.6	Very high	97.8	Very high	69 Å²	69	56.4 Å²	56.4	48%	0.483	29%	0.289	S	S	.	.	S	Bend	trans	-65.1	-14	175.7	59.3	0	0	0	0	114	Q3	Q3-S26 PolarHBondContact N-OG 2.89Å; Q3-S26 PolarHBondContact O-N 2.7Å
27	Q	96.2	Very high	97.8	Very high	109 Å²	109	54.8 Å²	54.8	51%	0.509	27%	0.27	S	S	.	.	S	Bend	trans	-151.1	167.2	178	61	-173.9	52.5	0	0	109.9	I2 A25 I29	I2-Q27 HydrophobicContact CG1-CG 4.09Å; A25-Q27 WeakPolarHBondContact CB-O 3.18Å; A25-Q27 PolarHBondContact O-N 2.86Å; A25-Q27 VanDerWaalsContact O-N 3.16Å; Q27-I29 HydrophobicContact CG-CG2 4.34Å; Q27-I29 PolarHBondContact O-N 2.74Å
28	E	95.8	Very high	97.8	Very high	129 Å²	129	52.9 Å²	52.9	60%	0.603	26%	0.261	S	S	*	.			trans	-70.3	121	176	-173.5	170.4	-177.8	0	0	111
29	I	97	Very high	97.7	Very high	5 Å²	5	47.1 Å²	47.1	3%	0.026	24%	0.241	C	C	.	.			trans	-112.8	18.5	179.8	63.2	173.5	0	0	0	112.2	I2 M4 A25 Q27 G31 Y32 L33 Y71 Q90 A92	I2-I29 HydrophobicContact CD1-CG2 3.79Å; I2-I29 HydrophobicContact CG1-CG2 4.5Å; I2-I29 HydrophobicContact CG2-CG2 3.96Å; M4-I29 HydrophobicContact CE-CD1 4.12Å; M4-I29 HydrophobicContact SD-CD1 4.33Å; A25-I29 HydrophobicContact CB-CD1 4Å; A25-I29 HydrophobicContact CB-CG1 4.15Å; A25-I29 HydrophobicContact CB-CG2 4.26Å; Q27-I29 HydrophobicContact CG-CG2 4.34Å; Q27-I29 PolarHBondContact O-N 2.74Å; I29-G31 PolarHBondContact O-N 3.27Å; I29-Y32 VanDerWaalsContact O-CB 3.31Å; I29-Y32 WeakPolarHBondContact O-CB 3.22Å; I29-Y32 WeakPolarHBondContact O-CD2 3.48Å; I29-Y32 PolarHBondContact O-N 3.09Å; I29-L33 HydrophobicContact CD1-CB 4.23Å; I29-L33 HydrophobicContact CD1-CD1 4.16Å; I29-Y71 HydrophobicContact CD1-CE2 4.14Å; I29-Y71 HydrophobicContact CG1-CE1 4.44Å; I29-Y71 HydrophobicContact CG1-CE2 3.92Å; I29-Y71 WeakPolarHBondContact CG1-OH 3.44Å; I29-Q90 HydrophobicContact CD1-CB 3.54Å; I29-A92 HydrophobicContact CB-CB 3.9Å; I29-A92 HydrophobicContact CG2-CB 4Å
30	S	96.2	Very high	97.6	Very high	54 Å²	54	52.4 Å²	52.4	38%	0.378	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	-132.3	-178.4	-172.1	0	0	0	0	112	Y32 R66 Y71	S30-Y32 VanDerWaalsContact C-N 3.28Å; S30-R66 WeakPolarHBondContact O-CD 3.38Å; S30-R66 PolarHBondContact O-NH1 3.42Å; S30-R66 VanDerWaalsContact O-NH1 3.07Å; S30-Y71 WeakPolarHBondContact O-CE1 3.33Å; S30-Y71 PolarHBondContact O-OH 3.22Å
31	G	96.9	Very high	97.5	Very high	15 Å²	15	55.5 Å²	55.5	16%	0.155	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	1.6	179.1	0	0	0	0	0	113.6	I29 L33 A50 A51 Y91	I29-G31 PolarHBondContact O-N 3.27Å; G31-L33 PolarHBondContact O-N 3.45Å; G31-A50 CarbonylContact O-C 3.52Å; G31-A50 WeakPolarHBondContact O-CA 3.24Å; G31-A51 PolarHBondContact O-N 3.34Å; G31-Y91 PolarHBondContact O-OH 3.07Å
32	Y	97.2	Very high	97.3	Very high	127 Å²	127	56.2 Å²	56.2	50%	0.498	30%	0.301	S	S	.	.			trans	-78.4	52.9	-169.5	-58.1	-69.6	0	0	0	112.9	I29 S30 Q90 Y91 A92	I29-Y32 VanDerWaalsContact O-CB 3.31Å; I29-Y32 WeakPolarHBondContact O-CB 3.22Å; I29-Y32 WeakPolarHBondContact O-CD2 3.48Å; I29-Y32 PolarHBondContact O-N 3.09Å; S30-Y32 VanDerWaalsContact C-N 3.28Å; Y32-Q90 WeakPolarHBondContact O-CA 3.26Å; Y32-Y91 VanDerWaalsContact C-CD1 3.48Å; Y32-Y91 AromaticContact CD1-CD2 3.85Å; Y32-Y91 HydrophobicContact CD1-CD2 3.85Å; Y32-Y91 AromaticContact CD1-CE2 3.49Å; Y32-Y91 HydrophobicContact CD1-CE2 3.49Å; Y32-Y91 VanDerWaalsContact CD1-CE2 3.49Å; Y32-Y91 HydrophobicContact CE1-CE2 4.44Å; Y32-Y91 HydrophobicContact CG-CD2 4.44Å; Y32-Y91 HydrophobicContact CG-CE2 4.26Å; Y32-Y91 WeakPolarHBondContact O-CD1 3.42Å; Y32-Y91 PolarHBondContact O-N 3.04Å; Y32-A92 HydrophobicContact CD2-CB 4.11Å; Y32-A92 HydrophobicContact CG-CB 4.21Å
33	L	98.1	Very high	97.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	135.8	178.3	-174.4	136.8	0	0	0	111.5	M4 I29 G31 W35 A50 A51 Y71 C88 L89	M4-L33 HydrophobicContact CE-CD1 3.43Å; M4-L33 VanDerWaalsContact CE-CD1 3.43Å; I29-L33 HydrophobicContact CD1-CB 4.23Å; I29-L33 HydrophobicContact CD1-CD1 4.16Å; G31-L33 PolarHBondContact O-N 3.45Å; L33-W35 HydrophobicContact CD2-CD2 4.44Å; L33-W35 HydrophobicContact CD2-CG 4.31Å; L33-A50 PolarHBondContact O-N 2.94Å; L33-A51 PolarHBondContact O-N 3.07Å; L33-Y71 HydrophobicContact CB-CD1 4Å; L33-Y71 HydrophobicContact CB-CE1 3.95Å; L33-Y71 HydrophobicContact CD1-CD1 3.78Å; L33-Y71 HydrophobicContact CD1-CD2 3.65Å; L33-Y71 HydrophobicContact CD1-CE1 4.17Å; L33-Y71 HydrophobicContact CD1-CE2 4.08Å; L33-Y71 HydrophobicContact CD1-CG 3.54Å; L33-Y71 HydrophobicContact CD2-CD1 4.08Å; L33-Y71 HydrophobicContact CD2-CG 4.26Å; L33-Y71 HydrophobicContact CG-CD1 4.18Å; L33-Y71 HydrophobicContact CG-CG 4.35Å; L33-C88 HydrophobicContact CD1-CB 4.06Å; L33-C88 HydrophobicContact CD2-CB 4.35Å; L33-C88 HydrophobicContact CG-CB 4.37Å; L33-L89 WeakPolarHBondContact CA-O 2.99Å
34	S	98.5	Very high	97.2	Very high	10 Å²	10	60.7 Å²	60.7	7%	0.07	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	146.4	169.8	-62.3	0	0	0	0	110.9	I48 C88 L89	S34-I48 CarbonylContact C-O 3.56Å; S34-I48 WeakPolarHBondContact CA-O 3.35Å; S34-I48 WeakPolarHBondContact CB-O 3.35Å; S34-C88 CarbonylContact O-C 3.51Å; S34-C88 WeakPolarHBondContact O-CA 3.14Å; S34-L89 PolarHBondContact N-O 3.34Å; S34-L89 PolarHBondContact O-N 2.98Å
35	W	98.7	Very high	97.2	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.3	166.1	-70.8	99.7	0	0	0	109.8	L21 C23 L33 L47 I48 S72 L73 Y87 C88	L21-W35 HydrophobicContact CB-CH2 4.28Å; L21-W35 HydrophobicContact CB-CZ3 4.34Å; C23-W35 HydrophobicContact CB-CH2 3.57Å; C23-W35 HydrophobicContact CB-CZ2 3.8Å; C23-W35 HydrophobicContact CB-CZ3 4.43Å; L33-W35 HydrophobicContact CD2-CD2 4.44Å; L33-W35 HydrophobicContact CD2-CG 4.31Å; W35-L47 PolarHBondContact O-N 2.82Å; W35-I48 HydrophobicContact CB-CB 4.14Å; W35-I48 PolarHBondContact N-O 2.93Å; W35-I48 PolarHBondContact O-N 3.43Å; W35-S72 PolarHBondContact NE1-O 2.84Å; W35-L73 HydrophobicContact CB-CD1 4.22Å; W35-L73 HydrophobicContact CB-CD2 4.39Å; W35-L73 HydrophobicContact CD2-CB 3.58Å; W35-L73 HydrophobicContact CD2-CD1 4.44Å; W35-L73 HydrophobicContact CD2-CD2 4.15Å; W35-L73 HydrophobicContact CD2-CG 4.28Å; W35-L73 HydrophobicContact CE3-CB 3.81Å; W35-L73 HydrophobicContact CE3-CD2 3.91Å; W35-L73 HydrophobicContact CE3-CG 4.43Å; W35-L73 HydrophobicContact CG-CB 4.08Å; W35-L73 HydrophobicContact CG-CD1 4.08Å; W35-L73 HydrophobicContact CG-CD2 4.37Å; W35-L73 HydrophobicContact CG-CG 4.42Å; W35-L73 HydrophobicContact CH2-CB 3.99Å; W35-L73 HydrophobicContact CZ2-CB 3.8Å; W35-L73 HydrophobicContact CZ3-CB 4Å; W35-L73 HydrophobicContact CZ3-CD2 4.48Å; W35-Y87 CarbonylContact C-O 3.53Å; W35-Y87 WeakPolarHBondContact CA-O 2.98Å; W35-C88 HydrophobicContact CD2-CB 4.32Å; W35-C88 HydrophobicContact CE3-CB 4.04Å; W35-C88 HydrophobicContact CH2-CB 4.13Å; W35-C88 HydrophobicContact CZ2-CB 4.37Å; W35-C88 HydrophobicContact CZ3-CB 3.95Å
36	L	98.4	Very high	97.2	Very high	36 Å²	36	64.5 Å²	64.5	19%	0.188	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	144.5	179.1	-52.2	178.7	0	0	0	109.7	I44 K45 R46 Y86 Y87 L89	L36-I44 HydrophobicContact CB-CG2 4.33Å; L36-I44 HydrophobicContact CD1-CG2 4.34Å; L36-K45 CarbonylContact C-O 3.58Å; L36-K45 VanDerWaalsContact CA-O 3.29Å; L36-K45 WeakPolarHBondContact CA-O 3.38Å; L36-R46 HydrophobicContact CD2-CB 3.82Å; L36-R46 HydrophobicContact CD2-CG 3.98Å; L36-Y86 WeakPolarHBondContact O-CA 3.33Å; L36-Y87 PolarHBondContact N-O 2.94Å; L36-Y87 PolarHBondContact O-N 2.77Å; L36-L89 HydrophobicContact CD1-CB 4.35Å; L36-L89 HydrophobicContact CD1-CD2 4.23Å
37	Q	98.5	Very high	97.2	Very high	10 Å²	10	61.6 Å²	61.6	5%	0.047	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.6	169	-173.9	-174.4	54.5	0	0	108.6	I44 K45 L47 A84 Y86	Q37-I44 CarbonylContact O-C 3.54Å; Q37-I44 WeakPolarHBondContact O-CA 3.17Å; Q37-K45 PolarHBondContact N-O 3.42Å; Q37-K45 PolarHBondContact O-N 3.23Å; Q37-L47 HydrophobicContact CB-CD1 3.78Å; Q37-L47 HydrophobicContact CB-CD2 4.1Å; Q37-L47 HydrophobicContact CB-CG 3.87Å; Q37-A84 HydrophobicContact CG-CB 3.37Å; Q37-Y86 HydrophobicContact CB-CD1 4.46Å; Q37-Y86 HydrophobicContact CB-CE1 4.24Å; Q37-Y86 HydrophobicContact CG-CE1 4.08Å; Q37-Y86 PolarHBondContact NE2-OH 2.94Å
38	Q	98.4	Very high	97.4	Very high	54 Å²	54	56.4 Å²	56.4	25%	0.252	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	115.2	171.2	-175.6	177.7	23	0	0	109.4	T43 I44 A84 D85 Y87	Q38-T43 WeakPolarHBondContact CA-O 3.42Å; Q38-I44 HydrophobicContact CB-CG1 4.31Å; Q38-I44 HydrophobicContact CG-CG1 4.08Å; Q38-A84 VanDerWaalsContact O-CB 3.28Å; Q38-A84 WeakPolarHBondContact O-CB 3.48Å; Q38-D85 HydrophobicContact CB-CB 4.35Å; Q38-D85 PolarHBondContact N-O 2.83Å; Q38-D85 PolarHBondContact O-N 3.16Å; Q38-Y87 HydrophobicContact CB-CD2 4.35Å; Q38-Y87 HydrophobicContact CB-CE2 3.86Å; Q38-Y87 PolarHBondContact OE1-OH 2.81Å
39	K	96.3	Very high	97.5	Very high	61 Å²	61	54.7 Å²	54.7	27%	0.265	28%	0.284	S	S	.	.			trans	-80.2	162.6	177.9	-72	-165.5	176.5	-155.6	0	111.6	D41 G42 T43 E81	K39-D41 WeakPolarHBondContact CB-OD1 3.38Å; K39-D41 PolarHBondContact O-N 2.82Å; K39-D41 VanDerWaalsContact O-N 3.07Å; K39-G42 WeakPolarHBondContact O-CA 3.35Å; K39-G42 PolarHBondContact O-N 2.76Å; K39-T43 PolarHBondContact N-O 2.91Å; K39-E81 PolarHBondContact NZ-O 2.77Å
40	P	95.4	Very high	97.5	Very high	127 Å²	127	56.1 Å²	56.1	83%	0.825	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.8	178.5	-27.7	35.9	0	0	0	115.2	G42	P40-G42 PolarHBondContact O-N 3.37Å
41	D	95.7	Very high	97.6	Very high	117 Å²	117	53.6 Å²	53.6	63%	0.626	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-0.5	174.4	68.9	-11	0	0	0	113.5	K39 T43	K39-D41 WeakPolarHBondContact CB-OD1 3.38Å; K39-D41 PolarHBondContact O-N 2.82Å; K39-D41 VanDerWaalsContact O-N 3.07Å; D41-T43 VanDerWaalsContact C-N 3.33Å; D41-T43 VanDerWaalsContact CG-OG1 3.24Å; D41-T43 WeakPolarHBondContact OD1-CB 3.44Å; D41-T43 PolarHBondContact OD1-N 2.73Å; D41-T43 PolarHBondContact OD1-OG1 2.82Å; D41-T43 VanDerWaalsContact OD1-OG1 3.09Å; D41-T43 PolarHBondContact OD2-OG1 3.41Å
42	G	95.7	Very high	97.7	Very high	41 Å²	41	56.4 Å²	56.4	42%	0.423	30%	0.297	S	S	.	.			trans	85.4	-2.2	-177.3	0	0	0	0	0	114.5	K39 P40 I44	K39-G42 WeakPolarHBondContact O-CA 3.35Å; K39-G42 PolarHBondContact O-N 2.76Å; P40-G42 PolarHBondContact O-N 3.37Å; G42-I44 PolarHBondContact O-N 2.78Å
43	T	96.8	Very high	97.7	Very high	56 Å²	56	53 Å²	53	34%	0.344	29%	0.289	S	S	.	.			trans	-65.8	121.4	178.7	-61.1	0	0	0	0	110.2	Q38 K39 D41 K45	Q38-T43 WeakPolarHBondContact CA-O 3.42Å; K39-T43 PolarHBondContact N-O 2.91Å; D41-T43 VanDerWaalsContact C-N 3.33Å; D41-T43 VanDerWaalsContact CG-OG1 3.24Å; D41-T43 WeakPolarHBondContact OD1-CB 3.44Å; D41-T43 PolarHBondContact OD1-N 2.73Å; D41-T43 PolarHBondContact OD1-OG1 2.82Å; D41-T43 VanDerWaalsContact OD1-OG1 3.09Å; D41-T43 PolarHBondContact OD2-OG1 3.41Å; T43-K45 HydrophobicContact CG2-CG 4.14Å
44	I	97.5	Very high	97.7	Very high	106 Å²	106	55.9 Å²	55.9	54%	0.544	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	129.9	174.2	-59.7	176.3	0	0	0	109.5	L36 Q37 Q38 G42	L36-I44 HydrophobicContact CB-CG2 4.33Å; L36-I44 HydrophobicContact CD1-CG2 4.34Å; Q37-I44 CarbonylContact O-C 3.54Å; Q37-I44 WeakPolarHBondContact O-CA 3.17Å; Q38-I44 HydrophobicContact CB-CG1 4.31Å; Q38-I44 HydrophobicContact CG-CG1 4.08Å; G42-I44 PolarHBondContact O-N 2.78Å
45	K	97.5	Very high	97.7	Very high	111 Å²	111	57.4 Å²	57.4	48%	0.483	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	143.1	173.8	-62.6	-174.2	-178.8	-175.1	0	110.6	L36 Q37 T43	L36-K45 CarbonylContact C-O 3.58Å; L36-K45 VanDerWaalsContact CA-O 3.29Å; L36-K45 WeakPolarHBondContact CA-O 3.38Å; Q37-K45 PolarHBondContact N-O 3.42Å; Q37-K45 PolarHBondContact O-N 3.23Å; T43-K45 HydrophobicContact CG2-CG 4.14Å
46	R	98.4	Very high	97.7	Very high	118 Å²	118	63 Å²	63	45%	0.445	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	126.9	168.7	-172.3	172.3	64.4	-162	-3.9	109.2	L36 D55	L36-R46 HydrophobicContact CD2-CB 3.82Å; L36-R46 HydrophobicContact CD2-CG 3.98Å; R46-D55 IonicContact CZ-OD2 3.21Å; R46-D55 IonicContact NE-OD2 2.73Å; R46-D55 PolarHBondContact NE-OD2 2.86Å; R46-D55 IonicContact NH2-OD1 3.83Å; R46-D55 IonicContact NH2-OD2 2.82Å; R46-D55 PolarHBondContact NH2-OD2 3.36Å
47	L	98.7	Very high	97.6	Very high	7 Å²	7	65.1 Å²	65.1	4%	0.037	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-46.1	177.2	-63.8	-179.4	0	0	0	111.2	W35 Q37 D55 V58 F62 L73 Y86	W35-L47 PolarHBondContact O-N 2.82Å; Q37-L47 HydrophobicContact CB-CD1 3.78Å; Q37-L47 HydrophobicContact CB-CD2 4.1Å; Q37-L47 HydrophobicContact CB-CG 3.87Å; L47-D55 PolarHBondContact O-N 2.93Å; L47-V58 HydrophobicContact CB-CG1 4.33Å; L47-V58 HydrophobicContact CD2-CG1 3.93Å; L47-V58 HydrophobicContact CD2-CG2 4.24Å; L47-F62 HydrophobicContact CD1-CD1 3.76Å; L47-F62 HydrophobicContact CD1-CE1 3.6Å; L47-F62 HydrophobicContact CD1-CZ 4.31Å; L47-L73 HydrophobicContact CD1-CD2 4.43Å; L47-Y86 HydrophobicContact CD1-CD1 3.96Å; L47-Y86 HydrophobicContact CD1-CE1 3.5Å
48	I	98.8	Very high	97.6	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	138.1	-174.4	-57.8	-173.3	0	0	0	108.3	S34 W35 T53 L54 L73	S34-I48 CarbonylContact C-O 3.56Å; S34-I48 WeakPolarHBondContact CA-O 3.35Å; S34-I48 WeakPolarHBondContact CB-O 3.35Å; W35-I48 HydrophobicContact CB-CB 4.14Å; W35-I48 PolarHBondContact N-O 2.93Å; W35-I48 PolarHBondContact O-N 3.43Å; I48-T53 CarbonylContact C-O 3.56Å; I48-T53 VanDerWaalsContact CA-O 3.24Å; I48-T53 WeakPolarHBondContact CA-O 3.43Å; I48-T53 WeakPolarHBondContact CG2-O 3.32Å; I48-L54 HydrophobicContact CD1-CD2 4.32Å; I48-L54 HydrophobicContact CG1-CD2 3.98Å; I48-L73 HydrophobicContact CD1-CD1 3.54Å; I48-L73 HydrophobicContact CG1-CD1 4.28Å
49	Y	98.2	Very high	97.6	Very high	93 Å²	93	65.2 Å²	65.2	37%	0.365	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	170.3	169	70.3	-84.6	0	0	0	109.7	A51 S52 T53	Y49-A51 PolarHBondContact O-N 2.82Å; Y49-A51 VanDerWaalsContact O-N 3.12Å; Y49-S52 PolarHBondContact O-N 2.96Å; Y49-T53 HydrophobicContact CD1-CG2 4.28Å; Y49-T53 WeakPolarHBondContact CD1-O 3.3Å; Y49-T53 HydrophobicContact CE1-CG2 3.51Å; Y49-T53 HydrophobicContact CE2-CG2 3.9Å; Y49-T53 PolarHBondContact N-O 3.49Å; Y49-T53 WeakPolarHBondContact O-CA 3.3Å; Y49-T53 WeakPolarHBondContact O-CB 3.38Å; Y49-T53 PolarHBondContact O-N 2.87Å; Y49-T53 VanDerWaalsContact OH-CG2 3.29Å; Y49-T53 WeakPolarHBondContact OH-CG2 3.01Å
50	A	97.7	Very high	97.7	Very high	35 Å²	35	71.8 Å²	71.8	29%	0.289	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	34.9	-178.3	0	0	0	0	0	113.2	G31 L33 S52 Y91	G31-A50 CarbonylContact O-C 3.52Å; G31-A50 WeakPolarHBondContact O-CA 3.24Å; L33-A50 PolarHBondContact O-N 2.94Å; A50-S52 PolarHBondContact O-N 2.8Å; A50-Y91 PolarHBondContact N-OH 3.32Å
51	A	98.1	Very high	97.8	Very high	2 Å²	2	67.1 Å²	67.1	2%	0.017	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	-28.9	-173.6	0	0	0	0	0	117.5	G31 L33 Y49 G64 R66 Y71	G31-A51 PolarHBondContact O-N 3.34Å; L33-A51 PolarHBondContact O-N 3.07Å; Y49-A51 PolarHBondContact O-N 2.82Å; Y49-A51 VanDerWaalsContact O-N 3.12Å; A51-G64 CarbonylContact O-C 3.59Å; A51-G64 WeakPolarHBondContact O-CA 3.31Å; A51-R66 HydrophobicContact CB-CB 4.31Å; A51-Y71 HydrophobicContact CB-CD1 3.93Å; A51-Y71 HydrophobicContact CB-CE1 4.01Å
52	S	98.3	Very high	98	Very high	74 Å²	74	61.7 Å²	61.7	52%	0.517	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	-4.1	-173.8	59.4	0	0	0	0	115.4	Y49 A50 G64	Y49-S52 PolarHBondContact O-N 2.96Å; A50-S52 PolarHBondContact O-N 2.8Å; S52-G64 VanDerWaalsContact CB-O 3.26Å; S52-G64 WeakPolarHBondContact CB-O 3.36Å
53	T	98.6	Very high	98.1	Very high	56 Å²	56	62.2 Å²	62.2	34%	0.344	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	118.8	-178.3	-51.3	0	0	0	0	110.8	I48 Y49	I48-T53 CarbonylContact C-O 3.56Å; I48-T53 VanDerWaalsContact CA-O 3.24Å; I48-T53 WeakPolarHBondContact CA-O 3.43Å; I48-T53 WeakPolarHBondContact CG2-O 3.32Å; Y49-T53 HydrophobicContact CD1-CG2 4.28Å; Y49-T53 WeakPolarHBondContact CD1-O 3.3Å; Y49-T53 HydrophobicContact CE1-CG2 3.51Å; Y49-T53 HydrophobicContact CE2-CG2 3.9Å; Y49-T53 PolarHBondContact N-O 3.49Å; Y49-T53 WeakPolarHBondContact O-CA 3.3Å; Y49-T53 WeakPolarHBondContact O-CB 3.38Å; Y49-T53 PolarHBondContact O-N 2.87Å; Y49-T53 VanDerWaalsContact OH-CG2 3.29Å; Y49-T53 WeakPolarHBondContact OH-CG2 3.01Å
54	L	98.6	Very high	98.2	Very high	60 Å²	60	60.2 Å²	60.2	31%	0.314	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	136.6	174.8	-76.9	162.9	0	0	0	111	I48 V58 F62	I48-L54 HydrophobicContact CD1-CD2 4.32Å; I48-L54 HydrophobicContact CG1-CD2 3.98Å; L54-V58 HydrophobicContact CD2-CB 4.04Å; L54-V58 HydrophobicContact CD2-CG1 3.55Å; L54-F62 HydrophobicContact CD2-CB 3.68Å
55	D	98.3	Very high	98.2	Very high	41 Å²	41	58 Å²	58	22%	0.219	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-72.9	161.2	170.7	-146.1	-24	0	0	0	111.1	R46 L47 G57 V58	R46-D55 IonicContact CZ-OD2 3.21Å; R46-D55 IonicContact NE-OD2 2.73Å; R46-D55 PolarHBondContact NE-OD2 2.86Å; R46-D55 IonicContact NH2-OD1 3.83Å; R46-D55 IonicContact NH2-OD2 2.82Å; R46-D55 PolarHBondContact NH2-OD2 3.36Å; L47-D55 PolarHBondContact O-N 2.93Å; D55-G57 PolarHBondContact O-N 2.84Å; D55-V58 HydrophobicContact CB-CG2 3.9Å; D55-V58 WeakPolarHBondContact O-CB 3.02Å; D55-V58 WeakPolarHBondContact O-CG2 3.34Å; D55-V58 PolarHBondContact O-N 2.84Å
56	S	97.7	Very high	98.2	Very high	119 Å²	119	57.6 Å²	57.6	83%	0.832	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	133.3	-178.3	-171.5	0	0	0	0	111.5	V58	S56-V58 VanDerWaalsContact C-N 3.27Å; S56-V58 PolarHBondContact O-N 2.86Å
57	G	97.1	Very high	98.2	Very high	79 Å²	79	56.4 Å²	56.4	81%	0.814	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-1.4	-179.7	0	0	0	0	0	115.1	D55	D55-G57 PolarHBondContact O-N 2.84Å
58	V	98.1	Very high	98	Very high	23 Å²	23	57.7 Å²	57.7	14%	0.139	35%	0.354	C	S	.	.			trans	-76.1	130.9	175.9	-178.4	0	0	0	0	109.9	L47 L54 D55 S56 F62	L47-V58 HydrophobicContact CB-CG1 4.33Å; L47-V58 HydrophobicContact CD2-CG1 3.93Å; L47-V58 HydrophobicContact CD2-CG2 4.24Å; L54-V58 HydrophobicContact CD2-CB 4.04Å; L54-V58 HydrophobicContact CD2-CG1 3.55Å; D55-V58 HydrophobicContact CB-CG2 3.9Å; D55-V58 WeakPolarHBondContact O-CB 3.02Å; D55-V58 WeakPolarHBondContact O-CG2 3.34Å; D55-V58 PolarHBondContact O-N 2.84Å; S56-V58 VanDerWaalsContact C-N 3.27Å; S56-V58 PolarHBondContact O-N 2.86Å; V58-F62 HydrophobicContact CG1-CB 3.99Å; V58-F62 HydrophobicContact CG1-CD2 3.81Å; V58-F62 HydrophobicContact CG1-CG 4.02Å
59	P	98.2	Very high	98	Very high	43 Å²	43	59 Å²	59	28%	0.279	36%	0.363	S	S	.	.			trans	-57.9	142	179.1	-28.5	37.4	0	0	0	113.4	R61 F62	P59-R61 HydrophobicContact CB-CG 3.86Å; P59-R61 PolarHBondContact O-N 3.48Å; P59-F62 HydrophobicContact CB-CD2 4.13Å; P59-F62 HydrophobicContact CB-CE2 4.35Å; P59-F62 HydrophobicContact CG-CD2 4.45Å; P59-F62 HydrophobicContact CG-CE2 4.32Å; P59-F62 WeakPolarHBondContact O-CD2 3.29Å; P59-F62 PolarHBondContact O-N 3.32Å; P59-F62 VanDerWaalsContact O-N 3.07Å
60	K	98.1	Very high	98	Very high	199 Å²	199	58.1 Å²	58.1	87%	0.865	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.9	-178.8	-66.6	-173.7	179.5	-179.2	0	114.7	F62	K60-F62 PolarHBondContact O-N 3Å
61	R	98.4	Very high	98	Very high	29 Å²	29	56.7 Å²	56.7	11%	0.109	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-22.4	173.4	58.4	174.6	-176.7	-85.8	-6.8	112.7	P59 I75 S76 S77 E79 E81 D82	P59-R61 HydrophobicContact CB-CG 3.86Å; P59-R61 PolarHBondContact O-N 3.48Å; R61-I75 HydrophobicContact CB-CG2 4.47Å; R61-I75 HydrophobicContact CG-CG2 4.2Å; R61-I75 CarbonylContact O-C 3.51Å; R61-I75 WeakPolarHBondContact O-CA 3.28Å; R61-S76 WeakPolarHBondContact CA-OG 3.49Å; R61-S76 PolarHBondContact O-N 3.47Å; R61-S76 PolarHBondContact O-OG 3.46Å; R61-S77 WeakPolarHBondContact CD-O 3.49Å; R61-E79 IonicContact CZ-OE1 3.63Å; R61-E79 IonicContact CZ-OE2 3.59Å; R61-E79 VanDerWaalsContact CZ-OE2 3.31Å; R61-E79 IonicContact NE-OE1 3.69Å; R61-E79 IonicContact NH1-OE1 2.7Å; R61-E79 PolarHBondContact NH1-OE1 3.07Å; R61-E79 IonicContact NH1-OE2 2.82Å; R61-E79 PolarHBondContact NH1-OE2 3.35Å; R61-E79 IonicContact NH2-OE2 3.57Å; R61-E81 IonicContact CZ-OE1 3.31Å; R61-E81 IonicContact NH1-OE1 2.89Å; R61-E81 IonicContact NH2-OE1 3.61Å; R61-E81 PolarHBondContact NH2-OE1 3.3Å; R61-D82 IonicContact CZ-OD1 3.43Å; R61-D82 IonicContact CZ-OD2 3.51Å; R61-D82 IonicContact NE-OD1 3.71Å; R61-D82 PolarHBondContact NE-OD1 2.85Å; R61-D82 IonicContact NE-OD2 3.37Å; R61-D82 PolarHBondContact NE-OD2 3.25Å; R61-D82 IonicContact NH2-OD1 2.78Å; R61-D82 PolarHBondContact NH2-OD1 3.12Å; R61-D82 IonicContact NH2-OD2 2.76Å
62	F	98.8	Very high	98.1	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.018	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	141.1	172.7	-68.8	-87	0	0	0	110.9	L47 L54 V58 P59 K60 L73 T74 I75 D82 Y86	L47-F62 HydrophobicContact CD1-CD1 3.76Å; L47-F62 HydrophobicContact CD1-CE1 3.6Å; L47-F62 HydrophobicContact CD1-CZ 4.31Å; L54-F62 HydrophobicContact CD2-CB 3.68Å; V58-F62 HydrophobicContact CG1-CB 3.99Å; V58-F62 HydrophobicContact CG1-CD2 3.81Å; V58-F62 HydrophobicContact CG1-CG 4.02Å; P59-F62 HydrophobicContact CB-CD2 4.13Å; P59-F62 HydrophobicContact CB-CE2 4.35Å; P59-F62 HydrophobicContact CG-CD2 4.45Å; P59-F62 HydrophobicContact CG-CE2 4.32Å; P59-F62 WeakPolarHBondContact O-CD2 3.29Å; P59-F62 PolarHBondContact O-N 3.32Å; P59-F62 VanDerWaalsContact O-N 3.07Å; K60-F62 PolarHBondContact O-N 3Å; F62-L73 HydrophobicContact CD1-CD1 4.33Å; F62-T74 CarbonylContact C-O 3.59Å; F62-T74 WeakPolarHBondContact CA-O 3.32Å; F62-I75 HydrophobicContact CD1-CD1 4.22Å; F62-I75 HydrophobicContact CD1-CG1 3.79Å; F62-I75 HydrophobicContact CE1-CD1 3.49Å; F62-I75 VanDerWaalsContact CE1-CD1 3.49Å; F62-I75 HydrophobicContact CE1-CG1 3.58Å; F62-I75 HydrophobicContact CE1-CG2 4.41Å; F62-I75 HydrophobicContact CZ-CD1 4.07Å; F62-I75 HydrophobicContact CZ-CG1 4.38Å; F62-I75 HydrophobicContact CZ-CG2 4.49Å; F62-D82 WeakPolarHBondContact CE2-OD1 3.37Å; F62-D82 HydrophobicContact CZ-CB 4.36Å; F62-D82 WeakPolarHBondContact CZ-OD1 3.17Å; F62-Y86 AromaticContact CE1-CE1 3.95Å; F62-Y86 HydrophobicContact CE1-CE1 3.95Å
63	S	98.7	Very high	98.1	Very high	51 Å²	51	54.1 Å²	54.1	36%	0.357	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	149.6	172.9	55.7	0	0	0	0	111	L73 T74	S63-L73 WeakPolarHBondContact O-CA 3.38Å; S63-T74 PolarHBondContact N-O 2.91Å; S63-T74 PolarHBondContact O-N 2.9Å; S63-T74 PolarHBondContact OG-O 2.99Å
64	G	98.6	Very high	98.1	Very high	14 Å²	14	51.9 Å²	51.9	14%	0.144	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.3	-178.9	0	0	0	0	0	110.2	A51 S52 S72	A51-G64 CarbonylContact O-C 3.59Å; A51-G64 WeakPolarHBondContact O-CA 3.31Å; S52-G64 VanDerWaalsContact CB-O 3.26Å; S52-G64 WeakPolarHBondContact CB-O 3.36Å; G64-S72 VanDerWaalsContact CA-O 3.29Å; G64-S72 WeakPolarHBondContact CA-O 3.47Å
65	S	98	Very high	98.1	Very high	59 Å²	59	49.4 Å²	49.4	41%	0.413	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	163.3	175.9	76.2	0	0	0	0	111.9	Y71 S72	S65-Y71 CarbonylContact O-C 3.53Å; S65-Y71 VanDerWaalsContact O-CA 3.29Å; S65-Y71 WeakPolarHBondContact O-CA 3.45Å; S65-S72 PolarHBondContact N-O 2.85Å; S65-S72 PolarHBondContact O-N 3Å; S65-S72 PolarHBondContact OG-OG 2.02Å
66	R	97.6	Very high	98.1	Very high	104 Å²	104	50.4 Å²	50.4	39%	0.392	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	140.7	179.5	-176.8	-175	95.5	-154.3	11.6	110.8	S30 A51 D70 Y71	S30-R66 WeakPolarHBondContact O-CD 3.38Å; S30-R66 PolarHBondContact O-NH1 3.42Å; S30-R66 VanDerWaalsContact O-NH1 3.07Å; A51-R66 HydrophobicContact CB-CB 4.31Å; R66-D70 CarbonylContact C-O 3.48Å; R66-D70 WeakPolarHBondContact CA-O 3.37Å; R66-Y71 HydrophobicContact CB-CD1 3.94Å; R66-Y71 HydrophobicContact CB-CE1 4.02Å; R66-Y71 HydrophobicContact CG-CD1 3.77Å; R66-Y71 HydrophobicContact CG-CE1 3.43Å; R66-Y71 VanDerWaalsContact CG-CE1 3.43Å
67	S	96.9	Very high	98.2	Very high	92 Å²	92	47 Å²	47	64%	0.643	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.7	108.9	164	-172.6	0	0	0	0	109.1	S69 D70	S67-S69 PolarHBondContact O-N 2.83Å; S67-D70 PolarHBondContact N-O 2.84Å; S67-D70 WeakPolarHBondContact O-CB 3.42Å; S67-D70 PolarHBondContact O-N 2.87Å
68	G	96.1	Very high	98.2	Very high	35 Å²	35	43.9 Å²	43.9	36%	0.361	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	-120.3	-174	0	0	0	0	0	112.5
69	S	97.7	Very high	98.2	Very high	28 Å²	28	46.4 Å²	46.4	20%	0.196	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	1	176.2	57.4	0	0	0	0	114.4	A25 S67 Y71	A25-S69 PolarHBondContact N-O 2.79Å; A25-S69 WeakPolarHBondContact O-CB 3.29Å; S67-S69 PolarHBondContact O-N 2.83Å; S69-Y71 WeakPolarHBondContact O-CD2 3.41Å; S69-Y71 WeakPolarHBondContact O-CE2 3.46Å
70	D	98.4	Very high	98.2	Very high	74 Å²	74	48.6 Å²	48.6	40%	0.396	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	137.1	-179.5	-62.7	-65.6	0	0	0	110.8	R24 R66 S67	R24-D70 WeakPolarHBondContact CB-OD1 3.36Å; R24-D70 VanDerWaalsContact CD-OD1 3.32Å; R24-D70 WeakPolarHBondContact CD-OD1 3.4Å; R24-D70 VanDerWaalsContact CG-OD1 3.28Å; R24-D70 WeakPolarHBondContact CG-OD1 3.36Å; R24-D70 IonicContact NE-OD1 3.93Å; R66-D70 CarbonylContact C-O 3.48Å; R66-D70 WeakPolarHBondContact CA-O 3.37Å; S67-D70 PolarHBondContact N-O 2.84Å; S67-D70 WeakPolarHBondContact O-CB 3.42Å; S67-D70 PolarHBondContact O-N 2.87Å
71	Y	98.7	Very high	98.1	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.016	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.1	-176.8	-56.3	-97.6	0	0	0	108.8	T22 C23 A25 I29 S30 L33 A51 S65 R66 S69	T22-Y71 CarbonylContact C-O 3.54Å; T22-Y71 VanDerWaalsContact CA-O 3.32Å; T22-Y71 WeakPolarHBondContact CA-O 3.49Å; C23-Y71 PolarHBondContact N-O 3.02Å; C23-Y71 WeakPolarHBondContact O-CA 3.37Å; C23-Y71 WeakPolarHBondContact O-CB 3.44Å; C23-Y71 WeakPolarHBondContact O-CD2 3.09Å; C23-Y71 PolarHBondContact O-N 3.22Å; A25-Y71 HydrophobicContact CB-CE2 4.15Å; I29-Y71 HydrophobicContact CD1-CE2 4.14Å; I29-Y71 HydrophobicContact CG1-CE1 4.44Å; I29-Y71 HydrophobicContact CG1-CE2 3.92Å; I29-Y71 WeakPolarHBondContact CG1-OH 3.44Å; S30-Y71 WeakPolarHBondContact O-CE1 3.33Å; S30-Y71 PolarHBondContact O-OH 3.22Å; L33-Y71 HydrophobicContact CB-CD1 4Å; L33-Y71 HydrophobicContact CB-CE1 3.95Å; L33-Y71 HydrophobicContact CD1-CD1 3.78Å; L33-Y71 HydrophobicContact CD1-CD2 3.65Å; L33-Y71 HydrophobicContact CD1-CE1 4.17Å; L33-Y71 HydrophobicContact CD1-CE2 4.08Å; L33-Y71 HydrophobicContact CD1-CG 3.54Å; L33-Y71 HydrophobicContact CD2-CD1 4.08Å; L33-Y71 HydrophobicContact CD2-CG 4.26Å; L33-Y71 HydrophobicContact CG-CD1 4.18Å; L33-Y71 HydrophobicContact CG-CG 4.35Å; A51-Y71 HydrophobicContact CB-CD1 3.93Å; A51-Y71 HydrophobicContact CB-CE1 4.01Å; S65-Y71 CarbonylContact O-C 3.53Å; S65-Y71 VanDerWaalsContact O-CA 3.29Å; S65-Y71 WeakPolarHBondContact O-CA 3.45Å; R66-Y71 HydrophobicContact CB-CD1 3.94Å; R66-Y71 HydrophobicContact CB-CE1 4.02Å; R66-Y71 HydrophobicContact CG-CD1 3.77Å; R66-Y71 HydrophobicContact CG-CE1 3.43Å; R66-Y71 VanDerWaalsContact CG-CE1 3.43Å; S69-Y71 WeakPolarHBondContact O-CD2 3.41Å; S69-Y71 WeakPolarHBondContact O-CE2 3.46Å
72	S	98.6	Very high	98	Very high	20 Å²	20	42.4 Å²	42.4	14%	0.14	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	150	171.6	72.3	0	0	0	0	112.4	L21 W35 G64 S65	L21-S72 CarbonylContact O-C 3.16Å; L21-S72 WeakPolarHBondContact O-CA 3.39Å; L21-S72 WeakPolarHBondContact O-CB 3.29Å; W35-S72 PolarHBondContact NE1-O 2.84Å; G64-S72 VanDerWaalsContact CA-O 3.29Å; G64-S72 WeakPolarHBondContact CA-O 3.47Å; S65-S72 PolarHBondContact N-O 2.85Å; S65-S72 PolarHBondContact O-N 3Å; S65-S72 PolarHBondContact OG-OG 2.02Å
73	L	98.8	Very high	97.9	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.7	166.3	177.8	68.7	0	0	0	107.3	S20 L21 W35 L47 I48 F62 S63 Y86	S20-L73 CarbonylContact C-O 3.43Å; S20-L73 VanDerWaalsContact CA-O 3.3Å; S20-L73 WeakPolarHBondContact CA-O 3.44Å; L21-L73 HydrophobicContact CB-CB 4.49Å; L21-L73 HydrophobicContact CD1-CD2 4.45Å; L21-L73 PolarHBondContact N-O 2.96Å; L21-L73 PolarHBondContact O-N 2.82Å; W35-L73 HydrophobicContact CB-CD1 4.22Å; W35-L73 HydrophobicContact CB-CD2 4.39Å; W35-L73 HydrophobicContact CD2-CB 3.58Å; W35-L73 HydrophobicContact CD2-CD1 4.44Å; W35-L73 HydrophobicContact CD2-CD2 4.15Å; W35-L73 HydrophobicContact CD2-CG 4.28Å; W35-L73 HydrophobicContact CE3-CB 3.81Å; W35-L73 HydrophobicContact CE3-CD2 3.91Å; W35-L73 HydrophobicContact CE3-CG 4.43Å; W35-L73 HydrophobicContact CG-CB 4.08Å; W35-L73 HydrophobicContact CG-CD1 4.08Å; W35-L73 HydrophobicContact CG-CD2 4.37Å; W35-L73 HydrophobicContact CG-CG 4.42Å; W35-L73 HydrophobicContact CH2-CB 3.99Å; W35-L73 HydrophobicContact CZ2-CB 3.8Å; W35-L73 HydrophobicContact CZ3-CB 4Å; W35-L73 HydrophobicContact CZ3-CD2 4.48Å; L47-L73 HydrophobicContact CD1-CD2 4.43Å; I48-L73 HydrophobicContact CD1-CD1 3.54Å; I48-L73 HydrophobicContact CG1-CD1 4.28Å; F62-L73 HydrophobicContact CD1-CD1 4.33Å; S63-L73 WeakPolarHBondContact O-CA 3.38Å; L73-Y86 HydrophobicContact CD2-CD1 3.38Å; L73-Y86 HydrophobicContact CD2-CE1 3.81Å; L73-Y86 HydrophobicContact CD2-CG 4.19Å
74	T	98.7	Very high	97.9	Very high	10 Å²	10	46.4 Å²	46.4	6%	0.061	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.2	173.9	-66.9	0	0	0	0	109.6	R18 V19 F62 S63	R18-T74 HydrophobicContact CG-CG2 4.03Å; V19-T74 WeakPolarHBondContact O-CA 3.37Å; F62-T74 CarbonylContact C-O 3.59Å; F62-T74 WeakPolarHBondContact CA-O 3.32Å; S63-T74 PolarHBondContact N-O 2.91Å; S63-T74 PolarHBondContact O-N 2.9Å; S63-T74 PolarHBondContact OG-O 2.99Å
75	I	98.7	Very high	97.9	Very high	7 Å²	7	50.4 Å²	50.4	4%	0.036	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	114.6	163.8	-44.1	178.3	0	0	0	106.2	R18 V19 R61 F62 L78 D82 Y86	R18-I75 WeakPolarHBondContact CA-O 3.3Å; V19-I75 HydrophobicContact CG2-CB 3.6Å; V19-I75 HydrophobicContact CG2-CD1 3.8Å; V19-I75 HydrophobicContact CG2-CG1 3.8Å; V19-I75 PolarHBondContact N-O 2.8Å; V19-I75 PolarHBondContact O-N 3.5Å; R61-I75 HydrophobicContact CB-CG2 4.47Å; R61-I75 HydrophobicContact CG-CG2 4.2Å; R61-I75 CarbonylContact O-C 3.51Å; R61-I75 WeakPolarHBondContact O-CA 3.28Å; F62-I75 HydrophobicContact CD1-CD1 4.22Å; F62-I75 HydrophobicContact CD1-CG1 3.79Å; F62-I75 HydrophobicContact CE1-CD1 3.49Å; F62-I75 VanDerWaalsContact CE1-CD1 3.49Å; F62-I75 HydrophobicContact CE1-CG1 3.58Å; F62-I75 HydrophobicContact CE1-CG2 4.41Å; F62-I75 HydrophobicContact CZ-CD1 4.07Å; F62-I75 HydrophobicContact CZ-CG1 4.38Å; F62-I75 HydrophobicContact CZ-CG2 4.49Å; I75-L78 HydrophobicContact CD1-CD1 4.13Å; I75-D82 HydrophobicContact CD1-CB 4.19Å; I75-Y86 HydrophobicContact CD1-CE1 4.3Å; I75-Y86 WeakPolarHBondContact CD1-OH 3.47Å
76	S	98.7	Very high	97.9	Very high	63 Å²	63	49 Å²	49	44%	0.441	28%	0.28	S	S	.	.	S	Bend	trans	-73.5	-26.6	-171.7	60.5	0	0	0	0	114	R61	R61-S76 WeakPolarHBondContact CA-OG 3.49Å; R61-S76 PolarHBondContact O-N 3.47Å; R61-S76 PolarHBondContact O-OG 3.46Å
77	S	98.5	Very high	97.9	Very high	48 Å²	48	48.9 Å²	48.9	34%	0.336	28%	0.28	S	S	.	.	S	Bend	trans	-148.3	97.2	178.5	170	0	0	0	0	108.2	R61 E79	R61-S77 WeakPolarHBondContact CD-O 3.49Å; S77-E79 PolarHBondContact O-N 2.89Å
78	L	98.5	Very high	98	Very high	12 Å²	12	45 Å²	45	6%	0.063	25%	0.253	C	S	.	.			trans	-60.6	128.9	-175.9	-174.7	70.1	0	0	0	111.9	A13 L15 G16 E17 V19 I75 D82 F83	A13-L78 HydrophobicContact CB-CD2 3.99Å; L15-L78 WeakPolarHBondContact CA-O 3.42Å; G16-L78 PolarHBondContact N-O 2.95Å; E17-L78 WeakPolarHBondContact O-CB 3.2Å; E17-L78 PolarHBondContact O-N 2.89Å; V19-L78 HydrophobicContact CG1-CD2 4.37Å; V19-L78 HydrophobicContact CG2-CD1 4.06Å; I75-L78 HydrophobicContact CD1-CD1 4.13Å; L78-D82 HydrophobicContact CD1-CB 3.7Å; L78-F83 HydrophobicContact CD2-CE1 4.11Å; L78-F83 HydrophobicContact CD2-CZ 4.36Å
79	E	98.3	Very high	98	Very high	77 Å²	77	47.8 Å²	47.8	36%	0.36	26%	0.259	S	S	.	.			trans	-113.1	164.3	174.6	-70.8	178.1	-148.2	0	0	111.9	R61 S77 E81 D82	R61-E79 IonicContact CZ-OE1 3.63Å; R61-E79 IonicContact CZ-OE2 3.59Å; R61-E79 VanDerWaalsContact CZ-OE2 3.31Å; R61-E79 IonicContact NE-OE1 3.69Å; R61-E79 IonicContact NH1-OE1 2.7Å; R61-E79 PolarHBondContact NH1-OE1 3.07Å; R61-E79 IonicContact NH1-OE2 2.82Å; R61-E79 PolarHBondContact NH1-OE2 3.35Å; R61-E79 IonicContact NH2-OE2 3.57Å; S77-E79 PolarHBondContact O-N 2.89Å; E79-E81 HydrophobicContact CB-CG 4.19Å; E79-E81 PolarHBondContact O-N 2.94Å; E79-D82 PolarHBondContact N-OD2 3.05Å; E79-D82 VanDerWaalsContact O-CB 3.3Å; E79-D82 WeakPolarHBondContact O-CB 3.19Å; E79-D82 PolarHBondContact O-N 3.31Å
80	S	96.6	Very high	98	Very high	88 Å²	88	47.8 Å²	47.8	62%	0.615	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-64.3	-25.1	-177.8	55.3	0	0	0	0	113.8	D82 F83	S80-D82 PolarHBondContact O-N 2.87Å; S80-F83 WeakPolarHBondContact O-CD2 3.46Å
81	E	96.2	Very high	97.9	Very high	94 Å²	94	47.9 Å²	47.9	44%	0.439	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-77.8	-8.2	175.7	61.1	-175.4	-142.5	0	0	114.2	K39 R61 E79	K39-E81 PolarHBondContact NZ-O 2.77Å; R61-E81 IonicContact CZ-OE1 3.31Å; R61-E81 IonicContact NH1-OE1 2.89Å; R61-E81 IonicContact NH2-OE1 3.61Å; R61-E81 PolarHBondContact NH2-OE1 3.3Å; E79-E81 HydrophobicContact CB-CG 4.19Å; E79-E81 PolarHBondContact O-N 2.94Å
82	D	97.5	Very high	97.7	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.021	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-90.4	-8.5	180	-57.5	-28.1	0	0	0	112.4	R61 F62 I75 L78 E79 S80 A84 Y86	R61-D82 IonicContact CZ-OD1 3.43Å; R61-D82 IonicContact CZ-OD2 3.51Å; R61-D82 IonicContact NE-OD1 3.71Å; R61-D82 PolarHBondContact NE-OD1 2.85Å; R61-D82 IonicContact NE-OD2 3.37Å; R61-D82 PolarHBondContact NE-OD2 3.25Å; R61-D82 IonicContact NH2-OD1 2.78Å; R61-D82 PolarHBondContact NH2-OD1 3.12Å; R61-D82 IonicContact NH2-OD2 2.76Å; F62-D82 WeakPolarHBondContact CE2-OD1 3.37Å; F62-D82 HydrophobicContact CZ-CB 4.36Å; F62-D82 WeakPolarHBondContact CZ-OD1 3.17Å; I75-D82 HydrophobicContact CD1-CB 4.19Å; L78-D82 HydrophobicContact CD1-CB 3.7Å; E79-D82 PolarHBondContact N-OD2 3.05Å; E79-D82 VanDerWaalsContact O-CB 3.3Å; E79-D82 WeakPolarHBondContact O-CB 3.19Å; E79-D82 PolarHBondContact O-N 3.31Å; S80-D82 PolarHBondContact O-N 2.87Å; D82-A84 PolarHBondContact O-N 2.89Å; D82-Y86 WeakPolarHBondContact O-CE2 3.38Å; D82-Y86 PolarHBondContact O-OH 3.37Å
83	F	96.6	Very high	97.3	Very high	113 Å²	113	51.7 Å²	51.7	50%	0.496	28%	0.281	S	S	.	.			trans	-65.6	104.7	173.4	-65.5	-65.7	0	0	0	110.3	L15 L78 S80	L15-F83 HydrophobicContact CD2-CE2 3.89Å; L15-F83 HydrophobicContact CD2-CZ 3.96Å; L78-F83 HydrophobicContact CD2-CE1 4.11Å; L78-F83 HydrophobicContact CD2-CZ 4.36Å; S80-F83 WeakPolarHBondContact O-CD2 3.46Å
84	A	97.7	Very high	96.5	Very high	26 Å²	26	60.5 Å²	60.5	22%	0.215	32%	0.316	C	S	.	.	S	Bend	trans	-163.2	165.3	-171.2	0	0	0	0	0	110.5	Q37 Q38 D82 Y86	Q37-A84 HydrophobicContact CG-CB 3.37Å; Q38-A84 VanDerWaalsContact O-CB 3.28Å; Q38-A84 WeakPolarHBondContact O-CB 3.48Å; D82-A84 PolarHBondContact O-N 2.89Å; A84-Y86 HydrophobicContact CB-CD2 4.5Å; A84-Y86 HydrophobicContact CB-CE2 3.95Å; A84-Y86 VanDerWaalsContact O-CD2 3.25Å; A84-Y86 WeakPolarHBondContact O-CD2 3.5Å; A84-Y86 WeakPolarHBondContact O-CE2 3.29Å
85	D	98.3	Very high	95.1	Very high	98 Å²	98	69.1 Å²	69.1	52%	0.524	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	143.7	162.7	-65.6	-45.1	0	0	0	109.5	Q38 Y87	Q38-D85 HydrophobicContact CB-CB 4.35Å; Q38-D85 PolarHBondContact N-O 2.83Å; Q38-D85 PolarHBondContact O-N 3.16Å; D85-Y87 HydrophobicContact CB-CE2 3.67Å
86	Y	98.5	Very high	94.9	Very high	29 Å²	29	72.2 Å²	72.2	11%	0.114	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135	-176.5	-72.1	-94.3	0	0	0	110.3	Q6 L21 L36 Q37 L47 F62 L73 I75 D82 A84	Q6-Y86 PolarHBondContact NE2-O 3.07Å; L21-Y86 VanDerWaalsContact CD1-CB 3.41Å; L21-Y86 HydrophobicContact CD1-CD1 4.48Å; L21-Y86 HydrophobicContact CD1-CD2 4.02Å; L21-Y86 HydrophobicContact CD1-CG 3.74Å; L36-Y86 WeakPolarHBondContact O-CA 3.33Å; Q37-Y86 HydrophobicContact CB-CD1 4.46Å; Q37-Y86 HydrophobicContact CB-CE1 4.24Å; Q37-Y86 HydrophobicContact CG-CE1 4.08Å; Q37-Y86 PolarHBondContact NE2-OH 2.94Å; L47-Y86 HydrophobicContact CD1-CD1 3.96Å; L47-Y86 HydrophobicContact CD1-CE1 3.5Å; F62-Y86 AromaticContact CE1-CE1 3.95Å; F62-Y86 HydrophobicContact CE1-CE1 3.95Å; L73-Y86 HydrophobicContact CD2-CD1 3.38Å; L73-Y86 HydrophobicContact CD2-CE1 3.81Å; L73-Y86 HydrophobicContact CD2-CG 4.19Å; I75-Y86 HydrophobicContact CD1-CE1 4.3Å; I75-Y86 WeakPolarHBondContact CD1-OH 3.47Å; D82-Y86 WeakPolarHBondContact O-CE2 3.38Å; D82-Y86 PolarHBondContact O-OH 3.37Å; A84-Y86 HydrophobicContact CB-CD2 4.5Å; A84-Y86 HydrophobicContact CB-CE2 3.95Å; A84-Y86 VanDerWaalsContact O-CD2 3.25Å; A84-Y86 WeakPolarHBondContact O-CD2 3.5Å; A84-Y86 WeakPolarHBondContact O-CE2 3.29Å
87	Y	98.4	Very high	94.7	Very high	102 Å²	102	72.7 Å²	72.7	40%	0.4	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	137.4	-176.8	-58.4	-84.6	0	0	0	111.6	Q6 W35 L36 Q38 D85	Q6-Y87 VanDerWaalsContact OE1-CA 3.31Å; W35-Y87 CarbonylContact C-O 3.53Å; W35-Y87 WeakPolarHBondContact CA-O 2.98Å; L36-Y87 PolarHBondContact N-O 2.94Å; L36-Y87 PolarHBondContact O-N 2.77Å; Q38-Y87 HydrophobicContact CB-CD2 4.35Å; Q38-Y87 HydrophobicContact CB-CE2 3.86Å; Q38-Y87 PolarHBondContact OE1-OH 2.81Å; D85-Y87 HydrophobicContact CB-CE2 3.67Å
88	C	98	Very high	94.5	Very high	12 Å²	12	74.1 Å²	74.1	8%	0.081	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	134.2	164.7	63	0	0	0	0	110.1	M4 Q6 C23 L33 S34 W35	M4-C88 HydrophobicContact CE-CB 4.43Å; Q6-C88 VanDerWaalsContact CD-SG 3.59Å; Q6-C88 HydrophobicContact CG-CB 4.49Å; Q6-C88 WeakPolarHBondContact CG-SG 3.21Å; Q6-C88 PolarHBondContact OE1-SG 2.91Å; Q6-C88 VanDerWaalsContact OE1-SG 3.34Å; C23-C88 HydrophobicContact CB-CB 3.5Å; C23-C88 WeakPolarHBondContact CB-SG 3.44Å; C23-C88 WeakPolarHBondContact SG-CB 3.31Å; C23-C88 CovalentContact SG-SG 2.02Å; C23-C88 PolarHBondContact SG-SG 2.68Å; L33-C88 HydrophobicContact CD1-CB 4.06Å; L33-C88 HydrophobicContact CD2-CB 4.35Å; L33-C88 HydrophobicContact CG-CB 4.37Å; S34-C88 CarbonylContact O-C 3.51Å; S34-C88 WeakPolarHBondContact O-CA 3.14Å; W35-C88 HydrophobicContact CD2-CB 4.32Å; W35-C88 HydrophobicContact CE3-CB 4.04Å; W35-C88 HydrophobicContact CH2-CB 4.13Å; W35-C88 HydrophobicContact CZ2-CB 4.37Å; W35-C88 HydrophobicContact CZ3-CB 3.95Å
89	L	97.1	Very high	94.2	Very high	93 Å²	93	77.7 Å²	77.7	49%	0.487	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	119.1	180	179.8	65.6	0	0	0	109.6	L33 S34 L36	L33-L89 WeakPolarHBondContact CA-O 2.99Å; S34-L89 PolarHBondContact N-O 3.34Å; S34-L89 PolarHBondContact O-N 2.98Å; L36-L89 HydrophobicContact CD1-CB 4.35Å; L36-L89 HydrophobicContact CD1-CD2 4.23Å
90	Q	97	Very high	94	Very high	28 Å²	28	77.8 Å²	77.8	13%	0.131	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	145.1	169.2	73	81.7	18.6	0	0	110.4	I2 M4 I29 Y32 S93	I2-Q90 HydrophobicContact CB-CG 4.16Å; I2-Q90 HydrophobicContact CG2-CB 4.46Å; I2-Q90 HydrophobicContact CG2-CG 3.94Å; M4-Q90 HydrophobicContact CE-CB 3.99Å; M4-Q90 HydrophobicContact CG-CB 4.3Å; M4-Q90 HydrophobicContact CG-CG 4.05Å; M4-Q90 HydrophobicContact SD-CB 3.78Å; M4-Q90 HydrophobicContact SD-CG 4.01Å; I29-Q90 HydrophobicContact CD1-CB 3.54Å; Y32-Q90 WeakPolarHBondContact O-CA 3.26Å; Q90-S93 PolarHBondContact NE2-O 2.93Å; Q90-S93 VanDerWaalsContact OE1-N 3.11Å; Q90-S93 PolarHBondContact OE1-O 3.21Å
91	Y	96	Very high	93.8	Very high	76 Å²	76	77.1 Å²	77.1	30%	0.298	40%	0.397	S	S	.	.			trans	-134.6	26.9	172.8	59.3	-88.8	0	0	0	112.1	G31 Y32 A50	G31-Y91 PolarHBondContact O-OH 3.07Å; Y32-Y91 VanDerWaalsContact C-CD1 3.48Å; Y32-Y91 AromaticContact CD1-CD2 3.85Å; Y32-Y91 HydrophobicContact CD1-CD2 3.85Å; Y32-Y91 AromaticContact CD1-CE2 3.49Å; Y32-Y91 HydrophobicContact CD1-CE2 3.49Å; Y32-Y91 VanDerWaalsContact CD1-CE2 3.49Å; Y32-Y91 HydrophobicContact CE1-CE2 4.44Å; Y32-Y91 HydrophobicContact CG-CD2 4.44Å; Y32-Y91 HydrophobicContact CG-CE2 4.26Å; Y32-Y91 WeakPolarHBondContact O-CD1 3.42Å; Y32-Y91 PolarHBondContact O-N 3.04Å; A50-Y91 PolarHBondContact N-OH 3.32Å
92	A	95	Very high	93.7	Very high	46 Å²	46	75.9 Å²	75.9	38%	0.38	39%	0.394	S	S	.	.	S	Bend	trans	-78.2	-30.5	175.3	0	0	0	0	0	112.5	I2 I29 Y32	I2-A92 HydrophobicContact CD1-CB 3.96Å; I29-A92 HydrophobicContact CB-CB 3.9Å; I29-A92 HydrophobicContact CG2-CB 4Å; Y32-A92 HydrophobicContact CD2-CB 4.11Å; Y32-A92 HydrophobicContact CG-CB 4.21Å
93	S	90.4	Very high	93.4	Very high	57 Å²	57	81.4 Å²	81.4	40%	0.399	42%	0.423	S	S	.	.			trans	-137.8	135.5	175.7	-170.2	0	0	0	0	109.6	Q90	Q90-S93 PolarHBondContact NE2-O 2.93Å; Q90-S93 VanDerWaalsContact OE1-N 3.11Å; Q90-S93 PolarHBondContact OE1-O 3.21Å
94	Y	82.5	Confident	93.1	Very high	187 Å²	187	78.8 Å²	78.8	73%	0.733	42%	0.417	S	S	*	.			trans	-83.5	152.7	165.1	-58.4	-75.3	0	0	0	109.3
95	P	68.2	Low	92.7	Very high	191 Å²	191	83.5 Å²	83.5	100%	1.24	44%	0.435	S	S	*	.			trans	-61.4	0	170.7	18.9	-23.2	0	0	0	112.5

Retrieved 95 of 95 residues in 89.3 ms (Link to these results)

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