A0A060Y881_ONCMY Loading...

Leucine rich repeat and fibronectin type III domain containing 5a

AlphaFold DB , UniProt , Accession A0A060Y881, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110505743, Length 790 aa.

						>A0A060Y881_ONCMY|A0A060Y881|LOC110505743
MEKLLVCLLVIGIAVKAQICPKRCVCQILSPNLATLCAKKGLLFAPPNIDRHTVELRLADNFVTSIKRKDFANMTRLQDLTLSRNTISFITPHAFADLENLRALHLNSNRLTRIANDTFSGMSKLHHLILNNNQLTLIHLGAFNDLLALEELDLSYNNLESIPWEAIQRMTSLATLSLDHNMIDYIPEGTFSLLQKLNRLDVTSNKLQKLPPDPLFQRAQVLATSGIMNSPSFALSFGGNPLHCNCELLWLRRLSREDDLETCASPQHLSGRYFWSIPEEEFLCEPPLITRHSHEMRVLEGQRVVLRCKARGDPEPAIHWISPEGKLVANSSRTLVYTNGTLDILISTVKDTGSFTCISSNPAGEAHQTVELLIIKLPHISNSTNNIQEPDPGSSDISTSTRAGANGSNHTGDTKTSTDKRVVIAEATSSTALIKFNFQRNIPGIRMFQIQYNGSYDDSLVYRMIPPTSKNFLVNNLAAGTSYDLCVLAIYDDGITSLTATRVVGCVQFTTESEYLRCHFMQSQFLGGTMIIIIGGIIVASVLVFIIILMIRYKVCNTTNSGKGTLVTNVHSQTNGAQSQGCTVTPSVSKQAMGGSDGGGGGCLKAVGHVSDTLTHSSETSLPDCSTATSQVTQSWNTPGSSGSLKPKRKPAPKPYAAAATPEPNIEALPNAETQNTNRNNSTALEQPCAPVFHSPLPFSSVKDTPILRRAHPRPSSKYLTLPVEGVRAKRRYSLNEDSSKHHCYVGTTQFGNMWSKRSMSMNGIVLQQEDIDSVKATFSSSEWILESTV
					

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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	53.7	Low	57.9	Low	208 Å²	208	123.4 Å²	123.4	100%	1.025	64%	0.639	S	S	*	*				0	-70.5	0	-62.2	-53.9	-96.9	0	0	111.5	K3 L4 L5	M1-K3 PolarHBondContact O-N 3.42Å; M1-L4 WeakPolarHBondContact O-CA 3.37Å; M1-L4 VanDerWaalsContact O-CB 3.3Å; M1-L4 WeakPolarHBondContact O-CB 3.02Å; M1-L4 PolarHBondContact O-N 3.23Å; M1-L5 PolarHBondContact O-N 2.72Å
2	E	58.5	Low	57.2	Low	162 Å²	162	117.8 Å²	117.8	76%	0.757	63%	0.634	S	S	*	*	H	α-helix	trans	-52.7	-47.5	-169.1	-61	168.4	137.6	0	0	115.2	L4 L5 V6	E2-L4 PolarHBondContact O-N 3.16Å; E2-L5 WeakPolarHBondContact O-CA 3.44Å; E2-L5 WeakPolarHBondContact O-CB 3.42Å; E2-L5 PolarHBondContact O-N 2.83Å; E2-V6 WeakPolarHBondContact O-CG2 3.32Å; E2-V6 PolarHBondContact O-N 3.21Å
3	K	58.9	Low	56.6	Low	186 Å²	186	118.9 Å²	118.9	81%	0.809	64%	0.637	S	S	*	*	H	α-helix	trans	-58	-32.4	177.1	-69	-171.8	176.9	-177	0	113.4	M1 C7	M1-K3 PolarHBondContact O-N 3.42Å; K3-C7 PolarHBondContact O-N 3.31Å; K3-C7 PolarHBondContact O-SG 3.42Å
4	L	58.8	Low	55.8	Low	124 Å²	124	116.2 Å²	116.2	65%	0.649	64%	0.64	S	S	*	*	H	α-helix	trans	-72.7	-39.1	175.5	-159	82.2	0	0	0	111.3	M1 E2 C7 L8	M1-L4 WeakPolarHBondContact O-CA 3.37Å; M1-L4 VanDerWaalsContact O-CB 3.3Å; M1-L4 WeakPolarHBondContact O-CB 3.02Å; M1-L4 PolarHBondContact O-N 3.23Å; E2-L4 PolarHBondContact O-N 3.16Å; L4-C7 PolarHBondContact O-N 2.97Å; L4-L8 WeakPolarHBondContact O-CG 3.4Å; L4-L8 PolarHBondContact O-N 2.95Å
5	L	59.4	Low	55.4	Low	112 Å²	112	115.7 Å²	115.7	59%	0.586	64%	0.641	S	S	*	*	H	α-helix	trans	-64.3	-42.1	175.7	-161.5	79.5	0	0	0	111.3	M1 E2 L8 L9	M1-L5 PolarHBondContact O-N 2.72Å; E2-L5 WeakPolarHBondContact O-CA 3.44Å; E2-L5 WeakPolarHBondContact O-CB 3.42Å; E2-L5 PolarHBondContact O-N 2.83Å; L5-L8 PolarHBondContact O-N 2.95Å; L5-L9 HydrophobicContact CG-CD1 4.5Å; L5-L9 WeakPolarHBondContact O-CB 3.27Å; L5-L9 WeakPolarHBondContact O-CG 3.37Å; L5-L9 PolarHBondContact O-N 3.34Å
6	V	63.4	Low	55.2	Low	85 Å²	85	119.6 Å²	119.6	52%	0.515	65%	0.649	S	S	.	*	H	α-helix	trans	-64.9	-43.3	174.5	174.9	0	0	0	0	111.1	E2 L8 L9 V10	E2-V6 WeakPolarHBondContact O-CG2 3.32Å; E2-V6 PolarHBondContact O-N 3.21Å; V6-L8 PolarHBondContact O-N 2.74Å; V6-L9 PolarHBondContact O-N 3.4Å; V6-V10 HydrophobicContact CG1-CG2 4.36Å; V6-V10 WeakPolarHBondContact O-CB 3.21Å; V6-V10 WeakPolarHBondContact O-CG2 3.13Å; V6-V10 PolarHBondContact O-N 3.2Å
7	C	57.8	Low	55.4	Low	71 Å²	71	117.7 Å²	117.7	48%	0.48	65%	0.653	S	S	.	*	H	α-helix	trans	-60.6	-42.2	173.4	-73.6	0	0	0	0	112.4	K3 L4 V10 I11	K3-C7 PolarHBondContact O-N 3.31Å; K3-C7 PolarHBondContact O-SG 3.42Å; L4-C7 PolarHBondContact O-N 2.97Å; C7-V10 PolarHBondContact O-N 3.06Å; C7-I11 WeakPolarHBondContact O-CB 3.26Å; C7-I11 WeakPolarHBondContact O-CD1 3.27Å; C7-I11 WeakPolarHBondContact O-CG1 3.42Å; C7-I11 PolarHBondContact O-N 2.64Å
8	L	58.6	Low	56.1	Low	107 Å²	107	117.5 Å²	117.5	56%	0.56	65%	0.647	S	S	*	*	H	α-helix	trans	-66.5	-37.3	176.3	-76	167	0	0	0	112.7	L4 L5 V6 G12	L4-L8 WeakPolarHBondContact O-CG 3.4Å; L4-L8 PolarHBondContact O-N 2.95Å; L5-L8 PolarHBondContact O-N 2.95Å; V6-L8 PolarHBondContact O-N 2.74Å; L8-G12 PolarHBondContact O-N 3.22Å
9	L	58	Low	57.5	Low	104 Å²	104	116.2 Å²	116.2	55%	0.545	64%	0.637	S	S	.	*	H	α-helix	trans	-64.8	-44.9	172.2	-80.5	162.6	0	0	0	111.8	L5 V6 G12 I13	L5-L9 HydrophobicContact CG-CD1 4.5Å; L5-L9 WeakPolarHBondContact O-CB 3.27Å; L5-L9 WeakPolarHBondContact O-CG 3.37Å; L5-L9 PolarHBondContact O-N 3.34Å; V6-L9 PolarHBondContact O-N 3.4Å; L9-G12 PolarHBondContact O-N 2.86Å; L9-I13 WeakPolarHBondContact O-CD1 3.34Å; L9-I13 VanDerWaalsContact O-CG1 3.25Å; L9-I13 WeakPolarHBondContact O-CG1 3.29Å; L9-I13 PolarHBondContact O-N 3.06Å
10	V	55.5	Low	59.1	Low	90 Å²	90	113.1 Å²	113.1	55%	0.545	62%	0.624	S	S	.	*	H	α-helix	trans	-65.3	-40.2	177.6	170.9	0	0	0	0	111.5	V6 C7 I13 A14	V6-V10 HydrophobicContact CG1-CG2 4.36Å; V6-V10 WeakPolarHBondContact O-CB 3.21Å; V6-V10 WeakPolarHBondContact O-CG2 3.13Å; V6-V10 PolarHBondContact O-N 3.2Å; C7-V10 PolarHBondContact O-N 3.06Å; V10-I13 PolarHBondContact O-N 3.49Å; V10-A14 WeakPolarHBondContact O-CB 3.46Å; V10-A14 PolarHBondContact O-N 3.38Å
11	I	54.6	Low	60.7	Low	108 Å²	108	108.3 Å²	108.3	55%	0.554	60%	0.598	S	S	*	*	H	α-helix	trans	-65	-40	173.2	-69	164.5	0	0	0	110.7	C7 I13 A14	C7-I11 WeakPolarHBondContact O-CB 3.26Å; C7-I11 WeakPolarHBondContact O-CD1 3.27Å; C7-I11 WeakPolarHBondContact O-CG1 3.42Å; C7-I11 PolarHBondContact O-N 2.64Å; I11-I13 VanDerWaalsContact C-N 3.29Å; I11-I13 PolarHBondContact O-N 2.94Å; I11-A14 PolarHBondContact O-N 2.75Å
12	G	48.9	Very low	62.3	Low	56 Å²	56	108.8 Å²	108.8	58%	0.577	60%	0.595	S	S	*	*	H	α-helix	trans	-64	-29.3	174	0	0	0	0	0	114.2	L8 L9	L8-G12 PolarHBondContact O-N 3.22Å; L9-G12 PolarHBondContact O-N 2.86Å
13	I	49.9	Very low	63.9	Low	133 Å²	133	108.7 Å²	108.7	68%	0.682	59%	0.587	S	S	*	*	H	α-helix	trans	-82	-27.6	174.5	-67.6	161.4	0	0	0	111.6	L9 V10 I11 V15	L9-I13 WeakPolarHBondContact O-CD1 3.34Å; L9-I13 VanDerWaalsContact O-CG1 3.25Å; L9-I13 WeakPolarHBondContact O-CG1 3.29Å; L9-I13 PolarHBondContact O-N 3.06Å; V10-I13 PolarHBondContact O-N 3.49Å; I11-I13 VanDerWaalsContact C-N 3.29Å; I11-I13 PolarHBondContact O-N 2.94Å; I13-V15 VanDerWaalsContact C-N 3.31Å; I13-V15 PolarHBondContact O-N 3.34Å
14	A	45.1	Very low	65.6	Low	81 Å²	81	100.5 Å²	100.5	67%	0.669	55%	0.553	S	S	*	*	H	α-helix	trans	-72.7	-19	-179	0	0	0	0	0	114	V10 I11 K16	V10-A14 WeakPolarHBondContact O-CB 3.46Å; V10-A14 PolarHBondContact O-N 3.38Å; I11-A14 PolarHBondContact O-N 2.75Å; A14-K16 PolarHBondContact O-N 2.71Å
15	V	49.3	Very low	67.2	Low	108 Å²	108	98 Å²	98	66%	0.655	54%	0.543	S	S	*	.	S	Bend	trans	-92.6	87.6	170.7	-173.5	0	0	0	0	109.6	I13 A17	I13-V15 VanDerWaalsContact C-N 3.31Å; I13-V15 PolarHBondContact O-N 3.34Å; V15-A17 PolarHBondContact O-N 3.12Å
16	K	53.1	Low	68.8	Low	179 Å²	179	94.5 Å²	94.5	78%	0.778	53%	0.528	S	S	*	.			trans	-59.3	105.4	163.3	-79.7	-173.6	175.3	-178.3	0	108.5	A14 Q18	A14-K16 PolarHBondContact O-N 2.71Å; K16-Q18 PolarHBondContact O-N 3.04Å
17	A	58.6	Low	70.1	Confident	87 Å²	87	95 Å²	95	72%	0.719	52%	0.524	S	S	*	.			trans	-64.1	99.8	178.5	0	0	0	0	0	110.4	V15 I19	V15-A17 PolarHBondContact O-N 3.12Å; A17-I19 PolarHBondContact O-N 3.02Å
18	Q	68.3	Low	71.4	Confident	114 Å²	114	96.1 Å²	96.1	53%	0.533	53%	0.525	S	S	.	.			trans	-66.1	130	-176.7	-74.3	159.8	-44.8	0	0	110.8	K16 C20 I28	K16-Q18 PolarHBondContact O-N 3.04Å; Q18-C20 PolarHBondContact O-N 2.82Å; Q18-I28 VanDerWaalsContact OE1-CD1 3.3Å
19	I	81.8	Confident	72.3	Confident	92 Å²	92	97.3 Å²	97.3	47%	0.472	53%	0.531	S	S	.	.			trans	-86.7	86.9	-164.7	-56.5	173.8	0	0	0	109.4	A17 N48 D50	A17-I19 PolarHBondContact O-N 3.02Å; I19-N48 HydrophobicContact CG2-CB 4.08Å; I19-D50 HydrophobicContact CB-CB 4.25Å; I19-D50 PolarHBondContact O-N 3.26Å; I19-D50 VanDerWaalsContact O-N 3.16Å
20	C	89.4	Confident	73	Confident	55 Å²	55	97.7 Å²	97.7	37%	0.372	54%	0.542	S	S	.	.			trans	-97.5	130.7	178.3	-160.9	0	0	0	0	112.4	Q18 C26	Q18-C20 PolarHBondContact O-N 2.82Å; C20-C26 WeakPolarHBondContact CA-SG 3.42Å; C20-C26 HydrophobicContact CB-CB 3.86Å; C20-C26 WeakPolarHBondContact CB-SG 3.5Å; C20-C26 WeakPolarHBondContact SG-CB 3.44Å; C20-C26 PolarHBondContact SG-N 3.02Å; C20-C26 VanDerWaalsContact SG-N 3.39Å; C20-C26 CovalentContact SG-SG 2.04Å; C20-C26 PolarHBondContact SG-SG 3.14Å
21	P	92.6	Very high	73.9	Confident	12 Å²	12	98.1 Å²	98.1	8%	0.078	55%	0.547	C	S	.	.			trans	-66.9	136	175.3	-12.2	21.9	0	0	0	112.3	R23 C24 T35 P46 N48 I49	P21-R23 PolarHBondContact O-N 2.7Å; P21-C24 HydrophobicContact CB-CB 4.19Å; P21-C24 HydrophobicContact CG-CB 4.16Å; P21-C24 PolarHBondContact O-N 2.96Å; P21-T35 HydrophobicContact CG-CG2 4.4Å; P21-P46 HydrophobicContact CB-CB 3.74Å; P21-P46 HydrophobicContact CB-CG 4.27Å; P21-P46 HydrophobicContact CG-CB 3.88Å; P21-P46 HydrophobicContact CG-CG 4.4Å; P21-N48 WeakPolarHBondContact CD-O 3.38Å; P21-N48 VanDerWaalsContact CG-O 3.31Å; P21-N48 WeakPolarHBondContact CG-O 3.37Å; P21-I49 HydrophobicContact CG-CG1 3.9Å
22	K	88.8	Confident	75.4	Confident	219 Å²	219	96.4 Å²	96.4	95%	0.952	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-17.5	-174	-63.8	-171.3	178.8	-174.4	0	117.5
23	R	90.7	Very high	77.4	Confident	159 Å²	159	94.5 Å²	94.5	60%	0.6	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-9.5	178.4	-68.9	-171.4	176.9	-161.8	2.7	113.8	P21 K40 L42	P21-R23 PolarHBondContact O-N 2.7Å; R23-K40 HydrophobicContact CB-CB 4.46Å; R23-K40 PolarHBondContact NH1-O 3.48Å; R23-K40 WeakPolarHBondContact O-CD 3.4Å; R23-K40 WeakPolarHBondContact O-CE 3.44Å; R23-K40 WeakPolarHBondContact O-CG 3.49Å; R23-L42 HydrophobicContact CB-CD2 4.41Å
24	C	94.2	Very high	79.4	Confident	14 Å²	14	88.7 Å²	88.7	10%	0.095	49%	0.487	C	S	.	.	S	Bend	trans	-102.3	167.1	-174.6	-53.4	0	0	0	0	110.8	P21 L36 C37	P21-C24 HydrophobicContact CB-CB 4.19Å; P21-C24 HydrophobicContact CG-CB 4.16Å; P21-C24 PolarHBondContact O-N 2.96Å; C24-L36 WeakPolarHBondContact CA-O 3.02Å; C24-L36 WeakPolarHBondContact CB-O 3.46Å; C24-C37 HydrophobicContact CB-CB 4.04Å; C24-C37 WeakPolarHBondContact CB-SG 3.3Å; C24-C37 WeakPolarHBondContact SG-CA 3.49Å; C24-C37 WeakPolarHBondContact SG-CB 3.21Å; C24-C37 CovalentContact SG-SG 2.03Å; C24-C37 PolarHBondContact SG-SG 2.8Å
25	V	93.4	Very high	81.8	Confident	73 Å²	73	84.8 Å²	84.8	44%	0.442	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.9	172.7	179.8	0	0	0	0	107.4	Q27 L36	V25-Q27 HydrophobicContact CG1-CG 4.21Å; V25-L36 PolarHBondContact N-O 2.77Å; V25-L36 WeakPolarHBondContact O-CA 3.47Å; V25-L36 VanDerWaalsContact O-CB 3.31Å; V25-L36 WeakPolarHBondContact O-CB 3.02Å; V25-L36 PolarHBondContact O-N 3.35Å
26	C	92.6	Very high	84	Confident	38 Å²	38	81.6 Å²	81.6	26%	0.257	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.3	177.1	-54.3	0	0	0	0	109.2	C20 A34	C20-C26 WeakPolarHBondContact CA-SG 3.42Å; C20-C26 HydrophobicContact CB-CB 3.86Å; C20-C26 WeakPolarHBondContact CB-SG 3.5Å; C20-C26 WeakPolarHBondContact SG-CB 3.44Å; C20-C26 PolarHBondContact SG-N 3.02Å; C20-C26 VanDerWaalsContact SG-N 3.39Å; C20-C26 CovalentContact SG-SG 2.04Å; C20-C26 PolarHBondContact SG-SG 3.14Å; C26-A34 CarbonylContact C-O 3.58Å; C26-A34 VanDerWaalsContact CA-O 3.32Å; C26-A34 WeakPolarHBondContact CA-O 3.49Å
27	Q	90.6	Very high	86.1	Confident	94 Å²	94	73 Å²	73	44%	0.439	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	143.3	-176.1	-66.5	-175	-18.8	0	0	110.3	V25 A34 L36	V25-Q27 HydrophobicContact CG1-CG 4.21Å; Q27-A34 PolarHBondContact N-O 2.89Å; Q27-A34 PolarHBondContact O-N 2.94Å; Q27-L36 HydrophobicContact CG-CD1 4.23Å
28	I	86.6	Confident	87.8	Confident	96 Å²	96	70.6 Å²	70.6	49%	0.492	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	94.1	-177.8	-56	149.2	0	0	0	107.5	Q18 N32 L33	Q18-I28 VanDerWaalsContact OE1-CD1 3.3Å; I28-N32 WeakPolarHBondContact CA-O 3.32Å; I28-L33 HydrophobicContact CG1-CD1 3.87Å
29	L	76.8	Confident	89.1	Confident	132 Å²	132	72.7 Å²	72.7	69%	0.691	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	86.7	167.1	-90.3	67	0	0	0	106.2	N32	L29-N32 CarbonylContact C-O 3.55Å; L29-N32 PolarHBondContact N-O 2.02Å; L29-N32 WeakPolarHBondContact O-CA 3.37Å; L29-N32 PolarHBondContact O-N 2.8Å
30	S	72.5	Confident	89.7	Confident	112 Å²	112	72.2 Å²	72.2	78%	0.783	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	125.3	-171.4	-169	0	0	0	0	111.7
31	P	74.9	Confident	90	Very high	98 Å²	98	71.1 Å²	71.1	64%	0.636	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	cis	-93.5	6.3	14.6	37.8	-37.7	0	0	0	115.9
32	N	85.4	Confident	90.1	Very high	72 Å²	72	71.3 Å²	71.3	39%	0.385	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	140	-170.6	-66.9	-14.6	0	0	0	112.9	I28 L29 V54	I28-N32 WeakPolarHBondContact CA-O 3.32Å; L29-N32 CarbonylContact C-O 3.55Å; L29-N32 PolarHBondContact N-O 2.02Å; L29-N32 WeakPolarHBondContact O-CA 3.37Å; L29-N32 PolarHBondContact O-N 2.8Å; N32-V54 HydrophobicContact CB-CB 4.27Å; N32-V54 HydrophobicContact CB-CG1 4.48Å; N32-V54 HydrophobicContact CB-CG2 4.32Å
33	L	90.2	Very high	90.4	Very high	16 Å²	16	66.3 Å²	66.3	8%	0.084	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.8	171.8	175	64	0	0	0	108.9	I28 D50 T53 V54 E55	I28-L33 HydrophobicContact CG1-CD1 3.87Å; L33-D50 HydrophobicContact CD2-CB 3.8Å; L33-T53 CarbonylContact O-C 3.52Å; L33-T53 WeakPolarHBondContact O-CA 3.3Å; L33-V54 PolarHBondContact O-N 3.03Å; L33-E55 PolarHBondContact O-N 3.12Å
34	A	93.6	Very high	90.6	Very high	11 Å²	11	64.7 Å²	64.7	9%	0.091	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.2	176.9	0	0	0	0	0	110.5	C26 Q27 L36 E55	C26-A34 CarbonylContact C-O 3.58Å; C26-A34 VanDerWaalsContact CA-O 3.32Å; C26-A34 WeakPolarHBondContact CA-O 3.49Å; Q27-A34 PolarHBondContact N-O 2.89Å; Q27-A34 PolarHBondContact O-N 2.94Å; A34-L36 HydrophobicContact CB-CD2 4.42Å; A34-E55 CarbonylContact C-O 3.6Å; A34-E55 WeakPolarHBondContact CA-O 3.01Å; A34-E55 HydrophobicContact CB-CB 4.07Å; A34-E55 HydrophobicContact CB-CG 4.48Å; A34-E55 WeakPolarHBondContact CB-OE2 3.27Å
35	T	94.6	Very high	90.7	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	107.8	177.3	-66.6	0	0	0	0	109.5	P21 I49 T53 E55 L56 R57	P21-T35 HydrophobicContact CG-CG2 4.4Å; T35-I49 HydrophobicContact CG2-CG2 4.45Å; T35-T53 PolarHBondContact OG1-OG1 2.95Å; T35-T53 VanDerWaalsContact OG1-OG1 3.08Å; T35-E55 PolarHBondContact N-O 2.89Å; T35-L56 HydrophobicContact CG2-CD1 3.72Å; T35-R57 PolarHBondContact O-N 3.06Å
36	L	95.8	Very high	90.7	Very high	40 Å²	40	61.4 Å²	61.4	21%	0.209	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	99.5	-172.1	-52.1	179.9	0	0	0	110.7	C24 V25 Q27 A34 R57	C24-L36 WeakPolarHBondContact CA-O 3.02Å; C24-L36 WeakPolarHBondContact CB-O 3.46Å; V25-L36 PolarHBondContact N-O 2.77Å; V25-L36 WeakPolarHBondContact O-CA 3.47Å; V25-L36 VanDerWaalsContact O-CB 3.31Å; V25-L36 WeakPolarHBondContact O-CB 3.02Å; V25-L36 PolarHBondContact O-N 3.35Å; Q27-L36 HydrophobicContact CG-CD1 4.23Å; A34-L36 HydrophobicContact CB-CD2 4.42Å; L36-R57 HydrophobicContact CD2-CB 4.11Å; L36-R57 HydrophobicContact CD2-CG 3.91Å
37	C	96	Very high	90.6	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.353	C	S	.	.			trans	-110.1	13.7	-178.3	-68.1	0	0	0	0	113.3	C24 K40 L42 R57 L58 N61	C24-C37 HydrophobicContact CB-CB 4.04Å; C24-C37 WeakPolarHBondContact CB-SG 3.3Å; C24-C37 WeakPolarHBondContact SG-CA 3.49Å; C24-C37 WeakPolarHBondContact SG-CB 3.21Å; C24-C37 CovalentContact SG-SG 2.03Å; C24-C37 PolarHBondContact SG-SG 2.8Å; C37-K40 VanDerWaalsContact O-CG 3.27Å; C37-K40 WeakPolarHBondContact O-CG 3.14Å; C37-L42 HydrophobicContact CB-CD1 3.87Å; C37-R57 CarbonylContact C-O 3.55Å; C37-R57 VanDerWaalsContact CA-O 3.29Å; C37-R57 WeakPolarHBondContact CA-O 3.3Å; C37-R57 WeakPolarHBondContact CB-O 3.32Å; C37-R57 PolarHBondContact N-O 3.2Å; C37-L58 HydrophobicContact CB-CD2 3.51Å; C37-L58 HydrophobicContact CB-CG 4.22Å; C37-N61 PolarHBondContact O-ND2 3.31Å
38	A	94.9	Very high	90.6	Very high	36 Å²	36	64.2 Å²	64.2	30%	0.298	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	144.8	-174.7	0	0	0	0	0	113.5	K40 R57 A59	A38-K40 WeakPolarHBondContact O-CG 3.16Å; A38-K40 PolarHBondContact O-N 3.47Å; A38-R57 PolarHBondContact N-O 2.03Å; A38-A59 WeakPolarHBondContact CA-O 3.39Å; A38-A59 WeakPolarHBondContact CB-O 3.23Å
39	K	95.8	Very high	90.8	Very high	158 Å²	158	60 Å²	60	69%	0.687	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	41.5	179.6	-61.5	-178	179.2	-178.3	0	113.6	A59 D60	K39-A59 PolarHBondContact N-O 3.31Å; K39-D60 VanDerWaalsContact CA-O 3.28Å; K39-D60 WeakPolarHBondContact CA-O 3.34Å; K39-D60 HydrophobicContact CB-CB 4.38Å; K39-D60 HydrophobicContact CD-CB 4.33Å; K39-D60 WeakPolarHBondContact CE-OD2 3.25Å; K39-D60 HydrophobicContact CG-CB 3.36Å; K39-D60 PolarHBondContact N-O 3.17Å
40	K	95.3	Very high	91.6	Very high	81 Å²	81	54.7 Å²	54.7	35%	0.352	31%	0.309	S	S	.	.	S	Bend	trans	-111.9	4	-176	-59.9	-54.4	-178.3	177.2	0	115	R23 C37 A38 L42 N61	R23-K40 HydrophobicContact CB-CB 4.46Å; R23-K40 PolarHBondContact NH1-O 3.48Å; R23-K40 WeakPolarHBondContact O-CD 3.4Å; R23-K40 WeakPolarHBondContact O-CE 3.44Å; R23-K40 WeakPolarHBondContact O-CG 3.49Å; C37-K40 VanDerWaalsContact O-CG 3.27Å; C37-K40 WeakPolarHBondContact O-CG 3.14Å; A38-K40 WeakPolarHBondContact O-CG 3.16Å; A38-K40 PolarHBondContact O-N 3.47Å; K40-L42 VanDerWaalsContact C-N 3.31Å; K40-L42 HydrophobicContact CB-CD1 4.2Å; K40-L42 HydrophobicContact CB-CD2 4.31Å; K40-L42 HydrophobicContact CB-CG 3.9Å; K40-L42 PolarHBondContact O-N 2.85Å; K40-N61 PolarHBondContact N-OD1 3.09Å; K40-N61 VanDerWaalsContact N-OD1 3.12Å
41	G	95.1	Very high	92.5	Very high	32 Å²	32	53 Å²	53	33%	0.33	29%	0.285	S	S	.	.			trans	60.9	38.3	179.7	0	0	0	0	0	112.9	N61	G41-N61 PolarHBondContact N-OD1 2.8Å
42	L	95.5	Very high	93.3	Very high	16 Å²	16	53.4 Å²	53.4	8%	0.084	28%	0.278	C	S	.	.			trans	-79.6	127.7	-178.2	-59.6	172.4	0	0	0	110.6	R23 C37 K40 P46 L58 N61 F62 V63	R23-L42 HydrophobicContact CB-CD2 4.41Å; C37-L42 HydrophobicContact CB-CD1 3.87Å; K40-L42 VanDerWaalsContact C-N 3.31Å; K40-L42 HydrophobicContact CB-CD1 4.2Å; K40-L42 HydrophobicContact CB-CD2 4.31Å; K40-L42 HydrophobicContact CB-CG 3.9Å; K40-L42 PolarHBondContact O-N 2.85Å; L42-P46 HydrophobicContact CD1-CG 3.86Å; L42-L58 HydrophobicContact CD1-CD2 3.88Å; L42-N61 HydrophobicContact CB-CB 4.19Å; L42-N61 PolarHBondContact N-OD1 3.14Å; L42-F62 CarbonylContact O-C 3.54Å; L42-F62 WeakPolarHBondContact O-CA 3.34Å; L42-F62 PolarHBondContact O-N 3.03Å; L42-V63 PolarHBondContact O-N 2.91Å
43	L	94.8	Very high	93.6	Very high	114 Å²	114	50 Å²	50	60%	0.597	26%	0.26	S	S	*	.	S	Bend	trans	-86	-13.2	176.1	-62.5	170.5	0	0	0	113	F62	L43-F62 HydrophobicContact CD2-CB 4.04Å
44	F	95.3	Very high	93.8	Very high	126 Å²	126	49.4 Å²	49.4	55%	0.553	26%	0.257	S	S	*	.	S	Bend	trans	-155.8	157	-177.3	50.8	-93.6	0	0	0	109.9
45	A	94.8	Very high	93.9	Very high	5 Å²	5	51 Å²	51	4%	0.041	26%	0.263	C	S	.	.			trans	-60.6	129.2	173.1	0	0	0	0	0	110.4	D70 F71	A45-D70 HydrophobicContact CB-CB 3.84Å; A45-F71 HydrophobicContact CB-CZ 4.46Å
46	P	94.1	Very high	94	Very high	12 Å²	12	51 Å²	51	8%	0.078	26%	0.263	C	S	.	.			trans	-59.7	132	-178.8	-25.2	33.6	0	0	0	112.2	P21 L42 N48 I49 L58	P21-P46 HydrophobicContact CB-CB 3.74Å; P21-P46 HydrophobicContact CB-CG 4.27Å; P21-P46 HydrophobicContact CG-CB 3.88Å; P21-P46 HydrophobicContact CG-CG 4.4Å; L42-P46 HydrophobicContact CD1-CG 3.86Å; P46-N48 VanDerWaalsContact C-N 3.28Å; P46-N48 PolarHBondContact O-N 2.82Å; P46-I49 HydrophobicContact CB-CD1 4.34Å; P46-I49 HydrophobicContact CB-CG1 4.2Å; P46-I49 VanDerWaalsContact O-CD1 3.26Å; P46-I49 WeakPolarHBondContact O-CD1 3.03Å; P46-I49 WeakPolarHBondContact O-CG1 3.43Å; P46-L58 HydrophobicContact CG-CD2 4.4Å
47	P	89.9	Confident	94.1	Very high	89 Å²	89	55 Å²	55	58%	0.578	28%	0.275	S	S	*	.	S	Bend	trans	-72.6	-20.5	-176.8	27.3	-34.5	0	0	0	113.8
48	N	90.1	Very high	94.1	Very high	103 Å²	103	55 Å²	55	55%	0.551	28%	0.275	S	S	*	.			trans	-106.6	63.3	-173.2	-61.7	21.6	0	0	0	110.2	I19 P21 P46	I19-N48 HydrophobicContact CG2-CB 4.08Å; P21-N48 WeakPolarHBondContact CD-O 3.38Å; P21-N48 VanDerWaalsContact CG-O 3.31Å; P21-N48 WeakPolarHBondContact CG-O 3.37Å; P46-N48 VanDerWaalsContact C-N 3.28Å; P46-N48 PolarHBondContact O-N 2.82Å
49	I	92.3	Very high	94.2	Very high	7 Å²	7	53.7 Å²	53.7	4%	0.036	26%	0.264	C	S	.	.			trans	-104	132.6	174.1	-63.4	165.9	0	0	0	108.5	P21 T35 P46 R51 L56 M74	P21-I49 HydrophobicContact CG-CG1 3.9Å; T35-I49 HydrophobicContact CG2-CG2 4.45Å; P46-I49 HydrophobicContact CB-CD1 4.34Å; P46-I49 HydrophobicContact CB-CG1 4.2Å; P46-I49 VanDerWaalsContact O-CD1 3.26Å; P46-I49 WeakPolarHBondContact O-CD1 3.03Å; P46-I49 WeakPolarHBondContact O-CG1 3.43Å; I49-R51 PolarHBondContact O-N 2.93Å; I49-L56 HydrophobicContact CD1-CD1 4.16Å; I49-L56 HydrophobicContact CD1-CD2 4.04Å; I49-M74 HydrophobicContact CG2-CE 3.75Å; I49-M74 HydrophobicContact CG2-SD 4.32Å
50	D	91.8	Very high	94.3	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.107	24%	0.243	C	C	.	.			trans	-62.5	125.1	173.4	-162.1	-41.3	0	0	0	111.2	I19 L33 H52 T53	I19-D50 HydrophobicContact CB-CB 4.25Å; I19-D50 PolarHBondContact O-N 3.26Å; I19-D50 VanDerWaalsContact O-N 3.16Å; L33-D50 HydrophobicContact CD2-CB 3.8Å; D50-H52 PolarHBondContact O-N 3.23Å; D50-H52 IonicContact OD1-CE1 2.72Å; D50-H52 IonicContact OD1-CG 3.33Å; D50-H52 PolarHBondContact OD1-N 3.43Å; D50-H52 IonicContact OD1-ND1 3.48Å; D50-H52 PolarHBondContact OD1-ND1 2.99Å; D50-T53 VanDerWaalsContact O-CB 3.23Å; D50-T53 WeakPolarHBondContact O-CB 3.34Å; D50-T53 PolarHBondContact O-N 2.96Å; D50-T53 VanDerWaalsContact O-N 3.08Å; D50-T53 PolarHBondContact O-OG1 3.18Å
51	R	92.3	Very high	94.4	Very high	76 Å²	76	44.7 Å²	44.7	29%	0.287	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-10.6	-176.9	-55.6	-54.8	-174.8	-178.5	6.4	113.6	I49 T53 K69 D70 A72 M74	I49-R51 PolarHBondContact O-N 2.93Å; R51-T53 VanDerWaalsContact C-N 3.3Å; R51-K69 PolarHBondContact NH2-O 3.25Å; R51-K69 VanDerWaalsContact NH2-O 3.11Å; R51-D70 PolarHBondContact NH1-O 2.95Å; R51-A72 WeakPolarHBondContact CD-O 3.42Å; R51-A72 PolarHBondContact NE-O 2.73Å; R51-A72 PolarHBondContact NH1-O 3.42Å; R51-M74 PolarHBondContact NH1-SD 3.2Å
52	H	91.1	Very high	94.5	Very high	107 Å²	107	49 Å²	49	50%	0.495	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	1	171.2	-50	88.5	0	0	0	113.5	D50 V54	D50-H52 PolarHBondContact O-N 3.23Å; D50-H52 IonicContact OD1-CE1 2.72Å; D50-H52 IonicContact OD1-CG 3.33Å; D50-H52 PolarHBondContact OD1-N 3.43Å; D50-H52 IonicContact OD1-ND1 3.48Å; D50-H52 PolarHBondContact OD1-ND1 2.99Å; H52-V54 PolarHBondContact O-N 3.25Å
53	T	92.5	Very high	94.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.234	C	C	.	.			trans	-56.5	129.3	175.1	-63.9	0	0	0	0	110.7	L33 T35 D50 R51 E55 L56 M74 L77	L33-T53 CarbonylContact O-C 3.52Å; L33-T53 WeakPolarHBondContact O-CA 3.3Å; T35-T53 PolarHBondContact OG1-OG1 2.95Å; T35-T53 VanDerWaalsContact OG1-OG1 3.08Å; D50-T53 VanDerWaalsContact O-CB 3.23Å; D50-T53 WeakPolarHBondContact O-CB 3.34Å; D50-T53 PolarHBondContact O-N 2.96Å; D50-T53 VanDerWaalsContact O-N 3.08Å; D50-T53 PolarHBondContact O-OG1 3.18Å; R51-T53 VanDerWaalsContact C-N 3.3Å; T53-E55 WeakPolarHBondContact CG2-O 3.48Å; T53-L56 HydrophobicContact CG2-CB 4.18Å; T53-M74 HydrophobicContact CG2-CE 4.34Å; T53-L77 HydrophobicContact CG2-CD1 4.12Å; T53-L77 WeakPolarHBondContact O-CA 3.18Å; T53-L77 PolarHBondContact O-N 3.08Å
54	V	95	Very high	94.7	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.03	23%	0.227	C	C	.	.	S	Bend	trans	-95	-31.6	177.2	179.5	0	0	0	0	111.4	N32 L33 H52 Q78 D79	N32-V54 HydrophobicContact CB-CB 4.27Å; N32-V54 HydrophobicContact CB-CG1 4.48Å; N32-V54 HydrophobicContact CB-CG2 4.32Å; L33-V54 PolarHBondContact O-N 3.03Å; H52-V54 PolarHBondContact O-N 3.25Å; V54-Q78 HydrophobicContact CG1-CB 4.16Å; V54-Q78 HydrophobicContact CG1-CG 4.26Å; V54-Q78 VanDerWaalsContact CG1-NE2 3.34Å; V54-Q78 PolarHBondContact O-N 3.33Å; V54-D79 PolarHBondContact O-N 3.24Å
55	E	95.5	Very high	94.7	Very high	45 Å²	45	42 Å²	42	21%	0.21	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.6	179.8	176	-175.9	-157	0	0	110.3	L33 A34 T35 T53 R57 D79	L33-E55 PolarHBondContact O-N 3.12Å; A34-E55 CarbonylContact C-O 3.6Å; A34-E55 WeakPolarHBondContact CA-O 3.01Å; A34-E55 HydrophobicContact CB-CB 4.07Å; A34-E55 HydrophobicContact CB-CG 4.48Å; A34-E55 WeakPolarHBondContact CB-OE2 3.27Å; T35-E55 PolarHBondContact N-O 2.89Å; T53-E55 WeakPolarHBondContact CG2-O 3.48Å; E55-R57 HydrophobicContact CG-CG 4.28Å; E55-R57 IonicContact OE1-CZ 3Å; E55-R57 IonicContact OE1-NE 2.69Å; E55-R57 PolarHBondContact OE1-NE 3.36Å; E55-R57 IonicContact OE1-NH2 2.73Å; E55-R57 PolarHBondContact OE1-NH2 2.93Å; E55-D79 HydrophobicContact CG-CB 4.31Å
56	L	96.3	Very high	94.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	104.7	180	179	57	0	0	0	111.3	T35 I49 T53 L58 F71 M74 L77 D79 L80 T81	T35-L56 HydrophobicContact CG2-CD1 3.72Å; I49-L56 HydrophobicContact CD1-CD1 4.16Å; I49-L56 HydrophobicContact CD1-CD2 4.04Å; T53-L56 HydrophobicContact CG2-CB 4.18Å; L56-L58 HydrophobicContact CD1-CD1 4.18Å; L56-L58 HydrophobicContact CD1-CG 4.12Å; L56-L58 HydrophobicContact CD2-CD1 3.9Å; L56-L58 HydrophobicContact CG-CD1 3.93Å; L56-L58 HydrophobicContact CG-CG 4.2Å; L56-F71 HydrophobicContact CD2-CD1 3.93Å; L56-F71 HydrophobicContact CD2-CE1 3.7Å; L56-M74 HydrophobicContact CD2-CE 4.18Å; L56-M74 HydrophobicContact CD2-SD 4.46Å; L56-L77 HydrophobicContact CB-CD1 3.69Å; L56-D79 PolarHBondContact N-O 2.93Å; L56-L80 HydrophobicContact CB-CD1 4.09Å; L56-L80 HydrophobicContact CD2-CD1 3.93Å; L56-L80 HydrophobicContact CG-CD1 4Å; L56-T81 PolarHBondContact O-N 3.44Å
57	R	97.1	Very high	94.9	Very high	123 Å²	123	45.9 Å²	45.9	46%	0.464	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	102.3	177.6	-59.3	-162.8	-170.4	-163.6	1	111.3	T35 L36 C37 A38 E55	T35-R57 PolarHBondContact O-N 3.06Å; L36-R57 HydrophobicContact CD2-CB 4.11Å; L36-R57 HydrophobicContact CD2-CG 3.91Å; C37-R57 CarbonylContact C-O 3.55Å; C37-R57 VanDerWaalsContact CA-O 3.29Å; C37-R57 WeakPolarHBondContact CA-O 3.3Å; C37-R57 WeakPolarHBondContact CB-O 3.32Å; C37-R57 PolarHBondContact N-O 3.2Å; A38-R57 PolarHBondContact N-O 2.03Å; E55-R57 HydrophobicContact CG-CG 4.28Å; E55-R57 IonicContact OE1-CZ 3Å; E55-R57 IonicContact OE1-NE 2.69Å; E55-R57 PolarHBondContact OE1-NE 3.36Å; E55-R57 IonicContact OE1-NH2 2.73Å; E55-R57 PolarHBondContact OE1-NH2 2.93Å
58	L	96.8	Very high	95.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.214	C	C	.	.			trans	-106.4	12.5	175.4	-79.4	163.2	0	0	0	113.2	C37 L42 P46 L56 N61 F71 T81 L82 N85	C37-L58 HydrophobicContact CB-CD2 3.51Å; C37-L58 HydrophobicContact CB-CG 4.22Å; L42-L58 HydrophobicContact CD1-CD2 3.88Å; P46-L58 HydrophobicContact CG-CD2 4.4Å; L56-L58 HydrophobicContact CD1-CD1 4.18Å; L56-L58 HydrophobicContact CD1-CG 4.12Å; L56-L58 HydrophobicContact CD2-CD1 3.9Å; L56-L58 HydrophobicContact CG-CD1 3.93Å; L56-L58 HydrophobicContact CG-CG 4.2Å; L58-N61 PolarHBondContact O-ND2 2.97Å; L58-F71 HydrophobicContact CD1-CE1 3.85Å; L58-F71 HydrophobicContact CD1-CZ 4.08Å; L58-T81 CarbonylContact C-O 3.46Å; L58-T81 WeakPolarHBondContact CA-O 3.11Å; L58-T81 PolarHBondContact N-O 3.4Å; L58-L82 HydrophobicContact CB-CD2 3.75Å; L58-L82 HydrophobicContact CD1-CD2 3.93Å; L58-L82 HydrophobicContact CG-CD2 4.5Å; L58-N85 PolarHBondContact O-ND2 2.98Å
59	A	96.8	Very high	95.3	Very high	8 Å²	8	47.9 Å²	47.9	7%	0.066	22%	0.219	C	C	.	.			trans	-63.1	158.9	-177.7	0	0	0	0	0	114.6	A38 K39 N61 T81 S83	A38-A59 WeakPolarHBondContact CA-O 3.39Å; A38-A59 WeakPolarHBondContact CB-O 3.23Å; K39-A59 PolarHBondContact N-O 3.31Å; A59-N61 PolarHBondContact O-ND2 3.02Å; A59-N61 VanDerWaalsContact O-ND2 3.16Å; A59-T81 HydrophobicContact CB-CG2 4.01Å; A59-T81 PolarHBondContact N-O 2.81Å; A59-S83 CarbonylContact C-O 3.54Å; A59-S83 WeakPolarHBondContact CA-O 3.24Å; A59-S83 WeakPolarHBondContact CB-O 3.47Å
60	D	97.7	Very high	95.4	Very high	47 Å²	47	48.2 Å²	48.2	25%	0.251	22%	0.221	S	C	.	.	S	Bend	trans	55.3	57.4	-179.9	-58	-79.3	0	0	0	112.5	K39 S83 R84	K39-D60 VanDerWaalsContact CA-O 3.28Å; K39-D60 WeakPolarHBondContact CA-O 3.34Å; K39-D60 HydrophobicContact CB-CB 4.38Å; K39-D60 HydrophobicContact CD-CB 4.33Å; K39-D60 WeakPolarHBondContact CE-OD2 3.25Å; K39-D60 HydrophobicContact CG-CB 3.36Å; K39-D60 PolarHBondContact N-O 3.17Å; D60-S83 PolarHBondContact N-O 3.25Å; D60-R84 VanDerWaalsContact CA-O 3.28Å; D60-R84 WeakPolarHBondContact CA-O 3.32Å; D60-R84 PolarHBondContact N-O 3.21Å; D60-R84 IonicContact OD1-CZ 3.31Å; D60-R84 IonicContact OD1-NE 3.31Å; D60-R84 PolarHBondContact OD1-NE 3.26Å; D60-R84 IonicContact OD1-NH2 3.17Å; D60-R84 PolarHBondContact OD1-NH2 2.91Å; D60-R84 IonicContact OD2-CZ 3.31Å; D60-R84 IonicContact OD2-NE 2.95Å; D60-R84 IonicContact OD2-NH2 3.01Å; D60-R84 PolarHBondContact OD2-NH2 2.79Å
61	N	97.6	Very high	95.6	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	22%	0.216	C	C	.	.	S	Bend	trans	-137.6	-171	178.7	-78.8	-64.9	0	0	0	110.1	C37 K40 G41 L42 L58 A59 V63 R84 N85	C37-N61 PolarHBondContact O-ND2 3.31Å; K40-N61 PolarHBondContact N-OD1 3.09Å; K40-N61 VanDerWaalsContact N-OD1 3.12Å; G41-N61 PolarHBondContact N-OD1 2.8Å; L42-N61 HydrophobicContact CB-CB 4.19Å; L42-N61 PolarHBondContact N-OD1 3.14Å; L58-N61 PolarHBondContact O-ND2 2.97Å; A59-N61 PolarHBondContact O-ND2 3.02Å; A59-N61 VanDerWaalsContact O-ND2 3.16Å; N61-V63 HydrophobicContact CB-CG2 4.43Å; N61-R84 PolarHBondContact N-O 3.18Å; N61-N85 WeakPolarHBondContact CA-OD1 3.48Å; N61-N85 WeakPolarHBondContact CB-OD1 3.35Å; N61-N85 WeakPolarHBondContact O-CA 3.46Å; N61-N85 PolarHBondContact O-OD1 3.25Å
62	F	97.6	Very high	95.7	Very high	123 Å²	123	44.6 Å²	44.6	54%	0.539	21%	0.209	S	C	.	.			trans	-122.1	35.3	-176.8	-55.6	-62.1	0	0	0	111.2	L42 L43 T64 N85 T86	L42-F62 CarbonylContact O-C 3.54Å; L42-F62 WeakPolarHBondContact O-CA 3.34Å; L42-F62 PolarHBondContact O-N 3.03Å; L43-F62 HydrophobicContact CD2-CB 4.04Å; F62-T64 PolarHBondContact O-N 2.82Å; F62-N85 PolarHBondContact N-OD1 2.82Å; F62-T86 VanDerWaalsContact C-OG1 3.3Å; F62-T86 PolarHBondContact O-OG1 2.83Å
63	V	97.4	Very high	95.8	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	22%	0.215	C	C	.	.			trans	-68.2	126.4	177	-178.4	0	0	0	0	108.5	L42 N61 I66 N85 T86 I87	L42-V63 PolarHBondContact O-N 2.91Å; N61-V63 HydrophobicContact CB-CG2 4.43Å; V63-I66 HydrophobicContact CG1-CD1 3.87Å; V63-N85 WeakPolarHBondContact CB-OD1 3.33Å; V63-N85 WeakPolarHBondContact CG2-OD1 3.3Å; V63-N85 PolarHBondContact N-OD1 2.81Å; V63-T86 CarbonylContact O-C 3.24Å; V63-T86 WeakPolarHBondContact O-CA 3.32Å; V63-T86 PolarHBondContact O-N 3.18Å; V63-T86 PolarHBondContact O-OG1 3.37Å; V63-I87 HydrophobicContact CB-CG1 4.31Å; V63-I87 HydrophobicContact CG1-CG1 4.21Å; V63-I87 WeakPolarHBondContact O-CG1 2.99Å; V63-I87 PolarHBondContact O-N 3.36Å
64	T	96.1	Very high	95.9	Very high	73 Å²	73	44.9 Å²	44.9	45%	0.448	22%	0.215	S	C	.	.			trans	-100.3	-25.4	-176.4	55.1	0	0	0	0	113.9	F62 I87 S88	F62-T64 PolarHBondContact O-N 2.82Å; T64-I87 WeakPolarHBondContact O-CA 3.17Å; T64-S88 PolarHBondContact O-N 3.17Å
65	S	96.5	Very high	95.7	Very high	33 Å²	33	47.7 Å²	47.7	23%	0.231	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	145.9	-177.6	50.9	0	0	0	0	111.7	F89	S65-F89 VanDerWaalsContact CA-O 3.27Å; S65-F89 WeakPolarHBondContact CA-O 3.39Å
66	I	96.9	Very high	95.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.2	174.7	-58.5	-55.1	0	0	0	109.7	V63 F71 L82 I87 F89 I90 T91 A94 F95	V63-I66 HydrophobicContact CG1-CD1 3.87Å; I66-F71 HydrophobicContact CD1-CE2 3.99Å; I66-F71 HydrophobicContact CD1-CZ 4.17Å; I66-F71 HydrophobicContact CG1-CE2 4.4Å; I66-F71 HydrophobicContact CG2-CD2 3.85Å; I66-F71 HydrophobicContact CG2-CE2 3.49Å; I66-F71 VanDerWaalsContact CG2-CE2 3.49Å; I66-L82 HydrophobicContact CD1-CD1 4.25Å; I66-L82 HydrophobicContact CD1-CD2 4.21Å; I66-L82 HydrophobicContact CG1-CD1 4.49Å; I66-I87 HydrophobicContact CD1-CD1 3.95Å; I66-I87 HydrophobicContact CD1-CG1 4.48Å; I66-I87 HydrophobicContact CG1-CD1 4.06Å; I66-I87 HydrophobicContact CG1-CG2 4.09Å; I66-F89 PolarHBondContact N-O 3.13Å; I66-I90 HydrophobicContact CB-CG1 4.3Å; I66-I90 HydrophobicContact CB-CG2 4.28Å; I66-I90 HydrophobicContact CG1-CG1 4.31Å; I66-I90 HydrophobicContact CG2-CG2 4.44Å; I66-T91 WeakPolarHBondContact O-CB 3.07Å; I66-T91 PolarHBondContact O-N 2.72Å; I66-T91 PolarHBondContact O-OG1 2.63Å; I66-A94 HydrophobicContact CG2-CB 3.95Å; I66-F95 HydrophobicContact CG2-CE1 4.29Å
67	K	95.4	Very high	95.5	Very high	100 Å²	100	50.8 Å²	50.8	44%	0.435	24%	0.242	S	C	.	.			trans	-109.5	147	-176.6	-56.4	170.8	-174.9	175	0	110.5	K69 D70 T91	K67-K69 HydrophobicContact CB-CG 4.42Å; K67-K69 PolarHBondContact O-N 3.34Å; K67-D70 WeakPolarHBondContact CB-OD2 3.49Å; K67-D70 PolarHBondContact N-OD2 3.48Å; K67-D70 WeakPolarHBondContact O-CB 3.44Å; K67-D70 PolarHBondContact O-N 2.89Å; K67-T91 WeakPolarHBondContact CA-OG1 3.3Å
68	R	93.8	Very high	95.5	Very high	86 Å²	86	47.3 Å²	47.3	33%	0.325	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-29.3	-176.7	-179.5	59.5	-177.6	95.1	-9.9	115	T91 H93 D97	R68-T91 HydrophobicContact CB-CG2 4.22Å; R68-H93 WeakPolarHBondContact CD-O 3.29Å; R68-H93 PolarHBondContact NE-O 3.02Å; R68-D97 IonicContact CZ-OD1 2.72Å; R68-D97 IonicContact CZ-OD2 3.58Å; R68-D97 IonicContact NH1-OD1 3.26Å; R68-D97 IonicContact NH1-OD2 3.6Å; R68-D97 PolarHBondContact NH1-OD2 2.99Å; R68-D97 VanDerWaalsContact NH2-CG 3.34Å; R68-D97 IonicContact NH2-OD1 2.63Å; R68-D97 PolarHBondContact NH2-OD1 3.31Å; R68-D97 IonicContact NH2-OD2 2.7Å; R68-D97 PolarHBondContact NH2-OD2 3.17Å
69	K	94.3	Very high	95.5	Very high	148 Å²	148	50 Å²	50	64%	0.643	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-15.4	-179.9	68.8	176	-174.5	173.5	0	115	R51 K67	R51-K69 PolarHBondContact NH2-O 3.25Å; R51-K69 VanDerWaalsContact NH2-O 3.11Å; K67-K69 HydrophobicContact CB-CG 4.42Å; K67-K69 PolarHBondContact O-N 3.34Å
70	D	95.5	Very high	95.5	Very high	14 Å²	14	49.6 Å²	49.6	8%	0.075	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-46.9	-169.6	-60.8	-15	0	0	0	109.8	A45 R51 K67	A45-D70 HydrophobicContact CB-CB 3.84Å; R51-D70 PolarHBondContact NH1-O 2.95Å; K67-D70 WeakPolarHBondContact CB-OD2 3.49Å; K67-D70 PolarHBondContact N-OD2 3.48Å; K67-D70 WeakPolarHBondContact O-CB 3.44Å; K67-D70 PolarHBondContact O-N 2.89Å
71	F	95.2	Very high	95.5	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	24%	0.237	C	C	.	.	S	Bend	trans	-103.8	13.4	176.2	-49.9	-52.4	0	0	0	114	A45 L56 L58 I66 M74 L80 L82 F95 L98	A45-F71 HydrophobicContact CB-CZ 4.46Å; L56-F71 HydrophobicContact CD2-CD1 3.93Å; L56-F71 HydrophobicContact CD2-CE1 3.7Å; L58-F71 HydrophobicContact CD1-CE1 3.85Å; L58-F71 HydrophobicContact CD1-CZ 4.08Å; I66-F71 HydrophobicContact CD1-CE2 3.99Å; I66-F71 HydrophobicContact CD1-CZ 4.17Å; I66-F71 HydrophobicContact CG1-CE2 4.4Å; I66-F71 HydrophobicContact CG2-CD2 3.85Å; I66-F71 HydrophobicContact CG2-CE2 3.49Å; I66-F71 VanDerWaalsContact CG2-CE2 3.49Å; F71-M74 HydrophobicContact CB-SD 4.44Å; F71-M74 HydrophobicContact CD1-SD 4.27Å; F71-M74 WeakPolarHBondContact O-CB 3.39Å; F71-M74 WeakPolarHBondContact O-CG 3.42Å; F71-M74 PolarHBondContact O-N 3.35Å; F71-L80 HydrophobicContact CD2-CD2 4.19Å; F71-L80 HydrophobicContact CE1-CD1 4.16Å; F71-L80 HydrophobicContact CE2-CD2 4.17Å; F71-L80 HydrophobicContact CG-CD2 4.4Å; F71-L80 HydrophobicContact CZ-CD1 4.27Å; F71-L80 HydrophobicContact CZ-CD2 4.38Å; F71-L82 HydrophobicContact CE2-CD1 4.01Å; F71-L82 HydrophobicContact CZ-CD1 4.09Å; F71-L82 HydrophobicContact CZ-CD2 4.07Å; F71-F95 AromaticContact CD2-CD1 3.94Å; F71-F95 HydrophobicContact CD2-CD1 3.94Å; F71-F95 AromaticContact CD2-CE1 3.67Å; F71-F95 HydrophobicContact CD2-CE1 3.67Å; F71-F95 AromaticContact CE2-CE1 3.81Å; F71-F95 HydrophobicContact CE2-CE1 3.81Å; F71-L98 HydrophobicContact CB-CD1 4.32Å; F71-L98 HydrophobicContact CB-CD2 4.32Å
72	A	94.2	Very high	95.5	Very high	18 Å²	18	48.4 Å²	48.4	15%	0.149	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	140.5	-178.2	0	0	0	0	0	113	R51 M74 D97	R51-A72 WeakPolarHBondContact CD-O 3.42Å; R51-A72 PolarHBondContact NE-O 2.73Å; R51-A72 PolarHBondContact NH1-O 3.42Å; A72-M74 PolarHBondContact O-N 2.69Å; A72-D97 WeakPolarHBondContact CA-OD2 3.16Å
73	N	93.7	Very high	95.6	Very high	114 Å²	114	42.9 Å²	42.9	61%	0.61	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	23.3	178.8	-56.4	2.7	0	0	0	115	T75 D97	N73-T75 VanDerWaalsContact C-N 3.25Å; N73-T75 PolarHBondContact O-N 3.29Å; N73-T75 VanDerWaalsContact O-N 3.12Å; N73-D97 PolarHBondContact N-OD2 2.84Å
74	M	93.6	Very high	95.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.234	C	C	.	.			trans	-87.1	52.2	179.8	-65.2	-168.1	66.9	0	0	113	I49 R51 T53 L56 F71 A72 R76 L77 L98	I49-M74 HydrophobicContact CG2-CE 3.75Å; I49-M74 HydrophobicContact CG2-SD 4.32Å; R51-M74 PolarHBondContact NH1-SD 3.2Å; T53-M74 HydrophobicContact CG2-CE 4.34Å; L56-M74 HydrophobicContact CD2-CE 4.18Å; L56-M74 HydrophobicContact CD2-SD 4.46Å; F71-M74 HydrophobicContact CB-SD 4.44Å; F71-M74 HydrophobicContact CD1-SD 4.27Å; F71-M74 WeakPolarHBondContact O-CB 3.39Å; F71-M74 WeakPolarHBondContact O-CG 3.42Å; F71-M74 PolarHBondContact O-N 3.35Å; A72-M74 PolarHBondContact O-N 2.69Å; M74-R76 PolarHBondContact O-N 2.99Å; M74-L77 HydrophobicContact CB-CB 4.25Å; M74-L77 HydrophobicContact CE-CD1 4.24Å; M74-L77 HydrophobicContact CE-CD2 4.36Å; M74-L77 VanDerWaalsContact O-CB 3.24Å; M74-L77 WeakPolarHBondContact O-CB 3.21Å; M74-L77 PolarHBondContact O-N 3.16Å; M74-L98 HydrophobicContact CB-CD2 3.72Å
75	T	91.9	Very high	95.7	Very high	64 Å²	64	45.5 Å²	45.5	39%	0.393	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-15.7	-169.4	60.1	0	0	0	0	115.3	N73 N100	N73-T75 VanDerWaalsContact C-N 3.25Å; N73-T75 PolarHBondContact O-N 3.29Å; N73-T75 VanDerWaalsContact O-N 3.12Å; T75-N100 PolarHBondContact O-ND2 3.24Å
76	R	92.9	Very high	95.7	Very high	109 Å²	109	45.6 Å²	45.6	41%	0.411	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-5.7	176.3	-62.4	-167	73.1	-151.7	-0.4	114.3	M74 Q78	M74-R76 PolarHBondContact O-N 2.99Å; R76-Q78 PolarHBondContact O-N 2.78Å
77	L	95.3	Very high	95.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.215	C	C	.	.			trans	-68.8	125.6	-177.1	-168.3	69.2	0	0	0	110.2	T53 L56 M74 L80 L98 N100 L101	T53-L77 HydrophobicContact CG2-CD1 4.12Å; T53-L77 WeakPolarHBondContact O-CA 3.18Å; T53-L77 PolarHBondContact O-N 3.08Å; L56-L77 HydrophobicContact CB-CD1 3.69Å; M74-L77 HydrophobicContact CB-CB 4.25Å; M74-L77 HydrophobicContact CE-CD1 4.24Å; M74-L77 HydrophobicContact CE-CD2 4.36Å; M74-L77 VanDerWaalsContact O-CB 3.24Å; M74-L77 WeakPolarHBondContact O-CB 3.21Å; M74-L77 PolarHBondContact O-N 3.16Å; L77-L80 HydrophobicContact CD2-CB 4.13Å; L77-L80 HydrophobicContact CD2-CD1 4.47Å; L77-L80 HydrophobicContact CD2-CD2 4.27Å; L77-L98 HydrophobicContact CB-CD2 4.43Å; L77-L98 HydrophobicContact CD2-CD1 4.29Å; L77-L98 HydrophobicContact CD2-CD2 4.08Å; L77-N100 CarbonylContact O-C 3.57Å; L77-N100 VanDerWaalsContact O-C 3.24Å; L77-L101 HydrophobicContact CB-CD1 4.4Å; L77-L101 HydrophobicContact CD2-CD1 3.99Å; L77-L101 HydrophobicContact CG-CD1 3.84Å; L77-L101 WeakPolarHBondContact O-CA 3.4Å; L77-L101 PolarHBondContact O-N 2.92Å
78	Q	95.8	Very high	95.8	Very high	50 Å²	50	44 Å²	44	23%	0.234	22%	0.216	C	C	.	.			trans	-106.9	-40.5	175.8	-76	172.9	74.3	0	0	111	V54 R76 N100 L101 R102 A103	V54-Q78 HydrophobicContact CG1-CB 4.16Å; V54-Q78 HydrophobicContact CG1-CG 4.26Å; V54-Q78 VanDerWaalsContact CG1-NE2 3.34Å; V54-Q78 PolarHBondContact O-N 3.33Å; R76-Q78 PolarHBondContact O-N 2.78Å; Q78-N100 WeakPolarHBondContact CG-O 3.39Å; Q78-L101 WeakPolarHBondContact O-CD1 3.11Å; Q78-R102 PolarHBondContact O-N 3.34Å; Q78-R102 VanDerWaalsContact OE1-CZ 3.3Å; Q78-A103 PolarHBondContact O-N 3.01Å; Q78-A103 VanDerWaalsContact O-N 3.1Å
79	D	96.8	Very high	95.9	Very high	57 Å²	57	45.5 Å²	45.5	31%	0.305	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	121.8	-174.7	-53.5	-49.2	0	0	0	111.4	V54 E55 L56	V54-D79 PolarHBondContact O-N 3.24Å; E55-D79 HydrophobicContact CG-CB 4.31Å; L56-D79 PolarHBondContact N-O 2.93Å
80	L	97.6	Very high	96	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	109	178.8	179.2	52.4	0	0	0	111	L56 F71 L77 L82 F95 L98 L101 A103 L104 H105	L56-L80 HydrophobicContact CB-CD1 4.09Å; L56-L80 HydrophobicContact CD2-CD1 3.93Å; L56-L80 HydrophobicContact CG-CD1 4Å; F71-L80 HydrophobicContact CD2-CD2 4.19Å; F71-L80 HydrophobicContact CE1-CD1 4.16Å; F71-L80 HydrophobicContact CE2-CD2 4.17Å; F71-L80 HydrophobicContact CG-CD2 4.4Å; F71-L80 HydrophobicContact CZ-CD1 4.27Å; F71-L80 HydrophobicContact CZ-CD2 4.38Å; L77-L80 HydrophobicContact CD2-CB 4.13Å; L77-L80 HydrophobicContact CD2-CD1 4.47Å; L77-L80 HydrophobicContact CD2-CD2 4.27Å; L80-L82 HydrophobicContact CD1-CD1 4.34Å; L80-L82 HydrophobicContact CD1-CG 4.13Å; L80-L82 HydrophobicContact CD2-CD1 4.17Å; L80-L82 HydrophobicContact CG-CD1 4.12Å; L80-L82 HydrophobicContact CG-CG 4.25Å; L80-F95 HydrophobicContact CD2-CD1 4.3Å; L80-F95 HydrophobicContact CD2-CE1 4.04Å; L80-L98 HydrophobicContact CD2-CD1 4.07Å; L80-L101 HydrophobicContact CB-CD1 3.81Å; L80-L101 HydrophobicContact CB-CD2 4.41Å; L80-A103 PolarHBondContact N-O 3.39Å; L80-L104 HydrophobicContact CB-CD1 4.11Å; L80-L104 HydrophobicContact CD2-CD1 3.91Å; L80-L104 HydrophobicContact CG-CD1 3.95Å; L80-H105 PolarHBondContact O-N 3.22Å
81	T	98	Very high	96	Very high	25 Å²	25	40.3 Å²	40.3	15%	0.153	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	105.9	179.6	-31.4	0	0	0	0	111.3	L56 L58 A59 S83 H105	L56-T81 PolarHBondContact O-N 3.44Å; L58-T81 CarbonylContact C-O 3.46Å; L58-T81 WeakPolarHBondContact CA-O 3.11Å; L58-T81 PolarHBondContact N-O 3.4Å; A59-T81 HydrophobicContact CB-CG2 4.01Å; A59-T81 PolarHBondContact N-O 2.81Å; T81-S83 WeakPolarHBondContact CG2-OG 3.19Å; T81-H105 HydrophobicContact CG2-CB 4.08Å
82	L	97.8	Very high	95.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.225	C	C	.	.			trans	-109.3	11.7	174.7	-70.3	165.4	0	0	0	112.7	L58 I66 F71 L80 N85 I87 F95 H105 L106 N109	L58-L82 HydrophobicContact CB-CD2 3.75Å; L58-L82 HydrophobicContact CD1-CD2 3.93Å; L58-L82 HydrophobicContact CG-CD2 4.5Å; I66-L82 HydrophobicContact CD1-CD1 4.25Å; I66-L82 HydrophobicContact CD1-CD2 4.21Å; I66-L82 HydrophobicContact CG1-CD1 4.49Å; F71-L82 HydrophobicContact CE2-CD1 4.01Å; F71-L82 HydrophobicContact CZ-CD1 4.09Å; F71-L82 HydrophobicContact CZ-CD2 4.07Å; L80-L82 HydrophobicContact CD1-CD1 4.34Å; L80-L82 HydrophobicContact CD1-CG 4.13Å; L80-L82 HydrophobicContact CD2-CD1 4.17Å; L80-L82 HydrophobicContact CG-CD1 4.12Å; L80-L82 HydrophobicContact CG-CG 4.25Å; L82-N85 PolarHBondContact O-ND2 3.13Å; L82-I87 HydrophobicContact CB-CD1 3.98Å; L82-I87 HydrophobicContact CD1-CD1 4.39Å; L82-I87 HydrophobicContact CD2-CD1 4.26Å; L82-I87 HydrophobicContact CG-CD1 4.45Å; L82-F95 HydrophobicContact CD1-CE1 4.44Å; L82-F95 HydrophobicContact CD1-CZ 4.47Å; L82-H105 CarbonylContact C-O 3.14Å; L82-H105 WeakPolarHBondContact CA-O 3.24Å; L82-H105 WeakPolarHBondContact CB-O 3.39Å; L82-H105 PolarHBondContact N-O 3.29Å; L82-L106 HydrophobicContact CB-CD2 3.97Å; L82-L106 HydrophobicContact CD1-CD2 3.78Å; L82-N109 PolarHBondContact O-ND2 2.75Å
83	S	98.1	Very high	95.8	Very high	7 Å²	7	46.3 Å²	46.3	5%	0.049	24%	0.236	C	C	.	.			trans	-50.8	145	-179.6	-49.9	0	0	0	0	114.6	A59 D60 T81 N85 H105 N107	A59-S83 CarbonylContact C-O 3.54Å; A59-S83 WeakPolarHBondContact CA-O 3.24Å; A59-S83 WeakPolarHBondContact CB-O 3.47Å; D60-S83 PolarHBondContact N-O 3.25Å; T81-S83 WeakPolarHBondContact CG2-OG 3.19Å; S83-N85 PolarHBondContact O-ND2 2.96Å; S83-H105 PolarHBondContact N-O 3.41Å; S83-H105 WeakPolarHBondContact OG-CB 3.42Å; S83-N107 CarbonylContact C-O 3.57Å; S83-N107 VanDerWaalsContact CA-O 3.24Å; S83-N107 WeakPolarHBondContact CA-O 3.27Å; S83-N107 WeakPolarHBondContact CB-OD1 3.33Å; S83-N107 PolarHBondContact OG-OD1 3.45Å
84	R	97.9	Very high	95.8	Very high	119 Å²	119	40.9 Å²	40.9	45%	0.449	21%	0.207	S	C	.	.	S	Bend	trans	53.6	61.5	174.9	-63	-178.9	-58.9	-77.4	-6.1	111.4	D60 N61 N107 S108	D60-R84 VanDerWaalsContact CA-O 3.28Å; D60-R84 WeakPolarHBondContact CA-O 3.32Å; D60-R84 PolarHBondContact N-O 3.21Å; D60-R84 IonicContact OD1-CZ 3.31Å; D60-R84 IonicContact OD1-NE 3.31Å; D60-R84 PolarHBondContact OD1-NE 3.26Å; D60-R84 IonicContact OD1-NH2 3.17Å; D60-R84 PolarHBondContact OD1-NH2 2.91Å; D60-R84 IonicContact OD2-CZ 3.31Å; D60-R84 IonicContact OD2-NE 2.95Å; D60-R84 IonicContact OD2-NH2 3.01Å; D60-R84 PolarHBondContact OD2-NH2 2.79Å; N61-R84 PolarHBondContact N-O 3.18Å; R84-N107 PolarHBondContact N-O 2.98Å; R84-S108 WeakPolarHBondContact CA-O 3.48Å; R84-S108 PolarHBondContact N-O 3.18Å
85	N	98.1	Very high	95.9	Very high	11 Å²	11	40.9 Å²	40.9	6%	0.059	21%	0.207	C	C	.	.	S	Bend	trans	-127.1	-169.7	173	-88.6	-87.2	0	0	0	109.3	L58 N61 F62 V63 L82 S83 I87 S108 N109	L58-N85 PolarHBondContact O-ND2 2.98Å; N61-N85 WeakPolarHBondContact CA-OD1 3.48Å; N61-N85 WeakPolarHBondContact CB-OD1 3.35Å; N61-N85 WeakPolarHBondContact O-CA 3.46Å; N61-N85 PolarHBondContact O-OD1 3.25Å; F62-N85 PolarHBondContact N-OD1 2.82Å; V63-N85 WeakPolarHBondContact CB-OD1 3.33Å; V63-N85 WeakPolarHBondContact CG2-OD1 3.3Å; V63-N85 PolarHBondContact N-OD1 2.81Å; L82-N85 PolarHBondContact O-ND2 3.13Å; S83-N85 PolarHBondContact O-ND2 2.96Å; N85-I87 HydrophobicContact CB-CD1 4.16Å; N85-I87 HydrophobicContact CB-CG1 3.98Å; N85-S108 PolarHBondContact N-O 2.71Å; N85-N109 WeakPolarHBondContact CA-OD1 3.31Å; N85-N109 WeakPolarHBondContact CB-OD1 3.43Å; N85-N109 PolarHBondContact O-OD1 2.91Å
86	T	97.5	Very high	96	Very high	35 Å²	35	39.1 Å²	39.1	22%	0.215	20%	0.199	C	C	.	.			trans	-114.4	26.2	178.5	47.6	0	0	0	0	112	F62 V63 S88 N109	F62-T86 VanDerWaalsContact C-OG1 3.3Å; F62-T86 PolarHBondContact O-OG1 2.83Å; V63-T86 CarbonylContact O-C 3.24Å; V63-T86 WeakPolarHBondContact O-CA 3.32Å; V63-T86 PolarHBondContact O-N 3.18Å; V63-T86 PolarHBondContact O-OG1 3.37Å; T86-S88 PolarHBondContact O-N 2.88Å; T86-S88 VanDerWaalsContact O-N 3.15Å; T86-N109 PolarHBondContact N-OD1 2.89Å
87	I	98.1	Very high	96	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.			trans	-67.8	115	-170.8	-56.3	166.4	0	0	0	108.9	V63 T64 I66 L82 N85 I90 L106 N109 R110 L111	V63-I87 HydrophobicContact CB-CG1 4.31Å; V63-I87 HydrophobicContact CG1-CG1 4.21Å; V63-I87 WeakPolarHBondContact O-CG1 2.99Å; V63-I87 PolarHBondContact O-N 3.36Å; T64-I87 WeakPolarHBondContact O-CA 3.17Å; I66-I87 HydrophobicContact CD1-CD1 3.95Å; I66-I87 HydrophobicContact CD1-CG1 4.48Å; I66-I87 HydrophobicContact CG1-CD1 4.06Å; I66-I87 HydrophobicContact CG1-CG2 4.09Å; L82-I87 HydrophobicContact CB-CD1 3.98Å; L82-I87 HydrophobicContact CD1-CD1 4.39Å; L82-I87 HydrophobicContact CD2-CD1 4.26Å; L82-I87 HydrophobicContact CG-CD1 4.45Å; N85-I87 HydrophobicContact CB-CD1 4.16Å; N85-I87 HydrophobicContact CB-CG1 3.98Å; I87-I90 HydrophobicContact CG2-CG1 4.03Å; I87-L106 HydrophobicContact CD1-CD2 4.3Å; I87-N109 HydrophobicContact CB-CB 4.4Å; I87-N109 VanDerWaalsContact CB-OD1 3.31Å; I87-N109 WeakPolarHBondContact CB-OD1 3.42Å; I87-N109 WeakPolarHBondContact CG1-OD1 3.44Å; I87-N109 PolarHBondContact N-OD1 2.91Å; I87-R110 CarbonylContact O-C 3.48Å; I87-R110 WeakPolarHBondContact O-CA 3.42Å; I87-R110 PolarHBondContact O-N 3.48Å; I87-L111 HydrophobicContact CG2-CD2 3.87Å; I87-L111 PolarHBondContact O-N 3.46Å
88	S	96.4	Very high	95.9	Very high	67 Å²	67	35.4 Å²	35.4	47%	0.469	19%	0.188	S	C	.	.			trans	-107.8	-14.2	174.4	60.3	0	0	0	0	113.6	T64 T86 R110	T64-S88 PolarHBondContact O-N 3.17Å; T86-S88 PolarHBondContact O-N 2.88Å; T86-S88 VanDerWaalsContact O-N 3.15Å; S88-R110 WeakPolarHBondContact CA-O 3.42Å
89	F	95.6	Very high	95.7	Very high	116 Å²	116	38.1 Å²	38.1	51%	0.509	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	135.2	-178.3	-176.9	-99.8	0	0	0	112.4	S65 I66	S65-F89 VanDerWaalsContact CA-O 3.27Å; S65-F89 WeakPolarHBondContact CA-O 3.39Å; I66-F89 PolarHBondContact N-O 3.13Å
90	I	96.6	Very high	95.6	Very high	15 Å²	15	38.2 Å²	38.2	8%	0.077	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.1	171.8	-59.2	175.3	0	0	0	106.9	I66 I87 A94 F95 L106 L111 T118	I66-I90 HydrophobicContact CB-CG1 4.3Å; I66-I90 HydrophobicContact CB-CG2 4.28Å; I66-I90 HydrophobicContact CG1-CG1 4.31Å; I66-I90 HydrophobicContact CG2-CG2 4.44Å; I87-I90 HydrophobicContact CG2-CG1 4.03Å; I90-A94 HydrophobicContact CG2-CB 3.93Å; I90-F95 HydrophobicContact CD1-CE2 4.04Å; I90-F95 HydrophobicContact CD1-CZ 4.16Å; I90-F95 HydrophobicContact CG2-CE2 3.9Å; I90-F95 HydrophobicContact CG2-CZ 4.12Å; I90-L106 HydrophobicContact CD1-CD1 3.97Å; I90-L106 HydrophobicContact CD1-CD2 4.07Å; I90-L111 HydrophobicContact CD1-CD1 4.1Å; I90-L111 HydrophobicContact CD1-CD2 3.86Å; I90-L111 HydrophobicContact CG1-CD2 3.93Å; I90-T118 HydrophobicContact CB-CG2 4.36Å; I90-T118 HydrophobicContact CD1-CG2 4.3Å; I90-T118 HydrophobicContact CG2-CG2 4.16Å
91	T	94.8	Very high	95.5	Very high	39 Å²	39	38.2 Å²	38.2	24%	0.239	20%	0.201	C	C	.	.			trans	-67.6	140.9	177.9	-53.3	0	0	0	0	110.1	I66 K67 R68 H93 A94	I66-T91 WeakPolarHBondContact O-CB 3.07Å; I66-T91 PolarHBondContact O-N 2.72Å; I66-T91 PolarHBondContact O-OG1 2.63Å; K67-T91 WeakPolarHBondContact CA-OG1 3.3Å; R68-T91 HydrophobicContact CB-CG2 4.22Å; T91-H93 PolarHBondContact O-N 2.91Å; T91-A94 WeakPolarHBondContact O-CB 3.43Å; T91-A94 PolarHBondContact O-N 2.03Å; T91-A94 VanDerWaalsContact O-N 3.1Å
92	P	92.5	Very high	95.4	Very high	64 Å²	64	43.4 Å²	43.4	42%	0.416	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	140.4	170.8	-31.3	37.4	0	0	0	113	A94 D117	P92-A94 PolarHBondContact O-N 2.89Å; P92-A94 VanDerWaalsContact O-N 3.11Å; P92-D117 HydrophobicContact CB-CB 3.91Å
93	H	93	Very high	95.4	Very high	80 Å²	80	43.7 Å²	43.7	37%	0.37	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	16.6	-176.6	-47.1	-56	0	0	0	115.4	R68 T91 F95 A96 D117 S120	R68-H93 WeakPolarHBondContact CD-O 3.29Å; R68-H93 PolarHBondContact NE-O 3.02Å; T91-H93 PolarHBondContact O-N 2.91Å; H93-F95 PolarHBondContact O-N 3.28Å; H93-A96 HydrophobicContact CB-CB 3.87Å; H93-A96 VanDerWaalsContact O-CB 3.32Å; H93-A96 WeakPolarHBondContact O-CB 3.43Å; H93-A96 PolarHBondContact O-N 2.71Å; H93-D117 WeakPolarHBondContact CA-O 3.35Å; H93-D117 VanDerWaalsContact CE1-CG 3.47Å; H93-D117 IonicContact CE1-OD1 3.49Å; H93-D117 PolarHBondContact CE1-OD1 3.09Å; H93-D117 VanDerWaalsContact CE1-OD1 3.25Å; H93-D117 PolarHBondContact N-O 3.09Å; H93-S120 PolarHBondContact ND1-OG 3.09Å; H93-S120 VanDerWaalsContact ND1-OG 3.1Å
94	A	94.4	Very high	95.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-22	-177.8	0	0	0	0	0	114.7	I66 I90 T91 P92	I66-A94 HydrophobicContact CG2-CB 3.95Å; I90-A94 HydrophobicContact CG2-CB 3.93Å; T91-A94 WeakPolarHBondContact O-CB 3.43Å; T91-A94 PolarHBondContact O-N 2.03Å; T91-A94 VanDerWaalsContact O-N 3.1Å; P92-A94 PolarHBondContact O-N 2.89Å; P92-A94 VanDerWaalsContact O-N 3.11Å
95	F	95.1	Very high	95.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	6.4	177.2	-53.6	-50	0	0	0	113.8	I66 F71 L80 L82 I90 H93 D97 L98 L104 L106 T118 F119 M122	I66-F95 HydrophobicContact CG2-CE1 4.29Å; F71-F95 AromaticContact CD2-CD1 3.94Å; F71-F95 HydrophobicContact CD2-CD1 3.94Å; F71-F95 AromaticContact CD2-CE1 3.67Å; F71-F95 HydrophobicContact CD2-CE1 3.67Å; F71-F95 AromaticContact CE2-CE1 3.81Å; F71-F95 HydrophobicContact CE2-CE1 3.81Å; L80-F95 HydrophobicContact CD2-CD1 4.3Å; L80-F95 HydrophobicContact CD2-CE1 4.04Å; L82-F95 HydrophobicContact CD1-CE1 4.44Å; L82-F95 HydrophobicContact CD1-CZ 4.47Å; I90-F95 HydrophobicContact CD1-CE2 4.04Å; I90-F95 HydrophobicContact CD1-CZ 4.16Å; I90-F95 HydrophobicContact CG2-CE2 3.9Å; I90-F95 HydrophobicContact CG2-CZ 4.12Å; H93-F95 PolarHBondContact O-N 3.28Å; F95-D97 VanDerWaalsContact C-N 3.28Å; F95-D97 PolarHBondContact O-N 2.69Å; F95-L98 HydrophobicContact CB-CD1 3.95Å; F95-L98 HydrophobicContact CB-CG 4.42Å; F95-L98 HydrophobicContact CD1-CD1 3.79Å; F95-L98 HydrophobicContact CG-CD1 4.29Å; F95-L98 VanDerWaalsContact O-CB 3.25Å; F95-L98 WeakPolarHBondContact O-CB 3.46Å; F95-L98 WeakPolarHBondContact O-CG 3.4Å; F95-L98 PolarHBondContact O-N 3.47Å; F95-L104 HydrophobicContact CD2-CD2 4.22Å; F95-L104 HydrophobicContact CE2-CD2 4.11Å; F95-L106 HydrophobicContact CE2-CD1 4.21Å; F95-L106 HydrophobicContact CZ-CD1 4.36Å; F95-T118 VanDerWaalsContact CD2-O 3.31Å; F95-T118 WeakPolarHBondContact CD2-O 3.47Å; F95-F119 HydrophobicContact CD2-CD1 4.18Å; F95-F119 HydrophobicContact CD2-CE1 4.44Å; F95-F119 HydrophobicContact CE2-CD1 4.43Å; F95-F119 HydrophobicContact CE2-CE1 4.25Å; F95-M122 HydrophobicContact CB-CG 4.27Å; F95-M122 HydrophobicContact CB-SD 3.71Å; F95-M122 HydrophobicContact CD2-SD 4.45Å; F95-M122 HydrophobicContact CG-SD 4.27Å
96	A	93.2	Very high	95.5	Very high	28 Å²	28	39.8 Å²	39.8	23%	0.231	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-23.9	-169.8	0	0	0	0	0	115	H93 L98 S120	H93-A96 HydrophobicContact CB-CB 3.87Å; H93-A96 VanDerWaalsContact O-CB 3.32Å; H93-A96 WeakPolarHBondContact O-CB 3.43Å; H93-A96 PolarHBondContact O-N 2.71Å; A96-L98 VanDerWaalsContact C-N 3.26Å; A96-L98 PolarHBondContact O-N 2.84Å; A96-S120 WeakPolarHBondContact CA-O 3.37Å
97	D	92.9	Very high	95.5	Very high	31 Å²	31	39.2 Å²	39.2	17%	0.166	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	2	177	-47.7	-31.1	0	0	0	112.8	R68 A72 N73 F95 E99	R68-D97 IonicContact CZ-OD1 2.72Å; R68-D97 IonicContact CZ-OD2 3.58Å; R68-D97 IonicContact NH1-OD1 3.26Å; R68-D97 IonicContact NH1-OD2 3.6Å; R68-D97 PolarHBondContact NH1-OD2 2.99Å; R68-D97 VanDerWaalsContact NH2-CG 3.34Å; R68-D97 IonicContact NH2-OD1 2.63Å; R68-D97 PolarHBondContact NH2-OD1 3.31Å; R68-D97 IonicContact NH2-OD2 2.7Å; R68-D97 PolarHBondContact NH2-OD2 3.17Å; A72-D97 WeakPolarHBondContact CA-OD2 3.16Å; N73-D97 PolarHBondContact N-OD2 2.84Å; F95-D97 VanDerWaalsContact C-N 3.28Å; F95-D97 PolarHBondContact O-N 2.69Å; D97-E99 VanDerWaalsContact C-N 3.29Å; D97-E99 PolarHBondContact O-N 2.85Å
98	L	94	Very high	95.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.			trans	-93.7	47.3	-171.9	-51.4	-174.6	0	0	0	111.9	F71 M74 L77 L80 F95 A96 N100 L101	F71-L98 HydrophobicContact CB-CD1 4.32Å; F71-L98 HydrophobicContact CB-CD2 4.32Å; M74-L98 HydrophobicContact CB-CD2 3.72Å; L77-L98 HydrophobicContact CB-CD2 4.43Å; L77-L98 HydrophobicContact CD2-CD1 4.29Å; L77-L98 HydrophobicContact CD2-CD2 4.08Å; L80-L98 HydrophobicContact CD2-CD1 4.07Å; F95-L98 HydrophobicContact CB-CD1 3.95Å; F95-L98 HydrophobicContact CB-CG 4.42Å; F95-L98 HydrophobicContact CD1-CD1 3.79Å; F95-L98 HydrophobicContact CG-CD1 4.29Å; F95-L98 VanDerWaalsContact O-CB 3.25Å; F95-L98 WeakPolarHBondContact O-CB 3.46Å; F95-L98 WeakPolarHBondContact O-CG 3.4Å; F95-L98 PolarHBondContact O-N 3.47Å; A96-L98 VanDerWaalsContact C-N 3.26Å; A96-L98 PolarHBondContact O-N 2.84Å; L98-N100 PolarHBondContact O-N 2.84Å; L98-L101 HydrophobicContact CB-CB 4.01Å; L98-L101 HydrophobicContact CB-CD2 4.45Å; L98-L101 HydrophobicContact CD1-CD2 4.11Å; L98-L101 WeakPolarHBondContact O-CB 3.46Å; L98-L101 PolarHBondContact O-N 2.85Å
99	E	91.1	Very high	95.6	Very high	106 Å²	106	38.5 Å²	38.5	50%	0.495	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-15.1	-174.8	-60.2	177.2	-173	0	0	115.9	D97 K124	D97-E99 VanDerWaalsContact C-N 3.29Å; D97-E99 PolarHBondContact O-N 2.85Å; E99-K124 WeakPolarHBondContact O-CD 3.09Å; E99-K124 WeakPolarHBondContact O-CE 3.35Å; E99-K124 PolarHBondContact O-NZ 3.32Å
100	N	94.1	Very high	95.7	Very high	59 Å²	59	39.7 Å²	39.7	32%	0.316	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.2	9.6	-179.1	-64.5	-66.6	0	0	0	113	T75 L77 Q78 L98 R102 K124	T75-N100 PolarHBondContact O-ND2 3.24Å; L77-N100 CarbonylContact O-C 3.57Å; L77-N100 VanDerWaalsContact O-C 3.24Å; Q78-N100 WeakPolarHBondContact CG-O 3.39Å; L98-N100 PolarHBondContact O-N 2.84Å; N100-R102 PolarHBondContact O-N 2.9Å; N100-K124 PolarHBondContact OD1-NZ 3.13Å
101	L	96.2	Very high	95.8	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	19%	0.194	C	C	.	.			trans	-66.8	129.7	177.4	-158.9	75	0	0	0	110.4	L77 Q78 L80 L98 L104 M122 K124 L125	L77-L101 HydrophobicContact CB-CD1 4.4Å; L77-L101 HydrophobicContact CD2-CD1 3.99Å; L77-L101 HydrophobicContact CG-CD1 3.84Å; L77-L101 WeakPolarHBondContact O-CA 3.4Å; L77-L101 PolarHBondContact O-N 2.92Å; Q78-L101 WeakPolarHBondContact O-CD1 3.11Å; L80-L101 HydrophobicContact CB-CD1 3.81Å; L80-L101 HydrophobicContact CB-CD2 4.41Å; L98-L101 HydrophobicContact CB-CB 4.01Å; L98-L101 HydrophobicContact CB-CD2 4.45Å; L98-L101 HydrophobicContact CD1-CD2 4.11Å; L98-L101 WeakPolarHBondContact O-CB 3.46Å; L98-L101 PolarHBondContact O-N 2.85Å; L101-L104 HydrophobicContact CD2-CB 3.95Å; L101-L104 HydrophobicContact CD2-CD1 4.32Å; L101-L104 HydrophobicContact CD2-CG 4.49Å; L101-M122 HydrophobicContact CD2-SD 3.75Å; L101-K124 CarbonylContact O-C 3.57Å; L101-L125 HydrophobicContact CB-CD1 4.32Å; L101-L125 HydrophobicContact CD2-CD1 3.97Å; L101-L125 HydrophobicContact CG-CD1 4.04Å; L101-L125 VanDerWaalsContact O-CA 3.3Å; L101-L125 WeakPolarHBondContact O-CA 3.36Å; L101-L125 PolarHBondContact O-N 2.78Å
102	R	96.8	Very high	95.9	Very high	133 Å²	133	40 Å²	40	50%	0.502	20%	0.199	S	C	.	.			trans	-108.9	-40	-179.9	-66.1	178.5	174.5	-171.4	-4.1	111.8	Q78 N100 H126 H127	Q78-R102 PolarHBondContact O-N 3.34Å; Q78-R102 VanDerWaalsContact OE1-CZ 3.3Å; N100-R102 PolarHBondContact O-N 2.9Å; R102-H126 PolarHBondContact O-N 3.29Å; R102-H127 PolarHBondContact O-N 2.91Å
103	A	97.9	Very high	96	Very high	7 Å²	7	45.8 Å²	45.8	6%	0.058	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	125.5	179.4	0	0	0	0	0	111.9	Q78 L80 H127	Q78-A103 PolarHBondContact O-N 3.01Å; Q78-A103 VanDerWaalsContact O-N 3.1Å; L80-A103 PolarHBondContact N-O 3.39Å; A103-H127 HydrophobicContact CB-CB 4.18Å
104	L	97.9	Very high	96.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	108.9	173.9	179.7	57.6	0	0	0	109.9	L80 F95 L101 L106 F119 M122 L125 H127 L128 I129	L80-L104 HydrophobicContact CB-CD1 4.11Å; L80-L104 HydrophobicContact CD2-CD1 3.91Å; L80-L104 HydrophobicContact CG-CD1 3.95Å; F95-L104 HydrophobicContact CD2-CD2 4.22Å; F95-L104 HydrophobicContact CE2-CD2 4.11Å; L101-L104 HydrophobicContact CD2-CB 3.95Å; L101-L104 HydrophobicContact CD2-CD1 4.32Å; L101-L104 HydrophobicContact CD2-CG 4.49Å; L104-L106 HydrophobicContact CD1-CD1 4.29Å; L104-L106 HydrophobicContact CD1-CG 4.13Å; L104-L106 HydrophobicContact CD2-CD1 3.87Å; L104-L106 HydrophobicContact CG-CD1 4Å; L104-L106 HydrophobicContact CG-CG 4.15Å; L104-F119 HydrophobicContact CD2-CD1 4.27Å; L104-F119 HydrophobicContact CD2-CE1 3.98Å; L104-M122 HydrophobicContact CD2-CE 3.76Å; L104-M122 HydrophobicContact CD2-SD 4.01Å; L104-L125 HydrophobicContact CB-CD1 3.9Å; L104-L125 HydrophobicContact CB-CD2 4.38Å; L104-H127 PolarHBondContact N-O 2.87Å; L104-L128 HydrophobicContact CB-CD1 4.27Å; L104-L128 HydrophobicContact CD2-CD1 4.08Å; L104-L128 HydrophobicContact CG-CD1 4.27Å; L104-I129 PolarHBondContact O-N 2.99Å
105	H	98.4	Very high	96.2	Very high	54 Å²	54	43.9 Å²	43.9	25%	0.25	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	108	175.7	-51.3	-93	0	0	0	110.3	L80 T81 L82 S83 I129	L80-H105 PolarHBondContact O-N 3.22Å; T81-H105 HydrophobicContact CG2-CB 4.08Å; L82-H105 CarbonylContact C-O 3.14Å; L82-H105 WeakPolarHBondContact CA-O 3.24Å; L82-H105 WeakPolarHBondContact CB-O 3.39Å; L82-H105 PolarHBondContact N-O 3.29Å; S83-H105 PolarHBondContact N-O 3.41Å; S83-H105 WeakPolarHBondContact OG-CB 3.42Å; H105-I129 HydrophobicContact CB-CB 4.48Å; H105-I129 WeakPolarHBondContact ND1-CG1 3.22Å
106	L	97.9	Very high	96.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.			trans	-111.2	11.7	175.8	-79.7	166.6	0	0	0	112.2	L82 I87 I90 F95 L104 N109 L111 F119 I129 L130 N133	L82-L106 HydrophobicContact CB-CD2 3.97Å; L82-L106 HydrophobicContact CD1-CD2 3.78Å; I87-L106 HydrophobicContact CD1-CD2 4.3Å; I90-L106 HydrophobicContact CD1-CD1 3.97Å; I90-L106 HydrophobicContact CD1-CD2 4.07Å; F95-L106 HydrophobicContact CE2-CD1 4.21Å; F95-L106 HydrophobicContact CZ-CD1 4.36Å; L104-L106 HydrophobicContact CD1-CD1 4.29Å; L104-L106 HydrophobicContact CD1-CG 4.13Å; L104-L106 HydrophobicContact CD2-CD1 3.87Å; L104-L106 HydrophobicContact CG-CD1 4Å; L104-L106 HydrophobicContact CG-CG 4.15Å; L106-N109 WeakPolarHBondContact O-CB 3.21Å; L106-N109 PolarHBondContact O-ND2 2.99Å; L106-L111 HydrophobicContact CB-CD1 4.28Å; L106-L111 HydrophobicContact CD1-CD1 4.43Å; L106-F119 HydrophobicContact CD1-CE1 3.95Å; L106-F119 HydrophobicContact CD1-CZ 4.3Å; L106-I129 PolarHBondContact N-O 2.87Å; L106-L130 HydrophobicContact CB-CD2 3.7Å; L106-L130 HydrophobicContact CD1-CD2 4.03Å; L106-N133 PolarHBondContact O-ND2 2.94Å
107	N	98.1	Very high	96	Very high	24 Å²	24	48.1 Å²	48.1	13%	0.128	23%	0.229	C	C	.	.			trans	-69.7	158.1	-174.9	61.4	-18.1	0	0	0	115.8	S83 R84 N109 I129 N131	S83-N107 CarbonylContact C-O 3.57Å; S83-N107 VanDerWaalsContact CA-O 3.24Å; S83-N107 WeakPolarHBondContact CA-O 3.27Å; S83-N107 WeakPolarHBondContact CB-OD1 3.33Å; S83-N107 PolarHBondContact OG-OD1 3.45Å; R84-N107 PolarHBondContact N-O 2.98Å; N107-N109 PolarHBondContact O-ND2 3.09Å; N107-I129 HydrophobicContact CB-CG2 4.11Å; N107-I129 PolarHBondContact N-O 3.04Å; N107-N131 CarbonylContact C-O 3.09Å; N107-N131 WeakPolarHBondContact CA-O 3.43Å; N107-N131 HydrophobicContact CB-CB 4.46Å; N107-N131 WeakPolarHBondContact CB-O 3.49Å; N107-N131 WeakPolarHBondContact CB-OD1 3.43Å; N107-N131 PolarHBondContact ND2-OD1 3.37Å
108	S	98.3	Very high	96	Very high	43 Å²	43	47.1 Å²	47.1	30%	0.301	22%	0.224	S	C	.	.	S	Bend	trans	53.1	59.2	-173.3	-57.3	0	0	0	0	111.5	R84 N85 N131 N132	R84-S108 WeakPolarHBondContact CA-O 3.48Å; R84-S108 PolarHBondContact N-O 3.18Å; N85-S108 PolarHBondContact N-O 2.71Å; S108-N131 PolarHBondContact N-O 3.28Å; S108-N132 WeakPolarHBondContact CA-O 3.44Å; S108-N132 PolarHBondContact N-O 3.32Å
109	N	98.6	Very high	96	Very high	9 Å²	9	47.2 Å²	47.2	5%	0.048	23%	0.225	C	C	.	.	S	Bend	trans	-132.7	-162.9	179.3	-88.7	-72.4	0	0	0	110.3	L82 N85 T86 I87 L106 N107 N132 N133	L82-N109 PolarHBondContact O-ND2 2.75Å; N85-N109 WeakPolarHBondContact CA-OD1 3.31Å; N85-N109 WeakPolarHBondContact CB-OD1 3.43Å; N85-N109 PolarHBondContact O-OD1 2.91Å; T86-N109 PolarHBondContact N-OD1 2.89Å; I87-N109 HydrophobicContact CB-CB 4.4Å; I87-N109 VanDerWaalsContact CB-OD1 3.31Å; I87-N109 WeakPolarHBondContact CB-OD1 3.42Å; I87-N109 WeakPolarHBondContact CG1-OD1 3.44Å; I87-N109 PolarHBondContact N-OD1 2.91Å; L106-N109 WeakPolarHBondContact O-CB 3.21Å; L106-N109 PolarHBondContact O-ND2 2.99Å; N107-N109 PolarHBondContact O-ND2 3.09Å; N109-N132 PolarHBondContact N-O 3.11Å; N109-N133 WeakPolarHBondContact CA-OD1 3.42Å; N109-N133 WeakPolarHBondContact CB-OD1 3.32Å
110	R	97.8	Very high	95.9	Very high	141 Å²	141	43.2 Å²	43.2	53%	0.532	21%	0.209	S	C	.	.			trans	-126.6	28.1	-176	-61.1	-174.9	176.6	-138.8	-2.4	112	I87 S88 T112 N133	I87-R110 CarbonylContact O-C 3.48Å; I87-R110 WeakPolarHBondContact O-CA 3.42Å; I87-R110 PolarHBondContact O-N 3.48Å; S88-R110 WeakPolarHBondContact CA-O 3.42Å; R110-T112 PolarHBondContact O-N 2.9Å; R110-N133 PolarHBondContact N-OD1 2.88Å
111	L	97.8	Very high	95.4	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	21%	0.208	C	C	.	.			trans	-67.3	131	177.8	-58.9	175.6	0	0	0	109.1	I87 I90 L106 I114 L130 N133 Q134 L135	I87-L111 HydrophobicContact CG2-CD2 3.87Å; I87-L111 PolarHBondContact O-N 3.46Å; I90-L111 HydrophobicContact CD1-CD1 4.1Å; I90-L111 HydrophobicContact CD1-CD2 3.86Å; I90-L111 HydrophobicContact CG1-CD2 3.93Å; L106-L111 HydrophobicContact CB-CD1 4.28Å; L106-L111 HydrophobicContact CD1-CD1 4.43Å; L111-I114 HydrophobicContact CD1-CD1 4.46Å; L111-L130 HydrophobicContact CD1-CD2 4.03Å; L111-N133 HydrophobicContact CB-CB 4.43Å; L111-N133 WeakPolarHBondContact CB-OD1 3.46Å; L111-N133 WeakPolarHBondContact CG-OD1 3.18Å; L111-N133 PolarHBondContact N-OD1 3.41Å; L111-Q134 CarbonylContact O-C 3.34Å; L111-Q134 VanDerWaalsContact O-CA 3.32Å; L111-Q134 WeakPolarHBondContact O-CA 3.31Å; L111-Q134 PolarHBondContact O-N 2.83Å; L111-L135 HydrophobicContact CB-CD2 3.71Å; L111-L135 HydrophobicContact CB-CG 4.48Å; L111-L135 PolarHBondContact O-N 2.91Å; L111-L135 VanDerWaalsContact O-N 3.12Å
112	T	96.8	Very high	95.2	Very high	56 Å²	56	41.8 Å²	41.8	34%	0.344	21%	0.208	S	C	.	.			trans	-108.8	-19.2	-179.7	53.2	0	0	0	0	113.7	R110 Q134 L135 T136	R110-T112 PolarHBondContact O-N 2.9Å; T112-Q134 HydrophobicContact CG2-CB 4.25Å; T112-L135 WeakPolarHBondContact O-CA 3.24Å; T112-T136 PolarHBondContact O-N 3.42Å; T112-T136 PolarHBondContact O-OG1 3.31Å
113	R	96.5	Very high	94.8	Very high	185 Å²	185	38.6 Å²	38.6	70%	0.698	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-152.6	150.8	178.5	64.4	-173.1	69	-175.2	-2.7	111.3	L137	R113-L137 VanDerWaalsContact CA-O 3.31Å; R113-L137 WeakPolarHBondContact CA-O 3.28Å
114	I	96.4	Very high	94.6	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.7	167.1	-57	-56.8	0	0	0	108.7	L111 T118 F119 L130 L135 L137 I138 H139 A142	L111-I114 HydrophobicContact CD1-CD1 4.46Å; I114-T118 HydrophobicContact CG2-CG2 4.41Å; I114-F119 HydrophobicContact CB-CE2 4.46Å; I114-F119 HydrophobicContact CD1-CE2 4.06Å; I114-F119 HydrophobicContact CD1-CZ 3.91Å; I114-F119 HydrophobicContact CG1-CE2 4.18Å; I114-F119 HydrophobicContact CG2-CD2 3.76Å; I114-F119 HydrophobicContact CG2-CE2 3.45Å; I114-F119 VanDerWaalsContact CG2-CE2 3.45Å; I114-F119 HydrophobicContact CG2-CZ 4.24Å; I114-L130 HydrophobicContact CD1-CD2 4.45Å; I114-L135 HydrophobicContact CD1-CD1 4.39Å; I114-L135 HydrophobicContact CD1-CD2 3.85Å; I114-L135 HydrophobicContact CG1-CD1 4.12Å; I114-L135 HydrophobicContact CG1-CD2 3.86Å; I114-L137 PolarHBondContact N-O 2.84Å; I114-L137 VanDerWaalsContact N-O 3.08Å; I114-I138 HydrophobicContact CB-CG1 4.25Å; I114-I138 HydrophobicContact CB-CG2 4.27Å; I114-I138 HydrophobicContact CG1-CG1 4.14Å; I114-H139 WeakPolarHBondContact O-CB 3.27Å; I114-H139 PolarHBondContact O-N 3.24Å; I114-A142 HydrophobicContact CG2-CB 3.74Å
115	A	94	Very high	94.6	Very high	38 Å²	38	42.5 Å²	42.5	31%	0.314	22%	0.222	S	C	.	.			trans	-94.9	159.3	173.6	0	0	0	0	0	111.5	D117 T118	A115-D117 PolarHBondContact O-N 3.01Å; A115-T118 PolarHBondContact N-OG1 3.24Å; A115-T118 VanDerWaalsContact O-CB 3.28Å; A115-T118 WeakPolarHBondContact O-CB 3.31Å; A115-T118 PolarHBondContact O-N 2.95Å; A115-T118 PolarHBondContact O-OG1 2.95Å
116	N	93.3	Very high	94.5	Very high	66 Å²	66	42.7 Å²	42.7	35%	0.353	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-42.4	-51.4	168.2	55.9	-49.5	0	0	0	112.3	T118	N116-T118 PolarHBondContact O-N 2.88Å
117	D	91.1	Very high	94.6	Very high	51 Å²	51	45.7 Å²	45.7	27%	0.273	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-81.5	6.3	-173.8	-57.5	-44.8	0	0	0	113.7	P92 H93 A115	P92-D117 HydrophobicContact CB-CB 3.91Å; H93-D117 WeakPolarHBondContact CA-O 3.35Å; H93-D117 VanDerWaalsContact CE1-CG 3.47Å; H93-D117 IonicContact CE1-OD1 3.49Å; H93-D117 PolarHBondContact CE1-OD1 3.09Å; H93-D117 VanDerWaalsContact CE1-OD1 3.25Å; H93-D117 PolarHBondContact N-O 3.09Å; A115-D117 PolarHBondContact O-N 3.01Å
118	T	93	Very high	94.6	Very high	10 Å²	10	44.5 Å²	44.5	6%	0.061	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-75.5	-41.4	-179.9	-53.3	0	0	0	0	111.1	I90 F95 I114 A115 N116	I90-T118 HydrophobicContact CB-CG2 4.36Å; I90-T118 HydrophobicContact CD1-CG2 4.3Å; I90-T118 HydrophobicContact CG2-CG2 4.16Å; F95-T118 VanDerWaalsContact CD2-O 3.31Å; F95-T118 WeakPolarHBondContact CD2-O 3.47Å; I114-T118 HydrophobicContact CG2-CG2 4.41Å; A115-T118 PolarHBondContact N-OG1 3.24Å; A115-T118 VanDerWaalsContact O-CB 3.28Å; A115-T118 WeakPolarHBondContact O-CB 3.31Å; A115-T118 PolarHBondContact O-N 2.95Å; A115-T118 PolarHBondContact O-OG1 2.95Å; N116-T118 PolarHBondContact O-N 2.88Å
119	F	93.5	Very high	94.6	Very high	1 Å²	1	43 Å²	43	0%	0.004	22%	0.219	C	C	.	.	S	Bend	trans	-114.2	7.6	-173.1	-60.2	-42.3	0	0	0	114.4	F95 L104 L106 I114 G121 M122 L128 L130 F143 L146	F95-F119 HydrophobicContact CD2-CD1 4.18Å; F95-F119 HydrophobicContact CD2-CE1 4.44Å; F95-F119 HydrophobicContact CE2-CD1 4.43Å; F95-F119 HydrophobicContact CE2-CE1 4.25Å; L104-F119 HydrophobicContact CD2-CD1 4.27Å; L104-F119 HydrophobicContact CD2-CE1 3.98Å; L106-F119 HydrophobicContact CD1-CE1 3.95Å; L106-F119 HydrophobicContact CD1-CZ 4.3Å; I114-F119 HydrophobicContact CB-CE2 4.46Å; I114-F119 HydrophobicContact CD1-CE2 4.06Å; I114-F119 HydrophobicContact CD1-CZ 3.91Å; I114-F119 HydrophobicContact CG1-CE2 4.18Å; I114-F119 HydrophobicContact CG2-CD2 3.76Å; I114-F119 HydrophobicContact CG2-CE2 3.45Å; I114-F119 VanDerWaalsContact CG2-CE2 3.45Å; I114-F119 HydrophobicContact CG2-CZ 4.24Å; F119-G121 PolarHBondContact O-N 3.3Å; F119-M122 HydrophobicContact CB-CE 3.67Å; F119-M122 HydrophobicContact CD1-CE 3.46Å; F119-M122 VanDerWaalsContact CD1-CE 3.46Å; F119-M122 HydrophobicContact CE1-CE 4.4Å; F119-M122 HydrophobicContact CG-CE 3.87Å; F119-M122 PolarHBondContact O-N 3.45Å; F119-L128 HydrophobicContact CD2-CD2 4.31Å; F119-L128 HydrophobicContact CE1-CD1 4.34Å; F119-L128 HydrophobicContact CE2-CD2 4.04Å; F119-L128 HydrophobicContact CZ-CD1 4.17Å; F119-L128 HydrophobicContact CZ-CD2 4.39Å; F119-L130 HydrophobicContact CE2-CD1 4.14Å; F119-L130 HydrophobicContact CZ-CD1 4.03Å; F119-L130 HydrophobicContact CZ-CD2 4.25Å; F119-F143 HydrophobicContact CD2-CD1 4.22Å; F119-F143 HydrophobicContact CD2-CE1 4.06Å; F119-F143 HydrophobicContact CE2-CE1 4.01Å; F119-L146 HydrophobicContact CB-CD1 4.43Å; F119-L146 HydrophobicContact CD2-CD1 4.46Å
120	S	89.4	Confident	94.5	Very high	23 Å²	23	42.6 Å²	42.6	16%	0.161	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	130	178.4	61.9	0	0	0	0	112.6	H93 A96 D145	H93-S120 PolarHBondContact ND1-OG 3.09Å; H93-S120 VanDerWaalsContact ND1-OG 3.1Å; A96-S120 WeakPolarHBondContact CA-O 3.37Å; S120-D145 WeakPolarHBondContact CA-OD2 3.44Å
121	G	84.7	Confident	94.6	Very high	29 Å²	29	37.1 Å²	37.1	30%	0.299	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.2	-12.3	174.2	0	0	0	0	0	116.3	F119 S123 D145	F119-G121 PolarHBondContact O-N 3.3Å; G121-S123 PolarHBondContact O-N 2.61Å; G121-D145 PolarHBondContact N-OD2 3.33Å
122	M	90.3	Very high	94.6	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.			trans	-80.7	51.5	-176.6	-60.5	-166.6	-55.4	0	0	113.6	F95 L101 L104 F119 K124 L125 L146	F95-M122 HydrophobicContact CB-CG 4.27Å; F95-M122 HydrophobicContact CB-SD 3.71Å; F95-M122 HydrophobicContact CD2-SD 4.45Å; F95-M122 HydrophobicContact CG-SD 4.27Å; L101-M122 HydrophobicContact CD2-SD 3.75Å; L104-M122 HydrophobicContact CD2-CE 3.76Å; L104-M122 HydrophobicContact CD2-SD 4.01Å; F119-M122 HydrophobicContact CB-CE 3.67Å; F119-M122 HydrophobicContact CD1-CE 3.46Å; F119-M122 VanDerWaalsContact CD1-CE 3.46Å; F119-M122 HydrophobicContact CE1-CE 4.4Å; F119-M122 HydrophobicContact CG-CE 3.87Å; F119-M122 PolarHBondContact O-N 3.45Å; M122-K124 PolarHBondContact O-N 3.36Å; M122-L125 HydrophobicContact CB-CB 4.32Å; M122-L125 HydrophobicContact CE-CD2 4.02Å; M122-L125 WeakPolarHBondContact O-CB 3.48Å; M122-L125 PolarHBondContact O-N 2.84Å; M122-L125 VanDerWaalsContact O-N 3.16Å; M122-L146 HydrophobicContact CB-CD2 4.11Å; M122-L146 HydrophobicContact CE-CD2 4.34Å
123	S	89.4	Confident	94.7	Very high	66 Å²	66	37.9 Å²	37.9	46%	0.462	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-13.2	-173.5	57.4	0	0	0	0	116.1	G121 A148	G121-S123 PolarHBondContact O-N 2.61Å; S123-A148 WeakPolarHBondContact O-CB 3.43Å
124	K	94.4	Very high	94.7	Very high	88 Å²	88	33.5 Å²	33.5	38%	0.383	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	15.4	-180	-55.9	-172.6	-163.8	116.4	0	113.5	E99 N100 L101 M122 H126	E99-K124 WeakPolarHBondContact O-CD 3.09Å; E99-K124 WeakPolarHBondContact O-CE 3.35Å; E99-K124 PolarHBondContact O-NZ 3.32Å; N100-K124 PolarHBondContact OD1-NZ 3.13Å; L101-K124 CarbonylContact O-C 3.57Å; M122-K124 PolarHBondContact O-N 3.36Å; K124-H126 PolarHBondContact O-CD2 3.49Å; K124-H126 VanDerWaalsContact O-CD2 3.27Å; K124-H126 PolarHBondContact O-N 3.42Å
125	L	96.7	Very high	94.8	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.186	C	C	.	.			trans	-73.2	125.2	178.2	-161.9	77.2	0	0	0	110.3	L101 L104 M122 L128 L146 A148 L149	L101-L125 HydrophobicContact CB-CD1 4.32Å; L101-L125 HydrophobicContact CD2-CD1 3.97Å; L101-L125 HydrophobicContact CG-CD1 4.04Å; L101-L125 VanDerWaalsContact O-CA 3.3Å; L101-L125 WeakPolarHBondContact O-CA 3.36Å; L101-L125 PolarHBondContact O-N 2.78Å; L104-L125 HydrophobicContact CB-CD1 3.9Å; L104-L125 HydrophobicContact CB-CD2 4.38Å; M122-L125 HydrophobicContact CB-CB 4.32Å; M122-L125 HydrophobicContact CE-CD2 4.02Å; M122-L125 WeakPolarHBondContact O-CB 3.48Å; M122-L125 PolarHBondContact O-N 2.84Å; M122-L125 VanDerWaalsContact O-N 3.16Å; L125-L128 HydrophobicContact CD2-CB 3.81Å; L125-L128 HydrophobicContact CD2-CD1 4.18Å; L125-L128 HydrophobicContact CD2-CD2 4.49Å; L125-L128 HydrophobicContact CD2-CG 4.37Å; L125-L146 HydrophobicContact CB-CD2 4.26Å; L125-L146 HydrophobicContact CD2-CD2 4.14Å; L125-A148 CarbonylContact O-C 3.4Å; L125-A148 VanDerWaalsContact O-C 3.27Å; L125-L149 HydrophobicContact CB-CD1 4.4Å; L125-L149 HydrophobicContact CD2-CD1 4.05Å; L125-L149 HydrophobicContact CG-CD1 4.16Å; L125-L149 WeakPolarHBondContact O-CA 3.47Å; L125-L149 PolarHBondContact O-N 3.32Å
126	H	97.5	Very high	95	Very high	58 Å²	58	35.4 Å²	35.4	27%	0.269	20%	0.195	S	C	.	.			trans	-100.7	-37.8	175.6	-74.5	-140.4	0	0	0	111.1	R102 K124 L149 E150 E151	R102-H126 PolarHBondContact O-N 3.29Å; K124-H126 PolarHBondContact O-CD2 3.49Å; K124-H126 VanDerWaalsContact O-CD2 3.27Å; K124-H126 PolarHBondContact O-N 3.42Å; H126-L149 WeakPolarHBondContact O-CD1 3.39Å; H126-E150 HydrophobicContact CB-CB 4.43Å; H126-E150 HydrophobicContact CB-CG 4.27Å; H126-E150 IonicContact CE1-OE1 2.75Å; H126-E150 IonicContact CE1-OE2 3.87Å; H126-E150 IonicContact CG-OE2 3.25Å; H126-E150 IonicContact ND1-OE1 3.48Å; H126-E150 IonicContact ND1-OE2 2.69Å; H126-E150 PolarHBondContact ND1-OE2 3.49Å; H126-E150 PolarHBondContact O-N 3.27Å; H126-E151 PolarHBondContact O-N 2.8Å
127	H	98.2	Very high	95.1	Very high	63 Å²	63	37 Å²	37	29%	0.292	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	118.9	-176.6	-50.7	-94.9	0	0	0	111.1	R102 A103 L104 E151	R102-H127 PolarHBondContact O-N 2.91Å; A103-H127 HydrophobicContact CB-CB 4.18Å; L104-H127 PolarHBondContact N-O 2.87Å; H127-E151 IonicContact CE1-OE2 2.71Å; H127-E151 IonicContact CG-OE2 2.67Å; H127-E151 IonicContact ND1-OE2 3.1Å; H127-E151 PolarHBondContact ND1-OE2 2.76Å
128	L	98.1	Very high	95.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	103.1	173	-179.7	54.7	0	0	0	110.1	L104 F119 L125 L130 F143 L146 L149 E151 L152 D153	L104-L128 HydrophobicContact CB-CD1 4.27Å; L104-L128 HydrophobicContact CD2-CD1 4.08Å; L104-L128 HydrophobicContact CG-CD1 4.27Å; F119-L128 HydrophobicContact CD2-CD2 4.31Å; F119-L128 HydrophobicContact CE1-CD1 4.34Å; F119-L128 HydrophobicContact CE2-CD2 4.04Å; F119-L128 HydrophobicContact CZ-CD1 4.17Å; F119-L128 HydrophobicContact CZ-CD2 4.39Å; L125-L128 HydrophobicContact CD2-CB 3.81Å; L125-L128 HydrophobicContact CD2-CD1 4.18Å; L125-L128 HydrophobicContact CD2-CD2 4.49Å; L125-L128 HydrophobicContact CD2-CG 4.37Å; L128-L130 HydrophobicContact CD1-CD1 4Å; L128-L130 HydrophobicContact CD1-CG 4.05Å; L128-L130 HydrophobicContact CD2-CD1 3.95Å; L128-L130 HydrophobicContact CG-CD1 3.82Å; L128-L130 HydrophobicContact CG-CG 4.2Å; L128-F143 HydrophobicContact CD2-CE1 4.04Å; L128-L146 HydrophobicContact CD2-CD1 3.69Å; L128-L149 HydrophobicContact CB-CD1 3.86Å; L128-L149 HydrophobicContact CB-CD2 4.33Å; L128-E151 PolarHBondContact N-O 3.3Å; L128-L152 HydrophobicContact CB-CD1 4.15Å; L128-L152 HydrophobicContact CD2-CD1 4.06Å; L128-L152 HydrophobicContact CG-CD1 4.14Å; L128-D153 PolarHBondContact O-N 3.42Å
129	I	98.4	Very high	95.5	Very high	11 Å²	11	38.8 Å²	38.8	6%	0.056	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	101.9	-171.8	-48.1	-57.2	0	0	0	109.7	L104 H105 L106 N107 N131 E151 D153	L104-I129 PolarHBondContact O-N 2.99Å; H105-I129 HydrophobicContact CB-CB 4.48Å; H105-I129 WeakPolarHBondContact ND1-CG1 3.22Å; L106-I129 PolarHBondContact N-O 2.87Å; N107-I129 HydrophobicContact CB-CG2 4.11Å; N107-I129 PolarHBondContact N-O 3.04Å; I129-N131 VanDerWaalsContact CG2-OD1 3.31Å; I129-N131 WeakPolarHBondContact CG2-OD1 3.46Å; I129-E151 HydrophobicContact CD1-CG 3.81Å; I129-D153 HydrophobicContact CD1-CB 3.84Å; I129-D153 HydrophobicContact CG2-CB 4.27Å
130	L	98.2	Very high	95.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.242	C	C	.	.			trans	-113.9	7.7	-173.3	-78.9	163.8	0	0	0	113.2	L106 L111 I114 F119 L128 N133 D153 L154 N157	L106-L130 HydrophobicContact CB-CD2 3.7Å; L106-L130 HydrophobicContact CD1-CD2 4.03Å; L111-L130 HydrophobicContact CD1-CD2 4.03Å; I114-L130 HydrophobicContact CD1-CD2 4.45Å; F119-L130 HydrophobicContact CE2-CD1 4.14Å; F119-L130 HydrophobicContact CZ-CD1 4.03Å; F119-L130 HydrophobicContact CZ-CD2 4.25Å; L128-L130 HydrophobicContact CD1-CD1 4Å; L128-L130 HydrophobicContact CD1-CG 4.05Å; L128-L130 HydrophobicContact CD2-CD1 3.95Å; L128-L130 HydrophobicContact CG-CD1 3.82Å; L128-L130 HydrophobicContact CG-CG 4.2Å; L130-N133 PolarHBondContact O-ND2 2.81Å; L130-D153 WeakPolarHBondContact CA-O 3.47Å; L130-D153 WeakPolarHBondContact CB-O 3.48Å; L130-D153 PolarHBondContact N-O 2.95Å; L130-L154 HydrophobicContact CB-CD2 3.97Å; L130-L154 HydrophobicContact CD1-CD2 3.73Å; L130-N157 PolarHBondContact O-ND2 3.43Å
131	N	98.3	Very high	95.6	Very high	26 Å²	26	45 Å²	45	14%	0.139	25%	0.245	C	C	.	.			trans	-61.1	156.3	-172.8	73.5	-65.6	0	0	0	115.3	N107 S108 I129 D153 S155	N107-N131 CarbonylContact C-O 3.09Å; N107-N131 WeakPolarHBondContact CA-O 3.43Å; N107-N131 HydrophobicContact CB-CB 4.46Å; N107-N131 WeakPolarHBondContact CB-O 3.49Å; N107-N131 WeakPolarHBondContact CB-OD1 3.43Å; N107-N131 PolarHBondContact ND2-OD1 3.37Å; S108-N131 PolarHBondContact N-O 3.28Å; I129-N131 VanDerWaalsContact CG2-OD1 3.31Å; I129-N131 WeakPolarHBondContact CG2-OD1 3.46Å; N131-D153 WeakPolarHBondContact CB-OD1 3.4Å; N131-D153 WeakPolarHBondContact CB-OD2 3.43Å; N131-D153 VanDerWaalsContact CG-OD2 3.28Å; N131-D153 PolarHBondContact N-O 3.34Å; N131-D153 PolarHBondContact OD1-OD2 2.83Å; N131-S155 CarbonylContact C-O 3.47Å; N131-S155 WeakPolarHBondContact CA-O 3.29Å; N131-S155 VanDerWaalsContact CB-O 3.31Å; N131-S155 WeakPolarHBondContact CB-O 3.29Å
132	N	98.3	Very high	96.1	Very high	65 Å²	65	43.8 Å²	43.8	35%	0.348	23%	0.232	S	C	.	.	S	Bend	trans	51.8	57.9	-176.6	-60.8	97.6	0	0	0	111.7	S108 N109 S155 Y156	S108-N132 WeakPolarHBondContact CA-O 3.44Å; S108-N132 PolarHBondContact N-O 3.32Å; N109-N132 PolarHBondContact N-O 3.11Å; N132-S155 PolarHBondContact N-O 2.96Å; N132-Y156 VanDerWaalsContact CA-O 3.25Å; N132-Y156 WeakPolarHBondContact CA-O 3.15Å; N132-Y156 PolarHBondContact N-O 3.34Å; N132-Y156 WeakPolarHBondContact ND2-CB 3.35Å; N132-Y156 VanDerWaalsContact ND2-CG 3.3Å
133	N	98.5	Very high	96.4	Very high	12 Å²	12	43.8 Å²	43.8	6%	0.064	23%	0.232	C	C	.	.	S	Bend	trans	-116.7	-158.4	169.6	-92.2	-79.8	0	0	0	108.9	L106 N109 R110 L111 L130 L135 Y156 N157	L106-N133 PolarHBondContact O-ND2 2.94Å; N109-N133 WeakPolarHBondContact CA-OD1 3.42Å; N109-N133 WeakPolarHBondContact CB-OD1 3.32Å; R110-N133 PolarHBondContact N-OD1 2.88Å; L111-N133 HydrophobicContact CB-CB 4.43Å; L111-N133 WeakPolarHBondContact CB-OD1 3.46Å; L111-N133 WeakPolarHBondContact CG-OD1 3.18Å; L111-N133 PolarHBondContact N-OD1 3.41Å; L130-N133 PolarHBondContact O-ND2 2.81Å; N133-L135 HydrophobicContact CB-CG 4.18Å; N133-Y156 PolarHBondContact N-O 3.32Å; N133-N157 VanDerWaalsContact CA-OD1 3.31Å; N133-N157 WeakPolarHBondContact CA-OD1 3.27Å; N133-N157 WeakPolarHBondContact CB-OD1 3.33Å
134	Q	97.6	Very high	96.5	Very high	92 Å²	92	44.4 Å²	44.4	43%	0.43	23%	0.23	S	C	.	.			trans	-129.5	26.2	179.3	-60.6	-179.1	-4.7	0	0	110.7	L111 T112 T136 N157 N158	L111-Q134 CarbonylContact O-C 3.34Å; L111-Q134 VanDerWaalsContact O-CA 3.32Å; L111-Q134 WeakPolarHBondContact O-CA 3.31Å; L111-Q134 PolarHBondContact O-N 2.83Å; T112-Q134 HydrophobicContact CG2-CB 4.25Å; Q134-T136 PolarHBondContact O-N 2.9Å; Q134-N157 PolarHBondContact N-OD1 2.73Å; Q134-N158 PolarHBondContact O-ND2 3.09Å
135	L	98.2	Very high	96.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.23	C	C	.	.			trans	-63.4	119.5	-172.3	-63.5	174.9	0	0	0	110.3	L111 T112 I114 N133 L154 N157 N158 L159	L111-L135 HydrophobicContact CB-CD2 3.71Å; L111-L135 HydrophobicContact CB-CG 4.48Å; L111-L135 PolarHBondContact O-N 2.91Å; L111-L135 VanDerWaalsContact O-N 3.12Å; T112-L135 WeakPolarHBondContact O-CA 3.24Å; I114-L135 HydrophobicContact CD1-CD1 4.39Å; I114-L135 HydrophobicContact CD1-CD2 3.85Å; I114-L135 HydrophobicContact CG1-CD1 4.12Å; I114-L135 HydrophobicContact CG1-CD2 3.86Å; N133-L135 HydrophobicContact CB-CG 4.18Å; L135-L154 HydrophobicContact CD1-CD2 4.47Å; L135-N157 HydrophobicContact CB-CB 4.26Å; L135-N157 WeakPolarHBondContact CB-OD1 3.47Å; L135-N157 WeakPolarHBondContact CG-OD1 3.37Å; L135-N157 PolarHBondContact N-OD1 3.12Å; L135-N158 CarbonylContact O-C 3.13Å; L135-N158 VanDerWaalsContact O-CA 3.28Å; L135-N158 WeakPolarHBondContact O-CA 3.2Å; L135-N158 WeakPolarHBondContact O-CB 3.45Å; L135-N158 PolarHBondContact O-N 3.43Å; L135-L159 HydrophobicContact CB-CD2 3.85Å; L135-L159 HydrophobicContact CB-CG 4.31Å; L135-L159 PolarHBondContact O-N 2.75Å
136	T	97.1	Very high	96.1	Very high	81 Å²	81	43.6 Å²	43.6	50%	0.497	23%	0.23	S	C	.	.			trans	-99.2	-24.4	171.9	65.1	0	0	0	0	112.1	T112 Q134 N158	T112-T136 PolarHBondContact O-N 3.42Å; T112-T136 PolarHBondContact O-OG1 3.31Å; Q134-T136 PolarHBondContact O-N 2.9Å; T136-N158 HydrophobicContact CG2-CB 3.95Å
137	L	96.1	Very high	95.8	Very high	100 Å²	100	44.4 Å²	44.4	52%	0.524	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	133.8	-176.6	-174.5	147.7	0	0	0	112.1	R113 I114	R113-L137 VanDerWaalsContact CA-O 3.31Å; R113-L137 WeakPolarHBondContact CA-O 3.28Å; I114-L137 PolarHBondContact N-O 2.84Å; I114-L137 VanDerWaalsContact N-O 3.08Å
138	I	97.1	Very high	95.7	Very high	11 Å²	11	42.6 Å²	42.6	6%	0.056	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.8	167.8	-63.4	167.6	0	0	0	107.1	I114 A142 F143 L154 L159 I162 P163	I114-I138 HydrophobicContact CB-CG1 4.25Å; I114-I138 HydrophobicContact CB-CG2 4.27Å; I114-I138 HydrophobicContact CG1-CG1 4.14Å; I138-A142 HydrophobicContact CG2-CB 4.11Å; I138-F143 HydrophobicContact CD1-CE2 4.38Å; I138-F143 HydrophobicContact CD1-CZ 3.99Å; I138-F143 HydrophobicContact CG2-CE1 4.21Å; I138-F143 HydrophobicContact CG2-CE2 4.27Å; I138-F143 HydrophobicContact CG2-CZ 4.01Å; I138-L154 HydrophobicContact CD1-CD1 4.06Å; I138-L154 HydrophobicContact CD1-CD2 3.9Å; I138-L159 HydrophobicContact CD1-CD1 3.87Å; I138-L159 HydrophobicContact CD1-CD2 3.85Å; I138-L159 HydrophobicContact CG1-CD2 3.86Å; I138-I162 HydrophobicContact CD1-CG2 4.3Å; I138-P163 HydrophobicContact CG2-CG 3.97Å
139	H	95.9	Very high	95.6	Very high	87 Å²	87	42.6 Å²	42.6	40%	0.403	23%	0.232	S	C	.	.			trans	-65	138.7	179.4	-176.9	-86.7	0	0	0	111.2	I114 G141 A142	I114-H139 WeakPolarHBondContact O-CB 3.27Å; I114-H139 PolarHBondContact O-N 3.24Å; H139-G141 VanDerWaalsContact C-N 3.33Å; H139-G141 PolarHBondContact ND1-N 2.86Å; H139-G141 PolarHBondContact O-N 2.8Å; H139-G141 VanDerWaalsContact O-N 3.15Å; H139-A142 HydrophobicContact CB-CB 4.45Å; H139-A142 WeakPolarHBondContact O-CB 3.5Å; H139-A142 PolarHBondContact O-N 3.32Å
140	L	93	Very high	95.6	Very high	134 Å²	134	45.2 Å²	45.2	70%	0.702	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-47.8	-50.1	-172.1	-66.9	173.3	0	0	0	113.7	A142 P163	L140-A142 VanDerWaalsContact C-N 3.3Å; L140-A142 PolarHBondContact O-N 2.58Å; L140-P163 WeakPolarHBondContact O-CB 3.18Å
141	G	92.6	Very high	95.6	Very high	21 Å²	21	48.1 Å²	48.1	22%	0.216	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-76.5	0.3	180	0	0	0	0	0	116.8	H139 F143 N144	H139-G141 VanDerWaalsContact C-N 3.33Å; H139-G141 PolarHBondContact ND1-N 2.86Å; H139-G141 PolarHBondContact O-N 2.8Å; H139-G141 VanDerWaalsContact O-N 3.15Å; G141-F143 VanDerWaalsContact C-N 3.27Å; G141-F143 PolarHBondContact O-N 2.88Å; G141-N144 WeakPolarHBondContact O-CB 3.22Å; G141-N144 PolarHBondContact O-N 3.05Å
142	A	95.1	Very high	95.6	Very high	4 Å²	4	46.9 Å²	46.9	3%	0.033	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-69.2	-19.5	-171.6	0	0	0	0	0	115	I114 I138 H139 L140	I114-A142 HydrophobicContact CG2-CB 3.74Å; I138-A142 HydrophobicContact CG2-CB 4.11Å; H139-A142 HydrophobicContact CB-CB 4.45Å; H139-A142 WeakPolarHBondContact O-CB 3.5Å; H139-A142 PolarHBondContact O-N 3.32Å; L140-A142 VanDerWaalsContact C-N 3.3Å; L140-A142 PolarHBondContact O-N 2.58Å
143	F	95.3	Very high	95.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-107.9	7.1	179	-66.2	-14.9	0	0	0	113.2	F119 L128 I138 G141 D145 L146 L152 L154 P163 A166 I167 M170	F119-F143 HydrophobicContact CD2-CD1 4.22Å; F119-F143 HydrophobicContact CD2-CE1 4.06Å; F119-F143 HydrophobicContact CE2-CE1 4.01Å; L128-F143 HydrophobicContact CD2-CE1 4.04Å; I138-F143 HydrophobicContact CD1-CE2 4.38Å; I138-F143 HydrophobicContact CD1-CZ 3.99Å; I138-F143 HydrophobicContact CG2-CE1 4.21Å; I138-F143 HydrophobicContact CG2-CE2 4.27Å; I138-F143 HydrophobicContact CG2-CZ 4.01Å; G141-F143 VanDerWaalsContact C-N 3.27Å; G141-F143 PolarHBondContact O-N 2.88Å; F143-D145 VanDerWaalsContact C-N 3.26Å; F143-D145 PolarHBondContact O-N 3.37Å; F143-L146 HydrophobicContact CB-CD1 4.37Å; F143-L146 HydrophobicContact CD1-CD1 3.68Å; F143-L146 HydrophobicContact CE1-CD1 4.34Å; F143-L146 HydrophobicContact CG-CD1 4.27Å; F143-L146 PolarHBondContact O-N 3.2Å; F143-L146 VanDerWaalsContact O-N 3.1Å; F143-L152 HydrophobicContact CE2-CD2 3.97Å; F143-L152 HydrophobicContact CZ-CD1 4.33Å; F143-L154 HydrophobicContact CE2-CD1 4.41Å; F143-L154 HydrophobicContact CZ-CD1 4.47Å; F143-L154 HydrophobicContact CZ-CD2 4.47Å; F143-P163 HydrophobicContact CB-CG 4.47Å; F143-P163 HydrophobicContact CD2-CG 3.51Å; F143-P163 HydrophobicContact CE2-CG 3.97Å; F143-P163 HydrophobicContact CG-CG 4.13Å; F143-A166 HydrophobicContact CB-CB 3.81Å; F143-I167 HydrophobicContact CD2-CG1 4.47Å; F143-M170 HydrophobicContact CB-CE 3.74Å; F143-M170 HydrophobicContact CD2-CE 4.15Å; F143-M170 HydrophobicContact CG-CE 4.15Å
144	N	91.6	Very high	95.6	Very high	78 Å²	78	44.3 Å²	44.3	42%	0.417	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.9	-172.4	-78.8	-1.5	0	0	0	114.5	G141 L147 R169	G141-N144 WeakPolarHBondContact O-CB 3.22Å; G141-N144 PolarHBondContact O-N 3.05Å; N144-L147 WeakPolarHBondContact O-CD2 3.35Å; N144-R169 PolarHBondContact O-NH1 3.39Å
145	D	90	Very high	95.6	Very high	71 Å²	71	40.1 Å²	40.1	38%	0.38	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-15.9	-178.3	-66.7	-3.4	0	0	0	113.3	S120 G121 F143 L147	S120-D145 WeakPolarHBondContact CA-OD2 3.44Å; G121-D145 PolarHBondContact N-OD2 3.33Å; F143-D145 VanDerWaalsContact C-N 3.26Å; F143-D145 PolarHBondContact O-N 3.37Å; D145-L147 PolarHBondContact O-N 2.92Å
146	L	93	Very high	95.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.238	C	C	.	.			trans	-85.7	49.2	-167.6	-56.8	-177.2	0	0	0	112.5	F119 M122 L125 L128 F143 L149 M170	F119-L146 HydrophobicContact CB-CD1 4.43Å; F119-L146 HydrophobicContact CD2-CD1 4.46Å; M122-L146 HydrophobicContact CB-CD2 4.11Å; M122-L146 HydrophobicContact CE-CD2 4.34Å; L125-L146 HydrophobicContact CB-CD2 4.26Å; L125-L146 HydrophobicContact CD2-CD2 4.14Å; L128-L146 HydrophobicContact CD2-CD1 3.69Å; F143-L146 HydrophobicContact CB-CD1 4.37Å; F143-L146 HydrophobicContact CD1-CD1 3.68Å; F143-L146 HydrophobicContact CE1-CD1 4.34Å; F143-L146 HydrophobicContact CG-CD1 4.27Å; F143-L146 PolarHBondContact O-N 3.2Å; F143-L146 VanDerWaalsContact O-N 3.1Å; L146-L149 WeakPolarHBondContact O-CB 3.49Å; L146-M170 HydrophobicContact CB-CE 4.11Å
147	L	91.8	Very high	95.7	Very high	75 Å²	75	41.7 Å²	41.7	39%	0.393	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-20.8	-172.2	-52.9	-176.6	0	0	0	114	N144 D145 L149 R169	N144-L147 WeakPolarHBondContact O-CD2 3.35Å; D145-L147 PolarHBondContact O-N 2.92Å; L147-L149 VanDerWaalsContact C-N 3.29Å; L147-R169 HydrophobicContact CD2-CB 4.4Å
148	A	95	Very high	95.8	Very high	26 Å²	26	40.7 Å²	40.7	22%	0.215	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	2.6	178.4	0	0	0	0	0	113.7	S123 L125 E150	S123-A148 WeakPolarHBondContact O-CB 3.43Å; L125-A148 CarbonylContact O-C 3.4Å; L125-A148 VanDerWaalsContact O-C 3.27Å; A148-E150 PolarHBondContact O-N 3.05Å
149	L	96.9	Very high	95.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.209	C	C	.	.			trans	-66.8	131.8	-170.1	-153.4	71.4	0	0	0	111.9	L125 H126 L128 L146 L147 L152 M170 S172 L173	L125-L149 HydrophobicContact CB-CD1 4.4Å; L125-L149 HydrophobicContact CD2-CD1 4.05Å; L125-L149 HydrophobicContact CG-CD1 4.16Å; L125-L149 WeakPolarHBondContact O-CA 3.47Å; L125-L149 PolarHBondContact O-N 3.32Å; H126-L149 WeakPolarHBondContact O-CD1 3.39Å; L128-L149 HydrophobicContact CB-CD1 3.86Å; L128-L149 HydrophobicContact CB-CD2 4.33Å; L146-L149 WeakPolarHBondContact O-CB 3.49Å; L147-L149 VanDerWaalsContact C-N 3.29Å; L149-L152 HydrophobicContact CD2-CB 3.76Å; L149-L152 HydrophobicContact CD2-CD1 4.16Å; L149-L152 HydrophobicContact CD2-CD2 4.37Å; L149-L152 HydrophobicContact CD2-CG 4.31Å; L149-M170 HydrophobicContact CB-SD 4.22Å; L149-M170 HydrophobicContact CD2-CE 4.15Å; L149-M170 HydrophobicContact CD2-SD 3.86Å; L149-S172 CarbonylContact O-C 3.16Å; L149-L173 HydrophobicContact CD2-CD1 4.38Å; L149-L173 HydrophobicContact CG-CD1 4.38Å; L149-L173 VanDerWaalsContact O-CA 3.32Å; L149-L173 WeakPolarHBondContact O-CA 3.23Å; L149-L173 PolarHBondContact O-N 3.33Å; L149-L173 VanDerWaalsContact O-N 3.09Å
150	E	97.4	Very high	95.9	Very high	66 Å²	66	42.4 Å²	42.4	31%	0.308	22%	0.22	S	C	.	.	S	Bend	trans	-110.6	-28.4	178.8	-59.9	-170.6	137.9	0	0	111.1	H126 A148 A174 T175	H126-E150 HydrophobicContact CB-CB 4.43Å; H126-E150 HydrophobicContact CB-CG 4.27Å; H126-E150 IonicContact CE1-OE1 2.75Å; H126-E150 IonicContact CE1-OE2 3.87Å; H126-E150 IonicContact CG-OE2 3.25Å; H126-E150 IonicContact ND1-OE1 3.48Å; H126-E150 IonicContact ND1-OE2 2.69Å; H126-E150 PolarHBondContact ND1-OE2 3.49Å; H126-E150 PolarHBondContact O-N 3.27Å; A148-E150 PolarHBondContact O-N 3.05Å; E150-A174 WeakPolarHBondContact O-CA 3.16Å; E150-A174 WeakPolarHBondContact O-CB 3.45Å; E150-A174 PolarHBondContact O-N 2.87Å; E150-T175 PolarHBondContact O-N 3.2Å; E150-T175 VanDerWaalsContact O-N 3.07Å
151	E	98.2	Very high	96	Very high	61 Å²	61	38 Å²	38	29%	0.285	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	122.5	178.3	-177.9	174.6	-148.5	0	0	111.4	H126 H127 L128 I129 T175	H126-E151 PolarHBondContact O-N 2.8Å; H127-E151 IonicContact CE1-OE2 2.71Å; H127-E151 IonicContact CG-OE2 2.67Å; H127-E151 IonicContact ND1-OE2 3.1Å; H127-E151 PolarHBondContact ND1-OE2 2.76Å; L128-E151 PolarHBondContact N-O 3.3Å; I129-E151 HydrophobicContact CD1-CG 3.81Å; E151-T175 HydrophobicContact CG-CG2 4.36Å
152	L	98.3	Very high	96.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	115.2	172.1	179.7	55.3	0	0	0	109.6	L128 F143 L149 L154 I167 L173 T175 L176 S177	L128-L152 HydrophobicContact CB-CD1 4.15Å; L128-L152 HydrophobicContact CD2-CD1 4.06Å; L128-L152 HydrophobicContact CG-CD1 4.14Å; F143-L152 HydrophobicContact CE2-CD2 3.97Å; F143-L152 HydrophobicContact CZ-CD1 4.33Å; L149-L152 HydrophobicContact CD2-CB 3.76Å; L149-L152 HydrophobicContact CD2-CD1 4.16Å; L149-L152 HydrophobicContact CD2-CD2 4.37Å; L149-L152 HydrophobicContact CD2-CG 4.31Å; L152-L154 HydrophobicContact CD1-CD1 4.3Å; L152-L154 HydrophobicContact CD1-CD2 4.33Å; L152-L154 HydrophobicContact CD1-CG 4Å; L152-L154 HydrophobicContact CD2-CD1 4.14Å; L152-L154 HydrophobicContact CG-CD1 4.18Å; L152-L154 HydrophobicContact CG-CG 4.16Å; L152-I167 HydrophobicContact CD2-CD1 4.38Å; L152-I167 HydrophobicContact CD2-CG1 4.44Å; L152-L173 HydrophobicContact CB-CD1 4Å; L152-T175 PolarHBondContact N-O 2.6Å; L152-L176 HydrophobicContact CB-CD1 3.97Å; L152-L176 HydrophobicContact CD2-CD1 3.88Å; L152-L176 HydrophobicContact CG-CD1 3.98Å; L152-L176 WeakPolarHBondContact O-CA 3.45Å; L152-S177 PolarHBondContact O-N 3.01Å
153	D	98.6	Very high	96.3	Very high	22 Å²	22	37.5 Å²	37.5	12%	0.118	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	109.1	178.4	178.3	11.2	0	0	0	110.4	L128 I129 L130 N131 S155	L128-D153 PolarHBondContact O-N 3.42Å; I129-D153 HydrophobicContact CD1-CB 3.84Å; I129-D153 HydrophobicContact CG2-CB 4.27Å; L130-D153 WeakPolarHBondContact CA-O 3.47Å; L130-D153 WeakPolarHBondContact CB-O 3.48Å; L130-D153 PolarHBondContact N-O 2.95Å; N131-D153 WeakPolarHBondContact CB-OD1 3.4Å; N131-D153 WeakPolarHBondContact CB-OD2 3.43Å; N131-D153 VanDerWaalsContact CG-OD2 3.28Å; N131-D153 PolarHBondContact N-O 3.34Å; N131-D153 PolarHBondContact OD1-OD2 2.83Å; D153-S155 WeakPolarHBondContact OD1-CB 3.31Å; D153-S155 PolarHBondContact OD1-N 3.37Å; D153-S155 VanDerWaalsContact OD1-N 3.08Å; D153-S155 PolarHBondContact OD1-OG 2.83Å
154	L	98.4	Very high	96.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.195	C	C	.	.			trans	-112.9	11.3	178.5	-67.4	170	0	0	0	112.1	L130 L135 I138 F143 L152 N157 L159 I162 S177 L178 N181	L130-L154 HydrophobicContact CB-CD2 3.97Å; L130-L154 HydrophobicContact CD1-CD2 3.73Å; L135-L154 HydrophobicContact CD1-CD2 4.47Å; I138-L154 HydrophobicContact CD1-CD1 4.06Å; I138-L154 HydrophobicContact CD1-CD2 3.9Å; F143-L154 HydrophobicContact CE2-CD1 4.41Å; F143-L154 HydrophobicContact CZ-CD1 4.47Å; F143-L154 HydrophobicContact CZ-CD2 4.47Å; L152-L154 HydrophobicContact CD1-CD1 4.3Å; L152-L154 HydrophobicContact CD1-CD2 4.33Å; L152-L154 HydrophobicContact CD1-CG 4Å; L152-L154 HydrophobicContact CD2-CD1 4.14Å; L152-L154 HydrophobicContact CG-CD1 4.18Å; L152-L154 HydrophobicContact CG-CG 4.16Å; L154-N157 PolarHBondContact O-ND2 3.08Å; L154-L159 HydrophobicContact CB-CD1 4.05Å; L154-L159 HydrophobicContact CD1-CD1 4.23Å; L154-L159 HydrophobicContact CD2-CD1 4.35Å; L154-L159 HydrophobicContact CG-CD1 4.46Å; L154-I162 HydrophobicContact CD1-CG2 4.23Å; L154-S177 PolarHBondContact N-O 3.08Å; L154-L178 HydrophobicContact CB-CD2 4.08Å; L154-L178 HydrophobicContact CD1-CD2 3.88Å; L154-N181 PolarHBondContact O-ND2 2.83Å
155	S	98.4	Very high	96.4	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.028	21%	0.211	C	C	.	.			trans	-65	154.6	-169.4	-61.2	0	0	0	0	114	N131 N132 D153 N157 S177 D179	N131-S155 CarbonylContact C-O 3.47Å; N131-S155 WeakPolarHBondContact CA-O 3.29Å; N131-S155 VanDerWaalsContact CB-O 3.31Å; N131-S155 WeakPolarHBondContact CB-O 3.29Å; N132-S155 PolarHBondContact N-O 2.96Å; D153-S155 WeakPolarHBondContact OD1-CB 3.31Å; D153-S155 PolarHBondContact OD1-N 3.37Å; D153-S155 VanDerWaalsContact OD1-N 3.08Å; D153-S155 PolarHBondContact OD1-OG 2.83Å; S155-N157 PolarHBondContact O-ND2 3.46Å; S155-S177 VanDerWaalsContact OG-CB 3.26Å; S155-S177 WeakPolarHBondContact OG-CB 3.3Å; S155-D179 CarbonylContact C-O 3.58Å; S155-D179 WeakPolarHBondContact CA-O 3.21Å; S155-D179 WeakPolarHBondContact CB-O 3.16Å; S155-D179 WeakPolarHBondContact CB-OD1 3.43Å; S155-D179 VanDerWaalsContact OG-CG 3.26Å; S155-D179 PolarHBondContact OG-N 2.89Å; S155-D179 PolarHBondContact OG-OD1 3.05Å
156	Y	98.4	Very high	96.6	Very high	107 Å²	107	39.1 Å²	39.1	42%	0.42	20%	0.195	S	C	.	.	S	Bend	trans	53.1	64.6	-174.8	-62	-98.1	0	0	0	112.2	N132 N133 D179 H180	N132-Y156 VanDerWaalsContact CA-O 3.25Å; N132-Y156 WeakPolarHBondContact CA-O 3.15Å; N132-Y156 PolarHBondContact N-O 3.34Å; N132-Y156 WeakPolarHBondContact ND2-CB 3.35Å; N132-Y156 VanDerWaalsContact ND2-CG 3.3Å; N133-Y156 PolarHBondContact N-O 3.32Å; Y156-D179 VanDerWaalsContact CE2-OD2 3.24Å; Y156-D179 WeakPolarHBondContact CE2-OD2 3.17Å; Y156-D179 PolarHBondContact N-O 3.48Å; Y156-H180 WeakPolarHBondContact CA-O 3.41Å; Y156-H180 HydrophobicContact CD1-CB 3.72Å; Y156-H180 AromaticContact CD1-CG 3.93Å; Y156-H180 HydrophobicContact CD2-CB 4.22Å; Y156-H180 HydrophobicContact CE1-CB 3.94Å; Y156-H180 AromaticContact CE1-CD2 3.98Å; Y156-H180 AromaticContact CE1-CG 3.59Å; Y156-H180 AromaticContact CE1-ND1 3.77Å; Y156-H180 HydrophobicContact CE2-CB 4.39Å; Y156-H180 AromaticContact CE2-ND1 3.61Å; Y156-H180 HydrophobicContact CG-CB 3.87Å; Y156-H180 AromaticContact CZ-CE1 3.76Å; Y156-H180 AromaticContact CZ-CG 3.68Å; Y156-H180 AromaticContact CZ-ND1 3.33Å; Y156-H180 VanDerWaalsContact CZ-ND1 3.33Å; Y156-H180 PolarHBondContact N-O 2.72Å; Y156-H180 PolarHBondContact OH-CE1 3.05Å; Y156-H180 PolarHBondContact OH-ND1 3.49Å
157	N	98.6	Very high	96.7	Very high	7 Å²	7	39 Å²	39	4%	0.037	19%	0.194	C	C	.	.	S	Bend	trans	-137.2	-172.8	174.2	-84.9	-76.3	0	0	0	109.7	L130 N133 Q134 L135 L154 S155 L159 H180 N181	L130-N157 PolarHBondContact O-ND2 3.43Å; N133-N157 VanDerWaalsContact CA-OD1 3.31Å; N133-N157 WeakPolarHBondContact CA-OD1 3.27Å; N133-N157 WeakPolarHBondContact CB-OD1 3.33Å; Q134-N157 PolarHBondContact N-OD1 2.73Å; L135-N157 HydrophobicContact CB-CB 4.26Å; L135-N157 WeakPolarHBondContact CB-OD1 3.47Å; L135-N157 WeakPolarHBondContact CG-OD1 3.37Å; L135-N157 PolarHBondContact N-OD1 3.12Å; L154-N157 PolarHBondContact O-ND2 3.08Å; S155-N157 PolarHBondContact O-ND2 3.46Å; N157-L159 HydrophobicContact CB-CD1 4.24Å; N157-L159 HydrophobicContact CB-CG 4.13Å; N157-H180 PolarHBondContact N-O 2.82Å; N157-H180 VanDerWaalsContact N-O 3.08Å; N157-H180 VanDerWaalsContact O-O 3.1Å; N157-N181 WeakPolarHBondContact CA-OD1 3.21Å; N157-N181 WeakPolarHBondContact CB-OD1 3.22Å; N157-N181 PolarHBondContact O-OD1 2.85Å
158	N	98.1	Very high	96.8	Very high	79 Å²	79	38.7 Å²	38.7	42%	0.422	19%	0.191	S	C	.	.			trans	-114.7	31.8	-177.8	-54.1	-54.9	0	0	0	111.2	Q134 L135 T136 E160	Q134-N158 PolarHBondContact O-ND2 3.09Å; L135-N158 CarbonylContact O-C 3.13Å; L135-N158 VanDerWaalsContact O-CA 3.28Å; L135-N158 WeakPolarHBondContact O-CA 3.2Å; L135-N158 WeakPolarHBondContact O-CB 3.45Å; L135-N158 PolarHBondContact O-N 3.43Å; T136-N158 HydrophobicContact CG2-CB 3.95Å; N158-E160 PolarHBondContact O-N 2.91Å
159	L	98.2	Very high	96.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.201	C	C	.	.			trans	-78.3	119.1	-171.3	-62	166.6	0	0	0	110.8	L135 I138 L154 N157 I162 N181 M182 I183	L135-L159 HydrophobicContact CB-CD2 3.85Å; L135-L159 HydrophobicContact CB-CG 4.31Å; L135-L159 PolarHBondContact O-N 2.75Å; I138-L159 HydrophobicContact CD1-CD1 3.87Å; I138-L159 HydrophobicContact CD1-CD2 3.85Å; I138-L159 HydrophobicContact CG1-CD2 3.86Å; L154-L159 HydrophobicContact CB-CD1 4.05Å; L154-L159 HydrophobicContact CD1-CD1 4.23Å; L154-L159 HydrophobicContact CD2-CD1 4.35Å; L154-L159 HydrophobicContact CG-CD1 4.46Å; N157-L159 HydrophobicContact CB-CD1 4.24Å; N157-L159 HydrophobicContact CB-CG 4.13Å; L159-I162 HydrophobicContact CB-CG2 4.29Å; L159-I162 HydrophobicContact CD1-CG2 3.91Å; L159-N181 VanDerWaalsContact CB-OD1 3.31Å; L159-N181 WeakPolarHBondContact CB-OD1 3.39Å; L159-N181 WeakPolarHBondContact CG-OD1 3.5Å; L159-N181 PolarHBondContact N-OD1 2.98Å; L159-N181 VanDerWaalsContact N-OD1 3.09Å; L159-M182 CarbonylContact O-C 3.27Å; L159-M182 VanDerWaalsContact O-CA 3.29Å; L159-M182 WeakPolarHBondContact O-CA 3.38Å; L159-M182 WeakPolarHBondContact O-CB 3.45Å; L159-M182 PolarHBondContact O-N 2.91Å; L159-I183 WeakPolarHBondContact O-CG1 3.34Å; L159-I183 PolarHBondContact O-N 3.15Å; L159-I183 VanDerWaalsContact O-N 3.13Å
160	E	96.3	Very high	96.6	Very high	135 Å²	135	42.8 Å²	42.8	63%	0.631	20%	0.201	S	C	*	.	S	Bend	trans	-78.1	-32.9	169	-65.7	172.7	177	0	0	111.1	N158 M182 I183	N158-E160 PolarHBondContact O-N 2.91Å; E160-M182 HydrophobicContact CG-CB 4.25Å; E160-I183 WeakPolarHBondContact O-CA 3.35Å
161	S	96.3	Very high	96.4	Very high	42 Å²	42	43.5 Å²	43.5	29%	0.294	21%	0.209	S	C	.	.			trans	-157.4	164.8	175.5	-155.7	0	0	0	0	111.3	W164	S161-W164 PolarHBondContact OG-NE1 2.94Å
162	I	96.5	Very high	96.3	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.041	21%	0.205	C	C	.	.			trans	-134.3	160.9	-176.5	64.9	-178.1	0	0	0	110	I138 L154 L159 W164 I167 L178 I183	I138-I162 HydrophobicContact CD1-CG2 4.3Å; L154-I162 HydrophobicContact CD1-CG2 4.23Å; L159-I162 HydrophobicContact CB-CG2 4.29Å; L159-I162 HydrophobicContact CD1-CG2 3.91Å; I162-W164 VanDerWaalsContact C-N 3.29Å; I162-W164 HydrophobicContact CD1-CD2 4.42Å; I162-W164 HydrophobicContact CD1-CE3 3.95Å; I162-W164 HydrophobicContact CD1-CH2 3.65Å; I162-W164 HydrophobicContact CD1-CZ2 4.13Å; I162-W164 HydrophobicContact CD1-CZ3 3.55Å; I162-W164 HydrophobicContact CG1-CD2 3.74Å; I162-W164 HydrophobicContact CG1-CE3 3.77Å; I162-W164 HydrophobicContact CG1-CG 4.5Å; I162-W164 HydrophobicContact CG1-CH2 3.75Å; I162-W164 HydrophobicContact CG1-CZ2 3.69Å; I162-W164 HydrophobicContact CG1-CZ3 3.79Å; I162-W164 PolarHBondContact O-N 3.39Å; I162-W164 PolarHBondContact O-NE1 3.28Å; I162-I167 HydrophobicContact CB-CD1 4.39Å; I162-I167 HydrophobicContact CD1-CD1 3.38Å; I162-I167 HydrophobicContact CG1-CD1 3.76Å; I162-L178 HydrophobicContact CD1-CD1 3.79Å; I162-L178 HydrophobicContact CD1-CD2 3.6Å; I162-L178 HydrophobicContact CD1-CG 4.38Å; I162-I183 HydrophobicContact CG2-CD1 4.45Å
163	P	96.2	Very high	96.2	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.032	21%	0.205	C	C	.	.			trans	-73.4	79.1	-177.9	29.8	-36.9	0	0	0	112.5	I138 L140 F143 E165 A166 I167	I138-P163 HydrophobicContact CG2-CG 3.97Å; L140-P163 WeakPolarHBondContact O-CB 3.18Å; F143-P163 HydrophobicContact CB-CG 4.47Å; F143-P163 HydrophobicContact CD2-CG 3.51Å; F143-P163 HydrophobicContact CE2-CG 3.97Å; F143-P163 HydrophobicContact CG-CG 4.13Å; P163-E165 VanDerWaalsContact C-N 3.3Å; P163-E165 PolarHBondContact O-N 2.89Å; P163-A166 HydrophobicContact CB-CB 4.21Å; P163-A166 WeakPolarHBondContact O-CB 3.4Å; P163-A166 PolarHBondContact O-N 2.84Å; P163-I167 PolarHBondContact O-N 2.88Å
164	W	95.4	Very high	96	Very high	16 Å²	16	41.9 Å²	41.9	6%	0.061	21%	0.208	C	C	.	.	H	α-helix	trans	-55.1	-39.6	-176.6	-57.2	110.3	0	0	0	113.6	S161 I162 A166 I167 Q168 L178 I183 Y185 I186 P187 T190	S161-W164 PolarHBondContact OG-NE1 2.94Å; I162-W164 VanDerWaalsContact C-N 3.29Å; I162-W164 HydrophobicContact CD1-CD2 4.42Å; I162-W164 HydrophobicContact CD1-CE3 3.95Å; I162-W164 HydrophobicContact CD1-CH2 3.65Å; I162-W164 HydrophobicContact CD1-CZ2 4.13Å; I162-W164 HydrophobicContact CD1-CZ3 3.55Å; I162-W164 HydrophobicContact CG1-CD2 3.74Å; I162-W164 HydrophobicContact CG1-CE3 3.77Å; I162-W164 HydrophobicContact CG1-CG 4.5Å; I162-W164 HydrophobicContact CG1-CH2 3.75Å; I162-W164 HydrophobicContact CG1-CZ2 3.69Å; I162-W164 HydrophobicContact CG1-CZ3 3.79Å; I162-W164 PolarHBondContact O-N 3.39Å; I162-W164 PolarHBondContact O-NE1 3.28Å; W164-A166 VanDerWaalsContact C-N 3.26Å; W164-A166 PolarHBondContact O-N 2.87Å; W164-I167 HydrophobicContact CE3-CD1 4.45Å; W164-I167 PolarHBondContact O-N 2.82Å; W164-I167 VanDerWaalsContact O-N 3.14Å; W164-Q168 WeakPolarHBondContact O-CB 3.37Å; W164-Q168 PolarHBondContact O-N 2.8Å; W164-L178 HydrophobicContact CH2-CD1 4.1Å; W164-L178 HydrophobicContact CZ3-CD1 4.26Å; W164-I183 HydrophobicContact CH2-CG2 4.25Å; W164-I183 HydrophobicContact CZ2-CG2 3.8Å; W164-Y185 WeakPolarHBondContact CZ2-O 3.3Å; W164-I186 HydrophobicContact CE3-CG2 4.27Å; W164-I186 HydrophobicContact CH2-CB 4.24Å; W164-I186 HydrophobicContact CH2-CD1 4.25Å; W164-I186 HydrophobicContact CH2-CG1 3.75Å; W164-I186 HydrophobicContact CH2-CG2 3.98Å; W164-I186 HydrophobicContact CZ2-CB 4.45Å; W164-I186 HydrophobicContact CZ2-CG1 4.13Å; W164-I186 HydrophobicContact CZ2-CG2 4.46Å; W164-I186 HydrophobicContact CZ3-CG1 4.44Å; W164-I186 HydrophobicContact CZ3-CG2 3.88Å; W164-P187 HydrophobicContact CB-CG 3.8Å; W164-P187 HydrophobicContact CD2-CG 4.19Å; W164-P187 VanDerWaalsContact CG-CD 3.48Å; W164-P187 HydrophobicContact CG-CG 3.57Å; W164-T190 HydrophobicContact CE3-CG2 3.81Å; W164-T190 HydrophobicContact CZ3-CG2 4.45Å
165	E	93.6	Very high	96	Very high	163 Å²	163	43.1 Å²	43.1	76%	0.762	22%	0.215	S	C	*	.	H	α-helix	trans	-60	-33.7	175.7	-62	-176.5	166.1	0	0	113.1	P163 R169	P163-E165 VanDerWaalsContact C-N 3.3Å; P163-E165 PolarHBondContact O-N 2.89Å; E165-R169 WeakPolarHBondContact O-CD 3.5Å; E165-R169 WeakPolarHBondContact O-CG 3.43Å
166	A	94.4	Very high	95.9	Very high	4 Å²	4	42.9 Å²	42.9	3%	0.033	21%	0.214	C	C	.	.	H	α-helix	trans	-75.5	-38.9	176	0	0	0	0	0	111	F143 P163 W164 R169	F143-A166 HydrophobicContact CB-CB 3.81Å; P163-A166 HydrophobicContact CB-CB 4.21Å; P163-A166 WeakPolarHBondContact O-CB 3.4Å; P163-A166 PolarHBondContact O-N 2.84Å; W164-A166 VanDerWaalsContact C-N 3.26Å; W164-A166 PolarHBondContact O-N 2.87Å; A166-R169 WeakPolarHBondContact O-CB 3.48Å; A166-R169 PolarHBondContact O-N 3.41Å
167	I	95.2	Very high	95.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.6	-41.8	178.1	-64.8	171	0	0	0	111.1	F143 L152 I162 P163 W164 R169 M170 L173 L176 L194	F143-I167 HydrophobicContact CD2-CG1 4.47Å; L152-I167 HydrophobicContact CD2-CD1 4.38Å; L152-I167 HydrophobicContact CD2-CG1 4.44Å; I162-I167 HydrophobicContact CB-CD1 4.39Å; I162-I167 HydrophobicContact CD1-CD1 3.38Å; I162-I167 HydrophobicContact CG1-CD1 3.76Å; P163-I167 PolarHBondContact O-N 2.88Å; W164-I167 HydrophobicContact CE3-CD1 4.45Å; W164-I167 PolarHBondContact O-N 2.82Å; W164-I167 VanDerWaalsContact O-N 3.14Å; I167-R169 PolarHBondContact O-N 3.31Å; I167-M170 HydrophobicContact CG1-SD 4.41Å; I167-M170 WeakPolarHBondContact O-CB 3.34Å; I167-M170 PolarHBondContact O-N 3.02Å; I167-L173 HydrophobicContact CG2-CD2 4.18Å; I167-L176 HydrophobicContact CG2-CD2 4.12Å; I167-L194 HydrophobicContact CG2-CD1 4.24Å
168	Q	94.1	Very high	95.9	Very high	68 Å²	68	38.3 Å²	38.3	32%	0.318	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.3	175.3	-170.8	-177.5	23.5	0	0	112.9	W164 G189 L193	W164-Q168 WeakPolarHBondContact O-CB 3.37Å; W164-Q168 PolarHBondContact O-N 2.8Å; Q168-G189 PolarHBondContact NE2-O 2.97Å; Q168-G189 VanDerWaalsContact NE2-O 3.16Å; Q168-L193 HydrophobicContact CG-CD1 4.32Å
169	R	93.4	Very high	95.9	Very high	112 Å²	112	35.6 Å²	35.6	42%	0.423	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-10.1	177.2	-65.7	168.7	61.5	-113.6	-2.3	114	N144 L147 E165 A166 I167 T171	N144-R169 PolarHBondContact O-NH1 3.39Å; L147-R169 HydrophobicContact CD2-CB 4.4Å; E165-R169 WeakPolarHBondContact O-CD 3.5Å; E165-R169 WeakPolarHBondContact O-CG 3.43Å; A166-R169 WeakPolarHBondContact O-CB 3.48Å; A166-R169 PolarHBondContact O-N 3.41Å; I167-R169 PolarHBondContact O-N 3.31Å; R169-T171 VanDerWaalsContact C-N 3.28Å; R169-T171 PolarHBondContact O-N 3.28Å
170	M	94.5	Very high	95.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.198	C	C	.	.			trans	-81.3	65	-178.3	-61.6	177	177.6	0	0	111.6	F143 L146 L149 I167 S172 L173 L194	F143-M170 HydrophobicContact CB-CE 3.74Å; F143-M170 HydrophobicContact CD2-CE 4.15Å; F143-M170 HydrophobicContact CG-CE 4.15Å; L146-M170 HydrophobicContact CB-CE 4.11Å; L149-M170 HydrophobicContact CB-SD 4.22Å; L149-M170 HydrophobicContact CD2-CE 4.15Å; L149-M170 HydrophobicContact CD2-SD 3.86Å; I167-M170 HydrophobicContact CG1-SD 4.41Å; I167-M170 WeakPolarHBondContact O-CB 3.34Å; I167-M170 PolarHBondContact O-N 3.02Å; M170-S172 PolarHBondContact O-N 3.49Å; M170-L173 HydrophobicContact CB-CB 4.05Å; M170-L173 VanDerWaalsContact O-CB 3.25Å; M170-L173 WeakPolarHBondContact O-CB 3.39Å; M170-L173 PolarHBondContact O-N 3.23Å; M170-L194 WeakPolarHBondContact O-CD2 3.48Å
171	T	93.4	Very high	96	Very high	80 Å²	80	32.6 Å²	32.6	49%	0.491	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-6.9	-173.8	58.3	0	0	0	0	115.3	R169	R169-T171 VanDerWaalsContact C-N 3.28Å; R169-T171 PolarHBondContact O-N 3.28Å
172	S	95.1	Very high	96.1	Very high	27 Å²	27	34.5 Å²	34.5	19%	0.189	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-7.1	171.2	-75.5	0	0	0	0	115.3	L149 M170 A174 K196	L149-S172 CarbonylContact O-C 3.16Å; M170-S172 PolarHBondContact O-N 3.49Å; S172-A174 PolarHBondContact O-N 2.83Å; S172-K196 PolarHBondContact OG-NZ 3.24Å
173	L	96.6	Very high	96.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.			trans	-63.9	122.8	-173.1	-163.9	68.6	0	0	0	111.1	L149 L152 I167 M170 L176 L194 K196 L197	L149-L173 HydrophobicContact CD2-CD1 4.38Å; L149-L173 HydrophobicContact CG-CD1 4.38Å; L149-L173 VanDerWaalsContact O-CA 3.32Å; L149-L173 WeakPolarHBondContact O-CA 3.23Å; L149-L173 PolarHBondContact O-N 3.33Å; L149-L173 VanDerWaalsContact O-N 3.09Å; L152-L173 HydrophobicContact CB-CD1 4Å; I167-L173 HydrophobicContact CG2-CD2 4.18Å; M170-L173 HydrophobicContact CB-CB 4.05Å; M170-L173 VanDerWaalsContact O-CB 3.25Å; M170-L173 WeakPolarHBondContact O-CB 3.39Å; M170-L173 PolarHBondContact O-N 3.23Å; L173-L176 HydrophobicContact CD2-CB 4.08Å; L173-L176 HydrophobicContact CD2-CD1 4.44Å; L173-L176 HydrophobicContact CD2-CD2 4.26Å; L173-L176 HydrophobicContact CD2-CG 4.5Å; L173-L194 HydrophobicContact CD2-CD1 4.32Å; L173-K196 CarbonylContact O-C 3.56Å; L173-L197 HydrophobicContact CB-CD1 4.33Å; L173-L197 HydrophobicContact CD2-CD1 4.1Å; L173-L197 HydrophobicContact CG-CD1 3.94Å; L173-L197 WeakPolarHBondContact O-CA 3.44Å; L173-L197 PolarHBondContact O-N 3.22Å
174	A	95.6	Very high	96.1	Very high	23 Å²	23	37.6 Å²	37.6	19%	0.19	19%	0.191	C	C	.	.			trans	-105.5	-42.6	178.9	0	0	0	0	0	111.3	E150 S172 N198 R199	E150-A174 WeakPolarHBondContact O-CA 3.16Å; E150-A174 WeakPolarHBondContact O-CB 3.45Å; E150-A174 PolarHBondContact O-N 2.87Å; S172-A174 PolarHBondContact O-N 2.83Å; A174-N198 PolarHBondContact O-N 3.41Å; A174-N198 PolarHBondContact O-OD1 2.68Å; A174-R199 PolarHBondContact O-N 2.94Å; A174-R199 VanDerWaalsContact O-N 3.15Å
175	T	97	Very high	96.1	Very high	25 Å²	25	42.9 Å²	42.9	15%	0.153	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.4	178.6	-61.5	0	0	0	0	110.9	E150 E151 L152 R199	E150-T175 PolarHBondContact O-N 3.2Å; E150-T175 VanDerWaalsContact O-N 3.07Å; E151-T175 HydrophobicContact CG-CG2 4.36Å; L152-T175 PolarHBondContact N-O 2.6Å; T175-R199 HydrophobicContact CG2-CB 4.29Å; T175-R199 HydrophobicContact CG2-CG 4.24Å
176	L	97.8	Very high	96.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	110.5	170.1	-179.6	54.7	0	0	0	109.8	L152 I167 L173 L178 F191 L197 R199 L200 D201	L152-L176 HydrophobicContact CB-CD1 3.97Å; L152-L176 HydrophobicContact CD2-CD1 3.88Å; L152-L176 HydrophobicContact CG-CD1 3.98Å; L152-L176 WeakPolarHBondContact O-CA 3.45Å; I167-L176 HydrophobicContact CG2-CD2 4.12Å; L173-L176 HydrophobicContact CD2-CB 4.08Å; L173-L176 HydrophobicContact CD2-CD1 4.44Å; L173-L176 HydrophobicContact CD2-CD2 4.26Å; L173-L176 HydrophobicContact CD2-CG 4.5Å; L176-L178 HydrophobicContact CD1-CD1 4.48Å; L176-L178 HydrophobicContact CD1-CD2 3.88Å; L176-L178 HydrophobicContact CD1-CG 4.08Å; L176-L178 HydrophobicContact CD2-CD1 4.25Å; L176-L178 HydrophobicContact CG-CD1 4.17Å; L176-L178 HydrophobicContact CG-CD2 4.39Å; L176-L178 HydrophobicContact CG-CG 4.04Å; L176-F191 HydrophobicContact CD2-CE1 4.23Å; L176-L197 HydrophobicContact CB-CD1 4.08Å; L176-R199 PolarHBondContact N-O 2.71Å; L176-L200 HydrophobicContact CB-CD1 4.03Å; L176-L200 HydrophobicContact CD2-CD1 3.88Å; L176-L200 HydrophobicContact CG-CD1 3.88Å; L176-L200 WeakPolarHBondContact O-CA 3.24Å; L176-D201 PolarHBondContact O-N 2.79Å
177	S	98.3	Very high	96.3	Very high	18 Å²	18	37.4 Å²	37.4	13%	0.126	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	118.7	178.1	-50	0	0	0	0	109.9	L152 L154 S155	L152-S177 PolarHBondContact O-N 3.01Å; L154-S177 PolarHBondContact N-O 3.08Å; S155-S177 VanDerWaalsContact OG-CB 3.26Å; S155-S177 WeakPolarHBondContact OG-CB 3.3Å
178	L	98.2	Very high	96.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.			trans	-126.1	9.3	-178.2	-58.5	177	0	0	0	111.7	L154 I162 W164 L176 N181 I183 L200 D201 V202 N205	L154-L178 HydrophobicContact CB-CD2 4.08Å; L154-L178 HydrophobicContact CD1-CD2 3.88Å; I162-L178 HydrophobicContact CD1-CD1 3.79Å; I162-L178 HydrophobicContact CD1-CD2 3.6Å; I162-L178 HydrophobicContact CD1-CG 4.38Å; W164-L178 HydrophobicContact CH2-CD1 4.1Å; W164-L178 HydrophobicContact CZ3-CD1 4.26Å; L176-L178 HydrophobicContact CD1-CD1 4.48Å; L176-L178 HydrophobicContact CD1-CD2 3.88Å; L176-L178 HydrophobicContact CD1-CG 4.08Å; L176-L178 HydrophobicContact CD2-CD1 4.25Å; L176-L178 HydrophobicContact CG-CD1 4.17Å; L176-L178 HydrophobicContact CG-CD2 4.39Å; L176-L178 HydrophobicContact CG-CG 4.04Å; L178-N181 WeakPolarHBondContact O-CB 3.4Å; L178-N181 PolarHBondContact O-ND2 2.82Å; L178-N181 VanDerWaalsContact O-ND2 3.09Å; L178-I183 HydrophobicContact CB-CD1 4.06Å; L178-I183 HydrophobicContact CD1-CD1 4.03Å; L178-I183 HydrophobicContact CD2-CD1 4.37Å; L178-I183 HydrophobicContact CG-CD1 4.39Å; L178-L200 HydrophobicContact CD1-CD1 4.46Å; L178-D201 WeakPolarHBondContact CA-O 3.45Å; L178-D201 WeakPolarHBondContact CB-O 3.26Å; L178-D201 PolarHBondContact N-O 2.72Å; L178-V202 HydrophobicContact CB-CG1 4.25Å; L178-V202 HydrophobicContact CD1-CG1 4.13Å; L178-N205 PolarHBondContact O-ND2 3.01Å
179	D	97.6	Very high	96	Very high	21 Å²	21	42.6 Å²	42.6	11%	0.112	22%	0.221	C	C	.	.			trans	-63.7	153.7	-172.7	69	-88.3	0	0	0	113.1	S155 Y156 N181 D201 T203	S155-D179 CarbonylContact C-O 3.58Å; S155-D179 WeakPolarHBondContact CA-O 3.21Å; S155-D179 WeakPolarHBondContact CB-O 3.16Å; S155-D179 WeakPolarHBondContact CB-OD1 3.43Å; S155-D179 VanDerWaalsContact OG-CG 3.26Å; S155-D179 PolarHBondContact OG-N 2.89Å; S155-D179 PolarHBondContact OG-OD1 3.05Å; Y156-D179 VanDerWaalsContact CE2-OD2 3.24Å; Y156-D179 WeakPolarHBondContact CE2-OD2 3.17Å; Y156-D179 PolarHBondContact N-O 3.48Å; D179-N181 PolarHBondContact O-ND2 3.06Å; D179-D201 HydrophobicContact CB-CB 4.49Å; D179-D201 PolarHBondContact N-O 3.07Å; D179-T203 CarbonylContact C-O 3.54Å; D179-T203 WeakPolarHBondContact CA-O 3.27Å; D179-T203 WeakPolarHBondContact CB-O 3.44Å
180	H	98.4	Very high	96	Very high	66 Å²	66	37.4 Å²	37.4	31%	0.306	20%	0.202	S	C	.	.	S	Bend	trans	53.6	58.6	-178	-58.6	86.5	0	0	0	112.4	Y156 N157 T203 S204	Y156-H180 WeakPolarHBondContact CA-O 3.41Å; Y156-H180 HydrophobicContact CD1-CB 3.72Å; Y156-H180 AromaticContact CD1-CG 3.93Å; Y156-H180 HydrophobicContact CD2-CB 4.22Å; Y156-H180 HydrophobicContact CE1-CB 3.94Å; Y156-H180 AromaticContact CE1-CD2 3.98Å; Y156-H180 AromaticContact CE1-CG 3.59Å; Y156-H180 AromaticContact CE1-ND1 3.77Å; Y156-H180 HydrophobicContact CE2-CB 4.39Å; Y156-H180 AromaticContact CE2-ND1 3.61Å; Y156-H180 HydrophobicContact CG-CB 3.87Å; Y156-H180 AromaticContact CZ-CE1 3.76Å; Y156-H180 AromaticContact CZ-CG 3.68Å; Y156-H180 AromaticContact CZ-ND1 3.33Å; Y156-H180 VanDerWaalsContact CZ-ND1 3.33Å; Y156-H180 PolarHBondContact N-O 2.72Å; Y156-H180 PolarHBondContact OH-CE1 3.05Å; Y156-H180 PolarHBondContact OH-ND1 3.49Å; N157-H180 PolarHBondContact N-O 2.82Å; N157-H180 VanDerWaalsContact N-O 3.08Å; N157-H180 VanDerWaalsContact O-O 3.1Å; H180-T203 PolarHBondContact N-O 3.38Å; H180-S204 WeakPolarHBondContact CA-O 3.21Å; H180-S204 WeakPolarHBondContact CD2-CB 3.22Å; H180-S204 PolarHBondContact CD2-OG 2.98Å; H180-S204 WeakPolarHBondContact NE2-CB 3.49Å; H180-S204 PolarHBondContact NE2-OG 2.9Å
181	N	98.6	Very high	95.9	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.032	20%	0.202	C	C	.	.	S	Bend	trans	-131.1	-167.1	174.6	-87.3	-80.9	0	0	0	110.2	L154 N157 L159 L178 D179 I183 S204 N205	L154-N181 PolarHBondContact O-ND2 2.83Å; N157-N181 WeakPolarHBondContact CA-OD1 3.21Å; N157-N181 WeakPolarHBondContact CB-OD1 3.22Å; N157-N181 PolarHBondContact O-OD1 2.85Å; L159-N181 VanDerWaalsContact CB-OD1 3.31Å; L159-N181 WeakPolarHBondContact CB-OD1 3.39Å; L159-N181 WeakPolarHBondContact CG-OD1 3.5Å; L159-N181 PolarHBondContact N-OD1 2.98Å; L159-N181 VanDerWaalsContact N-OD1 3.09Å; L178-N181 WeakPolarHBondContact O-CB 3.4Å; L178-N181 PolarHBondContact O-ND2 2.82Å; L178-N181 VanDerWaalsContact O-ND2 3.09Å; D179-N181 PolarHBondContact O-ND2 3.06Å; N181-I183 HydrophobicContact CB-CD1 4.48Å; N181-I183 HydrophobicContact CB-CG1 4.19Å; N181-S204 PolarHBondContact N-O 2.93Å; N181-N205 WeakPolarHBondContact CA-OD1 3.43Å; N181-N205 WeakPolarHBondContact CB-OD1 3.48Å; N181-N205 PolarHBondContact O-OD1 2.87Å
182	M	97.9	Very high	95.7	Very high	82 Å²	82	36.1 Å²	36.1	40%	0.404	20%	0.196	S	C	.	.			trans	-116.6	19.3	-177.9	-67.9	-68.3	-67.4	0	0	112.5	L159 E160 D184 N205 K206	L159-M182 CarbonylContact O-C 3.27Å; L159-M182 VanDerWaalsContact O-CA 3.29Å; L159-M182 WeakPolarHBondContact O-CA 3.38Å; L159-M182 WeakPolarHBondContact O-CB 3.45Å; L159-M182 PolarHBondContact O-N 2.91Å; E160-M182 HydrophobicContact CG-CB 4.25Å; M182-D184 PolarHBondContact O-N 3.04Å; M182-N205 PolarHBondContact N-OD1 2.83Å; M182-K206 HydrophobicContact CE-CD 4.37Å; M182-K206 HydrophobicContact CE-CG 4.13Å; M182-K206 WeakPolarHBondContact SD-CE 3.21Å; M182-K206 HydrophobicContact SD-CG 4.24Å
183	I	98	Very high	95.4	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	21%	0.211	C	C	.	.			trans	-67.4	124.8	-170.5	-55.7	175.6	0	0	0	110.4	L159 E160 I162 W164 L178 N181 Y185 N205 K206 L207	L159-I183 WeakPolarHBondContact O-CG1 3.34Å; L159-I183 PolarHBondContact O-N 3.15Å; L159-I183 VanDerWaalsContact O-N 3.13Å; E160-I183 WeakPolarHBondContact O-CA 3.35Å; I162-I183 HydrophobicContact CG2-CD1 4.45Å; W164-I183 HydrophobicContact CH2-CG2 4.25Å; W164-I183 HydrophobicContact CZ2-CG2 3.8Å; L178-I183 HydrophobicContact CB-CD1 4.06Å; L178-I183 HydrophobicContact CD1-CD1 4.03Å; L178-I183 HydrophobicContact CD2-CD1 4.37Å; L178-I183 HydrophobicContact CG-CD1 4.39Å; N181-I183 HydrophobicContact CB-CD1 4.48Å; N181-I183 HydrophobicContact CB-CG1 4.19Å; I183-Y185 WeakPolarHBondContact CG2-O 3.38Å; I183-N205 WeakPolarHBondContact CB-OD1 3.27Å; I183-N205 WeakPolarHBondContact CG1-OD1 3.48Å; I183-N205 PolarHBondContact N-OD1 2.95Å; I183-K206 CarbonylContact O-C 3.19Å; I183-K206 WeakPolarHBondContact O-CA 3.39Å; I183-K206 WeakPolarHBondContact O-CB 3.29Å; I183-K206 PolarHBondContact O-N 3.23Å; I183-L207 HydrophobicContact CB-CD2 4.46Å; I183-L207 HydrophobicContact CG2-CD2 3.93Å; I183-L207 WeakPolarHBondContact O-CD2 3.25Å; I183-L207 PolarHBondContact O-N 2.81Å; I183-L207 VanDerWaalsContact O-N 3.07Å
184	D	95.1	Very high	95.2	Very high	77 Å²	77	39.4 Å²	39.4	41%	0.412	21%	0.211	S	C	.	.			trans	-99.3	-33.8	-172.6	66	-29.6	0	0	0	113.9	M182 K206	M182-D184 PolarHBondContact O-N 3.04Å; D184-K206 HydrophobicContact CB-CB 4.3Å
185	Y	95.4	Very high	94.8	Very high	126 Å²	126	43.4 Å²	43.4	49%	0.494	23%	0.226	S	C	.	.			trans	-139.1	157.3	173.3	77.5	-83.2	0	0	0	113.5	W164 I183 P187	W164-Y185 WeakPolarHBondContact CZ2-O 3.3Å; I183-Y185 WeakPolarHBondContact CG2-O 3.38Å; Y185-P187 HydrophobicContact CD2-CG 4.44Å; Y185-P187 HydrophobicContact CE2-CG 4.02Å
186	I	96.4	Very high	94.5	Very high	13 Å²	13	47.2 Å²	47.2	7%	0.067	24%	0.24	C	C	.	.			trans	-121.9	128.7	167.6	-53.1	-175.7	0	0	0	107.7	W164 F191 V202 L207 L210 P211	W164-I186 HydrophobicContact CE3-CG2 4.27Å; W164-I186 HydrophobicContact CH2-CB 4.24Å; W164-I186 HydrophobicContact CH2-CD1 4.25Å; W164-I186 HydrophobicContact CH2-CG1 3.75Å; W164-I186 HydrophobicContact CH2-CG2 3.98Å; W164-I186 HydrophobicContact CZ2-CB 4.45Å; W164-I186 HydrophobicContact CZ2-CG1 4.13Å; W164-I186 HydrophobicContact CZ2-CG2 4.46Å; W164-I186 HydrophobicContact CZ3-CG1 4.44Å; W164-I186 HydrophobicContact CZ3-CG2 3.88Å; I186-F191 HydrophobicContact CD1-CZ 4.32Å; I186-F191 HydrophobicContact CG2-CE2 3.8Å; I186-F191 HydrophobicContact CG2-CZ 3.78Å; I186-V202 HydrophobicContact CD1-CG1 4.18Å; I186-L207 HydrophobicContact CD1-CD1 3.98Å; I186-L207 HydrophobicContact CD1-CD2 4.31Å; I186-L207 HydrophobicContact CG1-CD1 4.38Å; I186-L207 HydrophobicContact CG1-CD2 3.8Å; I186-L210 HydrophobicContact CD1-CD2 3.93Å; I186-P211 HydrophobicContact CB-CG 4.24Å; I186-P211 HydrophobicContact CG2-CG 4.22Å
187	P	95.3	Very high	94.3	Very high	39 Å²	39	47.5 Å²	47.5	25%	0.253	24%	0.242	S	C	.	.			trans	-64.7	143.7	178.2	-16.8	27.5	0	0	0	112.8	W164 Y185 T190	W164-P187 HydrophobicContact CB-CG 3.8Å; W164-P187 HydrophobicContact CD2-CG 4.19Å; W164-P187 VanDerWaalsContact CG-CD 3.48Å; W164-P187 HydrophobicContact CG-CG 3.57Å; Y185-P187 HydrophobicContact CD2-CG 4.44Å; Y185-P187 HydrophobicContact CE2-CG 4.02Å; P187-T190 WeakPolarHBondContact O-CB 3.49Å; P187-T190 PolarHBondContact O-N 3.18Å; P187-T190 PolarHBondContact O-OG1 2.88Å
188	E	92	Very high	94	Very high	149 Å²	149	50.3 Å²	50.3	70%	0.696	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	145.9	168.7	-69.3	178	-170.3	0	0	111.4	T190 P211	E188-T190 PolarHBondContact O-N 3.45Å; E188-P211 HydrophobicContact CB-CB 4.39Å; E188-P211 HydrophobicContact CG-CB 3.71Å
189	G	90.9	Very high	93.8	Very high	28 Å²	28	55.7 Å²	55.7	29%	0.289	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	-4.6	-179.6	0	0	0	0	0	116.1	Q168 F191 S192	Q168-G189 PolarHBondContact NE2-O 2.97Å; Q168-G189 VanDerWaalsContact NE2-O 3.16Å; G189-F191 VanDerWaalsContact C-N 3.27Å; G189-F191 PolarHBondContact O-N 3.16Å; G189-S192 WeakPolarHBondContact O-CB 3.34Å; G189-S192 PolarHBondContact O-N 3.05Å; G189-S192 PolarHBondContact O-OG 2.68Å
190	T	93.6	Very high	93.8	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.018	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-42.1	177.8	-62.4	0	0	0	0	112.9	W164 P187 E188	W164-T190 HydrophobicContact CE3-CG2 3.81Å; W164-T190 HydrophobicContact CZ3-CG2 4.45Å; P187-T190 WeakPolarHBondContact O-CB 3.49Å; P187-T190 PolarHBondContact O-N 3.18Å; P187-T190 PolarHBondContact O-OG1 2.88Å; E188-T190 PolarHBondContact O-N 3.45Å
191	F	92.1	Very high	93.7	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.009	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-8.5	-174.4	-50.4	-61.3	0	0	0	114	L176 I186 G189 L193 L194 L197 L200 L215 F216	L176-F191 HydrophobicContact CD2-CE1 4.23Å; I186-F191 HydrophobicContact CD1-CZ 4.32Å; I186-F191 HydrophobicContact CG2-CE2 3.8Å; I186-F191 HydrophobicContact CG2-CZ 3.78Å; G189-F191 VanDerWaalsContact C-N 3.27Å; G189-F191 PolarHBondContact O-N 3.16Å; F191-L193 PolarHBondContact O-N 2.94Å; F191-L193 VanDerWaalsContact O-N 3.07Å; F191-L194 HydrophobicContact CD1-CD1 4.16Å; F191-L194 WeakPolarHBondContact O-CB 3.39Å; F191-L194 PolarHBondContact O-N 3.2Å; F191-L197 HydrophobicContact CD1-CD2 4.11Å; F191-L200 HydrophobicContact CE1-CD1 4.4Å; F191-L200 HydrophobicContact CE1-CD2 4.12Å; F191-L200 HydrophobicContact CE2-CD2 4.01Å; F191-L200 HydrophobicContact CZ-CD1 4.42Å; F191-L200 HydrophobicContact CZ-CD2 3.64Å; F191-L215 HydrophobicContact CB-CD2 4.38Å; F191-F216 HydrophobicContact CD2-CE2 4.16Å; F191-F216 AromaticContact CD2-CZ 3.68Å; F191-F216 HydrophobicContact CD2-CZ 3.68Å; F191-F216 HydrophobicContact CE2-CE2 4.41Å; F191-F216 AromaticContact CE2-CZ 3.76Å; F191-F216 HydrophobicContact CE2-CZ 3.76Å
192	S	89.2	Confident	93.6	Very high	51 Å²	51	52.6 Å²	52.6	36%	0.357	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-34.1	-172.9	61.1	0	0	0	0	115.2	G189 Q195 D213	G189-S192 WeakPolarHBondContact O-CB 3.34Å; G189-S192 PolarHBondContact O-N 3.05Å; G189-S192 PolarHBondContact O-OG 2.68Å; S192-Q195 PolarHBondContact O-NE2 3.23Å; S192-D213 PolarHBondContact N-OD2 2.84Å
193	L	89.6	Confident	93.6	Very high	96 Å²	96	50.3 Å²	50.3	50%	0.503	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-11.5	178.6	-57.8	-176	0	0	0	113.6	Q168 F191 Q195	Q168-L193 HydrophobicContact CG-CD1 4.32Å; F191-L193 PolarHBondContact O-N 2.94Å; F191-L193 VanDerWaalsContact O-N 3.07Å; L193-Q195 PolarHBondContact O-N 3.07Å
194	L	91.3	Very high	93.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.265	C	S	.	.			trans	-87.7	56.3	-170	-52.2	-167.2	0	0	0	111.6	I167 M170 L173 F191 K196 L197	I167-L194 HydrophobicContact CG2-CD1 4.24Å; M170-L194 WeakPolarHBondContact O-CD2 3.48Å; L173-L194 HydrophobicContact CD2-CD1 4.32Å; F191-L194 HydrophobicContact CD1-CD1 4.16Å; F191-L194 WeakPolarHBondContact O-CB 3.39Å; F191-L194 PolarHBondContact O-N 3.2Å; L194-K196 PolarHBondContact O-N 2.87Å; L194-L197 HydrophobicContact CB-CB 4.17Å; L194-L197 VanDerWaalsContact O-CB 3.3Å; L194-L197 WeakPolarHBondContact O-CB 3.35Å; L194-L197 PolarHBondContact O-N 2.66Å
195	Q	87.6	Confident	93.7	Very high	108 Å²	108	48.5 Å²	48.5	51%	0.505	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-16.2	-170.7	-66.2	-61.3	-37.7	0	0	114.9	S192 L193 R218	S192-Q195 PolarHBondContact O-NE2 3.23Å; L193-Q195 PolarHBondContact O-N 3.07Å; Q195-R218 PolarHBondContact O-NH1 3.48Å
196	K	91.9	Very high	93.8	Very high	105 Å²	105	47 Å²	47	46%	0.457	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-12.1	172.9	-62.8	-164.8	-162.1	165.8	0	114.6	S172 L173 L194 N198	S172-K196 PolarHBondContact OG-NZ 3.24Å; L173-K196 CarbonylContact O-C 3.56Å; L194-K196 PolarHBondContact O-N 2.87Å; K196-N198 PolarHBondContact O-N 3.16Å; K196-N198 VanDerWaalsContact O-N 3.16Å
197	L	93.2	Very high	93.9	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.026	24%	0.239	C	C	.	.			trans	-62.2	120.1	-172.4	-160.3	75.9	0	0	0	109.5	L173 L176 F191 L194 L200 L215 F233	L173-L197 HydrophobicContact CB-CD1 4.33Å; L173-L197 HydrophobicContact CD2-CD1 4.1Å; L173-L197 HydrophobicContact CG-CD1 3.94Å; L173-L197 WeakPolarHBondContact O-CA 3.44Å; L173-L197 PolarHBondContact O-N 3.22Å; L176-L197 HydrophobicContact CB-CD1 4.08Å; F191-L197 HydrophobicContact CD1-CD2 4.11Å; L194-L197 HydrophobicContact CB-CB 4.17Å; L194-L197 VanDerWaalsContact O-CB 3.3Å; L194-L197 WeakPolarHBondContact O-CB 3.35Å; L194-L197 PolarHBondContact O-N 2.66Å; L197-L200 HydrophobicContact CD2-CB 4.44Å; L197-L215 HydrophobicContact CB-CD1 4.2Å; L197-L215 HydrophobicContact CB-CD2 4.36Å; L197-L215 HydrophobicContact CD2-CD2 3.87Å; L197-F233 HydrophobicContact CB-CE2 4.4Å; L197-F233 HydrophobicContact CD2-CE2 4.07Å; L197-F233 HydrophobicContact CD2-CZ 4.36Å; L197-F233 HydrophobicContact CG-CE2 4.02Å; L197-F233 VanDerWaalsContact O-CD2 3.27Å; L197-F233 WeakPolarHBondContact O-CD2 3.37Å
198	N	92.1	Very high	93.9	Very high	78 Å²	78	49.5 Å²	49.5	42%	0.417	25%	0.25	S	C	.	.			trans	-113.9	-16.8	-177.4	73.8	30.8	0	0	0	112.5	A174 K196 F233 A234	A174-N198 PolarHBondContact O-N 3.41Å; A174-N198 PolarHBondContact O-OD1 2.68Å; K196-N198 PolarHBondContact O-N 3.16Å; K196-N198 VanDerWaalsContact O-N 3.16Å; N198-F233 VanDerWaalsContact C-CD2 3.46Å; N198-F233 WeakPolarHBondContact O-CA 3.27Å; N198-A234 PolarHBondContact O-N 2.92Å
199	R	94.3	Very high	94.1	Very high	113 Å²	113	46.4 Å²	46.4	43%	0.426	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	127	177.7	176.5	175	-73.4	-103.3	-3.1	111.2	A174 T175 L176 A234	A174-R199 PolarHBondContact O-N 2.94Å; A174-R199 VanDerWaalsContact O-N 3.15Å; T175-R199 HydrophobicContact CG2-CB 4.29Å; T175-R199 HydrophobicContact CG2-CG 4.24Å; L176-R199 PolarHBondContact N-O 2.71Å; R199-A234 WeakPolarHBondContact CA-O 3.27Å; R199-A234 HydrophobicContact CB-CB 4.48Å
200	L	96	Very high	94.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	117.7	164.2	178.5	63.8	0	0	0	109.1	L176 L178 F191 L197 V202 F216 F233 A234 L235 S236	L176-L200 HydrophobicContact CB-CD1 4.03Å; L176-L200 HydrophobicContact CD2-CD1 3.88Å; L176-L200 HydrophobicContact CG-CD1 3.88Å; L176-L200 WeakPolarHBondContact O-CA 3.24Å; L178-L200 HydrophobicContact CD1-CD1 4.46Å; F191-L200 HydrophobicContact CE1-CD1 4.4Å; F191-L200 HydrophobicContact CE1-CD2 4.12Å; F191-L200 HydrophobicContact CE2-CD2 4.01Å; F191-L200 HydrophobicContact CZ-CD1 4.42Å; F191-L200 HydrophobicContact CZ-CD2 3.64Å; L197-L200 HydrophobicContact CD2-CB 4.44Å; L200-V202 HydrophobicContact CD1-CG1 3.94Å; L200-V202 HydrophobicContact CD2-CG1 4.4Å; L200-V202 HydrophobicContact CG-CG1 4.02Å; L200-F216 HydrophobicContact CD2-CE1 3.96Å; L200-F216 HydrophobicContact CD2-CZ 4.07Å; L200-F233 HydrophobicContact CB-CE1 4.38Å; L200-F233 HydrophobicContact CB-CE2 4.3Å; L200-F233 HydrophobicContact CB-CZ 3.54Å; L200-A234 PolarHBondContact N-O 3.36Å; L200-L235 HydrophobicContact CB-CD1 4.18Å; L200-L235 HydrophobicContact CD2-CD1 3.98Å; L200-L235 HydrophobicContact CG-CD1 4.21Å; L200-L235 WeakPolarHBondContact O-CA 3.49Å; L200-S236 PolarHBondContact O-N 2.93Å; L200-S236 VanDerWaalsContact O-N 3.11Å
201	D	96.8	Very high	94.3	Very high	25 Å²	25	45.7 Å²	45.7	13%	0.134	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.3	170.6	-153.7	-36.7	0	0	0	109.9	L176 L178 D179 T203 S236	L176-D201 PolarHBondContact O-N 2.79Å; L178-D201 WeakPolarHBondContact CA-O 3.45Å; L178-D201 WeakPolarHBondContact CB-O 3.26Å; L178-D201 PolarHBondContact N-O 2.72Å; D179-D201 HydrophobicContact CB-CB 4.49Å; D179-D201 PolarHBondContact N-O 3.07Å; D201-T203 WeakPolarHBondContact OD1-CB 3.35Å; D201-T203 PolarHBondContact OD1-N 2.88Å; D201-T203 PolarHBondContact OD1-OG1 2.84Å; D201-S236 WeakPolarHBondContact OD1-CB 3.29Å
202	V	96.9	Very high	94.3	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.012	25%	0.247	C	C	.	.			trans	-125.1	20.1	175.6	-65.7	0	0	0	0	111.4	L178 I186 L200 N205 L207 L210 S236 F237 N240	L178-V202 HydrophobicContact CB-CG1 4.25Å; L178-V202 HydrophobicContact CD1-CG1 4.13Å; I186-V202 HydrophobicContact CD1-CG1 4.18Å; L200-V202 HydrophobicContact CD1-CG1 3.94Å; L200-V202 HydrophobicContact CD2-CG1 4.4Å; L200-V202 HydrophobicContact CG-CG1 4.02Å; V202-N205 PolarHBondContact O-ND2 3.38Å; V202-N205 VanDerWaalsContact O-ND2 3.08Å; V202-L207 HydrophobicContact CB-CD1 3.78Å; V202-L207 HydrophobicContact CG1-CD1 4.33Å; V202-L207 HydrophobicContact CG2-CD1 3.78Å; V202-L210 HydrophobicContact CG2-CD2 4.41Å; V202-S236 VanDerWaalsContact CG2-O 3.31Å; V202-S236 WeakPolarHBondContact CG2-O 3.45Å; V202-S236 PolarHBondContact N-O 3.29Å; V202-F237 HydrophobicContact CG2-CB 3.79Å; V202-N240 PolarHBondContact O-ND2 2.83Å
203	T	97.1	Very high	94.3	Very high	34 Å²	34	47.5 Å²	47.5	21%	0.209	23%	0.234	C	C	.	.			trans	-56.5	145.8	-179.7	-54.7	0	0	0	0	111.7	D179 H180 D201 N205 S236 G238	D179-T203 CarbonylContact C-O 3.54Å; D179-T203 WeakPolarHBondContact CA-O 3.27Å; D179-T203 WeakPolarHBondContact CB-O 3.44Å; H180-T203 PolarHBondContact N-O 3.38Å; D201-T203 WeakPolarHBondContact OD1-CB 3.35Å; D201-T203 PolarHBondContact OD1-N 2.88Å; D201-T203 PolarHBondContact OD1-OG1 2.84Å; T203-N205 PolarHBondContact O-N 3.31Å; T203-N205 PolarHBondContact O-ND2 3.02Å; T203-S236 WeakPolarHBondContact OG1-CB 3.1Å; T203-G238 CarbonylContact C-O 3.55Å; T203-G238 VanDerWaalsContact CA-O 3.27Å; T203-G238 WeakPolarHBondContact CA-O 3.21Å; T203-G238 WeakPolarHBondContact CG2-O 3.37Å
204	S	97.5	Very high	94.2	Very high	40 Å²	40	47.2 Å²	47.2	28%	0.28	24%	0.238	S	C	.	.	S	Bend	trans	55.9	51.8	176.7	-59.5	0	0	0	0	114.2	H180 N181 G238	H180-S204 WeakPolarHBondContact CA-O 3.21Å; H180-S204 WeakPolarHBondContact CD2-CB 3.22Å; H180-S204 PolarHBondContact CD2-OG 2.98Å; H180-S204 WeakPolarHBondContact NE2-CB 3.49Å; H180-S204 PolarHBondContact NE2-OG 2.9Å; N181-S204 PolarHBondContact N-O 2.93Å; S204-G238 PolarHBondContact N-O 3.44Å
205	N	98.5	Very high	93.9	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.238	C	C	.	.	S	Bend	trans	-114.5	-156.5	175.5	-89.6	-82.8	0	0	0	111.8	L178 N181 M182 I183 V202 T203 L207 N240	L178-N205 PolarHBondContact O-ND2 3.01Å; N181-N205 WeakPolarHBondContact CA-OD1 3.43Å; N181-N205 WeakPolarHBondContact CB-OD1 3.48Å; N181-N205 PolarHBondContact O-OD1 2.87Å; M182-N205 PolarHBondContact N-OD1 2.83Å; I183-N205 WeakPolarHBondContact CB-OD1 3.27Å; I183-N205 WeakPolarHBondContact CG1-OD1 3.48Å; I183-N205 PolarHBondContact N-OD1 2.95Å; V202-N205 PolarHBondContact O-ND2 3.38Å; V202-N205 VanDerWaalsContact O-ND2 3.08Å; T203-N205 PolarHBondContact O-N 3.31Å; T203-N205 PolarHBondContact O-ND2 3.02Å; N205-L207 HydrophobicContact CB-CG 4.2Å; N205-N240 VanDerWaalsContact CA-OD1 3.23Å; N205-N240 WeakPolarHBondContact CA-OD1 3.32Å; N205-N240 WeakPolarHBondContact CB-OD1 3.18Å; N205-N240 PolarHBondContact N-OD1 3.32Å
206	K	97.9	Very high	93.9	Very high	94 Å²	94	42.2 Å²	42.2	41%	0.409	21%	0.214	S	C	.	.			trans	-116.7	17.2	175	-59.3	-63.3	164.4	-137.8	0	113	M182 I183 D184 Q208 N240	M182-K206 HydrophobicContact CE-CD 4.37Å; M182-K206 HydrophobicContact CE-CG 4.13Å; M182-K206 WeakPolarHBondContact SD-CE 3.21Å; M182-K206 HydrophobicContact SD-CG 4.24Å; I183-K206 CarbonylContact O-C 3.19Å; I183-K206 WeakPolarHBondContact O-CA 3.39Å; I183-K206 WeakPolarHBondContact O-CB 3.29Å; I183-K206 PolarHBondContact O-N 3.23Å; D184-K206 HydrophobicContact CB-CB 4.3Å; K206-Q208 PolarHBondContact O-N 2.81Å; K206-N240 PolarHBondContact N-OD1 3.34Å
207	L	97.5	Very high	93.3	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	22%	0.222	C	C	.	.			trans	-64.3	118.3	-176.9	-59.1	176.5	0	0	0	110.6	I183 I186 V202 N205 L210 N240	I183-L207 HydrophobicContact CB-CD2 4.46Å; I183-L207 HydrophobicContact CG2-CD2 3.93Å; I183-L207 WeakPolarHBondContact O-CD2 3.25Å; I183-L207 PolarHBondContact O-N 2.81Å; I183-L207 VanDerWaalsContact O-N 3.07Å; I186-L207 HydrophobicContact CD1-CD1 3.98Å; I186-L207 HydrophobicContact CD1-CD2 4.31Å; I186-L207 HydrophobicContact CG1-CD1 4.38Å; I186-L207 HydrophobicContact CG1-CD2 3.8Å; V202-L207 HydrophobicContact CB-CD1 3.78Å; V202-L207 HydrophobicContact CG1-CD1 4.33Å; V202-L207 HydrophobicContact CG2-CD1 3.78Å; N205-L207 HydrophobicContact CB-CG 4.2Å; L207-L210 HydrophobicContact CD1-CD2 3.88Å; L207-N240 HydrophobicContact CB-CB 4.36Å; L207-N240 WeakPolarHBondContact CB-OD1 3.43Å; L207-N240 PolarHBondContact N-OD1 3.47Å
208	Q	96.5	Very high	92.8	Very high	103 Å²	103	47.5 Å²	47.5	48%	0.481	24%	0.237	S	C	.	.	S	Bend	trans	-80.6	-32.1	170.4	-71.4	177.6	75.6	0	0	111.3	K206 H243	K206-Q208 PolarHBondContact O-N 2.81Å; Q208-H243 HydrophobicContact CB-CB 4.01Å; Q208-H243 PolarHBondContact O-N 3.38Å
209	K	95.1	Very high	92.1	Very high	85 Å²	85	43.9 Å²	43.9	37%	0.37	22%	0.218	S	C	.	.			trans	-147.1	163.8	176.9	64.7	-174.6	174.8	-173.5	0	112.3	E247 L248	K209-E247 HydrophobicContact CD-CB 4.27Å; K209-E247 WeakPolarHBondContact CD-OE2 3.43Å; K209-E247 IonicContact NZ-OE1 3.67Å; K209-E247 PolarHBondContact NZ-OE1 2.8Å; K209-E247 IonicContact NZ-OE2 2.77Å; K209-E247 PolarHBondContact NZ-OE2 2.99Å; K209-L248 HydrophobicContact CB-CD2 4.05Å; K209-L248 HydrophobicContact CB-CG 4.4Å
210	L	94.9	Very high	91.1	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	21%	0.208	C	C	.	.			trans	-112.3	136.4	170.3	-73.5	173.2	0	0	0	109.7	I186 V202 L207 F237 W250 L251	I186-L210 HydrophobicContact CD1-CD2 3.93Å; V202-L210 HydrophobicContact CG2-CD2 4.41Å; L207-L210 HydrophobicContact CD1-CD2 3.88Å; L210-F237 HydrophobicContact CD1-CB 3.98Å; L210-F237 HydrophobicContact CD1-CD1 4.41Å; L210-F237 HydrophobicContact CD1-CD2 4.28Å; L210-F237 HydrophobicContact CD1-CG 3.98Å; L210-W250 HydrophobicContact CB-CZ2 4.05Å; L210-W250 PolarHBondContact O-NE1 2.85Å; L210-L251 HydrophobicContact CD1-CD2 4Å
211	P	93.8	Very high	89.7	Confident	11 Å²	11	43 Å²	43	7%	0.071	22%	0.222	C	C	.	.			trans	-68.5	142.3	175.8	29.1	-34.5	0	0	0	110.6	I186 E188 D213 F216 W250	I186-P211 HydrophobicContact CB-CG 4.24Å; I186-P211 HydrophobicContact CG2-CG 4.22Å; E188-P211 HydrophobicContact CB-CB 4.39Å; E188-P211 HydrophobicContact CG-CB 3.71Å; P211-D213 PolarHBondContact O-N 3.47Å; P211-F216 WeakPolarHBondContact O-CE2 3.4Å; P211-W250 WeakPolarHBondContact O-CZ2 3.08Å
212	P	91.8	Very high	88	Confident	77 Å²	77	46.1 Å²	46.1	50%	0.5	24%	0.238	S	C	.	.			trans	-68.9	126.7	173.6	28.2	-33.2	0	0	0	110.7	W250	P212-W250 HydrophobicContact CB-CD2 4.04Å; P212-W250 HydrophobicContact CB-CG 4.11Å
213	D	90.6	Very high	85.9	Confident	15 Å²	15	49 Å²	49	8%	0.08	26%	0.261	C	S	.	.			trans	-138.7	138.8	176	-166.9	-69.1	0	0	0	110.3	S192 P211 L215 F216	S192-D213 PolarHBondContact N-OD2 2.84Å; P211-D213 PolarHBondContact O-N 3.47Å; D213-L215 PolarHBondContact O-N 3.17Å; D213-L215 VanDerWaalsContact O-N 3.09Å; D213-L215 WeakPolarHBondContact OD1-CB 3.46Å; D213-L215 PolarHBondContact OD1-N 3.28Å; D213-F216 HydrophobicContact CB-CD2 3.73Å; D213-F216 HydrophobicContact CB-CE2 3.74Å; D213-F216 PolarHBondContact O-N 3.47Å
214	P	85.8	Confident	83.8	Confident	90 Å²	90	51.6 Å²	51.6	58%	0.584	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-53.9	-24.8	174.8	-27.5	35.8	0	0	0	114.8	F216 Q217	P214-F216 VanDerWaalsContact C-N 3.28Å; P214-F216 PolarHBondContact O-N 2.84Å; P214-Q217 WeakPolarHBondContact O-CB 3.28Å; P214-Q217 PolarHBondContact O-N 2.89Å
215	L	86.4	Confident	81.6	Confident	2 Å²	2	56 Å²	56	1%	0.01	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-57.7	-40	173.1	-168.3	97.7	0	0	0	111.9	F191 L197 D213 Q217 R218 F233	F191-L215 HydrophobicContact CB-CD2 4.38Å; L197-L215 HydrophobicContact CB-CD1 4.2Å; L197-L215 HydrophobicContact CB-CD2 4.36Å; L197-L215 HydrophobicContact CD2-CD2 3.87Å; D213-L215 PolarHBondContact O-N 3.17Å; D213-L215 VanDerWaalsContact O-N 3.09Å; D213-L215 WeakPolarHBondContact OD1-CB 3.46Å; D213-L215 PolarHBondContact OD1-N 3.28Å; L215-Q217 PolarHBondContact O-N 3.35Å; L215-R218 VanDerWaalsContact O-CB 3.24Å; L215-R218 WeakPolarHBondContact O-CB 3.48Å; L215-R218 WeakPolarHBondContact O-CG 3.24Å; L215-R218 PolarHBondContact O-N 2.86Å; L215-F233 HydrophobicContact CD2-CD1 4.49Å; L215-F233 HydrophobicContact CD2-CD2 4.02Å; L215-F233 HydrophobicContact CD2-CE1 3.96Å; L215-F233 HydrophobicContact CD2-CE2 3.47Å; L215-F233 VanDerWaalsContact CD2-CE2 3.47Å; L215-F233 HydrophobicContact CD2-CG 4.5Å; L215-F233 HydrophobicContact CD2-CZ 3.39Å; L215-F233 HydrophobicContact CG-CD2 4.29Å; L215-F233 HydrophobicContact CG-CE2 4.22Å; L215-F233 HydrophobicContact CG-CZ 4.37Å
216	F	86.2	Confident	79.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-71.1	-17.6	-179	-56.4	-46.7	0	0	0	113.1	F191 L200 P211 D213 P214 R218 A219 F233 L235 W250 L254	F191-F216 HydrophobicContact CD2-CE2 4.16Å; F191-F216 AromaticContact CD2-CZ 3.68Å; F191-F216 HydrophobicContact CD2-CZ 3.68Å; F191-F216 HydrophobicContact CE2-CE2 4.41Å; F191-F216 AromaticContact CE2-CZ 3.76Å; F191-F216 HydrophobicContact CE2-CZ 3.76Å; L200-F216 HydrophobicContact CD2-CE1 3.96Å; L200-F216 HydrophobicContact CD2-CZ 4.07Å; P211-F216 WeakPolarHBondContact O-CE2 3.4Å; D213-F216 HydrophobicContact CB-CD2 3.73Å; D213-F216 HydrophobicContact CB-CE2 3.74Å; D213-F216 PolarHBondContact O-N 3.47Å; P214-F216 VanDerWaalsContact C-N 3.28Å; P214-F216 PolarHBondContact O-N 2.84Å; F216-R218 PolarHBondContact O-N 3.3Å; F216-R218 VanDerWaalsContact O-N 3.17Å; F216-A219 WeakPolarHBondContact O-CB 3.45Å; F216-A219 PolarHBondContact O-N 3.29Å; F216-F233 HydrophobicContact CD1-CD1 4.41Å; F216-F233 AromaticContact CD1-CE1 3.7Å; F216-F233 HydrophobicContact CD1-CE1 3.7Å; F216-F233 HydrophobicContact CD1-CZ 4.42Å; F216-F233 AromaticContact CE1-CE1 3.86Å; F216-F233 HydrophobicContact CE1-CE1 3.86Å; F216-F233 HydrophobicContact CE1-CZ 4.18Å; F216-L235 HydrophobicContact CD1-CD1 4.31Å; F216-L235 HydrophobicContact CD1-CD2 3.96Å; F216-L235 HydrophobicContact CE1-CD1 3.92Å; F216-L235 HydrophobicContact CE1-CD2 4.32Å; F216-W250 HydrophobicContact CB-CH2 3.92Å; F216-W250 HydrophobicContact CB-CZ3 3.64Å; F216-W250 AromaticContact CD2-CH2 3.43Å; F216-W250 HydrophobicContact CD2-CH2 3.43Å; F216-W250 VanDerWaalsContact CD2-CH2 3.43Å; F216-W250 HydrophobicContact CD2-CZ2 4.28Å; F216-W250 AromaticContact CD2-CZ3 3.99Å; F216-W250 HydrophobicContact CD2-CZ3 3.99Å; F216-W250 HydrophobicContact CE2-CH2 4.23Å; F216-W250 AromaticContact CG-CH2 3.91Å; F216-W250 HydrophobicContact CG-CH2 3.91Å; F216-W250 HydrophobicContact CG-CZ3 4.17Å; F216-L254 WeakPolarHBondContact O-CD1 3.26Å
217	Q	80.9	Confident	77.5	Confident	131 Å²	131	60.9 Å²	60.9	61%	0.612	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-68.6	-7.5	168.8	-56.5	-177.8	-2.8	0	0	113	P214 L215 Q220	P214-Q217 WeakPolarHBondContact O-CB 3.28Å; P214-Q217 PolarHBondContact O-N 2.89Å; L215-Q217 PolarHBondContact O-N 3.35Å; Q217-Q220 VanDerWaalsContact O-CG 3.3Å; Q217-Q220 WeakPolarHBondContact O-CG 3.36Å; Q217-Q220 PolarHBondContact O-NE2 2.91Å
218	R	81.2	Confident	75.5	Confident	91 Å²	91	67.9 Å²	67.9	34%	0.343	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-92.3	-7.2	170	-51.9	178.5	-172.9	167.9	4.8	113.2	Q195 L215 F216 Q220 F233	Q195-R218 PolarHBondContact O-NH1 3.48Å; L215-R218 VanDerWaalsContact O-CB 3.24Å; L215-R218 WeakPolarHBondContact O-CB 3.48Å; L215-R218 WeakPolarHBondContact O-CG 3.24Å; L215-R218 PolarHBondContact O-N 2.86Å; F216-R218 PolarHBondContact O-N 3.3Å; F216-R218 VanDerWaalsContact O-N 3.17Å; R218-Q220 VanDerWaalsContact C-N 3.32Å; R218-F233 HydrophobicContact CB-CB 3.83Å
219	A	77.4	Confident	73.7	Confident	2 Å²	2	67.3 Å²	67.3	2%	0.017	39%	0.392	C	S	.	.	S	Bend	trans	-85.7	0.9	-176.2	0	0	0	0	0	114.5	F216 F233 L235 L254 R256	F216-A219 WeakPolarHBondContact O-CB 3.45Å; F216-A219 PolarHBondContact O-N 3.29Å; A219-F233 HydrophobicContact CB-CD1 3.88Å; A219-L235 HydrophobicContact CB-CB 4.23Å; A219-L254 HydrophobicContact CB-CD1 4.5Å; A219-R256 PolarHBondContact O-NH1 2.77Å
220	Q	74.5	Confident	72	Confident	47 Å²	47	68.4 Å²	68.4	22%	0.22	41%	0.411	C	S	.	.	S	Bend	trans	-102.6	146.7	-175.3	50.4	172.3	-16.5	0	0	111.8	Q217 R218 L222 L254 S255	Q217-Q220 VanDerWaalsContact O-CG 3.3Å; Q217-Q220 WeakPolarHBondContact O-CG 3.36Å; Q217-Q220 PolarHBondContact O-NE2 2.91Å; R218-Q220 VanDerWaalsContact C-N 3.32Å; Q220-L222 HydrophobicContact CG-CD1 4.47Å; Q220-L222 HydrophobicContact CG-CG 4.13Å; Q220-L222 PolarHBondContact O-N 2.95Å; Q220-L254 HydrophobicContact CB-CB 4.38Å; Q220-L254 HydrophobicContact CB-CD2 4.47Å; Q220-S255 CarbonylContact C-O 3.33Å; Q220-S255 VanDerWaalsContact CA-O 3.25Å; Q220-S255 WeakPolarHBondContact CA-O 3.21Å
221	V	66.3	Low	70.6	Confident	47 Å²	47	71.4 Å²	71.4	29%	0.285	43%	0.43	S	S	.	.			trans	-89.4	94.6	177.2	-174.4	0	0	0	0	109.9	A223 P231 S255	V221-A223 PolarHBondContact O-N 3.35Å; V221-P231 HydrophobicContact CG2-CG 4.43Å; V221-S255 PolarHBondContact N-O 2.92Å
222	L	61	Low	69.8	Low	91 Å²	91	75.1 Å²	75.1	48%	0.476	46%	0.456	S	S	.	.			trans	-85.8	91	179.3	-70.7	175.1	0	0	0	111.8	Q220 T224	Q220-L222 HydrophobicContact CG-CD1 4.47Å; Q220-L222 HydrophobicContact CG-CG 4.13Å; Q220-L222 PolarHBondContact O-N 2.95Å; L222-T224 VanDerWaalsContact C-N 3.31Å; L222-T224 PolarHBondContact O-N 2.91Å
223	A	53.9	Low	69.5	Low	61 Å²	61	71.6 Å²	71.6	50%	0.504	43%	0.433	S	S	.	.			trans	-79.3	68.5	174.7	0	0	0	0	0	112.6	V221 M228	V221-A223 PolarHBondContact O-N 3.35Å; A223-M228 HydrophobicContact CB-CE 4.08Å; A223-M228 HydrophobicContact CB-SD 3.77Å
224	T	52.8	Low	69.5	Low	90 Å²	90	72.6 Å²	72.6	55%	0.552	44%	0.443	S	S	*	.			trans	-80.3	120.5	174.6	44.9	0	0	0	0	111.8	L222 G226 I227	L222-T224 VanDerWaalsContact C-N 3.31Å; L222-T224 PolarHBondContact O-N 2.91Å; T224-G226 VanDerWaalsContact C-N 3.33Å; T224-G226 PolarHBondContact O-N 3.4Å; T224-G226 VanDerWaalsContact O-N 3.12Å; T224-I227 PolarHBondContact O-N 2.88Å
225	S	50.2	Low	69.8	Low	132 Å²	132	68.4 Å²	68.4	92%	0.923	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	41	164.7	-55.8	0	0	0	0	116.4
226	G	54.3	Low	70.2	Confident	83 Å²	83	69.7 Å²	69.7	86%	0.856	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	2.8	169.7	0	0	0	0	0	116.2	T224	T224-G226 VanDerWaalsContact C-N 3.33Å; T224-G226 PolarHBondContact O-N 3.4Å; T224-G226 VanDerWaalsContact O-N 3.12Å
227	I	56.8	Low	70.6	Confident	114 Å²	114	69.8 Å²	69.8	59%	0.585	43%	0.426	S	S	*	.			trans	-105.1	111.7	169.4	-56.9	179.3	0	0	0	108.6	T224 N229	T224-I227 PolarHBondContact O-N 2.88Å; I227-N229 PolarHBondContact O-N 3.44Å; I227-N229 VanDerWaalsContact O-N 3.17Å
228	M	54.9	Low	71.3	Confident	149 Å²	149	63.9 Å²	63.9	73%	0.734	40%	0.4	S	S	*	.			trans	-76.8	96.5	170.3	-73.7	-66	-174.3	0	0	109.2	A223	A223-M228 HydrophobicContact CB-CE 4.08Å; A223-M228 HydrophobicContact CB-SD 3.77Å
229	N	58.1	Low	72	Confident	92 Å²	92	62.2 Å²	62.2	49%	0.492	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-79.3	121.4	169.9	-70.9	-40.2	0	0	0	109.5	I227	I227-N229 PolarHBondContact O-N 3.44Å; I227-N229 VanDerWaalsContact O-N 3.17Å
230	S	59.9	Low	72.9	Confident	108 Å²	108	62.5 Å²	62.5	76%	0.755	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-57.1	142	170.1	-50.6	0	0	0	0	110.5	S232	S230-S232 PolarHBondContact O-N 2.89Å
231	P	66.6	Low	74	Confident	67 Å²	67	62.3 Å²	62.3	44%	0.435	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-60.9	128.7	176.2	26	-33.3	0	0	0	109.5	V221 F233	V221-P231 HydrophobicContact CG2-CG 4.43Å; P231-F233 PolarHBondContact O-N 3.45Å
232	S	76.8	Confident	75.5	Confident	89 Å²	89	60.2 Å²	60.2	62%	0.622	40%	0.402	S	S	*	.	S	Bend	trans	-81.1	-3.7	-179.5	56.2	0	0	0	0	113.1	S230	S230-S232 PolarHBondContact O-N 2.89Å
233	F	85.4	Confident	77.3	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.009	39%	0.387	C	S	.	.	S	Bend	trans	-136.5	128.4	174.2	-177.2	-106.2	0	0	0	111.2	L197 N198 L200 L215 F216 R218 A219 P231 L235	L197-F233 HydrophobicContact CB-CE2 4.4Å; L197-F233 HydrophobicContact CD2-CE2 4.07Å; L197-F233 HydrophobicContact CD2-CZ 4.36Å; L197-F233 HydrophobicContact CG-CE2 4.02Å; L197-F233 VanDerWaalsContact O-CD2 3.27Å; L197-F233 WeakPolarHBondContact O-CD2 3.37Å; N198-F233 VanDerWaalsContact C-CD2 3.46Å; N198-F233 WeakPolarHBondContact O-CA 3.27Å; L200-F233 HydrophobicContact CB-CE1 4.38Å; L200-F233 HydrophobicContact CB-CE2 4.3Å; L200-F233 HydrophobicContact CB-CZ 3.54Å; L215-F233 HydrophobicContact CD2-CD1 4.49Å; L215-F233 HydrophobicContact CD2-CD2 4.02Å; L215-F233 HydrophobicContact CD2-CE1 3.96Å; L215-F233 HydrophobicContact CD2-CE2 3.47Å; L215-F233 VanDerWaalsContact CD2-CE2 3.47Å; L215-F233 HydrophobicContact CD2-CG 4.5Å; L215-F233 HydrophobicContact CD2-CZ 3.39Å; L215-F233 HydrophobicContact CG-CD2 4.29Å; L215-F233 HydrophobicContact CG-CE2 4.22Å; L215-F233 HydrophobicContact CG-CZ 4.37Å; F216-F233 HydrophobicContact CD1-CD1 4.41Å; F216-F233 AromaticContact CD1-CE1 3.7Å; F216-F233 HydrophobicContact CD1-CE1 3.7Å; F216-F233 HydrophobicContact CD1-CZ 4.42Å; F216-F233 AromaticContact CE1-CE1 3.86Å; F216-F233 HydrophobicContact CE1-CE1 3.86Å; F216-F233 HydrophobicContact CE1-CZ 4.18Å; R218-F233 HydrophobicContact CB-CB 3.83Å; A219-F233 HydrophobicContact CB-CD1 3.88Å; P231-F233 PolarHBondContact O-N 3.45Å; F233-L235 HydrophobicContact CD1-CB 4.18Å; F233-L235 HydrophobicContact CE1-CB 3.8Å; F233-L235 HydrophobicContact CE1-CD1 4.21Å; F233-L235 HydrophobicContact CE1-CG 4.5Å
234	A	89.6	Confident	79.4	Confident	36 Å²	36	54.6 Å²	54.6	30%	0.298	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.6	172.2	0	0	0	0	0	110.2	N198 R199 L200	N198-A234 PolarHBondContact O-N 2.92Å; R199-A234 WeakPolarHBondContact CA-O 3.27Å; R199-A234 HydrophobicContact CB-CB 4.48Å; L200-A234 PolarHBondContact N-O 3.36Å
235	L	92.6	Very high	81.5	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.016	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	135	169.5	-176.4	62.1	0	0	0	109.1	L200 F216 A219 F233 F237 L251 R256	L200-L235 HydrophobicContact CB-CD1 4.18Å; L200-L235 HydrophobicContact CD2-CD1 3.98Å; L200-L235 HydrophobicContact CG-CD1 4.21Å; L200-L235 WeakPolarHBondContact O-CA 3.49Å; F216-L235 HydrophobicContact CD1-CD1 4.31Å; F216-L235 HydrophobicContact CD1-CD2 3.96Å; F216-L235 HydrophobicContact CE1-CD1 3.92Å; F216-L235 HydrophobicContact CE1-CD2 4.32Å; A219-L235 HydrophobicContact CB-CB 4.23Å; F233-L235 HydrophobicContact CD1-CB 4.18Å; F233-L235 HydrophobicContact CE1-CB 3.8Å; F233-L235 HydrophobicContact CE1-CD1 4.21Å; F233-L235 HydrophobicContact CE1-CG 4.5Å; L235-F237 HydrophobicContact CD2-CD1 4.08Å; L235-F237 HydrophobicContact CD2-CE1 4.46Å; L235-F237 HydrophobicContact CG-CD1 4.11Å; L235-L251 HydrophobicContact CD2-CD1 4.41Å; L235-R256 PolarHBondContact O-NH1 2.96Å; L235-R256 PolarHBondContact O-NH2 2.91Å
236	S	94.1	Very high	83.7	Confident	29 Å²	29	45.8 Å²	45.8	20%	0.203	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	125.1	170.2	-53.9	0	0	0	0	109.6	L200 D201 V202 T203	L200-S236 PolarHBondContact O-N 2.93Å; L200-S236 VanDerWaalsContact O-N 3.11Å; D201-S236 WeakPolarHBondContact OD1-CB 3.29Å; V202-S236 VanDerWaalsContact CG2-O 3.31Å; V202-S236 WeakPolarHBondContact CG2-O 3.45Å; V202-S236 PolarHBondContact N-O 3.29Å; T203-S236 WeakPolarHBondContact OG1-CB 3.1Å
237	F	95.4	Very high	85.7	Confident	1 Å²	1	43.6 Å²	43.6	0%	0.004	27%	0.273	C	S	.	.			trans	-140	13.3	-176.2	68.9	-83.3	0	0	0	114.9	V202 L210 L235 N240 L242 L251 E261 F274 W275	V202-F237 HydrophobicContact CG2-CB 3.79Å; L210-F237 HydrophobicContact CD1-CB 3.98Å; L210-F237 HydrophobicContact CD1-CD1 4.41Å; L210-F237 HydrophobicContact CD1-CD2 4.28Å; L210-F237 HydrophobicContact CD1-CG 3.98Å; L235-F237 HydrophobicContact CD2-CD1 4.08Å; L235-F237 HydrophobicContact CD2-CE1 4.46Å; L235-F237 HydrophobicContact CG-CD1 4.11Å; F237-N240 PolarHBondContact O-ND2 3.31Å; F237-L242 HydrophobicContact CD2-CD1 4.04Å; F237-L242 HydrophobicContact CD2-CD2 4.32Å; F237-L242 HydrophobicContact CE2-CD1 3.82Å; F237-L251 HydrophobicContact CD2-CD2 4.32Å; F237-L251 HydrophobicContact CE1-CD1 4.16Å; F237-L251 HydrophobicContact CE1-CD2 4.23Å; F237-L251 HydrophobicContact CE2-CD2 3.73Å; F237-L251 HydrophobicContact CZ-CD1 4.23Å; F237-L251 HydrophobicContact CZ-CD2 3.68Å; F237-L251 HydrophobicContact CZ-CG 4.09Å; F237-E261 HydrophobicContact CD2-CB 4.46Å; F237-E261 HydrophobicContact CD2-CG 4.01Å; F237-E261 HydrophobicContact CE1-CG 4.36Å; F237-E261 WeakPolarHBondContact CE1-OE1 3.13Å; F237-E261 HydrophobicContact CE2-CB 3.97Å; F237-E261 HydrophobicContact CE2-CG 3.71Å; F237-E261 HydrophobicContact CG-CG 4.45Å; F237-E261 HydrophobicContact CZ-CB 4.44Å; F237-E261 HydrophobicContact CZ-CG 3.9Å; F237-E261 WeakPolarHBondContact CZ-OE1 3.45Å; F237-F274 HydrophobicContact CZ-CD1 4.37Å; F237-F274 HydrophobicContact CZ-CE1 4.36Å; F237-W275 HydrophobicContact CE1-CZ2 4.16Å; F237-W275 AromaticContact CZ-CZ2 3.83Å; F237-W275 HydrophobicContact CZ-CZ2 3.83Å
238	G	94.9	Very high	87.6	Confident	7 Å²	7	38.1 Å²	38.1	7%	0.072	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	165.1	176.3	0	0	0	0	0	113.9	T203 S204 N240	T203-G238 CarbonylContact C-O 3.55Å; T203-G238 VanDerWaalsContact CA-O 3.27Å; T203-G238 WeakPolarHBondContact CA-O 3.21Å; T203-G238 WeakPolarHBondContact CG2-O 3.37Å; S204-G238 PolarHBondContact N-O 3.44Å; G238-N240 PolarHBondContact O-N 2.88Å; G238-N240 VanDerWaalsContact O-N 3.13Å; G238-N240 PolarHBondContact O-ND2 2.88Å
239	G	95.6	Very high	89.5	Confident	56 Å²	56	32.5 Å²	32.5	58%	0.577	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.5	7.7	179.6	0	0	0	0	0	116
240	N	97.9	Very high	91.2	Very high	9 Å²	9	31 Å²	31	5%	0.048	21%	0.205	C	C	.	.	S	Bend	trans	-88.3	149.6	174	-81.4	-74.6	0	0	0	112.2	V202 N205 K206 L207 F237 G238 L242	V202-N240 PolarHBondContact O-ND2 2.83Å; N205-N240 VanDerWaalsContact CA-OD1 3.23Å; N205-N240 WeakPolarHBondContact CA-OD1 3.32Å; N205-N240 WeakPolarHBondContact CB-OD1 3.18Å; N205-N240 PolarHBondContact N-OD1 3.32Å; K206-N240 PolarHBondContact N-OD1 3.34Å; L207-N240 HydrophobicContact CB-CB 4.36Å; L207-N240 WeakPolarHBondContact CB-OD1 3.43Å; L207-N240 PolarHBondContact N-OD1 3.47Å; F237-N240 PolarHBondContact O-ND2 3.31Å; G238-N240 PolarHBondContact O-N 2.88Å; G238-N240 VanDerWaalsContact O-N 3.13Å; G238-N240 PolarHBondContact O-ND2 2.88Å; N240-L242 HydrophobicContact CB-CD2 3.94Å; N240-L242 HydrophobicContact CB-CG 4.25Å; N240-L242 PolarHBondContact O-N 2.92Å
241	P	97.5	Very high	92.8	Very high	43 Å²	43	25.9 Å²	25.9	28%	0.279	17%	0.169	S	C	.	.			trans	-80.5	65.8	177	35.9	-36.8	0	0	0	111.2	H243 A264	P241-H243 PolarHBondContact O-N 3.11Å; P241-A264 HydrophobicContact CB-CB 3.89Å
242	L	97.8	Very high	94.1	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	135.1	-170.6	-61.1	175.2	0	0	0	112.6	F237 N240 L248 E261 A264 S265 F274	F237-L242 HydrophobicContact CD2-CD1 4.04Å; F237-L242 HydrophobicContact CD2-CD2 4.32Å; F237-L242 HydrophobicContact CE2-CD1 3.82Å; N240-L242 HydrophobicContact CB-CD2 3.94Å; N240-L242 HydrophobicContact CB-CG 4.25Å; N240-L242 PolarHBondContact O-N 2.92Å; L242-L248 HydrophobicContact CB-CD1 4.17Å; L242-L248 HydrophobicContact CD2-CD1 4.31Å; L242-E261 HydrophobicContact CD1-CB 4.15Å; L242-A264 PolarHBondContact O-N 3.4Å; L242-S265 PolarHBondContact O-N 3.22Å; L242-F274 HydrophobicContact CD1-CD2 4.02Å; L242-F274 HydrophobicContact CD1-CG 4.45Å
243	H	97.7	Very high	94.9	Very high	33 Å²	33	27.8 Å²	27.8	15%	0.153	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	95.8	172.7	-173.8	9.8	0	0	0	108.4	Q208 P241 N245 L248 S265 D313	Q208-H243 HydrophobicContact CB-CB 4.01Å; Q208-H243 PolarHBondContact O-N 3.38Å; P241-H243 PolarHBondContact O-N 3.11Å; H243-N245 PolarHBondContact O-N 3.07Å; H243-L248 WeakPolarHBondContact O-CD1 3.27Å; H243-S265 CarbonylContact C-O 3.5Å; H243-S265 WeakPolarHBondContact CA-O 3.37Å; H243-S265 WeakPolarHBondContact CA-OG 3.1Å; H243-S265 WeakPolarHBondContact CB-OG 3.43Å; H243-S265 PolarHBondContact ND1-OG 3.2Å; H243-D313 IonicContact CE1-OD1 2.94Å; H243-D313 PolarHBondContact CE1-OD1 2.61Å; H243-D313 IonicContact CE1-OD2 3.26Å; H243-D313 PolarHBondContact CE1-OD2 3.06Å; H243-D313 VanDerWaalsContact CE1-OD2 3.31Å; H243-D313 IonicContact NE2-OD1 2.68Å; H243-D313 PolarHBondContact NE2-OD1 3.28Å
244	C	97.9	Very high	95.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.007	16%	0.158	C	C	.	.			trans	-84.8	61.7	-168.7	-64.7	0	0	0	0	112.3	C263 S265 L269 F282	C244-C263 HydrophobicContact CB-CB 3.8Å; C244-C263 WeakPolarHBondContact CB-SG 3.26Å; C244-C263 WeakPolarHBondContact SG-CB 3.15Å; C244-C263 CovalentContact SG-SG 2.02Å; C244-C263 PolarHBondContact SG-SG 3.45Å; C244-S265 PolarHBondContact N-O 2.52Å; C244-L269 HydrophobicContact CB-CD1 3.79Å; C244-L269 VanDerWaalsContact O-CD1 3.29Å; C244-L269 WeakPolarHBondContact O-CD1 3.42Å; C244-F282 HydrophobicContact CB-CD1 4.07Å; C244-F282 HydrophobicContact CB-CE1 3.64Å; C244-F282 HydrophobicContact CB-CZ 4.45Å
245	N	96.9	Very high	94.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-98.2	-172.8	170.4	69.8	10.9	0	0	0	110.6	H243 E247 L248 L283 D313	H243-N245 PolarHBondContact O-N 3.07Å; N245-E247 PolarHBondContact O-N 2.98Å; N245-E247 WeakPolarHBondContact OD1-CB 3.19Å; N245-E247 WeakPolarHBondContact OD1-CG 3.33Å; N245-E247 PolarHBondContact OD1-N 2.92Å; N245-L248 PolarHBondContact O-N 2.91Å; N245-L248 VanDerWaalsContact O-N 3.12Å; N245-L283 CarbonylContact C-O 3.46Å; N245-L283 WeakPolarHBondContact CA-O 3.33Å; N245-L283 WeakPolarHBondContact CB-O 3.44Å; N245-D313 WeakPolarHBondContact CB-OD1 3.41Å; N245-D313 PolarHBondContact ND2-OD1 3.04Å
246	C	96.5	Very high	94.4	Very high	38 Å²	38	32.6 Å²	32.6	26%	0.257	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-59.4	-17.8	179.2	76.3	0	0	0	0	114.8	L248 L249 F282 L283 C284	C246-L248 PolarHBondContact O-N 2.88Å; C246-L249 VanDerWaalsContact O-CB 3.26Å; C246-L249 WeakPolarHBondContact O-CB 3.35Å; C246-L249 PolarHBondContact O-N 2.89Å; C246-F282 VanDerWaalsContact CA-O 3.27Å; C246-F282 WeakPolarHBondContact CA-O 3.41Å; C246-F282 WeakPolarHBondContact CB-O 3.37Å; C246-F282 PolarHBondContact N-O 2.85Å; C246-L283 PolarHBondContact N-O 2.83Å; C246-C284 VanDerWaalsContact CA-SG 3.56Å; C246-C284 HydrophobicContact CB-CB 3.83Å; C246-C284 WeakPolarHBondContact CB-SG 2.95Å; C246-C284 PolarHBondContact N-SG 2.89Å; C246-C284 WeakPolarHBondContact SG-CB 3.2Å; C246-C284 CovalentContact SG-SG 2.03Å; C246-C284 PolarHBondContact SG-SG 2.95Å
247	E	96.2	Very high	93.9	Very high	36 Å²	36	38.4 Å²	38.4	17%	0.168	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-68.1	-21.7	176.7	-54.5	-167.5	96	0	0	112.8	K209 N245 W250 P314 P362	K209-E247 HydrophobicContact CD-CB 4.27Å; K209-E247 WeakPolarHBondContact CD-OE2 3.43Å; K209-E247 IonicContact NZ-OE1 3.67Å; K209-E247 PolarHBondContact NZ-OE1 2.8Å; K209-E247 IonicContact NZ-OE2 2.77Å; K209-E247 PolarHBondContact NZ-OE2 2.99Å; N245-E247 PolarHBondContact O-N 2.98Å; N245-E247 WeakPolarHBondContact OD1-CB 3.19Å; N245-E247 WeakPolarHBondContact OD1-CG 3.33Å; N245-E247 PolarHBondContact OD1-N 2.92Å; E247-W250 PolarHBondContact O-NE1 2.94Å; E247-W250 VanDerWaalsContact O-NE1 3.13Å; E247-P314 HydrophobicContact CG-CG 4.19Å; E247-P314 VanDerWaalsContact OE2-CB 3.32Å; E247-P314 WeakPolarHBondContact OE2-CB 3.33Å; E247-P314 WeakPolarHBondContact OE2-CG 2.9Å; E247-P362 HydrophobicContact CG-CG 4.17Å
248	L	96.5	Very high	93.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-98	0.4	174	-68.3	-175.8	0	0	0	113.9	K209 L242 H243 N245 C246 W250 L251 R252 F274 F282	K209-L248 HydrophobicContact CB-CD2 4.05Å; K209-L248 HydrophobicContact CB-CG 4.4Å; L242-L248 HydrophobicContact CB-CD1 4.17Å; L242-L248 HydrophobicContact CD2-CD1 4.31Å; H243-L248 WeakPolarHBondContact O-CD1 3.27Å; N245-L248 PolarHBondContact O-N 2.91Å; N245-L248 VanDerWaalsContact O-N 3.12Å; C246-L248 PolarHBondContact O-N 2.88Å; L248-W250 PolarHBondContact O-N 2.86Å; L248-L251 HydrophobicContact CD2-CD2 4.12Å; L248-L251 WeakPolarHBondContact O-CB 3.41Å; L248-L251 PolarHBondContact O-N 3.48Å; L248-R252 PolarHBondContact O-N 3.13Å; L248-F274 HydrophobicContact CB-CE2 3.95Å; L248-F274 HydrophobicContact CB-CZ 4.24Å; L248-F274 HydrophobicContact CD1-CE2 3.95Å; L248-F282 HydrophobicContact CB-CD1 4.41Å; L248-F282 HydrophobicContact CB-CE1 4.39Å
249	L	95.6	Very high	92.9	Very high	31 Å²	31	45.7 Å²	45.7	16%	0.162	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-31.2	179.6	179.4	58.5	0	0	0	112.8	C246 L251 R253 E279 F282	C246-L249 VanDerWaalsContact O-CB 3.26Å; C246-L249 WeakPolarHBondContact O-CB 3.35Å; C246-L249 PolarHBondContact O-N 2.89Å; L249-L251 VanDerWaalsContact C-N 3.33Å; L249-R253 WeakPolarHBondContact O-CG 3.43Å; L249-R253 PolarHBondContact O-N 2.86Å; L249-E279 HydrophobicContact CD1-CB 3.79Å; L249-E279 HydrophobicContact CD1-CG 3.85Å; L249-F282 HydrophobicContact CB-CB 4.31Å; L249-F282 HydrophobicContact CD1-CB 4.29Å
250	W	93.8	Very high	92.8	Very high	60 Å²	60	48.1 Å²	48.1	23%	0.227	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-35.4	174.8	73.9	-95.7	0	0	0	112.3	L210 P211 P212 F216 E247 L248 L254	L210-W250 HydrophobicContact CB-CZ2 4.05Å; L210-W250 PolarHBondContact O-NE1 2.85Å; P211-W250 WeakPolarHBondContact O-CZ2 3.08Å; P212-W250 HydrophobicContact CB-CD2 4.04Å; P212-W250 HydrophobicContact CB-CG 4.11Å; F216-W250 HydrophobicContact CB-CH2 3.92Å; F216-W250 HydrophobicContact CB-CZ3 3.64Å; F216-W250 AromaticContact CD2-CH2 3.43Å; F216-W250 HydrophobicContact CD2-CH2 3.43Å; F216-W250 VanDerWaalsContact CD2-CH2 3.43Å; F216-W250 HydrophobicContact CD2-CZ2 4.28Å; F216-W250 AromaticContact CD2-CZ3 3.99Å; F216-W250 HydrophobicContact CD2-CZ3 3.99Å; F216-W250 HydrophobicContact CE2-CH2 4.23Å; F216-W250 AromaticContact CG-CH2 3.91Å; F216-W250 HydrophobicContact CG-CH2 3.91Å; F216-W250 HydrophobicContact CG-CZ3 4.17Å; E247-W250 PolarHBondContact O-NE1 2.94Å; E247-W250 VanDerWaalsContact O-NE1 3.13Å; L248-W250 PolarHBondContact O-N 2.86Å; W250-L254 HydrophobicContact CZ3-CD1 4.3Å
251	L	94.1	Very high	92.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-75.3	-41.1	178.9	177.6	60.3	0	0	0	110.1	L210 L235 F237 L248 L249 R253 L254 F274 W275	L210-L251 HydrophobicContact CD1-CD2 4Å; L235-L251 HydrophobicContact CD2-CD1 4.41Å; F237-L251 HydrophobicContact CD2-CD2 4.32Å; F237-L251 HydrophobicContact CE1-CD1 4.16Å; F237-L251 HydrophobicContact CE1-CD2 4.23Å; F237-L251 HydrophobicContact CE2-CD2 3.73Å; F237-L251 HydrophobicContact CZ-CD1 4.23Å; F237-L251 HydrophobicContact CZ-CD2 3.68Å; F237-L251 HydrophobicContact CZ-CG 4.09Å; L248-L251 HydrophobicContact CD2-CD2 4.12Å; L248-L251 WeakPolarHBondContact O-CB 3.41Å; L248-L251 PolarHBondContact O-N 3.48Å; L249-L251 VanDerWaalsContact C-N 3.33Å; L251-R253 PolarHBondContact O-N 2.89Å; L251-L254 HydrophobicContact CD1-CD1 4.03Å; L251-L254 WeakPolarHBondContact O-CB 3.24Å; L251-L254 PolarHBondContact O-N 2.93Å; L251-L254 VanDerWaalsContact O-N 3.08Å; L251-F274 HydrophobicContact CB-CZ 4.16Å; L251-F274 HydrophobicContact CD2-CE1 4.37Å; L251-F274 HydrophobicContact CD2-CZ 4.01Å; L251-F274 HydrophobicContact CG-CE1 4.04Å; L251-F274 HydrophobicContact CG-CZ 3.91Å; L251-W275 WeakPolarHBondContact O-CH2 3.46Å; L251-W275 WeakPolarHBondContact O-CZ3 3.45Å
252	R	94.3	Very high	92.7	Very high	51 Å²	51	48 Å²	48	19%	0.192	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-26.6	175.6	-179.5	58	-172.4	81.2	-1.5	113.4	L248 L254 F274 W275 I277 E279 F282	L248-R252 PolarHBondContact O-N 3.13Å; R252-L254 VanDerWaalsContact C-N 3.31Å; R252-L254 PolarHBondContact O-N 2.95Å; R252-F274 HydrophobicContact CB-CE1 4.11Å; R252-F274 HydrophobicContact CB-CZ 3.94Å; R252-W275 PolarHBondContact NH2-O 3.39Å; R252-I277 VanDerWaalsContact CZ-O 3.25Å; R252-I277 PolarHBondContact NE-O 3.47Å; R252-I277 PolarHBondContact NH2-O 2.76Å; R252-E279 HydrophobicContact CG-CG 4.32Å; R252-F282 HydrophobicContact CB-CD2 4.46Å; R252-F282 HydrophobicContact CB-CE2 4.1Å; R252-F282 HydrophobicContact CB-CZ 4.14Å; R252-F282 HydrophobicContact CG-CD2 4.02Å; R252-F282 HydrophobicContact CG-CE2 3.52Å; R252-F282 HydrophobicContact CG-CZ 3.95Å
253	R	92.8	Very high	92.7	Very high	146 Å²	146	47.9 Å²	47.9	55%	0.551	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.5	176.5	-80.9	172	173.2	152.9	11.9	115.1	L249 L251 E279	L249-R253 WeakPolarHBondContact O-CG 3.43Å; L249-R253 PolarHBondContact O-N 2.86Å; L251-R253 PolarHBondContact O-N 2.89Å; R253-E279 WeakPolarHBondContact CG-OE1 3.48Å; R253-E279 IonicContact CZ-OE2 3.13Å; R253-E279 IonicContact NE-OE1 3.68Å; R253-E279 IonicContact NE-OE2 2.75Å; R253-E279 PolarHBondContact NE-OE2 2.78Å; R253-E279 IonicContact NH2-OE2 2.71Å; R253-E279 PolarHBondContact NH2-OE2 3.02Å
254	L	89.6	Confident	92.7	Very high	18 Å²	18	48.4 Å²	48.4	9%	0.094	25%	0.245	C	C	.	.	S	Bend	trans	-77.2	138.9	177.3	-58.4	-173	0	0	0	111	F216 A219 Q220 W250 L251 R252 R256 W275	F216-L254 WeakPolarHBondContact O-CD1 3.26Å; A219-L254 HydrophobicContact CB-CD1 4.5Å; Q220-L254 HydrophobicContact CB-CB 4.38Å; Q220-L254 HydrophobicContact CB-CD2 4.47Å; W250-L254 HydrophobicContact CZ3-CD1 4.3Å; L251-L254 HydrophobicContact CD1-CD1 4.03Å; L251-L254 WeakPolarHBondContact O-CB 3.24Å; L251-L254 PolarHBondContact O-N 2.93Å; L251-L254 VanDerWaalsContact O-N 3.08Å; R252-L254 VanDerWaalsContact C-N 3.31Å; R252-L254 PolarHBondContact O-N 2.95Å; L254-R256 HydrophobicContact CB-CG 4.22Å; L254-R256 PolarHBondContact O-N 3.34Å; L254-W275 WeakPolarHBondContact O-CZ3 3.41Å
255	S	84.8	Confident	92.6	Very high	73 Å²	73	50 Å²	50	51%	0.51	26%	0.256	S	S	.	.			trans	-82.5	109.3	169.2	-171.9	0	0	0	0	109.7	Q220 V221	Q220-S255 CarbonylContact C-O 3.33Å; Q220-S255 VanDerWaalsContact CA-O 3.25Å; Q220-S255 WeakPolarHBondContact CA-O 3.21Å; V221-S255 PolarHBondContact N-O 2.92Å
256	R	83.9	Confident	92.6	Very high	50 Å²	50	50.9 Å²	50.9	19%	0.189	26%	0.262	C	S	.	.			trans	-139.5	166.2	-174.2	-78.4	-173.5	53.3	81.7	0.8	111.9	A219 L235 L254 D259 W275	A219-R256 PolarHBondContact O-NH1 2.77Å; L235-R256 PolarHBondContact O-NH1 2.96Å; L235-R256 PolarHBondContact O-NH2 2.91Å; L254-R256 HydrophobicContact CB-CG 4.22Å; L254-R256 PolarHBondContact O-N 3.34Å; R256-D259 IonicContact NH2-OD2 2.66Å; R256-D259 PolarHBondContact NH2-OD2 3.44Å; R256-W275 HydrophobicContact CB-CH2 4.05Å; R256-W275 HydrophobicContact CB-CZ2 3.96Å; R256-W275 HydrophobicContact CG-CH2 4.31Å; R256-W275 HydrophobicContact CG-CZ2 4.46Å
257	E	82.8	Confident	92.6	Very high	152 Å²	152	58.1 Å²	58.1	71%	0.71	29%	0.292	S	S	*	.			trans	-75.6	154.8	165.1	-63.1	177.6	-172.2	0	0	109.8
258	D	83.3	Confident	92.6	Very high	81 Å²	81	62.1 Å²	62.1	43%	0.433	31%	0.311	S	S	.	.			trans	-93.9	104.9	-176.9	-171.4	-18.6	0	0	0	109.6	L260	D258-L260 PolarHBondContact O-N 3.49Å; D258-L260 WeakPolarHBondContact OD1-CA 3.49Å; D258-L260 PolarHBondContact OD1-N 3.4Å
259	D	86.1	Confident	92.6	Very high	80 Å²	80	62.1 Å²	62.1	43%	0.428	31%	0.311	S	S	.	.			trans	-88.1	18.4	178.5	-71.7	-51.2	0	0	0	111.4	R256 E261	R256-D259 IonicContact NH2-OD2 2.66Å; R256-D259 PolarHBondContact NH2-OD2 3.44Å; D259-E261 VanDerWaalsContact C-N 3.26Å; D259-E261 WeakPolarHBondContact CA-OE2 3.29Å; D259-E261 HydrophobicContact CB-CG 4.3Å; D259-E261 PolarHBondContact N-OE2 3.35Å; D259-E261 PolarHBondContact O-N 3.36Å
260	L	92.7	Very high	92.6	Very high	106 Å²	106	64 Å²	64	56%	0.555	33%	0.327	S	S	*	.			trans	60.9	29.3	-175.2	-53	176.6	0	0	0	113.5	D258 T262 Y273	D258-L260 PolarHBondContact O-N 3.49Å; D258-L260 WeakPolarHBondContact OD1-CA 3.49Å; D258-L260 PolarHBondContact OD1-N 3.4Å; L260-T262 PolarHBondContact O-N 3.08Å; L260-T262 PolarHBondContact O-OG1 2.93Å; L260-Y273 HydrophobicContact CB-CD1 4.27Å; L260-Y273 HydrophobicContact CB-CE1 4.05Å; L260-Y273 HydrophobicContact CD2-CD1 4.34Å; L260-Y273 HydrophobicContact CD2-CE1 4.04Å
261	E	95.9	Very high	92.7	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.345	C	S	.	.			trans	-58.2	136.3	174.6	-49.6	100.5	120.7	0	0	109.9	F237 L242 D259 Y273 F274 W275	F237-E261 HydrophobicContact CD2-CB 4.46Å; F237-E261 HydrophobicContact CD2-CG 4.01Å; F237-E261 HydrophobicContact CE1-CG 4.36Å; F237-E261 WeakPolarHBondContact CE1-OE1 3.13Å; F237-E261 HydrophobicContact CE2-CB 3.97Å; F237-E261 HydrophobicContact CE2-CG 3.71Å; F237-E261 HydrophobicContact CG-CG 4.45Å; F237-E261 HydrophobicContact CZ-CB 4.44Å; F237-E261 HydrophobicContact CZ-CG 3.9Å; F237-E261 WeakPolarHBondContact CZ-OE1 3.45Å; L242-E261 HydrophobicContact CD1-CB 4.15Å; D259-E261 VanDerWaalsContact C-N 3.26Å; D259-E261 WeakPolarHBondContact CA-OE2 3.29Å; D259-E261 HydrophobicContact CB-CG 4.3Å; D259-E261 PolarHBondContact N-OE2 3.35Å; D259-E261 PolarHBondContact O-N 3.36Å; E261-Y273 CarbonylContact O-C 3.54Å; E261-Y273 VanDerWaalsContact O-CA 3.3Å; E261-Y273 WeakPolarHBondContact O-CA 3.28Å; E261-F274 HydrophobicContact CB-CB 4.01Å; E261-F274 WeakPolarHBondContact O-CB 3.24Å; E261-F274 PolarHBondContact O-N 3.41Å; E261-W275 PolarHBondContact OE1-NE1 2.86Å; E261-W275 VanDerWaalsContact OE2-CD1 3.27Å; E261-W275 PolarHBondContact OE2-NE1 3.18Å
262	T	96.9	Very high	92.9	Very high	49 Å²	49	67.8 Å²	67.8	30%	0.301	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-131.3	135.2	-166.7	-61.6	0	0	0	0	110.9	L260 R272	L260-T262 PolarHBondContact O-N 3.08Å; L260-T262 PolarHBondContact O-OG1 2.93Å; T262-R272 WeakPolarHBondContact CA-O 3.31Å
263	C	98.1	Very high	93	Very high	1 Å²	1	70.8 Å²	70.8	1%	0.007	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	130.2	175.8	-62.5	0	0	0	0	111	C244 L269 S270 G271 R272 I277	C244-C263 HydrophobicContact CB-CB 3.8Å; C244-C263 WeakPolarHBondContact CB-SG 3.26Å; C244-C263 WeakPolarHBondContact SG-CB 3.15Å; C244-C263 CovalentContact SG-SG 2.02Å; C244-C263 PolarHBondContact SG-SG 3.45Å; C263-L269 HydrophobicContact CB-CB 4.14Å; C263-L269 WeakPolarHBondContact CB-O 3.48Å; C263-S270 CarbonylContact O-C 3.58Å; C263-S270 WeakPolarHBondContact O-CA 3.42Å; C263-G271 PolarHBondContact O-N 3.09Å; C263-R272 PolarHBondContact N-O 2.66Å; C263-I277 HydrophobicContact CB-CD1 4.26Å; C263-I277 WeakPolarHBondContact SG-CD1 3.42Å
264	A	98	Very high	93.2	Very high	44 Å²	44	63.8 Å²	63.8	36%	0.364	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-34.6	172.2	0	0	0	0	0	112	P241 L242 S270	P241-A264 HydrophobicContact CB-CB 3.89Å; L242-A264 PolarHBondContact O-N 3.4Å; A264-S270 WeakPolarHBondContact O-CB 3.38Å; A264-S270 PolarHBondContact O-OG 2.99Å
265	S	97	Very high	93.5	Very high	33 Å²	33	64.4 Å²	64.4	23%	0.231	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	164.2	178.9	55.6	0	0	0	0	110.3	L242 H243 C244	L242-S265 PolarHBondContact O-N 3.22Å; H243-S265 CarbonylContact C-O 3.5Å; H243-S265 WeakPolarHBondContact CA-O 3.37Å; H243-S265 WeakPolarHBondContact CA-OG 3.1Å; H243-S265 WeakPolarHBondContact CB-OG 3.43Å; H243-S265 PolarHBondContact ND1-OG 3.2Å; C244-S265 PolarHBondContact N-O 2.52Å
266	P	96.8	Very high	93.9	Very high	19 Å²	19	64 Å²	64	12%	0.123	34%	0.343	C	S	.	.	S	Bend	cis	-62.5	169.4	-10.7	29.1	-37.5	0	0	0	113	H268 L269 S270	P266-H268 WeakPolarHBondContact CG-CE1 3.35Å; P266-H268 PolarHBondContact O-N 3.29Å; P266-L269 HydrophobicContact CG-CD1 4.32Å; P266-L269 HydrophobicContact CG-CG 4.39Å; P266-L269 PolarHBondContact O-N 3.46Å; P266-S270 PolarHBondContact O-N 3.23Å; P266-S270 VanDerWaalsContact O-N 3.14Å
267	Q	95.4	Very high	94.5	Very high	190 Å²	190	61.7 Å²	61.7	89%	0.888	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-29.3	-171.3	-72.1	-174.4	-13.5	0	0	114.6
268	H	95.5	Very high	95.2	Very high	121 Å²	121	56.8 Å²	56.8	56%	0.56	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-15.1	179.6	62.9	-94.8	0	0	0	114.1	P266	P266-H268 WeakPolarHBondContact CG-CE1 3.35Å; P266-H268 PolarHBondContact O-N 3.29Å
269	L	96.9	Very high	95.8	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-6	173.2	-59	-178.4	0	0	0	113	C244 C263 P266 G271 R272 I277 E281	C244-L269 HydrophobicContact CB-CD1 3.79Å; C244-L269 VanDerWaalsContact O-CD1 3.29Å; C244-L269 WeakPolarHBondContact O-CD1 3.42Å; C263-L269 HydrophobicContact CB-CB 4.14Å; C263-L269 WeakPolarHBondContact CB-O 3.48Å; P266-L269 HydrophobicContact CG-CD1 4.32Å; P266-L269 HydrophobicContact CG-CG 4.39Å; P266-L269 PolarHBondContact O-N 3.46Å; L269-G271 PolarHBondContact O-N 3.01Å; L269-R272 WeakPolarHBondContact O-CB 3.4Å; L269-R272 PolarHBondContact O-N 3.13Å; L269-I277 HydrophobicContact CB-CD1 4.25Å; L269-I277 HydrophobicContact CD1-CD1 4.33Å; L269-I277 HydrophobicContact CD1-CG2 4.28Å; L269-I277 HydrophobicContact CD2-CD1 4.19Å; L269-I277 HydrophobicContact CD2-CG1 4.29Å; L269-I277 HydrophobicContact CD2-CG2 3.96Å; L269-I277 HydrophobicContact CG-CD1 4.48Å; L269-E281 HydrophobicContact CD2-CB 4.26Å; L269-E281 WeakPolarHBondContact CD2-OE2 3.32Å
270	S	97.1	Very high	96.3	Very high	71 Å²	71	59.3 Å²	59.3	50%	0.497	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	123.4	-176.3	-159.6	0	0	0	0	111.8	C263 A264 P266	C263-S270 CarbonylContact O-C 3.58Å; C263-S270 WeakPolarHBondContact O-CA 3.42Å; A264-S270 WeakPolarHBondContact O-CB 3.38Å; A264-S270 PolarHBondContact O-OG 2.99Å; P266-S270 PolarHBondContact O-N 3.23Å; P266-S270 VanDerWaalsContact O-N 3.14Å
271	G	95.8	Very high	96.5	Very high	59 Å²	59	57.1 Å²	57.1	61%	0.608	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	1.9	-177.8	0	0	0	0	0	115.7	C263 L269	C263-G271 PolarHBondContact O-N 3.09Å; L269-G271 PolarHBondContact O-N 3.01Å
272	R	96.9	Very high	96.6	Very high	79 Å²	79	57.3 Å²	57.3	30%	0.298	31%	0.31	S	S	.	.			trans	-85.9	145.1	170.7	-70.8	-178.2	66	-178.4	-3.9	111.5	T262 C263 L269 S276 I277 E281	T262-R272 WeakPolarHBondContact CA-O 3.31Å; C263-R272 PolarHBondContact N-O 2.66Å; L269-R272 WeakPolarHBondContact O-CB 3.4Å; L269-R272 PolarHBondContact O-N 3.13Å; R272-S276 PolarHBondContact NH2-O 2.77Å; R272-I277 HydrophobicContact CB-CD1 3.89Å; R272-I277 HydrophobicContact CB-CG1 3.95Å; R272-E281 IonicContact CZ-OE1 3.12Å; R272-E281 IonicContact CZ-OE2 2.69Å; R272-E281 IonicContact NH1-OE1 2.71Å; R272-E281 PolarHBondContact NH1-OE1 2.85Å; R272-E281 IonicContact NH1-OE2 3.47Å; R272-E281 PolarHBondContact NH1-OE2 2.78Å; R272-E281 IonicContact NH2-OE1 3.16Å; R272-E281 PolarHBondContact NH2-OE1 2.89Å; R272-E281 VanDerWaalsContact NH2-OE1 3.16Å
273	Y	96.8	Very high	96.6	Very high	114 Å²	114	60.5 Å²	60.5	45%	0.447	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-68.2	134	171.5	-59.9	-64.1	0	0	0	110.8	L260 E261 W275 S276	L260-Y273 HydrophobicContact CB-CD1 4.27Å; L260-Y273 HydrophobicContact CB-CE1 4.05Å; L260-Y273 HydrophobicContact CD2-CD1 4.34Å; L260-Y273 HydrophobicContact CD2-CE1 4.04Å; E261-Y273 CarbonylContact O-C 3.54Å; E261-Y273 VanDerWaalsContact O-CA 3.3Å; E261-Y273 WeakPolarHBondContact O-CA 3.28Å; Y273-W275 PolarHBondContact O-N 2.94Å; Y273-S276 WeakPolarHBondContact O-CB 3.31Å; Y273-S276 PolarHBondContact O-N 3.21Å; Y273-S276 PolarHBondContact O-OG 3.24Å
274	F	97.1	Very high	96.5	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-54.6	-49.1	-172.2	-178.5	-98.5	0	0	0	112.7	F237 L242 L248 L251 R252 E261 S276 I277 F282	F237-F274 HydrophobicContact CZ-CD1 4.37Å; F237-F274 HydrophobicContact CZ-CE1 4.36Å; L242-F274 HydrophobicContact CD1-CD2 4.02Å; L242-F274 HydrophobicContact CD1-CG 4.45Å; L248-F274 HydrophobicContact CB-CE2 3.95Å; L248-F274 HydrophobicContact CB-CZ 4.24Å; L248-F274 HydrophobicContact CD1-CE2 3.95Å; L251-F274 HydrophobicContact CB-CZ 4.16Å; L251-F274 HydrophobicContact CD2-CE1 4.37Å; L251-F274 HydrophobicContact CD2-CZ 4.01Å; L251-F274 HydrophobicContact CG-CE1 4.04Å; L251-F274 HydrophobicContact CG-CZ 3.91Å; R252-F274 HydrophobicContact CB-CE1 4.11Å; R252-F274 HydrophobicContact CB-CZ 3.94Å; E261-F274 HydrophobicContact CB-CB 4.01Å; E261-F274 WeakPolarHBondContact O-CB 3.24Å; E261-F274 PolarHBondContact O-N 3.41Å; F274-S276 VanDerWaalsContact C-N 3.3Å; F274-S276 PolarHBondContact O-N 2.9Å; F274-I277 PolarHBondContact O-N 3.2Å; F274-F282 HydrophobicContact CD2-CE1 4.01Å; F274-F282 AromaticContact CD2-CZ 3.99Å; F274-F282 HydrophobicContact CD2-CZ 3.99Å; F274-F282 AromaticContact CE2-CE1 3.54Å; F274-F282 HydrophobicContact CE2-CE1 3.54Å; F274-F282 AromaticContact CE2-CZ 3.82Å; F274-F282 HydrophobicContact CE2-CZ 3.82Å; F274-F282 HydrophobicContact CZ-CE1 4.2Å; F274-F282 HydrophobicContact CZ-CZ 4.29Å
275	W	95.3	Very high	96.5	Very high	31 Å²	31	65.6 Å²	65.6	12%	0.117	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-71.8	-21.8	179.8	-54.5	108	0	0	0	113.4	F237 L251 R252 L254 R256 E261 Y273 I277	F237-W275 HydrophobicContact CE1-CZ2 4.16Å; F237-W275 AromaticContact CZ-CZ2 3.83Å; F237-W275 HydrophobicContact CZ-CZ2 3.83Å; L251-W275 WeakPolarHBondContact O-CH2 3.46Å; L251-W275 WeakPolarHBondContact O-CZ3 3.45Å; R252-W275 PolarHBondContact NH2-O 3.39Å; L254-W275 WeakPolarHBondContact O-CZ3 3.41Å; R256-W275 HydrophobicContact CB-CH2 4.05Å; R256-W275 HydrophobicContact CB-CZ2 3.96Å; R256-W275 HydrophobicContact CG-CH2 4.31Å; R256-W275 HydrophobicContact CG-CZ2 4.46Å; E261-W275 PolarHBondContact OE1-NE1 2.86Å; E261-W275 VanDerWaalsContact OE2-CD1 3.27Å; E261-W275 PolarHBondContact OE2-NE1 3.18Å; Y273-W275 PolarHBondContact O-N 2.94Å; W275-I277 VanDerWaalsContact C-N 3.27Å; W275-I277 PolarHBondContact O-N 3.43Å
276	S	94.8	Very high	96.5	Very high	65 Å²	65	67.9 Å²	67.9	46%	0.455	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-76.9	-9.9	176.4	81	0	0	0	0	114.3	R272 Y273 F274	R272-S276 PolarHBondContact NH2-O 2.77Å; Y273-S276 WeakPolarHBondContact O-CB 3.31Å; Y273-S276 PolarHBondContact O-N 3.21Å; Y273-S276 PolarHBondContact O-OG 3.24Å; F274-S276 VanDerWaalsContact C-N 3.3Å; F274-S276 PolarHBondContact O-N 2.9Å
277	I	96.4	Very high	96.5	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.355	C	S	.	.	S	Bend	trans	-89.6	132.2	177.1	-59.6	159.2	0	0	0	107.7	R252 C263 L269 R272 F274 W275 E281 F282	R252-I277 VanDerWaalsContact CZ-O 3.25Å; R252-I277 PolarHBondContact NE-O 3.47Å; R252-I277 PolarHBondContact NH2-O 2.76Å; C263-I277 HydrophobicContact CB-CD1 4.26Å; C263-I277 WeakPolarHBondContact SG-CD1 3.42Å; L269-I277 HydrophobicContact CB-CD1 4.25Å; L269-I277 HydrophobicContact CD1-CD1 4.33Å; L269-I277 HydrophobicContact CD1-CG2 4.28Å; L269-I277 HydrophobicContact CD2-CD1 4.19Å; L269-I277 HydrophobicContact CD2-CG1 4.29Å; L269-I277 HydrophobicContact CD2-CG2 3.96Å; L269-I277 HydrophobicContact CG-CD1 4.48Å; R272-I277 HydrophobicContact CB-CD1 3.89Å; R272-I277 HydrophobicContact CB-CG1 3.95Å; F274-I277 PolarHBondContact O-N 3.2Å; W275-I277 VanDerWaalsContact C-N 3.27Å; W275-I277 PolarHBondContact O-N 3.43Å; I277-E281 HydrophobicContact CG2-CB 3.57Å; I277-E281 HydrophobicContact CG2-CG 4.45Å; I277-F282 HydrophobicContact CB-CE2 3.69Å; I277-F282 HydrophobicContact CB-CZ 4.06Å; I277-F282 HydrophobicContact CD1-CZ 4.42Å; I277-F282 HydrophobicContact CG2-CD2 3.91Å; I277-F282 HydrophobicContact CG2-CE2 3.41Å; I277-F282 VanDerWaalsContact CG2-CE2 3.41Å; I277-F282 HydrophobicContact CG2-CZ 4.04Å
278	P	96.7	Very high	96.6	Very high	50 Å²	50	64.1 Å²	64.1	33%	0.325	34%	0.342	S	S	.	.			trans	-75.1	160.1	175.6	35.6	-36.8	0	0	0	110.8	E280 E281 F282	P278-E280 PolarHBondContact O-N 3.07Å; P278-E281 WeakPolarHBondContact CD-OE1 3.25Å; P278-E281 HydrophobicContact CG-CB 4.29Å; P278-E281 HydrophobicContact CG-CG 3.84Å; P278-E281 WeakPolarHBondContact CG-OE1 3.48Å; P278-E281 PolarHBondContact O-N 3.14Å; P278-F282 WeakPolarHBondContact O-CD2 3.49Å
279	E	96.4	Very high	96.6	Very high	65 Å²	65	59.6 Å²	59.6	30%	0.304	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-59.5	-32.7	-175.7	-76	-171.1	-147.1	0	0	113.3	L249 R252 R253 E281 F282	L249-E279 HydrophobicContact CD1-CB 3.79Å; L249-E279 HydrophobicContact CD1-CG 3.85Å; R252-E279 HydrophobicContact CG-CG 4.32Å; R253-E279 WeakPolarHBondContact CG-OE1 3.48Å; R253-E279 IonicContact CZ-OE2 3.13Å; R253-E279 IonicContact NE-OE1 3.68Å; R253-E279 IonicContact NE-OE2 2.75Å; R253-E279 PolarHBondContact NE-OE2 2.78Å; R253-E279 IonicContact NH2-OE2 2.71Å; R253-E279 PolarHBondContact NH2-OE2 3.02Å; E279-E281 PolarHBondContact O-N 3.31Å; E279-F282 PolarHBondContact O-N 2.9Å
280	E	96	Very high	96.5	Very high	148 Å²	148	62.8 Å²	62.8	69%	0.692	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-71.3	-14.7	-176.6	-59.1	81.4	178.8	0	0	113.8	P278 L283	P278-E280 PolarHBondContact O-N 3.07Å; E280-L283 WeakPolarHBondContact O-CD2 3.18Å
281	E	96.9	Very high	96.4	Very high	60 Å²	60	68.5 Å²	68.5	28%	0.28	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-87.1	-13.5	174.3	-74.6	-169.6	-106.9	0	0	112.9	L269 R272 I277 P278 E279 L283	L269-E281 HydrophobicContact CD2-CB 4.26Å; L269-E281 WeakPolarHBondContact CD2-OE2 3.32Å; R272-E281 IonicContact CZ-OE1 3.12Å; R272-E281 IonicContact CZ-OE2 2.69Å; R272-E281 IonicContact NH1-OE1 2.71Å; R272-E281 PolarHBondContact NH1-OE1 2.85Å; R272-E281 IonicContact NH1-OE2 3.47Å; R272-E281 PolarHBondContact NH1-OE2 2.78Å; R272-E281 IonicContact NH2-OE1 3.16Å; R272-E281 PolarHBondContact NH2-OE1 2.89Å; R272-E281 VanDerWaalsContact NH2-OE1 3.16Å; I277-E281 HydrophobicContact CG2-CB 3.57Å; I277-E281 HydrophobicContact CG2-CG 4.45Å; P278-E281 WeakPolarHBondContact CD-OE1 3.25Å; P278-E281 HydrophobicContact CG-CB 4.29Å; P278-E281 HydrophobicContact CG-CG 3.84Å; P278-E281 WeakPolarHBondContact CG-OE1 3.48Å; P278-E281 PolarHBondContact O-N 3.14Å; E279-E281 PolarHBondContact O-N 3.31Å; E281-L283 VanDerWaalsContact C-N 3.26Å; E281-L283 PolarHBondContact O-N 3.01Å
282	F	97.4	Very high	96.3	Very high	5 Å²	5	68.1 Å²	68.1	2%	0.022	33%	0.334	C	S	.	.			trans	-81	68.7	176.9	-72.6	-95.8	0	0	0	111.5	C244 C246 L248 L249 R252 F274 I277 P278 E279	C244-F282 HydrophobicContact CB-CD1 4.07Å; C244-F282 HydrophobicContact CB-CE1 3.64Å; C244-F282 HydrophobicContact CB-CZ 4.45Å; C246-F282 VanDerWaalsContact CA-O 3.27Å; C246-F282 WeakPolarHBondContact CA-O 3.41Å; C246-F282 WeakPolarHBondContact CB-O 3.37Å; C246-F282 PolarHBondContact N-O 2.85Å; L248-F282 HydrophobicContact CB-CD1 4.41Å; L248-F282 HydrophobicContact CB-CE1 4.39Å; L249-F282 HydrophobicContact CB-CB 4.31Å; L249-F282 HydrophobicContact CD1-CB 4.29Å; R252-F282 HydrophobicContact CB-CD2 4.46Å; R252-F282 HydrophobicContact CB-CE2 4.1Å; R252-F282 HydrophobicContact CB-CZ 4.14Å; R252-F282 HydrophobicContact CG-CD2 4.02Å; R252-F282 HydrophobicContact CG-CE2 3.52Å; R252-F282 HydrophobicContact CG-CZ 3.95Å; F274-F282 HydrophobicContact CD2-CE1 4.01Å; F274-F282 AromaticContact CD2-CZ 3.99Å; F274-F282 HydrophobicContact CD2-CZ 3.99Å; F274-F282 AromaticContact CE2-CE1 3.54Å; F274-F282 HydrophobicContact CE2-CE1 3.54Å; F274-F282 AromaticContact CE2-CZ 3.82Å; F274-F282 HydrophobicContact CE2-CZ 3.82Å; F274-F282 HydrophobicContact CZ-CE1 4.2Å; F274-F282 HydrophobicContact CZ-CZ 4.29Å; I277-F282 HydrophobicContact CB-CE2 3.69Å; I277-F282 HydrophobicContact CB-CZ 4.06Å; I277-F282 HydrophobicContact CD1-CZ 4.42Å; I277-F282 HydrophobicContact CG2-CD2 3.91Å; I277-F282 HydrophobicContact CG2-CE2 3.41Å; I277-F282 VanDerWaalsContact CG2-CE2 3.41Å; I277-F282 HydrophobicContact CG2-CZ 4.04Å; P278-F282 WeakPolarHBondContact O-CD2 3.49Å; E279-F282 PolarHBondContact O-N 2.9Å
283	L	96.6	Very high	96.1	Very high	115 Å²	115	65.1 Å²	65.1	60%	0.602	33%	0.326	S	S	*	.			trans	-87.8	162.9	-177	-59.8	177.9	0	0	0	112.7	N245 C246 E280 E281	N245-L283 CarbonylContact C-O 3.46Å; N245-L283 WeakPolarHBondContact CA-O 3.33Å; N245-L283 WeakPolarHBondContact CB-O 3.44Å; C246-L283 PolarHBondContact N-O 2.83Å; E280-L283 WeakPolarHBondContact O-CD2 3.18Å; E281-L283 VanDerWaalsContact C-N 3.26Å; E281-L283 PolarHBondContact O-N 3.01Å
284	C	97.3	Very high	95.8	Very high	24 Å²	24	66.1 Å²	66.1	16%	0.162	33%	0.334	C	S	.	.			trans	-131	148.4	168.2	-80.9	0	0	0	0	108.7	C246 D313 A363	C246-C284 VanDerWaalsContact CA-SG 3.56Å; C246-C284 HydrophobicContact CB-CB 3.83Å; C246-C284 WeakPolarHBondContact CB-SG 2.95Å; C246-C284 PolarHBondContact N-SG 2.89Å; C246-C284 WeakPolarHBondContact SG-CB 3.2Å; C246-C284 CovalentContact SG-SG 2.03Å; C246-C284 PolarHBondContact SG-SG 2.95Å; C284-D313 CarbonylContact C-O 3.57Å; C284-D313 VanDerWaalsContact CA-O 3.3Å; C284-D313 WeakPolarHBondContact CA-O 3.45Å; C284-D313 WeakPolarHBondContact CB-O 3.28Å; C284-A363 HydrophobicContact CB-CB 3.74Å
285	E	97	Very high	95.6	Very high	129 Å²	129	71.2 Å²	71.2	60%	0.603	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	126	177.3	-62.2	-171.7	166.2	0	0	110.3	D313 N361	E285-D313 HydrophobicContact CB-CB 3.92Å; E285-D313 HydrophobicContact CG-CB 4.07Å; E285-D313 PolarHBondContact N-O 3.01Å; E285-D313 PolarHBondContact O-N 3.04Å; E285-D313 VanDerWaalsContact O-N 3.09Å; E285-N361 PolarHBondContact O-ND2 3.09Å
286	P	97.3	Very high	95.4	Very high	81 Å²	81	72 Å²	72	53%	0.526	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	155.6	-179.5	28.7	-35.6	0	0	0	112	A363	P286-A363 HydrophobicContact CB-CB 4.15Å
287	P	97.7	Very high	95.4	Very high	12 Å²	12	76.6 Å²	76.6	8%	0.078	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	137.3	-174.5	26.1	-34.8	0	0	0	112.7	R311 P316 S359 N361 G364 A366	P287-R311 CarbonylContact C-O 3.5Å; P287-R311 WeakPolarHBondContact CA-O 3.39Å; P287-P316 HydrophobicContact CB-CB 3.84Å; P287-P316 HydrophobicContact CB-CG 3.98Å; P287-S359 VanDerWaalsContact CG-O 3.3Å; P287-S359 WeakPolarHBondContact CG-O 3.32Å; P287-N361 WeakPolarHBondContact CD-OD1 3.41Å; P287-G364 VanDerWaalsContact CD-O 3.27Å; P287-G364 WeakPolarHBondContact CD-O 3.5Å; P287-G364 VanDerWaalsContact CG-O 3.32Å; P287-G364 WeakPolarHBondContact CG-O 3.42Å; P287-A366 HydrophobicContact CB-CB 4.13Å; P287-A366 HydrophobicContact CG-CB 3.91Å; P287-A366 VanDerWaalsContact O-CB 3.23Å; P287-A366 WeakPolarHBondContact O-CB 3.42Å
288	L	96.8	Very high	95.3	Very high	117 Å²	117	77.3 Å²	77.3	61%	0.613	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	114	173.7	179.2	64.2	0	0	0	109.6	T290 A310 R311	L288-T290 HydrophobicContact CG-CG2 4.36Å; L288-T290 WeakPolarHBondContact O-CG2 3.33Å; L288-T290 PolarHBondContact O-N 3.32Å; L288-T290 VanDerWaalsContact O-N 3.14Å; L288-A310 CarbonylContact O-C 3.58Å; L288-A310 WeakPolarHBondContact O-CA 3.4Å; L288-R311 PolarHBondContact N-O 2.9Å; L288-R311 PolarHBondContact O-N 3.11Å
289	I	96.2	Very high	95.1	Very high	27 Å²	27	78.1 Å²	78.1	14%	0.138	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	105.4	176.8	-63.6	172.6	0	0	0	109.1	H292 A310 A366 Q368	I289-H292 HydrophobicContact CG2-CB 4.29Å; I289-A310 HydrophobicContact CG1-CB 4.2Å; I289-A366 HydrophobicContact CD1-CB 4.36Å; I289-A366 HydrophobicContact CG1-CB 4.33Å; I289-Q368 HydrophobicContact CD1-CB 3.64Å; I289-Q368 HydrophobicContact CG2-CB 4.2Å
290	T	94.9	Very high	94.9	Very high	66 Å²	66	78.3 Å²	78.3	41%	0.405	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-23.8	-173.4	63.1	0	0	0	0	114.3	L288 K309 R311	L288-T290 HydrophobicContact CG-CG2 4.36Å; L288-T290 WeakPolarHBondContact O-CG2 3.33Å; L288-T290 PolarHBondContact O-N 3.32Å; L288-T290 VanDerWaalsContact O-N 3.14Å; T290-K309 PolarHBondContact N-O 3.46Å; T290-K309 PolarHBondContact OG1-O 3.28Å; T290-R311 HydrophobicContact CG2-CB 4.28Å; T290-R311 HydrophobicContact CG2-CG 4.05Å
291	R	93.3	Very high	94.6	Very high	191 Å²	191	73.5 Å²	73.5	72%	0.721	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145	138.5	174	-62.6	-173.8	176.3	-168.8	-1.9	110.3	C308 K309	R291-C308 CarbonylContact O-C 3.21Å; R291-C308 WeakPolarHBondContact O-CA 2.99Å; R291-K309 HydrophobicContact CB-CB 4.35Å; R291-K309 PolarHBondContact N-O 2.87Å; R291-K309 VanDerWaalsContact N-O 3.13Å; R291-K309 PolarHBondContact O-N 2.95Å
292	H	93.9	Very high	94.4	Very high	51 Å²	51	75.1 Å²	75.1	24%	0.236	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	151.7	175.1	52.9	-89.2	0	0	0	110.9	I289 H294 R307 Q368	I289-H292 HydrophobicContact CG2-CB 4.29Å; H292-H294 AromaticContact CD2-CE1 3.7Å; H292-H294 AromaticContact CD2-ND1 3.69Å; H292-H294 AromaticContact NE2-CE1 3.43Å; H292-H294 PolarHBondContact NE2-CE1 2.93Å; H292-H294 AromaticContact NE2-ND1 3.87Å; H292-H294 PolarHBondContact O-ND1 2.9Å; H292-R307 CarbonylContact C-O 3.57Å; H292-R307 VanDerWaalsContact CA-O 3.24Å; H292-R307 WeakPolarHBondContact CA-O 3.46Å; H292-Q368 HydrophobicContact CB-CG 4.13Å; H292-Q368 PolarHBondContact CE1-NE2 2.81Å; H292-Q368 PolarHBondContact NE2-NE2 3.09Å
293	S	92.9	Very high	94.3	Very high	16 Å²	16	82.3 Å²	82.3	11%	0.112	40%	0.402	C	S	.	.			trans	-60.2	140.8	164.6	-69.7	0	0	0	0	109.8	R307 V370	S293-R307 PolarHBondContact N-O 2.89Å; S293-R307 PolarHBondContact OG-N 2.6Å; S293-V370 WeakPolarHBondContact O-CG1 3.21Å; S293-V370 VanDerWaalsContact O-CG2 3.29Å; S293-V370 WeakPolarHBondContact O-CG2 3.41Å
294	H	90.3	Very high	94.2	Very high	136 Å²	136	76.9 Å²	76.9	63%	0.63	37%	0.373	S	S	*	.			trans	-93.8	-168.7	171.3	-69	43.4	0	0	0	109.4	H292 M296 V370	H292-H294 AromaticContact CD2-CE1 3.7Å; H292-H294 AromaticContact CD2-ND1 3.69Å; H292-H294 AromaticContact NE2-CE1 3.43Å; H292-H294 PolarHBondContact NE2-CE1 2.93Å; H292-H294 AromaticContact NE2-ND1 3.87Å; H292-H294 PolarHBondContact O-ND1 2.9Å; H294-M296 PolarHBondContact O-N 2.79Å; H294-V370 WeakPolarHBondContact O-CG1 3.28Å
295	E	93	Very high	94.2	Very high	107 Å²	107	77.7 Å²	77.7	50%	0.5	38%	0.378	S	S	.	.	S	Bend	trans	-46.8	127.6	176.5	-163.9	-153	145.2	0	0	111.4	R297 E371	E295-R297 IonicContact OE1-CZ 3.73Å; E295-R297 IonicContact OE1-NE 2.83Å; E295-R297 PolarHBondContact OE1-NE 3.11Å; E295-R297 IonicContact OE1-NH2 2.73Å; E295-R297 PolarHBondContact OE1-NH2 3.06Å; E295-R297 IonicContact OE2-NH2 2.74Å; E295-R297 PolarHBondContact OE2-NH2 3.41Å; E295-E371 WeakPolarHBondContact CA-O 3.11Å; E295-E371 HydrophobicContact CG-CB 4.17Å
296	M	92	Very high	94.1	Very high	46 Å²	46	71.5 Å²	71.5	23%	0.227	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.3	-173.8	-164.2	177.8	-64.8	0	0	111.2	H294 V298 V304 L306 E371 L372 L373	H294-M296 PolarHBondContact O-N 2.79Å; M296-V298 HydrophobicContact CG-CG2 3.8Å; M296-V298 HydrophobicContact SD-CG2 4.08Å; M296-V304 HydrophobicContact SD-CG1 3.74Å; M296-L306 HydrophobicContact CE-CD2 3.93Å; M296-L306 HydrophobicContact SD-CD2 4.01Å; M296-E371 PolarHBondContact N-O 2.96Å; M296-L372 HydrophobicContact CB-CD1 4.08Å; M296-L372 HydrophobicContact CG-CD1 4.35Å; M296-L372 WeakPolarHBondContact O-CA 3.42Å; M296-L373 PolarHBondContact O-N 2.71Å
297	R	94.2	Very high	94	Very high	163 Å²	163	75.4 Å²	75.4	62%	0.615	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.7	178.7	-55.4	-170.7	-179.9	177.8	4.5	109.2	E295 L373 I375	E295-R297 IonicContact OE1-CZ 3.73Å; E295-R297 IonicContact OE1-NE 2.83Å; E295-R297 PolarHBondContact OE1-NE 3.11Å; E295-R297 IonicContact OE1-NH2 2.73Å; E295-R297 PolarHBondContact OE1-NH2 3.06Å; E295-R297 IonicContact OE2-NH2 2.74Å; E295-R297 PolarHBondContact OE2-NH2 3.41Å; R297-L373 WeakPolarHBondContact CA-O 3.42Å; R297-L373 HydrophobicContact CG-CB 4.29Å; R297-L373 HydrophobicContact CG-CD2 4.31Å; R297-I375 HydrophobicContact CB-CD1 4.23Å
298	V	93.6	Very high	93.9	Very high	15 Å²	15	74.8 Å²	74.8	9%	0.091	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	147.1	-171.4	-174.2	0	0	0	0	109.5	M296 Q302 V304 L372 L373 I374 I375	M296-V298 HydrophobicContact CG-CG2 3.8Å; M296-V298 HydrophobicContact SD-CG2 4.08Å; V298-Q302 HydrophobicContact CG1-CB 3.69Å; V298-V304 HydrophobicContact CB-CG2 4.39Å; V298-V304 HydrophobicContact CG1-CG2 4.16Å; V298-V304 HydrophobicContact CG2-CG1 4.46Å; V298-V304 HydrophobicContact CG2-CG2 4.3Å; V298-L372 HydrophobicContact CG2-CD1 4.1Å; V298-L373 PolarHBondContact N-O 2.94Å; V298-I374 HydrophobicContact CB-CD1 4Å; V298-I374 CarbonylContact O-C 3.6Å; V298-I374 WeakPolarHBondContact O-CA 3.37Å; V298-I375 PolarHBondContact O-N 2.79Å
299	L	92.6	Very high	93.9	Very high	66 Å²	66	74.1 Å²	74.1	35%	0.346	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	150.4	176.4	-64.9	163.2	0	0	0	111.2	G301 Q302 S347 I375 L377	L299-G301 PolarHBondContact O-N 3.36Å; L299-Q302 HydrophobicContact CB-CG 4.16Å; L299-Q302 VanDerWaalsContact N-OE1 3.11Å; L299-Q302 WeakPolarHBondContact O-CB 3.07Å; L299-Q302 PolarHBondContact O-N 3Å; L299-S347 PolarHBondContact O-OG 2.8Å; L299-I375 CarbonylContact C-O 3.59Å; L299-I375 WeakPolarHBondContact CA-O 3.35Å; L299-I375 HydrophobicContact CD2-CB 4.03Å; L299-I375 HydrophobicContact CD2-CG2 3.9Å; L299-L377 HydrophobicContact CB-CD1 3.85Å; L299-L377 HydrophobicContact CD1-CD1 4.33Å; L299-L377 HydrophobicContact CD2-CD1 3.9Å; L299-L377 HydrophobicContact CG-CD1 4.24Å
300	E	93.4	Very high	93.9	Very high	70 Å²	70	73.4 Å²	73.4	33%	0.327	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	133.3	174.8	-173.7	157.3	-128.9	0	0	111	S347 V349 I374 I375	E300-S347 WeakPolarHBondContact CA-OG 3.4Å; E300-V349 VanDerWaalsContact CD-CG2 3.48Å; E300-V349 HydrophobicContact CG-CG2 4.43Å; E300-V349 VanDerWaalsContact OE1-CG2 3.24Å; E300-V349 WeakPolarHBondContact OE1-CG2 3.08Å; E300-V349 PolarHBondContact OE1-N 3.47Å; E300-I374 HydrophobicContact CB-CG2 3.86Å; E300-I374 HydrophobicContact CG-CG2 4.43Å; E300-I375 PolarHBondContact N-O 2.93Å
301	G	89.8	Confident	93.9	Very high	47 Å²	47	78.8 Å²	78.8	49%	0.485	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	-8.9	-175.2	0	0	0	0	0	116.1	L299 S347	L299-G301 PolarHBondContact O-N 3.36Å; G301-S347 PolarHBondContact N-O 3.14Å; G301-S347 PolarHBondContact N-OG 2.73Å
302	Q	92.6	Very high	94.1	Very high	94 Å²	94	70.8 Å²	70.8	44%	0.439	33%	0.329	S	S	.	.	S	Bend	trans	-84.8	163	176.7	-66.2	-177	-33.3	0	0	112.9	V298 L299 S347	V298-Q302 HydrophobicContact CG1-CB 3.69Å; L299-Q302 HydrophobicContact CB-CG 4.16Å; L299-Q302 VanDerWaalsContact N-OE1 3.11Å; L299-Q302 WeakPolarHBondContact O-CB 3.07Å; L299-Q302 PolarHBondContact O-N 3Å; Q302-S347 PolarHBondContact N-OG 2.85Å; Q302-S347 VanDerWaalsContact O-CB 3.28Å; Q302-S347 WeakPolarHBondContact O-CB 3.38Å; Q302-S347 PolarHBondContact O-N 2.71Å; Q302-S347 PolarHBondContact O-OG 3.29Å
303	R	94.8	Very high	94.2	Very high	155 Å²	155	69.5 Å²	69.5	59%	0.585	32%	0.324	S	S	*	.			trans	-79	132.2	173.2	177.7	-179.8	172.2	-155.2	2.8	110.8	V305 D343 I344	R303-V305 HydrophobicContact CG-CG2 4.3Å; R303-D343 IonicContact CZ-OD2 3.83Å; R303-D343 IonicContact NE-OD2 2.75Å; R303-D343 PolarHBondContact NE-OD2 2.99Å; R303-D343 IonicContact NH2-OD2 3.16Å; R303-D343 PolarHBondContact NH2-OD2 3.22Å; R303-I344 CarbonylContact C-O 3.57Å; R303-I344 VanDerWaalsContact CA-O 3.31Å; R303-I344 WeakPolarHBondContact CA-O 3.45Å
304	V	95.7	Very high	94.4	Very high	1 Å²	1	69.4 Å²	69.4	1%	0.006	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	142	173.6	-168.2	0	0	0	0	109.1	M296 V298 L306 D343 I344 L372 I374	M296-V304 HydrophobicContact SD-CG1 3.74Å; V298-V304 HydrophobicContact CB-CG2 4.39Å; V298-V304 HydrophobicContact CG1-CG2 4.16Å; V298-V304 HydrophobicContact CG2-CG1 4.46Å; V298-V304 HydrophobicContact CG2-CG2 4.3Å; V304-L306 HydrophobicContact CG1-CD2 3.76Å; V304-L306 HydrophobicContact CG1-CG 4.06Å; V304-D343 WeakPolarHBondContact O-CA 3.37Å; V304-I344 HydrophobicContact CB-CB 4.01Å; V304-I344 HydrophobicContact CB-CD1 4.37Å; V304-I344 HydrophobicContact CB-CG1 4.31Å; V304-I344 HydrophobicContact CG2-CB 4.27Å; V304-I344 PolarHBondContact N-O 2.95Å; V304-I344 PolarHBondContact O-N 2.83Å; V304-L372 HydrophobicContact CG1-CD1 3.66Å; V304-L372 HydrophobicContact CG1-CD2 3.96Å; V304-L372 HydrophobicContact CG1-CG 4.5Å; V304-L372 HydrophobicContact CG2-CD1 4.35Å; V304-L372 HydrophobicContact CG2-CD2 4.26Å; V304-I374 HydrophobicContact CG2-CD1 4.3Å
305	V	95.8	Very high	94.6	Very high	41 Å²	41	71.1 Å²	71.1	25%	0.248	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	93.9	178.6	-178.9	0	0	0	0	109.4	R303 R307 T341	R303-V305 HydrophobicContact CG-CG2 4.3Å; V305-R307 HydrophobicContact CG1-CG 4.28Å; V305-T341 HydrophobicContact CG1-CG2 3.69Å
306	L	96.1	Very high	94.8	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	116.7	177	-55.9	-173.6	0	0	0	109.3	M296 V304 W320 T341 L342 F355 V370	M296-L306 HydrophobicContact CE-CD2 3.93Å; M296-L306 HydrophobicContact SD-CD2 4.01Å; V304-L306 HydrophobicContact CG1-CD2 3.76Å; V304-L306 HydrophobicContact CG1-CG 4.06Å; L306-W320 HydrophobicContact CB-CH2 3.67Å; L306-W320 HydrophobicContact CB-CZ2 4Å; L306-W320 HydrophobicContact CB-CZ3 4.13Å; L306-W320 HydrophobicContact CD1-CZ3 4.24Å; L306-W320 WeakPolarHBondContact O-CZ2 3.31Å; L306-T341 CarbonylContact O-C 3.54Å; L306-T341 WeakPolarHBondContact O-CA 3.15Å; L306-T341 WeakPolarHBondContact O-CG2 3.38Å; L306-L342 HydrophobicContact CB-CB 4.38Å; L306-L342 HydrophobicContact CD1-CD2 4.35Å; L306-L342 PolarHBondContact N-O 2.8Å; L306-L342 PolarHBondContact O-N 2.84Å; L306-F355 HydrophobicContact CD1-CB 3.86Å; L306-F355 HydrophobicContact CD1-CD1 4.08Å; L306-F355 HydrophobicContact CD1-CD2 3.89Å; L306-F355 HydrophobicContact CD1-CE2 4.5Å; L306-F355 HydrophobicContact CD1-CG 3.66Å; L306-V370 HydrophobicContact CD2-CG1 4.16Å
307	R	95.4	Very high	94.9	Very high	162 Å²	162	66.6 Å²	66.6	61%	0.611	32%	0.319	S	S	*	.			trans	-99.1	137.7	-179.7	-67.4	175	176.2	167	-1.2	109.7	H292 S293 V305 T341	H292-R307 CarbonylContact C-O 3.57Å; H292-R307 VanDerWaalsContact CA-O 3.24Å; H292-R307 WeakPolarHBondContact CA-O 3.46Å; S293-R307 PolarHBondContact N-O 2.89Å; S293-R307 PolarHBondContact OG-N 2.6Å; V305-R307 HydrophobicContact CG1-CG 4.28Å; R307-T341 HydrophobicContact CG-CG2 4.09Å
308	C	95.6	Very high	95	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	136.8	165.4	-170.6	0	0	0	0	108.2	R291 I318 W320 G340 C357	R291-C308 CarbonylContact O-C 3.21Å; R291-C308 WeakPolarHBondContact O-CA 2.99Å; C308-I318 HydrophobicContact CB-CG2 4.3Å; C308-W320 HydrophobicContact CB-CH2 3.98Å; C308-W320 HydrophobicContact CB-CZ2 3.45Å; C308-W320 VanDerWaalsContact CB-CZ2 3.45Å; C308-G340 PolarHBondContact N-O 3.37Å; C308-G340 CarbonylContact O-C 3.58Å; C308-G340 WeakPolarHBondContact O-CA 3.21Å; C308-C357 HydrophobicContact CB-CB 3.68Å; C308-C357 WeakPolarHBondContact CB-SG 3.11Å; C308-C357 WeakPolarHBondContact SG-CB 3.25Å; C308-C357 CovalentContact SG-SG 2.03Å; C308-C357 PolarHBondContact SG-SG 3.1Å
309	K	95.7	Very high	95	Very high	103 Å²	103	63.7 Å²	63.7	45%	0.448	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	123.4	174.1	-66.9	-161.7	171.6	-158	0	110.3	T290 R291	T290-K309 PolarHBondContact N-O 3.46Å; T290-K309 PolarHBondContact OG1-O 3.28Å; R291-K309 HydrophobicContact CB-CB 4.35Å; R291-K309 PolarHBondContact N-O 2.87Å; R291-K309 VanDerWaalsContact N-O 3.13Å; R291-K309 PolarHBondContact O-N 2.95Å
310	A	95.9	Very high	95.2	Very high	11 Å²	11	60.5 Å²	60.5	9%	0.091	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	174.6	174.7	0	0	0	0	0	111.9	L288 I289 P316 I318 S359	L288-A310 CarbonylContact O-C 3.58Å; L288-A310 WeakPolarHBondContact O-CA 3.4Å; I289-A310 HydrophobicContact CG1-CB 4.2Å; A310-P316 HydrophobicContact CB-CG 3.67Å; A310-I318 HydrophobicContact CB-CD1 4.46Å; A310-S359 WeakPolarHBondContact CB-OG 3.1Å
311	R	95.9	Very high	95.4	Very high	180 Å²	180	59.4 Å²	59.4	68%	0.679	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	155.7	166.7	-70.8	-176.6	173.9	-96.2	-0.3	108.2	P287 L288 T290	P287-R311 CarbonylContact C-O 3.5Å; P287-R311 WeakPolarHBondContact CA-O 3.39Å; L288-R311 PolarHBondContact N-O 2.9Å; L288-R311 PolarHBondContact O-N 3.11Å; T290-R311 HydrophobicContact CG2-CB 4.28Å; T290-R311 HydrophobicContact CG2-CG 4.05Å
312	G	96	Very high	95.6	Very high	22 Å²	22	57.9 Å²	57.9	23%	0.227	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.7	176.2	177.5	0	0	0	0	0	109	P314 E315	G312-P314 CarbonylContact C-O 3.17Å; G312-P314 CarbonylContact O-C 3.59Å; G312-E315 PolarHBondContact O-N 2.81Å
313	D	97	Very high	95.7	Very high	25 Å²	25	55.6 Å²	55.6	13%	0.134	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	110.7	173.7	-173.6	-24	0	0	0	107.7	H243 N245 C284 E285 N361	H243-D313 IonicContact CE1-OD1 2.94Å; H243-D313 PolarHBondContact CE1-OD1 2.61Å; H243-D313 IonicContact CE1-OD2 3.26Å; H243-D313 PolarHBondContact CE1-OD2 3.06Å; H243-D313 VanDerWaalsContact CE1-OD2 3.31Å; H243-D313 IonicContact NE2-OD1 2.68Å; H243-D313 PolarHBondContact NE2-OD1 3.28Å; N245-D313 WeakPolarHBondContact CB-OD1 3.41Å; N245-D313 PolarHBondContact ND2-OD1 3.04Å; C284-D313 CarbonylContact C-O 3.57Å; C284-D313 VanDerWaalsContact CA-O 3.3Å; C284-D313 WeakPolarHBondContact CA-O 3.45Å; C284-D313 WeakPolarHBondContact CB-O 3.28Å; E285-D313 HydrophobicContact CB-CB 3.92Å; E285-D313 HydrophobicContact CG-CB 4.07Å; E285-D313 PolarHBondContact N-O 3.01Å; E285-D313 PolarHBondContact O-N 3.04Å; E285-D313 VanDerWaalsContact O-N 3.09Å; D313-N361 PolarHBondContact O-ND2 3.45Å
314	P	96.6	Very high	95.5	Very high	14 Å²	14	53.8 Å²	53.8	9%	0.091	26%	0.264	C	S	.	.	S	Bend	cis	-68.7	168.6	-4.6	32.9	-39.8	0	0	0	112.9	E247 G312 N361 P362	E247-P314 HydrophobicContact CG-CG 4.19Å; E247-P314 VanDerWaalsContact OE2-CB 3.32Å; E247-P314 WeakPolarHBondContact OE2-CB 3.33Å; E247-P314 WeakPolarHBondContact OE2-CG 2.9Å; G312-P314 CarbonylContact C-O 3.17Å; G312-P314 CarbonylContact O-C 3.59Å; P314-N361 HydrophobicContact CG-CB 4.19Å; P314-N361 PolarHBondContact O-ND2 3.1Å; P314-P362 HydrophobicContact CG-CG 4.23Å
315	E	94.9	Very high	95.3	Very high	171 Å²	171	56.5 Å²	56.5	80%	0.799	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-57.4	121.1	176.7	-173.7	167.6	-156.7	0	0	110.4	G312	G312-E315 PolarHBondContact O-N 2.81Å
316	P	96.4	Very high	95.1	Very high	11 Å²	11	61.1 Å²	61.1	7%	0.071	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-80.2	143.9	-165	32	-38.4	0	0	0	112.9	P287 A310 S359 S360 N361	P287-P316 HydrophobicContact CB-CB 3.84Å; P287-P316 HydrophobicContact CB-CG 3.98Å; A310-P316 HydrophobicContact CB-CG 3.67Å; P316-S359 WeakPolarHBondContact CB-OG 3.36Å; P316-S359 VanDerWaalsContact CG-OG 3.3Å; P316-S359 WeakPolarHBondContact CG-OG 3.33Å; P316-S360 CarbonylContact C-O 3.56Å; P316-S360 VanDerWaalsContact CA-O 3.31Å; P316-S360 WeakPolarHBondContact CA-O 3.32Å; P316-S360 WeakPolarHBondContact CB-O 3.11Å; P316-N361 HydrophobicContact CB-CB 3.98Å
317	A	95	Very high	95.1	Very high	48 Å²	48	66.8 Å²	66.8	40%	0.397	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	151.8	169.8	0	0	0	0	0	110.2	S359 S360	A317-S359 CarbonylContact O-C 3.46Å; A317-S359 WeakPolarHBondContact O-CA 3.08Å; A317-S359 PolarHBondContact O-OG 2.95Å; A317-S359 VanDerWaalsContact O-OG 3.09Å; A317-S360 PolarHBondContact N-O 3.3Å; A317-S360 PolarHBondContact O-N 2.94Å
318	I	95.4	Very high	95	Very high	30 Å²	30	60.2 Å²	60.2	15%	0.154	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126.9	177.4	-64.1	175.1	0	0	0	109.7	C308 A310 I358	C308-I318 HydrophobicContact CB-CG2 4.3Å; A310-I318 HydrophobicContact CB-CD1 4.46Å; I318-I358 WeakPolarHBondContact CA-O 3.31Å
319	H	95.3	Very high	94.8	Very high	86 Å²	86	63.2 Å²	63.2	40%	0.398	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	154.8	-179.3	-62.3	-52.4	0	0	0	110.1	L327 I358	H319-L327 HydrophobicContact CB-CD1 3.92Å; H319-I358 PolarHBondContact N-O 2.78Å; H319-I358 PolarHBondContact O-N 3.06Å
320	W	96.6	Very high	94.7	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.8	-179.8	-75.1	92.3	0	0	0	110.5	L306 C308 V328 G340 L342 F355 T356 C357 V370	L306-W320 HydrophobicContact CB-CH2 3.67Å; L306-W320 HydrophobicContact CB-CZ2 4Å; L306-W320 HydrophobicContact CB-CZ3 4.13Å; L306-W320 HydrophobicContact CD1-CZ3 4.24Å; L306-W320 WeakPolarHBondContact O-CZ2 3.31Å; C308-W320 HydrophobicContact CB-CH2 3.98Å; C308-W320 HydrophobicContact CB-CZ2 3.45Å; C308-W320 VanDerWaalsContact CB-CZ2 3.45Å; W320-V328 HydrophobicContact CB-CB 4.1Å; W320-V328 HydrophobicContact CB-CG2 4.25Å; W320-V328 PolarHBondContact O-N 2.77Å; W320-G340 PolarHBondContact NE1-O 3.33Å; W320-L342 HydrophobicContact CB-CD2 3.84Å; W320-L342 HydrophobicContact CD2-CB 3.92Å; W320-L342 HydrophobicContact CD2-CD2 3.94Å; W320-L342 HydrophobicContact CE3-CD2 4.23Å; W320-L342 HydrophobicContact CG-CB 3.84Å; W320-L342 HydrophobicContact CG-CD2 3.8Å; W320-L342 HydrophobicContact CG-CG 4.45Å; W320-L342 HydrophobicContact CZ2-CB 4.35Å; W320-F355 HydrophobicContact CE3-CB 4.1Å; W320-F355 HydrophobicContact CZ3-CB 4.1Å; W320-T356 WeakPolarHBondContact CA-O 3.31Å; W320-C357 HydrophobicContact CD2-CB 4.37Å; W320-C357 HydrophobicContact CE3-CB 4.11Å; W320-C357 HydrophobicContact CH2-CB 4.02Å; W320-C357 HydrophobicContact CZ2-CB 4.27Å; W320-C357 HydrophobicContact CZ3-CB 3.93Å; W320-V370 HydrophobicContact CH2-CG2 4.16Å; W320-V370 HydrophobicContact CZ3-CG2 4.1Å
321	I	96.6	Very high	94.5	Very high	47 Å²	47	65.7 Å²	65.7	24%	0.241	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.7	171	-65.5	-169.4	0	0	0	109.2	K326 F355 T356 I358	I321-K326 CarbonylContact C-O 3.53Å; I321-K326 VanDerWaalsContact CA-O 3.31Å; I321-K326 WeakPolarHBondContact CA-O 3.4Å; I321-F355 CarbonylContact O-C 3.59Å; I321-F355 WeakPolarHBondContact O-CA 3.24Å; I321-T356 PolarHBondContact N-O 2.9Å; I321-T356 PolarHBondContact O-N 3.16Å; I321-I358 HydrophobicContact CD1-CD1 3.49Å; I321-I358 VanDerWaalsContact CD1-CD1 3.49Å; I321-I358 HydrophobicContact CD1-CG1 4.46Å; I321-I358 HydrophobicContact CG1-CD1 4.04Å
322	S	95	Very high	94.3	Very high	15 Å²	15	63.1 Å²	63.1	11%	0.105	37%	0.372	C	S	.	.			trans	-77.5	165.7	176.8	77	0	0	0	0	112.3	E324 G325 K326	S322-E324 VanDerWaalsContact CB-OE2 3.24Å; S322-E324 WeakPolarHBondContact CB-OE2 3.07Å; S322-E324 PolarHBondContact O-N 2.79Å; S322-E324 PolarHBondContact OG-OE2 3.03Å; S322-G325 PolarHBondContact O-N 3.48Å; S322-K326 PolarHBondContact N-O 2.04Å
323	P	93.4	Very high	94.2	Very high	45 Å²	45	65.6 Å²	65.6	29%	0.292	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-24	177.8	-27.2	36.3	0	0	0	114.7	G325 F355	P323-G325 VanDerWaalsContact C-N 3.27Å; P323-G325 PolarHBondContact O-N 2.84Å; P323-F355 HydrophobicContact CG-CD2 4.08Å; P323-F355 HydrophobicContact CG-CE2 3.86Å; P323-F355 HydrophobicContact CG-CZ 4.34Å
324	E	91	Very high	94	Very high	117 Å²	117	65.2 Å²	65.2	55%	0.547	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	12.9	174.9	-40.8	96.5	135.2	0	0	114.1	S322	S322-E324 VanDerWaalsContact CB-OE2 3.24Å; S322-E324 WeakPolarHBondContact CB-OE2 3.07Å; S322-E324 PolarHBondContact O-N 2.79Å; S322-E324 PolarHBondContact OG-OE2 3.03Å
325	G	91.3	Very high	94	Very high	59 Å²	59	67.1 Å²	67.1	61%	0.608	38%	0.382	S	S	*	.	S	Bend	trans	74.6	22.8	176.6	0	0	0	0	0	114.8	S322 P323	S322-G325 PolarHBondContact O-N 3.48Å; P323-G325 VanDerWaalsContact C-N 3.27Å; P323-G325 PolarHBondContact O-N 2.84Å
326	K	92.9	Very high	94	Very high	138 Å²	138	60.6 Å²	60.6	60%	0.6	35%	0.354	S	S	*	.			trans	-108	140.7	-176.9	-65.2	175.4	-175.7	170.3	0	112.1	I321 S322 V328	I321-K326 CarbonylContact C-O 3.53Å; I321-K326 VanDerWaalsContact CA-O 3.31Å; I321-K326 WeakPolarHBondContact CA-O 3.4Å; S322-K326 PolarHBondContact N-O 2.04Å; K326-V328 PolarHBondContact O-N 3.27Å
327	L	94.2	Very high	93.8	Very high	118 Å²	118	64.6 Å²	64.6	62%	0.618	37%	0.368	S	S	*	.	B	Isolated β-bridge	trans	-60.8	124.4	169.9	-176.3	68.3	0	0	0	110.1	H319	H319-L327 HydrophobicContact CB-CD1 3.92Å
328	V	94.1	Very high	93.5	Very high	24 Å²	24	69.8 Å²	69.8	15%	0.145	40%	0.395	C	S	.	.			trans	-82.3	126.4	175.8	-175.5	0	0	0	0	108.9	W320 K326 T334 V336 L342 F355	W320-V328 HydrophobicContact CB-CB 4.1Å; W320-V328 HydrophobicContact CB-CG2 4.25Å; W320-V328 PolarHBondContact O-N 2.77Å; K326-V328 PolarHBondContact O-N 3.27Å; V328-T334 HydrophobicContact CG1-CG2 4.17Å; V328-V336 HydrophobicContact CG1-CG2 4.21Å; V328-L342 HydrophobicContact CB-CD2 4.47Å; V328-L342 HydrophobicContact CG1-CD1 3.72Å; V328-L342 HydrophobicContact CG1-CD2 4.16Å; V328-L342 HydrophobicContact CG2-CD2 4.36Å; V328-F355 HydrophobicContact CG2-CE1 4.35Å
329	A	91.9	Very high	93.2	Very high	63 Å²	63	72.1 Å²	72.1	52%	0.521	41%	0.408	S	S	.	.			trans	-120.7	172.4	177.5	0	0	0	0	0	111	S331 T334	A329-S331 PolarHBondContact O-N 3.19Å; A329-T334 PolarHBondContact O-OG1 3.34Å
330	N	93.3	Very high	93.1	Very high	110 Å²	110	68 Å²	68	59%	0.588	39%	0.389	S	S	*	.			trans	-65.8	127.3	174.1	-69.5	-12.9	0	0	0	110.4	T334 V336	N330-T334 CarbonylContact C-O 3.53Å; N330-T334 WeakPolarHBondContact CA-O 3.45Å; N330-V336 PolarHBondContact OD1-N 3.09Å; N330-V336 PolarHBondContact OD1-O 3.42Å
331	S	92.5	Very high	93	Very high	57 Å²	57	68.6 Å²	68.6	40%	0.399	39%	0.393	S	S	.	.			trans	-145.2	-178.4	-178.6	78.5	0	0	0	0	110.6	A329 R333 T334	A329-S331 PolarHBondContact O-N 3.19Å; S331-R333 PolarHBondContact O-N 2.84Å; S331-R333 VanDerWaalsContact O-N 3.14Å; S331-R333 PolarHBondContact OG-N 2.86Å; S331-R333 VanDerWaalsContact OG-N 3.11Å; S331-T334 PolarHBondContact N-O 3.33Å; S331-T334 PolarHBondContact OG-N 2.9Å; S331-T334 PolarHBondContact OG-OG1 3.31Å
332	S	91.4	Very high	93	Very high	125 Å²	125	66.4 Å²	66.4	87%	0.874	38%	0.381	S	S	*	.	S	Bend	trans	-65.2	-8.5	171.7	53.1	0	0	0	0	114.4
333	R	92.7	Very high	93.1	Very high	75 Å²	75	65.8 Å²	65.8	28%	0.283	38%	0.377	S	S	.	.	S	Bend	trans	-126.6	-21	-176.2	-162.2	-179.1	70.9	92.7	-2.5	114	S331 I344 L345 I346 D351	S331-R333 PolarHBondContact O-N 2.84Å; S331-R333 VanDerWaalsContact O-N 3.14Å; S331-R333 PolarHBondContact OG-N 2.86Å; S331-R333 VanDerWaalsContact OG-N 3.11Å; R333-I344 VanDerWaalsContact NH1-CG2 3.32Å; R333-I344 CarbonylContact O-C 3.54Å; R333-L345 PolarHBondContact O-N 2.99Å; R333-I346 PolarHBondContact NH1-O 3.27Å; R333-I346 VanDerWaalsContact NH1-O 3.09Å; R333-D351 IonicContact CZ-OD1 3.63Å; R333-D351 VanDerWaalsContact CZ-OD1 3.26Å; R333-D351 IonicContact CZ-OD2 2.75Å; R333-D351 IonicContact NH1-OD1 2.78Å; R333-D351 PolarHBondContact NH1-OD1 3Å; R333-D351 IonicContact NH1-OD2 3.79Å; R333-D351 PolarHBondContact NH1-OD2 2.88Å; R333-D351 IonicContact NH2-OD1 3.43Å; R333-D351 PolarHBondContact NH2-OD1 3.15Å; R333-D351 IonicContact NH2-OD2 3.63Å
334	T	94.1	Very high	93.2	Very high	16 Å²	16	63.7 Å²	63.7	10%	0.098	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135	-175.3	50.9	0	0	0	0	110.9	V328 A329 N330 S331 D343 I344	V328-T334 HydrophobicContact CG1-CG2 4.17Å; A329-T334 PolarHBondContact O-OG1 3.34Å; N330-T334 CarbonylContact C-O 3.53Å; N330-T334 WeakPolarHBondContact CA-O 3.45Å; S331-T334 PolarHBondContact N-O 3.33Å; S331-T334 PolarHBondContact OG-N 2.9Å; S331-T334 PolarHBondContact OG-OG1 3.31Å; T334-D343 CarbonylContact C-O 3.56Å; T334-D343 VanDerWaalsContact CA-O 3.31Å; T334-D343 WeakPolarHBondContact CA-O 3.49Å; T334-I344 HydrophobicContact CG2-CG1 4.46Å; T334-I344 HydrophobicContact CG2-CG2 4.49Å
335	L	95.5	Very high	93.4	Very high	54 Å²	54	61.4 Å²	61.4	28%	0.283	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	123.3	175.3	-60.9	175.9	0	0	0	109.4	Y337 L342 D343 L345	L335-Y337 HydrophobicContact CB-CE2 4.08Å; L335-L342 WeakPolarHBondContact O-CA 3.42Å; L335-D343 HydrophobicContact CB-CB 4.3Å; L335-D343 PolarHBondContact N-O 2.91Å; L335-D343 PolarHBondContact O-N 2.74Å; L335-L345 HydrophobicContact CD1-CD1 4.29Å; L335-L345 HydrophobicContact CD1-CD2 4.15Å; L335-L345 HydrophobicContact CG-CD1 4.45Å
336	V	94.7	Very high	93.4	Very high	34 Å²	34	63.4 Å²	63.4	21%	0.206	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125	172.7	-177.6	0	0	0	0	108.2	V328 N330 T341 L342	V328-V336 HydrophobicContact CG1-CG2 4.21Å; N330-V336 PolarHBondContact OD1-N 3.09Å; N330-V336 PolarHBondContact OD1-O 3.42Å; V336-T341 WeakPolarHBondContact CA-O 3.43Å; V336-L342 HydrophobicContact CG2-CD1 4.01Å
337	Y	93.6	Very high	93.4	Very high	95 Å²	95	56.9 Å²	56.9	37%	0.373	32%	0.322	S	S	.	.			trans	-100.5	149.9	-178.5	-64.8	-82.9	0	0	0	111.4	L335 N339 G340 T341 D343	L335-Y337 HydrophobicContact CB-CE2 4.08Å; Y337-N339 WeakPolarHBondContact CB-OD1 3.31Å; Y337-N339 PolarHBondContact O-N 3.2Å; Y337-G340 PolarHBondContact O-N 3.08Å; Y337-T341 HydrophobicContact CD2-CG2 4.48Å; Y337-T341 PolarHBondContact N-O 3.04Å; Y337-D343 HydrophobicContact CE2-CB 4.04Å
338	T	88	Confident	93.3	Very high	157 Å²	157	53.3 Å²	53.3	96%	0.963	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-23	175	50.6	0	0	0	0	113.6	G340	T338-G340 PolarHBondContact O-N 2.87Å
339	N	90.1	Very high	93.1	Very high	79 Å²	79	54.6 Å²	54.6	42%	0.422	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	8.4	175.7	72.1	19	0	0	0	114.7	Y337 T341	Y337-N339 WeakPolarHBondContact CB-OD1 3.31Å; Y337-N339 PolarHBondContact O-N 3.2Å; N339-T341 VanDerWaalsContact OD1-CB 3.22Å; N339-T341 WeakPolarHBondContact OD1-CB 3.5Å; N339-T341 PolarHBondContact OD1-N 2.84Å; N339-T341 PolarHBondContact OD1-OG1 3.33Å
340	G	91.8	Very high	93	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.324	C	S	.	.	S	Bend	trans	83.5	2.8	179	0	0	0	0	0	116.1	C308 W320 Y337 T338	C308-G340 PolarHBondContact N-O 3.37Å; C308-G340 CarbonylContact O-C 3.58Å; C308-G340 WeakPolarHBondContact O-CA 3.21Å; W320-G340 PolarHBondContact NE1-O 3.33Å; Y337-G340 PolarHBondContact O-N 3.08Å; T338-G340 PolarHBondContact O-N 2.87Å
341	T	95.3	Very high	92.9	Very high	13 Å²	13	55.2 Å²	55.2	8%	0.08	30%	0.299	C	S	.	.			trans	-81.3	137.2	177.9	-49.1	0	0	0	0	111.4	V305 L306 R307 V336 Y337 N339	V305-T341 HydrophobicContact CG1-CG2 3.69Å; L306-T341 CarbonylContact O-C 3.54Å; L306-T341 WeakPolarHBondContact O-CA 3.15Å; L306-T341 WeakPolarHBondContact O-CG2 3.38Å; R307-T341 HydrophobicContact CG-CG2 4.09Å; V336-T341 WeakPolarHBondContact CA-O 3.43Å; Y337-T341 HydrophobicContact CD2-CG2 4.48Å; Y337-T341 PolarHBondContact N-O 3.04Å; N339-T341 VanDerWaalsContact OD1-CB 3.22Å; N339-T341 WeakPolarHBondContact OD1-CB 3.5Å; N339-T341 PolarHBondContact OD1-N 2.84Å; N339-T341 PolarHBondContact OD1-OG1 3.33Å
342	L	96.5	Very high	93	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	116.6	166.7	163.4	59.5	0	0	0	109.5	L306 W320 V328 L335 V336 F355	L306-L342 HydrophobicContact CB-CB 4.38Å; L306-L342 HydrophobicContact CD1-CD2 4.35Å; L306-L342 PolarHBondContact N-O 2.8Å; L306-L342 PolarHBondContact O-N 2.84Å; W320-L342 HydrophobicContact CB-CD2 3.84Å; W320-L342 HydrophobicContact CD2-CB 3.92Å; W320-L342 HydrophobicContact CD2-CD2 3.94Å; W320-L342 HydrophobicContact CE3-CD2 4.23Å; W320-L342 HydrophobicContact CG-CB 3.84Å; W320-L342 HydrophobicContact CG-CD2 3.8Å; W320-L342 HydrophobicContact CG-CG 4.45Å; W320-L342 HydrophobicContact CZ2-CB 4.35Å; V328-L342 HydrophobicContact CB-CD2 4.47Å; V328-L342 HydrophobicContact CG1-CD1 3.72Å; V328-L342 HydrophobicContact CG1-CD2 4.16Å; V328-L342 HydrophobicContact CG2-CD2 4.36Å; L335-L342 WeakPolarHBondContact O-CA 3.42Å; V336-L342 HydrophobicContact CG2-CD1 4.01Å; L342-F355 HydrophobicContact CD2-CD1 3.88Å; L342-F355 HydrophobicContact CD2-CE1 4.02Å
343	D	96.2	Very high	93.2	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.016	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	132.9	169.2	-89.6	41.9	0	0	0	110.6	R303 V304 T334 L335 Y337	R303-D343 IonicContact CZ-OD2 3.83Å; R303-D343 IonicContact NE-OD2 2.75Å; R303-D343 PolarHBondContact NE-OD2 2.99Å; R303-D343 IonicContact NH2-OD2 3.16Å; R303-D343 PolarHBondContact NH2-OD2 3.22Å; V304-D343 WeakPolarHBondContact O-CA 3.37Å; T334-D343 CarbonylContact C-O 3.56Å; T334-D343 VanDerWaalsContact CA-O 3.31Å; T334-D343 WeakPolarHBondContact CA-O 3.49Å; L335-D343 HydrophobicContact CB-CB 4.3Å; L335-D343 PolarHBondContact N-O 2.91Å; L335-D343 PolarHBondContact O-N 2.74Å; Y337-D343 HydrophobicContact CE2-CB 4.04Å
344	I	96.1	Very high	93.4	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	109.6	165.1	-47.9	177.8	0	0	0	106.4	R303 V304 R333 T334 I346 F355 L372	R303-I344 CarbonylContact C-O 3.57Å; R303-I344 VanDerWaalsContact CA-O 3.31Å; R303-I344 WeakPolarHBondContact CA-O 3.45Å; V304-I344 HydrophobicContact CB-CB 4.01Å; V304-I344 HydrophobicContact CB-CD1 4.37Å; V304-I344 HydrophobicContact CB-CG1 4.31Å; V304-I344 HydrophobicContact CG2-CB 4.27Å; V304-I344 PolarHBondContact N-O 2.95Å; V304-I344 PolarHBondContact O-N 2.83Å; R333-I344 VanDerWaalsContact NH1-CG2 3.32Å; R333-I344 CarbonylContact O-C 3.54Å; T334-I344 HydrophobicContact CG2-CG1 4.46Å; T334-I344 HydrophobicContact CG2-CG2 4.49Å; I344-I346 VanDerWaalsContact C-N 3.33Å; I344-I346 PolarHBondContact O-N 3.18Å; I344-F355 HydrophobicContact CD1-CE1 4.27Å; I344-F355 HydrophobicContact CD1-CE2 4.37Å; I344-F355 HydrophobicContact CD1-CZ 3.77Å; I344-L372 HydrophobicContact CD1-CD2 3.98Å
345	L	94.4	Very high	93.5	Very high	69 Å²	69	49 Å²	49	36%	0.361	27%	0.269	S	S	.	.	S	Bend	trans	-68.1	-34	-171	-61.7	178.4	0	0	0	112.8	R333 L335	R333-L345 PolarHBondContact O-N 2.99Å; L335-L345 HydrophobicContact CD1-CD1 4.29Å; L335-L345 HydrophobicContact CD1-CD2 4.15Å; L335-L345 HydrophobicContact CG-CD1 4.45Å
346	I	92.6	Very high	93.6	Very high	100 Å²	100	48 Å²	48	51%	0.513	27%	0.265	S	S	.	.	S	Bend	trans	-137.2	110.2	177.1	-53.7	178	0	0	0	107.3	R333 I344	R333-I346 PolarHBondContact NH1-O 3.27Å; R333-I346 VanDerWaalsContact NH1-O 3.09Å; I344-I346 VanDerWaalsContact C-N 3.33Å; I344-I346 PolarHBondContact O-N 3.18Å
347	S	92.9	Very high	93.6	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.007	26%	0.255	C	S	.	.			trans	-68.2	144.4	173.1	67.5	0	0	0	0	111.4	L299 E300 G301 Q302	L299-S347 PolarHBondContact O-OG 2.8Å; E300-S347 WeakPolarHBondContact CA-OG 3.4Å; G301-S347 PolarHBondContact N-O 3.14Å; G301-S347 PolarHBondContact N-OG 2.73Å; Q302-S347 PolarHBondContact N-OG 2.85Å; Q302-S347 VanDerWaalsContact O-CB 3.28Å; Q302-S347 WeakPolarHBondContact O-CB 3.38Å; Q302-S347 PolarHBondContact O-N 2.71Å; Q302-S347 PolarHBondContact O-OG 3.29Å
348	T	91.9	Very high	93.8	Very high	43 Å²	43	43 Å²	43	26%	0.264	24%	0.243	S	C	.	.			trans	-134.3	155.4	172.1	70	0	0	0	0	108.5	K350 D351	T348-K350 PolarHBondContact O-N 2.78Å; T348-D351 WeakPolarHBondContact CA-OD2 3.42Å; T348-D351 WeakPolarHBondContact CB-OD2 3.19Å; T348-D351 PolarHBondContact N-OD2 2.99Å; T348-D351 WeakPolarHBondContact O-CB 3.34Å; T348-D351 PolarHBondContact O-N 3.25Å; T348-D351 PolarHBondContact OG1-OD2 2.81Å
349	V	90.4	Very high	94.2	Very high	52 Å²	52	35.5 Å²	35.5	32%	0.315	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-61.8	-18.6	-179.5	169.7	0	0	0	0	113.6	E300 D351 T352 I374 K376	E300-V349 VanDerWaalsContact CD-CG2 3.48Å; E300-V349 HydrophobicContact CG-CG2 4.43Å; E300-V349 VanDerWaalsContact OE1-CG2 3.24Å; E300-V349 WeakPolarHBondContact OE1-CG2 3.08Å; E300-V349 PolarHBondContact OE1-N 3.47Å; V349-D351 PolarHBondContact O-N 3.38Å; V349-T352 VanDerWaalsContact O-CB 3.28Å; V349-T352 WeakPolarHBondContact O-CB 3.15Å; V349-T352 PolarHBondContact O-N 2.68Å; V349-T352 PolarHBondContact O-OG1 2.85Å; V349-I374 HydrophobicContact CG2-CB 4.46Å; V349-I374 HydrophobicContact CG2-CG2 4.06Å; V349-K376 HydrophobicContact CG2-CD 4.07Å; V349-K376 HydrophobicContact CG2-CG 3.44Å; V349-K376 VanDerWaalsContact CG2-CG 3.44Å
350	K	89.9	Confident	94.5	Very high	175 Å²	175	32.8 Å²	32.8	76%	0.761	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-66	-22.8	171.1	-66	-176.2	178.2	-179.8	0	113.9	T348 T352	T348-K350 PolarHBondContact O-N 2.78Å; K350-T352 PolarHBondContact O-N 2.85Å
351	D	91.2	Very high	94.7	Very high	10 Å²	10	33.8 Å²	33.8	5%	0.053	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-77.9	1.6	175.5	-54.2	-73.5	0	0	0	112.7	R333 T348 V349 G353 F355 L372 I374	R333-D351 IonicContact CZ-OD1 3.63Å; R333-D351 VanDerWaalsContact CZ-OD1 3.26Å; R333-D351 IonicContact CZ-OD2 2.75Å; R333-D351 IonicContact NH1-OD1 2.78Å; R333-D351 PolarHBondContact NH1-OD1 3Å; R333-D351 IonicContact NH1-OD2 3.79Å; R333-D351 PolarHBondContact NH1-OD2 2.88Å; R333-D351 IonicContact NH2-OD1 3.43Å; R333-D351 PolarHBondContact NH2-OD1 3.15Å; R333-D351 IonicContact NH2-OD2 3.63Å; T348-D351 WeakPolarHBondContact CA-OD2 3.42Å; T348-D351 WeakPolarHBondContact CB-OD2 3.19Å; T348-D351 PolarHBondContact N-OD2 2.99Å; T348-D351 WeakPolarHBondContact O-CB 3.34Å; T348-D351 PolarHBondContact O-N 3.25Å; T348-D351 PolarHBondContact OG1-OD2 2.81Å; V349-D351 PolarHBondContact O-N 3.38Å; D351-G353 PolarHBondContact O-N 3.2Å; D351-F355 WeakPolarHBondContact O-CE2 3.05Å; D351-L372 HydrophobicContact CB-CD2 4.26Å; D351-I374 HydrophobicContact CB-CG1 4.23Å
352	T	94.6	Very high	94.8	Very high	55 Å²	55	37.2 Å²	37.2	34%	0.337	21%	0.212	S	C	.	.			trans	-72	120.3	176.8	-58.2	0	0	0	0	110.5	V349 K350 L372 L373 I374	V349-T352 VanDerWaalsContact O-CB 3.28Å; V349-T352 WeakPolarHBondContact O-CB 3.15Å; V349-T352 PolarHBondContact O-N 2.68Å; V349-T352 PolarHBondContact O-OG1 2.85Å; K350-T352 PolarHBondContact O-N 2.85Å; T352-L372 CarbonylContact C-O 3.48Å; T352-L372 WeakPolarHBondContact CA-O 3.21Å; T352-L373 HydrophobicContact CG2-CD1 3.78Å; T352-I374 PolarHBondContact OG1-N 3.12Å
353	G	94.9	Very high	94.8	Very high	25 Å²	25	39.3 Å²	39.3	26%	0.258	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	151.5	-166.7	176.6	0	0	0	0	0	113.5	D351 L372	D351-G353 PolarHBondContact O-N 3.2Å; G353-L372 PolarHBondContact N-O 3.27Å; G353-L372 PolarHBondContact O-N 3.01Å
354	S	95.9	Very high	94.8	Very high	57 Å²	57	40.4 Å²	40.4	40%	0.399	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	111.8	179.6	43.4	0	0	0	0	112
355	F	96.8	Very high	94.8	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	136.6	164.7	-77.2	-99	0	0	0	109.3	L306 W320 I321 P323 V328 L342 I344 D351 T369 V370 L372	L306-F355 HydrophobicContact CD1-CB 3.86Å; L306-F355 HydrophobicContact CD1-CD1 4.08Å; L306-F355 HydrophobicContact CD1-CD2 3.89Å; L306-F355 HydrophobicContact CD1-CE2 4.5Å; L306-F355 HydrophobicContact CD1-CG 3.66Å; W320-F355 HydrophobicContact CE3-CB 4.1Å; W320-F355 HydrophobicContact CZ3-CB 4.1Å; I321-F355 CarbonylContact O-C 3.59Å; I321-F355 WeakPolarHBondContact O-CA 3.24Å; P323-F355 HydrophobicContact CG-CD2 4.08Å; P323-F355 HydrophobicContact CG-CE2 3.86Å; P323-F355 HydrophobicContact CG-CZ 4.34Å; V328-F355 HydrophobicContact CG2-CE1 4.35Å; L342-F355 HydrophobicContact CD2-CD1 3.88Å; L342-F355 HydrophobicContact CD2-CE1 4.02Å; I344-F355 HydrophobicContact CD1-CE1 4.27Å; I344-F355 HydrophobicContact CD1-CE2 4.37Å; I344-F355 HydrophobicContact CD1-CZ 3.77Å; D351-F355 WeakPolarHBondContact O-CE2 3.05Å; F355-T369 CarbonylContact O-C 3.6Å; F355-T369 WeakPolarHBondContact O-CA 3.45Å; F355-V370 PolarHBondContact N-O 3.21Å; F355-V370 PolarHBondContact O-N 2.93Å; F355-L372 HydrophobicContact CD2-CB 4.11Å; F355-L372 HydrophobicContact CD2-CD2 4.28Å; F355-L372 HydrophobicContact CE2-CB 4.21Å; F355-L372 HydrophobicContact CE2-CD2 3.72Å; F355-L372 HydrophobicContact CZ-CD2 4.46Å
356	T	96.8	Very high	94.9	Very high	32 Å²	32	44 Å²	44	20%	0.196	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	116.8	175.3	-52.1	0	0	0	0	109.6	W320 I321 I358 H367 T369	W320-T356 WeakPolarHBondContact CA-O 3.31Å; I321-T356 PolarHBondContact N-O 2.9Å; I321-T356 PolarHBondContact O-N 3.16Å; T356-I358 HydrophobicContact CG2-CG1 4.19Å; T356-H367 HydrophobicContact CG2-CB 4.26Å; T356-T369 HydrophobicContact CG2-CG2 4.36Å
357	C	96.7	Very high	95.1	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	128.5	161.2	176.1	0	0	0	0	108.3	C308 W320 H367 Q368	C308-C357 HydrophobicContact CB-CB 3.68Å; C308-C357 WeakPolarHBondContact CB-SG 3.11Å; C308-C357 WeakPolarHBondContact SG-CB 3.25Å; C308-C357 CovalentContact SG-SG 2.03Å; C308-C357 PolarHBondContact SG-SG 3.1Å; W320-C357 HydrophobicContact CD2-CB 4.37Å; W320-C357 HydrophobicContact CE3-CB 4.11Å; W320-C357 HydrophobicContact CH2-CB 4.02Å; W320-C357 HydrophobicContact CZ2-CB 4.27Å; W320-C357 HydrophobicContact CZ3-CB 3.93Å; C357-H367 CarbonylContact O-C 3.55Å; C357-H367 WeakPolarHBondContact O-CA 3.41Å; C357-Q368 PolarHBondContact N-O 3.22Å; C357-Q368 PolarHBondContact O-N 2.84Å
358	I	96.6	Very high	95.2	Very high	24 Å²	24	47.1 Å²	47.1	12%	0.123	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132.7	167.3	-54.9	-170.9	0	0	0	107	I318 H319 I321 T356 H367	I318-I358 WeakPolarHBondContact CA-O 3.31Å; H319-I358 PolarHBondContact N-O 2.78Å; H319-I358 PolarHBondContact O-N 3.06Å; I321-I358 HydrophobicContact CD1-CD1 3.49Å; I321-I358 VanDerWaalsContact CD1-CD1 3.49Å; I321-I358 HydrophobicContact CD1-CG1 4.46Å; I321-I358 HydrophobicContact CG1-CD1 4.04Å; T356-I358 HydrophobicContact CG2-CG1 4.19Å; I358-H367 WeakPolarHBondContact CG1-ND1 3.44Å
359	S	96.8	Very high	95.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.5	170.6	-168.6	0	0	0	0	109.8	P287 A310 P316 A317 E365 A366	P287-S359 VanDerWaalsContact CG-O 3.3Å; P287-S359 WeakPolarHBondContact CG-O 3.32Å; A310-S359 WeakPolarHBondContact CB-OG 3.1Å; P316-S359 WeakPolarHBondContact CB-OG 3.36Å; P316-S359 VanDerWaalsContact CG-OG 3.3Å; P316-S359 WeakPolarHBondContact CG-OG 3.33Å; A317-S359 CarbonylContact O-C 3.46Å; A317-S359 WeakPolarHBondContact O-CA 3.08Å; A317-S359 PolarHBondContact O-OG 2.95Å; A317-S359 VanDerWaalsContact O-OG 3.09Å; S359-E365 CarbonylContact O-C 3.44Å; S359-E365 WeakPolarHBondContact O-CA 3.13Å; S359-A366 PolarHBondContact N-O 3.25Å; S359-A366 PolarHBondContact O-N 2.75Å
360	S	96.4	Very high	95.7	Very high	23 Å²	23	46.9 Å²	46.9	16%	0.161	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	143.4	-170.3	54.7	0	0	0	0	112.9	P316 A317 G364 E365	P316-S360 CarbonylContact C-O 3.56Å; P316-S360 VanDerWaalsContact CA-O 3.31Å; P316-S360 WeakPolarHBondContact CA-O 3.32Å; P316-S360 WeakPolarHBondContact CB-O 3.11Å; A317-S360 PolarHBondContact N-O 3.3Å; A317-S360 PolarHBondContact O-N 2.94Å; S360-G364 WeakPolarHBondContact CA-O 3.44Å; S360-E365 WeakPolarHBondContact CB-OE1 3.49Å
361	N	96.7	Very high	96	Very high	21 Å²	21	44.4 Å²	44.4	11%	0.112	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	176.8	169.3	79.2	5.5	0	0	0	110.3	E285 P287 D313 P314 P316 A363 G364	E285-N361 PolarHBondContact O-ND2 3.09Å; P287-N361 WeakPolarHBondContact CD-OD1 3.41Å; D313-N361 PolarHBondContact O-ND2 3.45Å; P314-N361 HydrophobicContact CG-CB 4.19Å; P314-N361 PolarHBondContact O-ND2 3.1Å; P316-N361 HydrophobicContact CB-CB 3.98Å; N361-A363 PolarHBondContact O-N 3.3Å; N361-A363 WeakPolarHBondContact OD1-CA 3.39Å; N361-A363 WeakPolarHBondContact OD1-CB 3.31Å; N361-A363 PolarHBondContact OD1-N 2.79Å; N361-G364 PolarHBondContact N-O 2.78Å; N361-G364 PolarHBondContact O-N 3.43Å; N361-G364 VanDerWaalsContact O-O 3.04Å; N361-G364 PolarHBondContact OD1-N 3.11Å
362	P	95.9	Very high	96.2	Very high	85 Å²	85	44.1 Å²	44.1	55%	0.552	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-16.2	-179.7	-29.4	38	0	0	0	116.7	E247 P314	E247-P362 HydrophobicContact CG-CG 4.17Å; P314-P362 HydrophobicContact CG-CG 4.23Å
363	A	96.1	Very high	96.2	Very high	44 Å²	44	44.7 Å²	44.7	36%	0.364	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-14.1	175.1	0	0	0	0	0	114.1	C284 P286 N361	C284-A363 HydrophobicContact CB-CB 3.74Å; P286-A363 HydrophobicContact CB-CB 4.15Å; N361-A363 PolarHBondContact O-N 3.3Å; N361-A363 WeakPolarHBondContact OD1-CA 3.39Å; N361-A363 WeakPolarHBondContact OD1-CB 3.31Å; N361-A363 PolarHBondContact OD1-N 2.79Å
364	G	96.1	Very high	96.2	Very high	26 Å²	26	43.9 Å²	43.9	27%	0.268	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	156.3	-167.8	174.1	0	0	0	0	0	115.1	P287 S360 N361	P287-G364 VanDerWaalsContact CD-O 3.27Å; P287-G364 WeakPolarHBondContact CD-O 3.5Å; P287-G364 VanDerWaalsContact CG-O 3.32Å; P287-G364 WeakPolarHBondContact CG-O 3.42Å; S360-G364 WeakPolarHBondContact CA-O 3.44Å; N361-G364 PolarHBondContact N-O 2.78Å; N361-G364 PolarHBondContact O-N 3.43Å; N361-G364 VanDerWaalsContact O-O 3.04Å; N361-G364 PolarHBondContact OD1-N 3.11Å
365	E	96.9	Very high	96	Very high	125 Å²	125	44.9 Å²	44.9	58%	0.584	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.8	146.9	178.8	-51.9	-161.3	132.3	0	0	111.3	S359 S360	S359-E365 CarbonylContact O-C 3.44Å; S359-E365 WeakPolarHBondContact O-CA 3.13Å; S360-E365 WeakPolarHBondContact CB-OE1 3.49Å
366	A	96.8	Very high	95.5	Very high	20 Å²	20	50.9 Å²	50.9	17%	0.165	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140.6	174.6	0	0	0	0	0	110	P287 I289 S359	P287-A366 HydrophobicContact CB-CB 4.13Å; P287-A366 HydrophobicContact CG-CB 3.91Å; P287-A366 VanDerWaalsContact O-CB 3.23Å; P287-A366 WeakPolarHBondContact O-CB 3.42Å; I289-A366 HydrophobicContact CD1-CB 4.36Å; I289-A366 HydrophobicContact CG1-CB 4.33Å; S359-A366 PolarHBondContact N-O 3.25Å; S359-A366 PolarHBondContact O-N 2.75Å
367	H	96.3	Very high	94.4	Very high	101 Å²	101	54 Å²	54	47%	0.468	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139.3	-171	-53.3	-108	0	0	0	109.7	T356 C357 I358	T356-H367 HydrophobicContact CG2-CB 4.26Å; C357-H367 CarbonylContact O-C 3.55Å; C357-H367 WeakPolarHBondContact O-CA 3.41Å; I358-H367 WeakPolarHBondContact CG1-ND1 3.44Å
368	Q	96.3	Very high	93.1	Very high	66 Å²	66	59.5 Å²	59.5	31%	0.308	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	128.6	173.2	-173.3	66.2	-0.5	0	0	110.6	I289 H292 C357	I289-Q368 HydrophobicContact CD1-CB 3.64Å; I289-Q368 HydrophobicContact CG2-CB 4.2Å; H292-Q368 HydrophobicContact CB-CG 4.13Å; H292-Q368 PolarHBondContact CE1-NE2 2.81Å; H292-Q368 PolarHBondContact NE2-NE2 3.09Å; C357-Q368 PolarHBondContact N-O 3.22Å; C357-Q368 PolarHBondContact O-N 2.84Å
369	T	95.8	Very high	91	Very high	87 Å²	87	67.1 Å²	67.1	53%	0.534	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	142.2	179.7	48.5	0	0	0	0	112.2	F355 T356	F355-T369 CarbonylContact O-C 3.6Å; F355-T369 WeakPolarHBondContact O-CA 3.45Å; T356-T369 HydrophobicContact CG2-CG2 4.36Å
370	V	95.8	Very high	89.1	Confident	2 Å²	2	74.4 Å²	74.4	1%	0.012	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	120	177.3	-173.8	0	0	0	0	108.1	S293 H294 L306 W320 F355	S293-V370 WeakPolarHBondContact O-CG1 3.21Å; S293-V370 VanDerWaalsContact O-CG2 3.29Å; S293-V370 WeakPolarHBondContact O-CG2 3.41Å; H294-V370 WeakPolarHBondContact O-CG1 3.28Å; L306-V370 HydrophobicContact CD2-CG1 4.16Å; W320-V370 HydrophobicContact CH2-CG2 4.16Å; W320-V370 HydrophobicContact CZ3-CG2 4.1Å; F355-V370 PolarHBondContact N-O 3.21Å; F355-V370 PolarHBondContact O-N 2.93Å
371	E	96.1	Very high	86.6	Confident	124 Å²	124	77.8 Å²	77.8	58%	0.579	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	127.6	177.3	-65.3	-170.4	169.3	0	0	110.9	E295 M296	E295-E371 WeakPolarHBondContact CA-O 3.11Å; E295-E371 HydrophobicContact CG-CB 4.17Å; M296-E371 PolarHBondContact N-O 2.96Å
372	L	96.1	Very high	84.3	Confident	3 Å²	3	84.2 Å²	84.2	2%	0.016	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.7	176	-179.5	62.7	0	0	0	109.6	M296 V298 V304 I344 D351 T352 G353 F355 I374	M296-L372 HydrophobicContact CB-CD1 4.08Å; M296-L372 HydrophobicContact CG-CD1 4.35Å; M296-L372 WeakPolarHBondContact O-CA 3.42Å; V298-L372 HydrophobicContact CG2-CD1 4.1Å; V304-L372 HydrophobicContact CG1-CD1 3.66Å; V304-L372 HydrophobicContact CG1-CD2 3.96Å; V304-L372 HydrophobicContact CG1-CG 4.5Å; V304-L372 HydrophobicContact CG2-CD1 4.35Å; V304-L372 HydrophobicContact CG2-CD2 4.26Å; I344-L372 HydrophobicContact CD1-CD2 3.98Å; D351-L372 HydrophobicContact CB-CD2 4.26Å; T352-L372 CarbonylContact C-O 3.48Å; T352-L372 WeakPolarHBondContact CA-O 3.21Å; G353-L372 PolarHBondContact N-O 3.27Å; G353-L372 PolarHBondContact O-N 3.01Å; F355-L372 HydrophobicContact CD2-CB 4.11Å; F355-L372 HydrophobicContact CD2-CD2 4.28Å; F355-L372 HydrophobicContact CE2-CB 4.21Å; F355-L372 HydrophobicContact CE2-CD2 3.72Å; F355-L372 HydrophobicContact CZ-CD2 4.46Å; L372-I374 HydrophobicContact CD1-CD1 3.85Å; L372-I374 HydrophobicContact CD2-CD1 4.03Å; L372-I374 HydrophobicContact CG-CD1 3.8Å; L372-I374 HydrophobicContact CG-CG1 4.38Å
373	L	95.1	Very high	81.5	Confident	68 Å²	68	85 Å²	85	36%	0.356	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	116	176.2	177.5	61.4	0	0	0	110.3	M296 R297 V298 T352 I375	M296-L373 PolarHBondContact O-N 2.71Å; R297-L373 WeakPolarHBondContact CA-O 3.42Å; R297-L373 HydrophobicContact CG-CB 4.29Å; R297-L373 HydrophobicContact CG-CD2 4.31Å; V298-L373 PolarHBondContact N-O 2.94Å; T352-L373 HydrophobicContact CG2-CD1 3.78Å; L373-I375 HydrophobicContact CG-CG1 4.46Å
374	I	94.6	Very high	79.2	Confident	8 Å²	8	89.2 Å²	89.2	4%	0.041	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	114.8	177.6	-54.6	-51.9	0	0	0	110.4	V298 E300 V304 V349 D351 T352 L372	V298-I374 HydrophobicContact CB-CD1 4Å; V298-I374 CarbonylContact O-C 3.6Å; V298-I374 WeakPolarHBondContact O-CA 3.37Å; E300-I374 HydrophobicContact CB-CG2 3.86Å; E300-I374 HydrophobicContact CG-CG2 4.43Å; V304-I374 HydrophobicContact CG2-CD1 4.3Å; V349-I374 HydrophobicContact CG2-CB 4.46Å; V349-I374 HydrophobicContact CG2-CG2 4.06Å; D351-I374 HydrophobicContact CB-CG1 4.23Å; T352-I374 PolarHBondContact OG1-N 3.12Å; L372-I374 HydrophobicContact CD1-CD1 3.85Å; L372-I374 HydrophobicContact CD2-CD1 4.03Å; L372-I374 HydrophobicContact CG-CD1 3.8Å; L372-I374 HydrophobicContact CG-CG1 4.38Å
375	I	91.6	Very high	76.6	Confident	78 Å²	78	95.5 Å²	95.5	40%	0.4	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.2	-178.1	-59.6	174.5	0	0	0	109.1	R297 V298 L299 E300 L373	R297-I375 HydrophobicContact CB-CD1 4.23Å; V298-I375 PolarHBondContact O-N 2.79Å; L299-I375 CarbonylContact C-O 3.59Å; L299-I375 WeakPolarHBondContact CA-O 3.35Å; L299-I375 HydrophobicContact CD2-CB 4.03Å; L299-I375 HydrophobicContact CD2-CG2 3.9Å; E300-I375 PolarHBondContact N-O 2.93Å; L373-I375 HydrophobicContact CG-CG1 4.46Å
376	K	85.9	Confident	74.1	Confident	131 Å²	131	97.3 Å²	97.3	57%	0.57	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-69.5	139.1	171.7	-68.3	-165.1	166.3	-175.9	0	111.1	V349	V349-K376 HydrophobicContact CG2-CD 4.07Å; V349-K376 HydrophobicContact CG2-CG 3.44Å; V349-K376 VanDerWaalsContact CG2-CG 3.44Å
377	L	73.9	Confident	71.3	Confident	99 Å²	99	104 Å²	104	52%	0.518	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-69.4	138.9	160.3	-81.9	76.4	0	0	0	109.1	L299 H379	L299-L377 HydrophobicContact CB-CD1 3.85Å; L299-L377 HydrophobicContact CD1-CD1 4.33Å; L299-L377 HydrophobicContact CD2-CD1 3.9Å; L299-L377 HydrophobicContact CG-CD1 4.24Å; L377-H379 PolarHBondContact O-N 3.47Å
378	P	68.6	Low	68.8	Low	114 Å²	114	108.2 Å²	108.2	74%	0.74	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-69	120.8	171.6	28.2	-32.7	0	0	0	109.8	I380	P378-I380 PolarHBondContact O-N 3.25Å; P378-I380 VanDerWaalsContact O-N 3.11Å
379	H	54.2	Low	66	Low	184 Å²	184	113.4 Å²	113.4	85%	0.852	60%	0.603	S	S	*	*			trans	-69.9	106.1	169.2	-70.7	-76.7	0	0	0	109.4	L377 S381	L377-H379 PolarHBondContact O-N 3.47Å; H379-S381 VanDerWaalsContact C-N 3.35Å; H379-S381 PolarHBondContact O-N 2.98Å
380	I	54.9	Low	63.3	Low	154 Å²	154	114.8 Å²	114.8	79%	0.79	61%	0.614	S	S	*	*			trans	-69.8	93.7	171.4	-58.2	176.7	0	0	0	108.2	P378 N382	P378-I380 PolarHBondContact O-N 3.25Å; P378-I380 VanDerWaalsContact O-N 3.11Å; I380-N382 PolarHBondContact O-N 3.19Å
381	S	44	Very low	60.5	Low	94 Å²	94	122.5 Å²	122.5	66%	0.657	65%	0.654	S	S	*	*			trans	-71.6	115.8	168.5	54.1	0	0	0	0	109.2	H379 S383	H379-S381 VanDerWaalsContact C-N 3.35Å; H379-S381 PolarHBondContact O-N 2.98Å; S381-S383 PolarHBondContact O-N 2.81Å
382	N	48.5	Very low	57.8	Low	155 Å²	155	122.4 Å²	122.4	83%	0.829	67%	0.665	S	S	*	*			trans	-55.5	112.4	174.8	-91.9	-13.8	0	0	0	110.5	I380	I380-N382 PolarHBondContact O-N 3.19Å
383	S	38.4	Very low	55	Low	102 Å²	102	125.4 Å²	125.4	71%	0.713	70%	0.696	S	S	*	*			trans	-143.7	87.6	173.2	-74.2	0	0	0	0	107.4	S381 N385	S381-S383 PolarHBondContact O-N 2.81Å; S383-N385 PolarHBondContact O-N 2.64Å; S383-N385 VanDerWaalsContact O-N 3.15Å
384	T	47.8	Very low	52.2	Low	132 Å²	132	127.1 Å²	127.1	81%	0.81	71%	0.714	S	S	*	*			trans	-65.3	109.2	-177.8	47.3	0	0	0	0	110.8
385	N	40.2	Very low	49.3	Very low	158 Å²	158	132.5 Å²	132.5	85%	0.845	75%	0.752	S	S	*	*			trans	-144.8	129.4	154.7	-94.3	-41.1	0	0	0	108.4	S383 I387	S383-N385 PolarHBondContact O-N 2.64Å; S383-N385 VanDerWaalsContact O-N 3.15Å; N385-I387 PolarHBondContact O-N 2.85Å
386	N	44.5	Very low	46.6	Very low	163 Å²	163	135.7 Å²	135.7	87%	0.872	77%	0.77	S	S	*	*			trans	-77.1	123.7	-171	-62.1	-47.7	0	0	0	111.2
387	I	39	Very low	44.2	Very low	160 Å²	160	137.4 Å²	137.4	82%	0.821	78%	0.784	S	S	*	*			trans	-123.2	126.7	149.6	-61	-179.9	0	0	0	105.5	N385	N385-I387 PolarHBondContact O-N 2.85Å
388	Q	42.5	Very low	42.5	Very low	191 Å²	191	138 Å²	138	89%	0.893	80%	0.796	S	S	*	*			trans	-103.7	102.1	-173	-174.2	171.1	5.6	0	0	109.7
389	E	37.9	Very low	40.8	Very low	175 Å²	175	139.4 Å²	139.4	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-101.7	151.3	166	-85.5	-170.8	119.6	0	0	110.8
390	P	39.4	Very low	39.8	Very low	116 Å²	116	135.7 Å²	135.7	75%	0.753	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-82.1	146.2	-173.4	33	-35.3	0	0	0	113.1	P392	P390-P392 VanDerWaalsContact O-CD 3.24Å; P390-P392 WeakPolarHBondContact O-CD 3.36Å
391	D	37.2	Very low	38.9	Very low	163 Å²	163	135.4 Å²	135.4	87%	0.872	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-53.9	116.7	-172	-65.2	-71.9	0	0	0	115.6
392	P	39	Very low	38.4	Very low	123 Å²	123	142.8 Å²	142.8	80%	0.799	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-80.6	116.3	149	31.7	-25.2	0	0	0	108.5	P390 S394	P390-P392 VanDerWaalsContact O-CD 3.24Å; P390-P392 WeakPolarHBondContact O-CD 3.36Å; P392-S394 PolarHBondContact O-N 2.97Å
393	G	37.5	Very low	37.6	Very low	65 Å²	65	140.4 Å²	140.4	67%	0.67	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-57.6	130.5	-171.1	0	0	0	0	0	114.6
394	S	36.5	Very low	37.2	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-48.7	139.2	179.4	175.8	0	0	0	0	113.3	P392	P392-S394 PolarHBondContact O-N 2.97Å
395	S	34.3	Very low	36.4	Very low	120 Å²	120	138.1 Å²	138.1	84%	0.839	83%	0.827	S	S	*	*			trans	-129.1	28.7	178	-64.5	0	0	0	0	112.6
396	D	34.7	Very low	36	Very low	145 Å²	145	139 Å²	139	78%	0.775	83%	0.832	S	S	*	*			trans	-90.4	122.8	171.5	-75.1	-40	0	0	0	111.3
397	I	36	Very low	35.3	Very low	168 Å²	168	134.4 Å²	134.4	86%	0.862	82%	0.824	S	S	*	*			trans	-120.5	106	154.9	-66.8	-177.1	0	0	0	107.7
398	S	37.2	Very low	34.8	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	82%	0.819	S	S	*	*			trans	-78.6	142.5	174	46.8	0	0	0	0	111.4	S400	S398-S400 PolarHBondContact O-N 3.46Å
399	T	34.1	Very low	34.1	Very low	143 Å²	143	129 Å²	129	88%	0.877	81%	0.811	S	S	*	*			trans	-73.1	108	174.6	49.4	0	0	0	0	111.3
400	S	32.6	Very low	33.8	Very low	106 Å²	106	128.4 Å²	128.4	74%	0.741	81%	0.808	S	S	*	*			trans	-178.4	118.9	149.5	-177.6	0	0	0	0	113.2	S398	S398-S400 PolarHBondContact O-N 3.46Å
401	T	34.7	Very low	33.3	Very low	148 Å²	148	129.1 Å²	129.1	91%	0.908	81%	0.81	S	S	*	*			trans	-141.6	77.9	155.6	40.4	0	0	0	0	111.1
402	R	35	Very low	32.8	Very low	249 Å²	249	124.6 Å²	124.6	94%	0.94	80%	0.801	S	S	*	*			trans	-107	88.1	167.1	-162.9	179.8	-158	164	8.6	110.4
403	A	31.6	Very low	32.2	Very low	106 Å²	106	126 Å²	126	88%	0.876	80%	0.803	S	S	*	*			trans	-113.4	125.8	176	0	0	0	0	0	110.5
404	G	30.1	Very low	31.8	Very low	83 Å²	83	129.2 Å²	129.2	86%	0.856	81%	0.809	S	S	*	*			trans	-130.7	126.5	172.6	0	0	0	0	0	110.4
405	A	31	Very low	31.8	Very low	103 Å²	103	133.8 Å²	133.8	85%	0.851	82%	0.816	S	S	*	*			trans	-151.9	141.8	172.2	0	0	0	0	0	110
406	N	31	Very low	31.6	Very low	175 Å²	175	134.9 Å²	134.9	94%	0.936	82%	0.818	S	S	*	*			trans	-88.5	155.5	172.2	-64.4	-49.2	0	0	0	110.1
407	G	29.6	Very low	31.6	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	82%	0.818	S	S	*	*			trans	151.3	63.3	158.5	0	0	0	0	0	120.6
408	S	29.5	Very low	31.7	Very low	103 Å²	103	131.2 Å²	131.2	72%	0.72	81%	0.813	S	S	*	*			trans	50.8	121.9	140.7	61.1	0	0	0	0	123.5
409	N	28.5	Very low	32	Very low	134 Å²	134	130.8 Å²	130.8	72%	0.717	80%	0.802	S	S	*	*				88.6	121	127.1	-65.8	0.9	0	0	0	123.4
410	H	30.9	Very low	33.1	Very low	163 Å²	163	131.2 Å²	131.2	76%	0.755	79%	0.792	S	S	*	*			trans	66.8	141.5	148.9	-61.2	-48.5	0	0	0	118.3
411	T	29	Very low	34.8	Very low	130 Å²	130	131.9 Å²	131.9	80%	0.798	78%	0.778	S	S	*	*			cis	-159.5	153	-0.3	2.2	0	0	0	0	110.9
412	G	26.9	Very low	36.9	Very low	68 Å²	68	125 Å²	125	70%	0.701	74%	0.736	S	S	*	*			trans	86.5	111.5	146.4	0	0	0	0	0	119.9
413	D	26.5	Very low	39.3	Very low	154 Å²	154	116.5 Å²	116.5	82%	0.824	71%	0.711	S	S	*	*			trans	28.5	113	133.6	-70.2	-40.3	0	0	0	118.7
414	T	28.8	Very low	41.7	Very low	132 Å²	132	113.1 Å²	113.1	81%	0.81	68%	0.678	S	S	*	*				178.9	162.2	61.8	18.5	0	0	0	0	112.5
415	K	35.6	Very low	44.1	Very low	200 Å²	200	111.2 Å²	111.2	87%	0.87	66%	0.655	S	S	*	*			trans	-5.7	121.8	167.4	-71	177.3	174.4	175.8	0	118.8
416	T	30.1	Very low	46.5	Very low	143 Å²	143	112.4 Å²	112.4	88%	0.877	64%	0.643	S	S	*	*				-153.6	140.9	117.6	3.1	0	0	0	0	109.9
417	S	34.8	Very low	49.1	Very low	112 Å²	112	105.6 Å²	105.6	78%	0.783	61%	0.611	S	S	*	*			trans	-84.2	116.7	178.1	-176.8	0	0	0	0	109.3	D419	S417-D419 PolarHBondContact O-N 2.81Å
418	T	37.9	Very low	51.8	Low	125 Å²	125	104.9 Å²	104.9	77%	0.767	59%	0.593	S	S	*	*			trans	-74.9	115.2	164	41.6	0	0	0	0	108.3	K420	T418-K420 PolarHBondContact O-N 2.98Å
419	D	44.4	Very low	54.4	Low	102 Å²	102	100.8 Å²	100.8	55%	0.545	57%	0.565	S	S	.	*			trans	-71.8	90	-165.6	-168.9	35.2	0	0	0	112.3	S417 R421	S417-D419 PolarHBondContact O-N 2.81Å; D419-R421 PolarHBondContact O-N 3.08Å; D419-R421 VanDerWaalsContact O-N 3.1Å
420	K	57.1	Low	57.1	Low	151 Å²	151	96.9 Å²	96.9	66%	0.657	55%	0.548	S	S	*	.			trans	-66.4	105.3	173.5	-74.4	-170.6	176.3	-173.1	0	109	T418 V422 V423	T418-K420 PolarHBondContact O-N 2.98Å; K420-V422 PolarHBondContact O-N 3.15Å; K420-V422 VanDerWaalsContact O-N 3.16Å; K420-V423 HydrophobicContact CB-CG2 3.95Å; K420-V423 WeakPolarHBondContact O-CG2 3.11Å
421	R	67.5	Low	59.8	Low	121 Å²	121	91 Å²	91	46%	0.457	52%	0.523	S	S	.	.	S	Bend	trans	-63.5	-21	-176.5	-65	-175.8	-178.7	163.8	5.3	115	D419 F436 N437	D419-R421 PolarHBondContact O-N 3.08Å; D419-R421 VanDerWaalsContact O-N 3.1Å; R421-F436 CarbonylContact O-C 3.43Å; R421-F436 WeakPolarHBondContact O-CA 3.37Å; R421-F436 WeakPolarHBondContact O-CB 3.38Å; R421-N437 PolarHBondContact O-N 3.18Å
422	V	79.9	Confident	62.7	Low	4 Å²	4	84.8 Å²	84.8	2%	0.024	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.5	171.2	-177.2	0	0	0	0	107.2	K420 I434 F436 V487 V504 V507	K420-V422 PolarHBondContact O-N 3.15Å; K420-V422 VanDerWaalsContact O-N 3.16Å; V422-I434 HydrophobicContact CG1-CG2 3.73Å; V422-F436 HydrophobicContact CB-CB 4.46Å; V422-F436 HydrophobicContact CG2-CB 3.98Å; V422-V487 HydrophobicContact CG1-CG2 3.91Å; V422-V487 HydrophobicContact CG2-CB 4.11Å; V422-V487 HydrophobicContact CG2-CG2 3.95Å; V422-V504 HydrophobicContact CG2-CG1 4.28Å; V422-V507 HydrophobicContact CG1-CB 4.43Å; V422-V507 HydrophobicContact CG1-CG1 3.84Å
423	V	83.8	Confident	65.6	Low	69 Å²	69	83.1 Å²	83.1	42%	0.418	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.7	-179.2	-166.6	0	0	0	0	108.5	K420 K435	K420-V423 HydrophobicContact CB-CG2 3.95Å; K420-V423 WeakPolarHBondContact O-CG2 3.11Å; V423-K435 PolarHBondContact N-O 3.24Å; V423-K435 PolarHBondContact O-N 3.1Å
424	I	83.9	Confident	68.6	Low	35 Å²	35	75.8 Å²	75.8	18%	0.179	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.1	168.3	-70.8	160.2	0	0	0	107.6	E426 A427 I434 V507 F509	I424-E426 WeakPolarHBondContact CG2-O 3.39Å; I424-A427 HydrophobicContact CG2-CB 4.25Å; I424-I434 HydrophobicContact CG1-CG1 4.31Å; I424-V507 HydrophobicContact CD1-CG1 3.75Å; I424-V507 HydrophobicContact CD1-CG2 4.01Å; I424-V507 HydrophobicContact CG1-CG1 4.09Å; I424-V507 HydrophobicContact CG1-CG2 4.43Å; I424-F509 HydrophobicContact CD1-CB 3.55Å; I424-F509 HydrophobicContact CD1-CD1 3.17Å; I424-F509 HydrophobicContact CD1-CD2 4.06Å; I424-F509 HydrophobicContact CD1-CE1 3.76Å; I424-F509 HydrophobicContact CD1-CG 3.33Å; I424-F509 HydrophobicContact CD1-CZ 4.42Å
425	A	80.1	Confident	71.3	Confident	44 Å²	44	74.3 Å²	74.3	36%	0.364	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-45.9	-178.8	0	0	0	0	0	111.4	L433 K435	A425-L433 HydrophobicContact CB-CD2 4.26Å; A425-L433 HydrophobicContact CB-CG 4.36Å; A425-L433 PolarHBondContact N-O 3.29Å; A425-K435 HydrophobicContact CB-CD 3.7Å; A425-K435 VanDerWaalsContact CB-CE 3.41Å; A425-K435 HydrophobicContact CB-CG 4.06Å
426	E	81.4	Confident	73.6	Confident	127 Å²	127	65 Å²	65	59%	0.593	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.3	142.7	-174.5	-74.8	155.2	-139.9	0	0	107.9	I424 L433	I424-E426 WeakPolarHBondContact CG2-O 3.39Å; E426-L433 HydrophobicContact CB-CB 4.36Å; E426-L433 PolarHBondContact O-N 2.88Å
427	A	84.1	Confident	75.5	Confident	33 Å²	33	62.3 Å²	62.3	27%	0.273	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	145.1	172.1	0	0	0	0	0	108.9	I424 T431 A432 F509	I424-A427 HydrophobicContact CG2-CB 4.25Å; A427-T431 WeakPolarHBondContact CA-O 3.4Å; A427-A432 HydrophobicContact CB-CB 4.27Å; A427-F509 HydrophobicContact CB-CD2 4.46Å
428	T	86.2	Confident	77	Confident	52 Å²	52	59.6 Å²	59.6	32%	0.319	32%	0.317	S	S	.	.			trans	-124.3	-163.5	-179.8	67	0	0	0	0	109.4	S430 T431 T511 E512	T428-S430 VanDerWaalsContact C-N 3.31Å; T428-S430 PolarHBondContact OG1-N 2.89Å; T428-T431 PolarHBondContact N-O 2.97Å; T428-T431 PolarHBondContact OG1-N 2.83Å; T428-T431 PolarHBondContact OG1-O 3.28Å; T428-T431 PolarHBondContact OG1-OG1 3.47Å; T428-T511 WeakPolarHBondContact O-CA 3.43Å; T428-T511 VanDerWaalsContact O-CB 3.32Å; T428-T511 WeakPolarHBondContact O-CB 3.36Å; T428-E512 PolarHBondContact O-N 2.96Å
429	S	84.6	Confident	77.8	Confident	18 Å²	18	60.8 Å²	60.8	13%	0.126	31%	0.314	C	S	.	.	S	Bend	trans	-67.5	-27.6	170.4	59	0	0	0	0	114.2	A478 A479 E512 E514	S429-A478 CarbonylContact O-C 3.55Å; S429-A479 WeakPolarHBondContact O-CA 3.32Å; S429-A479 PolarHBondContact O-N 3.3Å; S429-E512 WeakPolarHBondContact CA-O 3.33Å; S429-E514 WeakPolarHBondContact CB-OE2 3.17Å; S429-E514 PolarHBondContact OG-OE2 2.75Å
430	S	84.6	Confident	78.4	Confident	52 Å²	52	64.4 Å²	64.4	36%	0.364	32%	0.32	S	S	.	.	S	Bend	trans	-136.5	-3.8	-167.8	53.6	0	0	0	0	115.2	T428 N475 N476 L477	T428-S430 VanDerWaalsContact C-N 3.31Å; T428-S430 PolarHBondContact OG1-N 2.89Å; S430-N475 CarbonylContact O-C 3.54Å; S430-N476 PolarHBondContact O-N 3.22Å; S430-N476 VanDerWaalsContact O-N 3.09Å; S430-L477 WeakPolarHBondContact CA-O 3.31Å; S430-L477 PolarHBondContact O-N 3.27Å
431	T	88.6	Confident	78.1	Confident	39 Å²	39	65.1 Å²	65.1	24%	0.239	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	154.1	178.8	68.9	0	0	0	0	112.4	A427 T428 V474 N475	A427-T431 WeakPolarHBondContact CA-O 3.4Å; T428-T431 PolarHBondContact N-O 2.97Å; T428-T431 PolarHBondContact OG1-N 2.83Å; T428-T431 PolarHBondContact OG1-O 3.28Å; T428-T431 PolarHBondContact OG1-OG1 3.47Å; T431-V474 CarbonylContact C-O 3.5Å; T431-V474 WeakPolarHBondContact CA-O 3.1Å; T431-V474 WeakPolarHBondContact CB-O 3.39Å; T431-N475 HydrophobicContact CG2-CB 4.18Å
432	A	89.2	Confident	77.7	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	127.9	173.1	0	0	0	0	0	111.6	A427 V474 L477 F509	A427-A432 HydrophobicContact CB-CB 4.27Å; A432-V474 PolarHBondContact N-O 3.45Å; A432-V474 PolarHBondContact O-N 3.1Å; A432-L477 HydrophobicContact CB-CD1 3.72Å; A432-F509 HydrophobicContact CB-CD2 4.35Å; A432-F509 HydrophobicContact CB-CE2 3.54Å; A432-F509 HydrophobicContact CB-CZ 3.77Å
433	L	88.3	Confident	76.7	Confident	33 Å²	33	66 Å²	66	17%	0.173	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	107.3	-179.7	-179	63.4	0	0	0	110.5	A425 E426 L473	A425-L433 HydrophobicContact CB-CD2 4.26Å; A425-L433 HydrophobicContact CB-CG 4.36Å; A425-L433 PolarHBondContact N-O 3.29Å; E426-L433 HydrophobicContact CB-CB 4.36Å; E426-L433 PolarHBondContact O-N 2.88Å; L433-L473 HydrophobicContact CB-CD1 4.06Å; L433-L473 HydrophobicContact CD1-CB 4.33Å; L433-L473 HydrophobicContact CD1-CD1 4.4Å
434	I	90.6	Very high	75.9	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	139	177.1	-50.4	154.1	0	0	0	108.8	V422 I424 F436 I450 N471 F472 V474 L485	V422-I434 HydrophobicContact CG1-CG2 3.73Å; I424-I434 HydrophobicContact CG1-CG1 4.31Å; I434-F436 HydrophobicContact CG2-CD1 4.25Å; I434-I450 HydrophobicContact CD1-CD1 4.02Å; I434-I450 HydrophobicContact CD1-CG2 4.35Å; I434-N471 CarbonylContact O-C 3.41Å; I434-N471 WeakPolarHBondContact O-CA 3.16Å; I434-N471 VanDerWaalsContact O-CB 3.29Å; I434-N471 WeakPolarHBondContact O-CB 3.43Å; I434-F472 PolarHBondContact N-O 2.76Å; I434-F472 PolarHBondContact O-N 2.95Å; I434-V474 HydrophobicContact CD1-CG2 3.56Å; I434-V474 HydrophobicContact CG1-CG2 4.49Å; I434-L485 HydrophobicContact CD1-CD1 3.5Å; I434-L485 VanDerWaalsContact CD1-CD1 3.5Å; I434-L485 HydrophobicContact CD1-CD2 3.81Å; I434-L485 HydrophobicContact CD1-CG 4.33Å; I434-L485 HydrophobicContact CG1-CD1 4.29Å; I434-L485 HydrophobicContact CG1-CD2 4.38Å
435	K	84.8	Confident	75.4	Confident	100 Å²	100	65.1 Å²	65.1	44%	0.435	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.3	167.1	-63.2	-179.4	-174	161.7	0	108.1	V423 A425 N471	V423-K435 PolarHBondContact N-O 3.24Å; V423-K435 PolarHBondContact O-N 3.1Å; A425-K435 HydrophobicContact CB-CD 3.7Å; A425-K435 VanDerWaalsContact CB-CE 3.41Å; A425-K435 HydrophobicContact CB-CG 4.06Å; K435-N471 HydrophobicContact CG-CB 4.04Å
436	F	84.1	Confident	75.1	Confident	6 Å²	6	67.7 Å²	67.7	3%	0.026	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	131.1	178.9	57.7	-90.1	0	0	0	110.5	R421 V422 I434 F448 I465 S469 K470 V487	R421-F436 CarbonylContact O-C 3.43Å; R421-F436 WeakPolarHBondContact O-CA 3.37Å; R421-F436 WeakPolarHBondContact O-CB 3.38Å; V422-F436 HydrophobicContact CB-CB 4.46Å; V422-F436 HydrophobicContact CG2-CB 3.98Å; I434-F436 HydrophobicContact CG2-CD1 4.25Å; F436-F448 HydrophobicContact CE2-CD1 4.36Å; F436-F448 HydrophobicContact CE2-CD2 4.05Å; F436-F448 HydrophobicContact CE2-CE1 4.32Å; F436-F448 HydrophobicContact CE2-CE2 4Å; F436-F448 HydrophobicContact CE2-CG 4.24Å; F436-F448 HydrophobicContact CE2-CZ 4.15Å; F436-F448 HydrophobicContact CZ-CD2 4.27Å; F436-F448 HydrophobicContact CZ-CG 4.49Å; F436-I465 HydrophobicContact CE1-CD1 3.91Å; F436-I465 HydrophobicContact CZ-CD1 3.67Å; F436-S469 VanDerWaalsContact CE2-O 3.22Å; F436-S469 WeakPolarHBondContact CE2-O 3.16Å; F436-S469 WeakPolarHBondContact CZ-O 3.27Å; F436-K470 PolarHBondContact N-O 2.95Å; F436-K470 VanDerWaalsContact O-O 3.1Å; F436-V487 HydrophobicContact CD1-CG2 4.49Å; F436-V487 HydrophobicContact CD2-CG1 4.47Å; F436-V487 HydrophobicContact CG-CG1 4.47Å
437	N	69.4	Low	75.2	Confident	86 Å²	86	64.6 Å²	64.6	46%	0.46	34%	0.34	S	S	.	.			trans	-113.1	111.8	-173.4	-166.5	13.9	0	0	0	110.7	R421	R421-N437 PolarHBondContact O-N 3.18Å
438	F	65.4	Low	75.3	Confident	54 Å²	54	63.3 Å²	63.3	24%	0.237	33%	0.329	C	S	.	.			trans	-103.6	88.2	-174.2	-159.3	-108.8	0	0	0	111.7	R440 I442 I445 V504	F438-R440 WeakPolarHBondContact CD1-O 3.33Å; F438-R440 WeakPolarHBondContact CE1-O 3.43Å; F438-R440 PolarHBondContact O-N 3.41Å; F438-I442 HydrophobicContact CE1-CB 4.36Å; F438-I442 HydrophobicContact CE1-CD1 4.09Å; F438-I442 HydrophobicContact CE1-CG1 4Å; F438-I442 HydrophobicContact CZ-CD1 3.67Å; F438-I442 HydrophobicContact CZ-CG1 4.01Å; F438-I445 HydrophobicContact CD1-CD1 3.93Å; F438-I445 HydrophobicContact CE1-CD1 3.68Å; F438-V504 HydrophobicContact CD2-CG1 3.82Å; F438-V504 HydrophobicContact CD2-CG2 4.14Å; F438-V504 HydrophobicContact CE2-CG1 4.26Å; F438-V504 HydrophobicContact CE2-CG2 4.02Å
439	Q	54.9	Low	75.4	Confident	151 Å²	151	62.3 Å²	62.3	71%	0.706	32%	0.32	S	S	*	.			trans	-83.4	0.9	-174.2	-74.5	-172.4	-19.2	0	0	115.9
440	R	57.2	Low	75.6	Confident	178 Å²	178	61.4 Å²	61.4	67%	0.672	31%	0.314	S	S	*	.	S	Bend	trans	-108.9	118	176.9	-70.3	-172.2	176.6	-168.9	-2.2	109.7	F438 I442	F438-R440 WeakPolarHBondContact CD1-O 3.33Å; F438-R440 WeakPolarHBondContact CE1-O 3.43Å; F438-R440 PolarHBondContact O-N 3.41Å; R440-I442 PolarHBondContact O-N 3.3Å
441	N	51.3	Low	75.8	Confident	166 Å²	166	61.3 Å²	61.3	89%	0.888	31%	0.308	S	S	*	.			trans	-64.5	97.1	171.4	-78.2	0.5	0	0	0	110
442	I	59.6	Low	75.7	Confident	32 Å²	32	60.2 Å²	60.2	16%	0.164	30%	0.299	C	S	.	.			trans	-82.1	118	156.6	-64.8	-177.3	0	0	0	106	F438 R440 I445 Y491	F438-I442 HydrophobicContact CE1-CB 4.36Å; F438-I442 HydrophobicContact CE1-CD1 4.09Å; F438-I442 HydrophobicContact CE1-CG1 4Å; F438-I442 HydrophobicContact CZ-CD1 3.67Å; F438-I442 HydrophobicContact CZ-CG1 4.01Å; R440-I442 PolarHBondContact O-N 3.3Å; I442-I445 HydrophobicContact CB-CD1 4.17Å; I442-I445 HydrophobicContact CB-CG1 3.97Å; I442-I445 HydrophobicContact CG2-CG1 4.08Å; I442-Y491 HydrophobicContact CD1-CD1 4.45Å; I442-Y491 HydrophobicContact CD1-CE1 4.48Å; I442-Y491 HydrophobicContact CG2-CD1 4.27Å; I442-Y491 HydrophobicContact CG2-CD2 3.81Å; I442-Y491 HydrophobicContact CG2-CE2 4.46Å; I442-Y491 HydrophobicContact CG2-CG 3.71Å
443	P	58.4	Low	75.7	Confident	112 Å²	112	62.6 Å²	62.6	73%	0.727	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	140	170.2	29	-33.3	0	0	0	109.4
444	G	67.4	Low	75.4	Confident	45 Å²	45	61.2 Å²	61.2	46%	0.464	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	25.4	172.9	0	0	0	0	0	116.8	R446 Y491 D492	G444-R446 PolarHBondContact O-N 3.21Å; G444-Y491 CarbonylContact O-C 3.6Å; G444-Y491 WeakPolarHBondContact O-CA 3.28Å; G444-Y491 WeakPolarHBondContact O-CB 3.39Å; G444-D492 PolarHBondContact O-N 3.28Å
445	I	72.8	Confident	74.9	Confident	39 Å²	39	64.8 Å²	64.8	20%	0.2	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	118.5	166.2	-53.9	175.1	0	0	0	108.9	F438 I442 F448 P467	F438-I445 HydrophobicContact CD1-CD1 3.93Å; F438-I445 HydrophobicContact CE1-CD1 3.68Å; I442-I445 HydrophobicContact CB-CD1 4.17Å; I442-I445 HydrophobicContact CB-CG1 3.97Å; I442-I445 HydrophobicContact CG2-CG1 4.08Å; I445-F448 HydrophobicContact CD1-CZ 4.3Å; I445-F448 HydrophobicContact CG2-CE1 4.46Å; I445-F448 HydrophobicContact CG2-CE2 4.48Å; I445-F448 HydrophobicContact CG2-CZ 4.26Å; I445-P467 HydrophobicContact CG2-CB 4.11Å
446	R	73.3	Confident	74.1	Confident	99 Å²	99	69 Å²	69	37%	0.374	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-35.4	175.4	-75.8	-174.3	-67	-121.4	-33.9	113	G444 P467 I490 Y491 D492	G444-R446 PolarHBondContact O-N 3.21Å; R446-P467 WeakPolarHBondContact O-CD 3.43Å; R446-P467 VanDerWaalsContact O-CG 3.27Å; R446-P467 WeakPolarHBondContact O-CG 3.28Å; R446-I490 PolarHBondContact N-O 3.29Å; R446-Y491 PolarHBondContact NH2-O 3.29Å; R446-D492 WeakPolarHBondContact CD-OD2 3.34Å; R446-D492 IonicContact CZ-OD1 3.84Å; R446-D492 IonicContact CZ-OD2 3.65Å; R446-D492 IonicContact NE-OD2 3.12Å; R446-D492 PolarHBondContact NE-OD2 3.29Å; R446-D492 IonicContact NH1-OD1 3.46Å; R446-D492 PolarHBondContact NH1-OD1 3.02Å; R446-D492 IonicContact NH1-OD2 2.72Å; R446-D492 PolarHBondContact NH1-OD2 3.2Å; R446-D492 IonicContact NH2-OD1 2.72Å; R446-D492 PolarHBondContact NH2-OD1 3.07Å; R446-D492 IonicContact NH2-OD2 3.79Å; R446-D492 PolarHBondContact NH2-OD2 2.89Å
447	M	84.1	Confident	73.1	Confident	62 Å²	62	73.2 Å²	73.2	31%	0.305	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	166.4	-173.2	60.5	-154.1	-41.8	0	0	110.8	M464 I465 I490	M447-M464 HydrophobicContact CE-CB 3.91Å; M447-M464 HydrophobicContact CE-CE 3.6Å; M447-M464 HydrophobicContact CE-CG 4.41Å; M447-M464 HydrophobicContact CG-CE 4.19Å; M447-M464 HydrophobicContact SD-CE 3.79Å; M447-I465 WeakPolarHBondContact CB-O 3.46Å; M447-I490 HydrophobicContact CG-CB 3.89Å; M447-I490 HydrophobicContact CG-CD1 4.13Å; M447-I490 HydrophobicContact CG-CG1 4.29Å; M447-I490 HydrophobicContact CG-CG2 4.48Å; M447-I490 PolarHBondContact N-O 2.9Å; M447-I490 PolarHBondContact O-N 3.17Å
448	F	85.9	Confident	72.6	Confident	6 Å²	6	77 Å²	77	3%	0.026	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	153.8	163.6	-56.7	-89.4	0	0	0	110.2	F436 I445 I465 V487 L488 A489 V504	F436-F448 HydrophobicContact CE2-CD1 4.36Å; F436-F448 HydrophobicContact CE2-CD2 4.05Å; F436-F448 HydrophobicContact CE2-CE1 4.32Å; F436-F448 HydrophobicContact CE2-CE2 4Å; F436-F448 HydrophobicContact CE2-CG 4.24Å; F436-F448 HydrophobicContact CE2-CZ 4.15Å; F436-F448 HydrophobicContact CZ-CD2 4.27Å; F436-F448 HydrophobicContact CZ-CG 4.49Å; I445-F448 HydrophobicContact CD1-CZ 4.3Å; I445-F448 HydrophobicContact CG2-CE1 4.46Å; I445-F448 HydrophobicContact CG2-CE2 4.48Å; I445-F448 HydrophobicContact CG2-CZ 4.26Å; F448-I465 HydrophobicContact CB-CD1 4.07Å; F448-I465 HydrophobicContact CB-CG1 3.7Å; F448-I465 PolarHBondContact N-O 3.03Å; F448-I465 PolarHBondContact O-N 3.04Å; F448-V487 HydrophobicContact CB-CG1 4.39Å; F448-V487 HydrophobicContact CD1-CG1 4.44Å; F448-L488 CarbonylContact C-O 3.44Å; F448-L488 WeakPolarHBondContact CA-O 3.45Å; F448-L488 WeakPolarHBondContact CB-O 3.35Å; F448-A489 HydrophobicContact CD1-CB 3.76Å; F448-A489 HydrophobicContact CE1-CB 3.74Å; F448-V504 HydrophobicContact CD1-CG2 4.2Å; F448-V504 HydrophobicContact CE1-CG2 4.15Å
449	Q	88	Confident	72.6	Confident	30 Å²	30	76.9 Å²	76.9	14%	0.14	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.3	170.5	-179.6	179.6	7.8	0	0	108.1	Q451 M464 L488 I490	Q449-Q451 HydrophobicContact CG-CG 4.06Å; Q449-Q451 VanDerWaalsContact NE2-NE2 3.16Å; Q449-M464 HydrophobicContact CB-CE 4.16Å; Q449-M464 HydrophobicContact CB-SD 3.89Å; Q449-M464 HydrophobicContact CG-CE 4.49Å; Q449-M464 HydrophobicContact CG-SD 3.69Å; Q449-L488 PolarHBondContact N-O 3.33Å; Q449-L488 PolarHBondContact O-N 3.31Å; Q449-I490 HydrophobicContact CB-CD1 4.19Å
450	I	88.6	Confident	73.7	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	136.2	166.5	-61.2	178.2	0	0	0	107.1	I434 Y452 Y462 R463 I465 F472 L485 C486 V487	I434-I450 HydrophobicContact CD1-CD1 4.02Å; I434-I450 HydrophobicContact CD1-CG2 4.35Å; I450-Y452 HydrophobicContact CG2-CD1 4.19Å; I450-Y462 CarbonylContact O-C 3.43Å; I450-Y462 WeakPolarHBondContact O-CA 3.35Å; I450-Y462 WeakPolarHBondContact O-CB 3.35Å; I450-R463 PolarHBondContact N-O 3Å; I450-R463 PolarHBondContact O-N 2.97Å; I450-I465 HydrophobicContact CD1-CD1 3.83Å; I450-I465 HydrophobicContact CD1-CG2 4.45Å; I450-I465 HydrophobicContact CG1-CD1 4.1Å; I450-F472 HydrophobicContact CD1-CB 3.71Å; I450-F472 HydrophobicContact CD1-CD1 3.48Å; I450-F472 VanDerWaalsContact CD1-CD1 3.48Å; I450-F472 HydrophobicContact CD1-CE1 4.29Å; I450-F472 HydrophobicContact CD1-CG 3.73Å; I450-L485 HydrophobicContact CG2-CD1 3.89Å; I450-L485 HydrophobicContact CG2-CD2 4.12Å; I450-L485 HydrophobicContact CG2-CG 3.99Å; I450-C486 WeakPolarHBondContact CA-O 3.46Å; I450-V487 HydrophobicContact CG1-CG2 4.33Å
451	Q	89.2	Confident	74.8	Confident	49 Å²	49	66.2 Å²	66.2	23%	0.229	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	135.6	173.7	-63.2	180	-13.4	0	0	108.9	Q449 L460 V461 L485 C486 L488	Q449-Q451 HydrophobicContact CG-CG 4.06Å; Q449-Q451 VanDerWaalsContact NE2-NE2 3.16Å; Q451-L460 HydrophobicContact CB-CD1 4.28Å; Q451-V461 CarbonylContact C-O 3.56Å; Q451-V461 WeakPolarHBondContact CA-O 3.42Å; Q451-L485 CarbonylContact O-C 3.43Å; Q451-L485 WeakPolarHBondContact O-CA 3.3Å; Q451-C486 PolarHBondContact N-O 3.02Å; Q451-C486 PolarHBondContact O-N 2.9Å; Q451-L488 HydrophobicContact CB-CD1 4.43Å; Q451-L488 HydrophobicContact CG-CD1 3.81Å
452	Y	88	Confident	76.4	Confident	16 Å²	16	61.4 Å²	61.4	6%	0.063	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	147.2	173.9	59.5	-83.2	0	0	0	113.5	I450 V461 V474 L477 Y483 D484 L485	I450-Y452 HydrophobicContact CG2-CD1 4.19Å; Y452-V461 HydrophobicContact CD2-CB 4.3Å; Y452-V461 HydrophobicContact CE1-CB 4.15Å; Y452-V461 HydrophobicContact CE1-CG1 3.93Å; Y452-V461 HydrophobicContact CE2-CB 3.93Å; Y452-V461 HydrophobicContact CE2-CG1 4.19Å; Y452-V461 HydrophobicContact CE2-CG2 4.33Å; Y452-V461 PolarHBondContact N-O 2.69Å; Y452-V461 PolarHBondContact O-N 2.93Å; Y452-V474 HydrophobicContact CE1-CG1 3.83Å; Y452-V474 HydrophobicContact CE1-CG2 4.5Å; Y452-V474 HydrophobicContact CE2-CG1 4.07Å; Y452-L477 HydrophobicContact CD2-CD2 4.29Å; Y452-L477 HydrophobicContact CE2-CD2 3.89Å; Y452-Y483 HydrophobicContact CD2-CD1 4.14Å; Y452-Y483 HydrophobicContact CD2-CE1 4.26Å; Y452-D484 VanDerWaalsContact CA-O 3.27Å; Y452-D484 WeakPolarHBondContact CA-O 3.4Å; Y452-L485 HydrophobicContact CD1-CD1 4.28Å; Y452-L485 HydrophobicContact CG-CD1 4.34Å
453	N	87.3	Confident	77.5	Confident	51 Å²	51	60.6 Å²	60.6	27%	0.273	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	144.2	176.1	172.6	-58.8	0	0	0	108.1	D458 L460 Y483 D484	N453-D458 PolarHBondContact ND2-O 3.19Å; N453-L460 HydrophobicContact CB-CD1 4.09Å; N453-Y483 WeakPolarHBondContact O-CA 3.37Å; N453-Y483 WeakPolarHBondContact O-CD1 3.43Å; N453-D484 PolarHBondContact N-O 3.44Å; N453-D484 VanDerWaalsContact N-O 3.13Å; N453-D484 PolarHBondContact O-N 2.98Å
454	G	83.4	Confident	78.7	Confident	4 Å²	4	57 Å²	57	4%	0.041	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	145	-177.9	0	0	0	0	0	112.1	Y456 D457 S482 Y483	G454-Y456 PolarHBondContact O-N 3.48Å; G454-D457 CarbonylContact O-C 3.11Å; G454-D457 PolarHBondContact O-N 3.35Å; G454-D457 VanDerWaalsContact O-O 3.12Å; G454-S482 CarbonylContact C-O 3.5Å; G454-S482 WeakPolarHBondContact CA-O 3.42Å; G454-Y483 VanDerWaalsContact CA-CD1 3.45Å
455	S	80.3	Confident	79.4	Confident	74 Å²	74	55 Å²	55	52%	0.517	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	3.2	-170.4	68.1	0	0	0	0	117.7	S482	S455-S482 PolarHBondContact N-O 2.8Å; S455-S482 PolarHBondContact OG-N 2.87Å
456	Y	67.5	Low	79.8	Confident	189 Å²	189	55.9 Å²	55.9	74%	0.741	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	-13	175.1	-73.4	-83.7	0	0	0	113.4	G454 T481	G454-Y456 PolarHBondContact O-N 3.48Å; Y456-T481 HydrophobicContact CD2-CG2 3.61Å; Y456-T481 HydrophobicContact CE2-CG2 3.97Å
457	D	62.8	Low	79.9	Confident	94 Å²	94	54.1 Å²	54.1	50%	0.503	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	105.4	-175.4	-71.9	-56.1	0	0	0	109.6	G454 S459	G454-D457 CarbonylContact O-C 3.11Å; G454-D457 PolarHBondContact O-N 3.35Å; G454-D457 VanDerWaalsContact O-O 3.12Å; D457-S459 PolarHBondContact O-N 2.8Å
458	D	59.7	Low	79.5	Confident	166 Å²	166	56.9 Å²	56.9	89%	0.888	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	-1.9	178.8	-78.3	-39	0	0	0	114.2	N453	N453-D458 PolarHBondContact ND2-O 3.19Å
459	S	64.6	Low	79.2	Confident	52 Å²	52	57.9 Å²	57.9	36%	0.364	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	123.9	178.7	56.9	0	0	0	0	112.4	D457 V461	D457-S459 PolarHBondContact O-N 2.8Å; S459-V461 PolarHBondContact O-N 2.67Å
460	L	78.1	Confident	78.6	Confident	81 Å²	81	63.6 Å²	63.6	42%	0.424	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	98.3	175.6	-174.9	68.6	0	0	0	110.3	Q451 N453	Q451-L460 HydrophobicContact CB-CD1 4.28Å; N453-L460 HydrophobicContact CB-CD1 4.09Å
461	V	80.6	Confident	78.4	Confident	23 Å²	23	67.9 Å²	67.9	14%	0.139	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	132.9	176.2	-175.3	0	0	0	0	109.4	Q451 Y452 S459	Q451-V461 CarbonylContact C-O 3.56Å; Q451-V461 WeakPolarHBondContact CA-O 3.42Å; Y452-V461 HydrophobicContact CD2-CB 4.3Å; Y452-V461 HydrophobicContact CE1-CB 4.15Å; Y452-V461 HydrophobicContact CE1-CG1 3.93Å; Y452-V461 HydrophobicContact CE2-CB 3.93Å; Y452-V461 HydrophobicContact CE2-CG1 4.19Å; Y452-V461 HydrophobicContact CE2-CG2 4.33Å; Y452-V461 PolarHBondContact N-O 2.69Å; Y452-V461 PolarHBondContact O-N 2.93Å; S459-V461 PolarHBondContact O-N 2.67Å
462	Y	84.1	Confident	78.2	Confident	65 Å²	65	67.1 Å²	67.1	26%	0.255	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	146.3	171.5	65.5	-88.5	0	0	0	112.7	I450 M464 S788 V790	I450-Y462 CarbonylContact O-C 3.43Å; I450-Y462 WeakPolarHBondContact O-CA 3.35Å; I450-Y462 WeakPolarHBondContact O-CB 3.35Å; Y462-M464 HydrophobicContact CD2-SD 4.19Å; Y462-S788 WeakPolarHBondContact OH-CB 3.47Å; Y462-S788 PolarHBondContact OH-OG 3.25Å; Y462-V790 HydrophobicContact CE1-CG2 3.89Å
463	R	83.6	Confident	78.2	Confident	15 Å²	15	70.7 Å²	70.7	6%	0.057	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	131.4	180	-71.7	-176.3	171.5	-176	-0.1	110.7	I450 N475 E787	I450-R463 PolarHBondContact N-O 3Å; I450-R463 PolarHBondContact O-N 2.97Å; R463-N475 PolarHBondContact NH1-OD1 3.32Å; R463-N475 PolarHBondContact NH2-OD1 3.45Å; R463-E787 IonicContact CZ-OE1 3.61Å; R463-E787 IonicContact NE-OE1 3.53Å; R463-E787 PolarHBondContact NE-OE1 3.19Å; R463-E787 IonicContact NH2-OE1 3.98Å; R463-E787 PolarHBondContact NH2-OE1 2.93Å; R463-E787 IonicContact NH2-OE2 3.63Å
464	M	82.8	Confident	78.1	Confident	37 Å²	37	68.2 Å²	68.2	18%	0.182	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	127.8	179.4	-54.1	-51.5	-74.5	0	0	109.7	M447 Q449 Y462 I490	M447-M464 HydrophobicContact CE-CB 3.91Å; M447-M464 HydrophobicContact CE-CE 3.6Å; M447-M464 HydrophobicContact CE-CG 4.41Å; M447-M464 HydrophobicContact CG-CE 4.19Å; M447-M464 HydrophobicContact SD-CE 3.79Å; Q449-M464 HydrophobicContact CB-CE 4.16Å; Q449-M464 HydrophobicContact CB-SD 3.89Å; Q449-M464 HydrophobicContact CG-CE 4.49Å; Q449-M464 HydrophobicContact CG-SD 3.69Å; Y462-M464 HydrophobicContact CD2-SD 4.19Å; M464-I490 HydrophobicContact CE-CD1 3.62Å
465	I	83.1	Confident	78.2	Confident	4 Å²	4	71 Å²	71	2%	0.021	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	149.8	-176.9	68.4	173.7	0	0	0	112.5	F436 M447 F448 I450 F472	F436-I465 HydrophobicContact CE1-CD1 3.91Å; F436-I465 HydrophobicContact CZ-CD1 3.67Å; M447-I465 WeakPolarHBondContact CB-O 3.46Å; F448-I465 HydrophobicContact CB-CD1 4.07Å; F448-I465 HydrophobicContact CB-CG1 3.7Å; F448-I465 PolarHBondContact N-O 3.03Å; F448-I465 PolarHBondContact O-N 3.04Å; I450-I465 HydrophobicContact CD1-CD1 3.83Å; I450-I465 HydrophobicContact CD1-CG2 4.45Å; I450-I465 HydrophobicContact CG1-CD1 4.1Å; I465-F472 HydrophobicContact CD1-CB 4.38Å; I465-F472 HydrophobicContact CG2-CD2 3.63Å; I465-F472 HydrophobicContact CG2-CE2 3.63Å; I465-F472 HydrophobicContact CG2-CG 4.18Å; I465-F472 HydrophobicContact CG2-CZ 4.17Å
466	P	81.3	Confident	78.3	Confident	57 Å²	57	74 Å²	74	37%	0.37	39%	0.385	S	S	.	.			trans	-56.3	152.2	180	-27.8	36.2	0	0	0	114.5	T468 S469	P466-T468 PolarHBondContact O-N 3.25Å; P466-S469 WeakPolarHBondContact O-CB 3.38Å; P466-S469 PolarHBondContact O-N 3.05Å; P466-S469 VanDerWaalsContact O-N 3.12Å; P466-S469 PolarHBondContact O-OG 3.34Å
467	P	75.4	Confident	79.1	Confident	62 Å²	62	65.5 Å²	65.5	40%	0.403	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-10.7	179.6	31.7	-34.9	0	0	0	112.9	I445 R446	I445-P467 HydrophobicContact CG2-CB 4.11Å; R446-P467 WeakPolarHBondContact O-CD 3.43Å; R446-P467 VanDerWaalsContact O-CG 3.27Å; R446-P467 WeakPolarHBondContact O-CG 3.28Å
468	T	75.2	Confident	80.1	Confident	120 Å²	120	62.9 Å²	62.9	74%	0.736	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-16	173.5	48.7	0	0	0	0	113.3	P466	P466-T468 PolarHBondContact O-N 3.25Å
469	S	79.1	Confident	81.3	Confident	27 Å²	27	57.2 Å²	57.2	19%	0.189	32%	0.32	C	S	.	.			trans	-68.7	130.9	-178.7	-61.8	0	0	0	0	111.8	F436 P466	F436-S469 VanDerWaalsContact CE2-O 3.22Å; F436-S469 WeakPolarHBondContact CE2-O 3.16Å; F436-S469 WeakPolarHBondContact CZ-O 3.27Å; P466-S469 WeakPolarHBondContact O-CB 3.38Å; P466-S469 PolarHBondContact O-N 3.05Å; P466-S469 VanDerWaalsContact O-N 3.12Å; P466-S469 PolarHBondContact O-OG 3.34Å
470	K	75.9	Confident	82.1	Confident	150 Å²	150	56.7 Å²	56.7	65%	0.652	32%	0.323	S	S	*	.	S	Bend	trans	-116.6	-4.9	171.7	-60	-179.8	-177.7	179	0	112.6	F436	F436-K470 PolarHBondContact N-O 2.95Å; F436-K470 VanDerWaalsContact O-O 3.1Å
471	N	84.2	Confident	82.4	Confident	89 Å²	89	53.4 Å²	53.4	48%	0.476	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	152.3	-179.4	58.6	-41.9	0	0	0	108.7	I434 K435	I434-N471 CarbonylContact O-C 3.41Å; I434-N471 WeakPolarHBondContact O-CA 3.16Å; I434-N471 VanDerWaalsContact O-CB 3.29Å; I434-N471 WeakPolarHBondContact O-CB 3.43Å; K435-N471 HydrophobicContact CG-CB 4.04Å
472	F	86.4	Confident	82.8	Confident	33 Å²	33	54.6 Å²	54.6	15%	0.145	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	140.1	178	-173.9	-102.6	0	0	0	110	I434 I450 I465 V474	I434-F472 PolarHBondContact N-O 2.76Å; I434-F472 PolarHBondContact O-N 2.95Å; I450-F472 HydrophobicContact CD1-CB 3.71Å; I450-F472 HydrophobicContact CD1-CD1 3.48Å; I450-F472 VanDerWaalsContact CD1-CD1 3.48Å; I450-F472 HydrophobicContact CD1-CE1 4.29Å; I450-F472 HydrophobicContact CD1-CG 3.73Å; I465-F472 HydrophobicContact CD1-CB 4.38Å; I465-F472 HydrophobicContact CG2-CD2 3.63Å; I465-F472 HydrophobicContact CG2-CE2 3.63Å; I465-F472 HydrophobicContact CG2-CG 4.18Å; I465-F472 HydrophobicContact CG2-CZ 4.17Å; F472-V474 HydrophobicContact CD1-CG2 3.93Å; F472-V474 HydrophobicContact CE1-CG2 4.09Å
473	L	86.3	Confident	82.9	Confident	91 Å²	91	52.2 Å²	52.2	48%	0.476	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	112.2	174.5	-176.1	69.2	0	0	0	108.7	L433	L433-L473 HydrophobicContact CB-CD1 4.06Å; L433-L473 HydrophobicContact CD1-CB 4.33Å; L433-L473 HydrophobicContact CD1-CD1 4.4Å
474	V	86.8	Confident	83.1	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	136.9	166.1	-172.8	0	0	0	0	107.8	T431 A432 I434 Y452 F472 L477 L485	T431-V474 CarbonylContact C-O 3.5Å; T431-V474 WeakPolarHBondContact CA-O 3.1Å; T431-V474 WeakPolarHBondContact CB-O 3.39Å; A432-V474 PolarHBondContact N-O 3.45Å; A432-V474 PolarHBondContact O-N 3.1Å; I434-V474 HydrophobicContact CD1-CG2 3.56Å; I434-V474 HydrophobicContact CG1-CG2 4.49Å; Y452-V474 HydrophobicContact CE1-CG1 3.83Å; Y452-V474 HydrophobicContact CE1-CG2 4.5Å; Y452-V474 HydrophobicContact CE2-CG1 4.07Å; F472-V474 HydrophobicContact CD1-CG2 3.93Å; F472-V474 HydrophobicContact CE1-CG2 4.09Å; V474-L477 HydrophobicContact CG1-CD1 4.37Å; V474-L477 HydrophobicContact CG1-CD2 3.66Å; V474-L477 HydrophobicContact CG1-CG 4.06Å; V474-L485 HydrophobicContact CG2-CD1 4.24Å
475	N	85.6	Confident	83.5	Confident	62 Å²	62	53.7 Å²	53.7	33%	0.332	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	169.8	-179.8	65.2	-20.5	0	0	0	110.1	S430 T431 R463 L477	S430-N475 CarbonylContact O-C 3.54Å; T431-N475 HydrophobicContact CG2-CB 4.18Å; R463-N475 PolarHBondContact NH1-OD1 3.32Å; R463-N475 PolarHBondContact NH2-OD1 3.45Å; N475-L477 PolarHBondContact O-N 3.41Å
476	N	81.5	Confident	83.7	Confident	137 Å²	137	55.2 Å²	55.2	73%	0.733	33%	0.326	S	S	*	.	S	Bend	trans	59.9	33.8	-177.1	-50.7	-17	0	0	0	112.8	S430	S430-N476 PolarHBondContact O-N 3.22Å; S430-N476 VanDerWaalsContact O-N 3.09Å
477	L	84.3	Confident	84	Confident	11 Å²	11	52.5 Å²	52.5	6%	0.058	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-74.8	151.5	168.1	-59.5	177.9	0	0	0	109.9	S430 A432 Y452 V474 N475 Y483 F509 T511	S430-L477 WeakPolarHBondContact CA-O 3.31Å; S430-L477 PolarHBondContact O-N 3.27Å; A432-L477 HydrophobicContact CB-CD1 3.72Å; Y452-L477 HydrophobicContact CD2-CD2 4.29Å; Y452-L477 HydrophobicContact CE2-CD2 3.89Å; V474-L477 HydrophobicContact CG1-CD1 4.37Å; V474-L477 HydrophobicContact CG1-CD2 3.66Å; V474-L477 HydrophobicContact CG1-CG 4.06Å; N475-L477 PolarHBondContact O-N 3.41Å; L477-Y483 HydrophobicContact CB-CE2 3.82Å; L477-Y483 HydrophobicContact CD1-CE2 4.42Å; L477-Y483 HydrophobicContact CD2-CD1 4.35Å; L477-Y483 HydrophobicContact CD2-CD2 4.25Å; L477-Y483 HydrophobicContact CD2-CE1 3.96Å; L477-Y483 HydrophobicContact CD2-CE2 3.81Å; L477-Y483 HydrophobicContact CD2-CG 4.5Å; L477-Y483 HydrophobicContact CG-CE2 4.23Å; L477-F509 HydrophobicContact CD1-CE2 3.82Å; L477-F509 HydrophobicContact CD1-CZ 3.82Å; L477-T511 HydrophobicContact CB-CG2 3.83Å; L477-T511 HydrophobicContact CD1-CG2 3.86Å
478	A	83.2	Confident	84.5	Confident	39 Å²	39	50.4 Å²	50.4	32%	0.322	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-77.9	150.9	170.3	0	0	0	0	0	110.6	S429 T481 Y483 T511	S429-A478 CarbonylContact O-C 3.55Å; A478-T481 HydrophobicContact CB-CG2 3.71Å; A478-T481 PolarHBondContact O-OG1 3.04Å; A478-T481 VanDerWaalsContact O-OG1 3.1Å; A478-Y483 PolarHBondContact N-OH 3.29Å; A478-T511 WeakPolarHBondContact O-CB 3.46Å; A478-T511 WeakPolarHBondContact O-CG2 3.5Å; A478-T511 PolarHBondContact O-OG1 2.81Å
479	A	84.7	Confident	84.8	Confident	47 Å²	47	44.7 Å²	44.7	39%	0.388	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	137.3	-177.6	0	0	0	0	0	112.3	S429 T481 E514	S429-A479 WeakPolarHBondContact O-CA 3.32Å; S429-A479 PolarHBondContact O-N 3.3Å; A479-T481 VanDerWaalsContact C-N 3.31Å; A479-T481 PolarHBondContact O-N 3.16Å; A479-E514 HydrophobicContact CB-CB 3.78Å
480	G	82.7	Confident	85	Confident	41 Å²	41	44.3 Å²	44.3	42%	0.423	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	21.9	-179.9	0	0	0	0	0	115.3	T511 E512	G480-T511 PolarHBondContact N-OG1 3.43Å; G480-E512 PolarHBondContact N-O 2.94Å
481	T	84	Confident	85.1	Confident	12 Å²	12	38.8 Å²	38.8	7%	0.074	23%	0.23	C	C	.	.			trans	-107.3	151.3	-179.1	61.2	0	0	0	0	111.6	Y456 A478 A479 Y483 T510 T511	Y456-T481 HydrophobicContact CD2-CG2 3.61Å; Y456-T481 HydrophobicContact CE2-CG2 3.97Å; A478-T481 HydrophobicContact CB-CG2 3.71Å; A478-T481 PolarHBondContact O-OG1 3.04Å; A478-T481 VanDerWaalsContact O-OG1 3.1Å; A479-T481 VanDerWaalsContact C-N 3.31Å; A479-T481 PolarHBondContact O-N 3.16Å; T481-Y483 WeakPolarHBondContact OG1-CE2 3.31Å; T481-T510 WeakPolarHBondContact O-CA 3.45Å; T481-T511 PolarHBondContact N-OG1 3.22Å; T481-T511 PolarHBondContact O-N 3.25Å; T481-T511 PolarHBondContact O-OG1 2.98Å
482	S	88.4	Confident	84.7	Confident	47 Å²	47	37 Å²	37	33%	0.329	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	135.8	174.7	-164.5	0	0	0	0	110	G454 S455 F509	G454-S482 CarbonylContact C-O 3.5Å; G454-S482 WeakPolarHBondContact CA-O 3.42Å; S455-S482 PolarHBondContact N-O 2.8Å; S455-S482 PolarHBondContact OG-N 2.87Å; S482-F509 CarbonylContact C-O 3.52Å; S482-F509 WeakPolarHBondContact CA-O 3.49Å
483	Y	87.2	Confident	83.7	Confident	16 Å²	16	37 Å²	37	6%	0.063	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	130.1	179.5	-76.8	-75.9	0	0	0	111.2	Y452 N453 G454 L477 A478 T481 Q508 F509 T511	Y452-Y483 HydrophobicContact CD2-CD1 4.14Å; Y452-Y483 HydrophobicContact CD2-CE1 4.26Å; N453-Y483 WeakPolarHBondContact O-CA 3.37Å; N453-Y483 WeakPolarHBondContact O-CD1 3.43Å; G454-Y483 VanDerWaalsContact CA-CD1 3.45Å; L477-Y483 HydrophobicContact CB-CE2 3.82Å; L477-Y483 HydrophobicContact CD1-CE2 4.42Å; L477-Y483 HydrophobicContact CD2-CD1 4.35Å; L477-Y483 HydrophobicContact CD2-CD2 4.25Å; L477-Y483 HydrophobicContact CD2-CE1 3.96Å; L477-Y483 HydrophobicContact CD2-CE2 3.81Å; L477-Y483 HydrophobicContact CD2-CG 4.5Å; L477-Y483 HydrophobicContact CG-CE2 4.23Å; A478-Y483 PolarHBondContact N-OH 3.29Å; T481-Y483 WeakPolarHBondContact OG1-CE2 3.31Å; Y483-Q508 WeakPolarHBondContact O-CA 3.38Å; Y483-F509 HydrophobicContact CD2-CE2 4.1Å; Y483-F509 HydrophobicContact CD2-CZ 4.03Å; Y483-F509 HydrophobicContact CG-CE1 4.28Å; Y483-F509 HydrophobicContact CG-CE2 4.49Å; Y483-F509 HydrophobicContact CG-CZ 4Å; Y483-F509 PolarHBondContact N-O 3.1Å; Y483-F509 WeakPolarHBondContact O-CD1 3.49Å; Y483-F509 PolarHBondContact O-N 3.2Å; Y483-T511 HydrophobicContact CD2-CG2 4.13Å; Y483-T511 HydrophobicContact CE2-CG2 3.97Å
484	D	87.9	Confident	82.6	Confident	80 Å²	80	36.8 Å²	36.8	43%	0.428	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	121.1	169.6	-77.9	2.2	0	0	0	108.3	Y452 N453 Q508	Y452-D484 VanDerWaalsContact CA-O 3.27Å; Y452-D484 WeakPolarHBondContact CA-O 3.4Å; N453-D484 PolarHBondContact N-O 3.44Å; N453-D484 VanDerWaalsContact N-O 3.13Å; N453-D484 PolarHBondContact O-N 2.98Å; D484-Q508 VanDerWaalsContact CG-NE2 3.3Å; D484-Q508 WeakPolarHBondContact OD1-CG 3.36Å; D484-Q508 PolarHBondContact OD1-NE2 2.82Å; D484-Q508 PolarHBondContact OD2-NE2 3.04Å; D484-Q508 VanDerWaalsContact OD2-NE2 3.11Å
485	L	89.9	Confident	81.5	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	131.8	-172	-174.9	146.4	0	0	0	112	I434 I450 Q451 Y452 V474 V487 C506 V507 F509	I434-L485 HydrophobicContact CD1-CD1 3.5Å; I434-L485 VanDerWaalsContact CD1-CD1 3.5Å; I434-L485 HydrophobicContact CD1-CD2 3.81Å; I434-L485 HydrophobicContact CD1-CG 4.33Å; I434-L485 HydrophobicContact CG1-CD1 4.29Å; I434-L485 HydrophobicContact CG1-CD2 4.38Å; I450-L485 HydrophobicContact CG2-CD1 3.89Å; I450-L485 HydrophobicContact CG2-CD2 4.12Å; I450-L485 HydrophobicContact CG2-CG 3.99Å; Q451-L485 CarbonylContact O-C 3.43Å; Q451-L485 WeakPolarHBondContact O-CA 3.3Å; Y452-L485 HydrophobicContact CD1-CD1 4.28Å; Y452-L485 HydrophobicContact CG-CD1 4.34Å; V474-L485 HydrophobicContact CG2-CD1 4.24Å; L485-V487 HydrophobicContact CD2-CG2 4.13Å; L485-C506 CarbonylContact O-C 3.17Å; L485-C506 WeakPolarHBondContact O-CA 3.35Å; L485-C506 WeakPolarHBondContact O-CB 3.25Å; L485-V507 HydrophobicContact CB-CG1 4.33Å; L485-V507 HydrophobicContact CD2-CG1 4.06Å; L485-V507 PolarHBondContact N-O 3.22Å; L485-V507 PolarHBondContact O-N 3.41Å; L485-F509 HydrophobicContact CB-CE1 4.2Å; L485-F509 HydrophobicContact CD1-CE1 4.28Å
486	C	88	Confident	80.5	Confident	37 Å²	37	45.2 Å²	45.2	25%	0.25	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	145.3	175.4	-69.8	0	0	0	0	111.5	I450 Q451 L488 C506	I450-C486 WeakPolarHBondContact CA-O 3.46Å; Q451-C486 PolarHBondContact N-O 3.02Å; Q451-C486 PolarHBondContact O-N 2.9Å; C486-L488 HydrophobicContact CB-CD1 4.39Å; C486-C506 HydrophobicContact CB-CB 4.07Å; C486-C506 WeakPolarHBondContact CB-SG 3.39Å; C486-C506 WeakPolarHBondContact SG-CB 3.45Å; C486-C506 CovalentContact SG-SG 2.04Å; C486-C506 PolarHBondContact SG-SG 3.05Å
487	V	86.8	Confident	79.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.9	170.6	-173.4	0	0	0	0	108.5	V422 F436 F448 I450 L485 V504 G505	V422-V487 HydrophobicContact CG1-CG2 3.91Å; V422-V487 HydrophobicContact CG2-CB 4.11Å; V422-V487 HydrophobicContact CG2-CG2 3.95Å; F436-V487 HydrophobicContact CD1-CG2 4.49Å; F436-V487 HydrophobicContact CD2-CG1 4.47Å; F436-V487 HydrophobicContact CG-CG1 4.47Å; F448-V487 HydrophobicContact CB-CG1 4.39Å; F448-V487 HydrophobicContact CD1-CG1 4.44Å; I450-V487 HydrophobicContact CG1-CG2 4.33Å; L485-V487 HydrophobicContact CD2-CG2 4.13Å; V487-V504 HydrophobicContact CB-CB 4.32Å; V487-V504 HydrophobicContact CG1-CB 4.35Å; V487-V504 HydrophobicContact CG1-CG2 4.48Å; V487-V504 WeakPolarHBondContact O-CB 3.24Å; V487-V504 PolarHBondContact O-N 3.03Å; V487-G505 PolarHBondContact N-O 2.86Å; V487-G505 PolarHBondContact O-N 3.2Å
488	L	85.9	Confident	78.5	Confident	17 Å²	17	48.5 Å²	48.5	9%	0.089	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.1	177.2	-56.8	90.7	0	0	0	110	F448 Q449 Q451 C486 R502 V503	F448-L488 CarbonylContact C-O 3.44Å; F448-L488 WeakPolarHBondContact CA-O 3.45Å; F448-L488 WeakPolarHBondContact CB-O 3.35Å; Q449-L488 PolarHBondContact N-O 3.33Å; Q449-L488 PolarHBondContact O-N 3.31Å; Q451-L488 HydrophobicContact CB-CD1 4.43Å; Q451-L488 HydrophobicContact CG-CD1 3.81Å; C486-L488 HydrophobicContact CB-CD1 4.39Å; L488-R502 CarbonylContact C-O 3.13Å; L488-R502 WeakPolarHBondContact CA-O 3.29Å; L488-V503 HydrophobicContact CD2-CG2 4.04Å; L488-V503 HydrophobicContact CG-CG2 4.2Å
489	A	82.7	Confident	78	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.008	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	133.2	170.2	0	0	0	0	0	109.5	F448 T501 R502 V504	F448-A489 HydrophobicContact CD1-CB 3.76Å; F448-A489 HydrophobicContact CE1-CB 3.74Å; A489-T501 WeakPolarHBondContact O-CA 3.31Å; A489-R502 PolarHBondContact N-O 3.41Å; A489-R502 PolarHBondContact O-N 3.01Å; A489-V504 HydrophobicContact CB-CG2 3.8Å
490	I	82.6	Confident	77.5	Confident	18 Å²	18	50.2 Å²	50.2	9%	0.092	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118.4	174.3	-51.5	-171.3	0	0	0	108	R446 M447 Q449 M464 A500 T501	R446-I490 PolarHBondContact N-O 3.29Å; M447-I490 HydrophobicContact CG-CB 3.89Å; M447-I490 HydrophobicContact CG-CD1 4.13Å; M447-I490 HydrophobicContact CG-CG1 4.29Å; M447-I490 HydrophobicContact CG-CG2 4.48Å; M447-I490 PolarHBondContact N-O 2.9Å; M447-I490 PolarHBondContact O-N 3.17Å; Q449-I490 HydrophobicContact CB-CD1 4.19Å; M464-I490 HydrophobicContact CE-CD1 3.62Å; I490-A500 WeakPolarHBondContact CA-O 3.32Å; I490-T501 HydrophobicContact CD1-CG2 4.39Å; I490-T501 HydrophobicContact CG1-CG2 4.1Å; I490-T501 HydrophobicContact CG2-CG2 4.47Å
491	Y	79.1	Confident	77.4	Confident	34 Å²	34	52.3 Å²	52.3	13%	0.133	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	159.5	-175.9	63.1	-82.3	0	0	0	111.2	I442 G444 R446 D493 A500 R502	I442-Y491 HydrophobicContact CD1-CD1 4.45Å; I442-Y491 HydrophobicContact CD1-CE1 4.48Å; I442-Y491 HydrophobicContact CG2-CD1 4.27Å; I442-Y491 HydrophobicContact CG2-CD2 3.81Å; I442-Y491 HydrophobicContact CG2-CE2 4.46Å; I442-Y491 HydrophobicContact CG2-CG 3.71Å; G444-Y491 CarbonylContact O-C 3.6Å; G444-Y491 WeakPolarHBondContact O-CA 3.28Å; G444-Y491 WeakPolarHBondContact O-CB 3.39Å; R446-Y491 PolarHBondContact NH2-O 3.29Å; Y491-D493 HydrophobicContact CE2-CB 4.5Å; Y491-A500 HydrophobicContact CD1-CB 4.39Å; Y491-A500 HydrophobicContact CD2-CB 4.16Å; Y491-A500 HydrophobicContact CE1-CB 3.98Å; Y491-A500 HydrophobicContact CE2-CB 3.7Å; Y491-A500 HydrophobicContact CG-CB 4.47Å; Y491-A500 PolarHBondContact N-O 2.8Å; Y491-A500 PolarHBondContact O-N 3.15Å; Y491-R502 HydrophobicContact CE1-CB 3.83Å; Y491-R502 PolarHBondContact OH-NH2 3.44Å
492	D	75.4	Confident	77.2	Confident	52 Å²	52	58.1 Å²	58.1	28%	0.278	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	127	164.1	-76.5	-61.1	0	0	0	109.4	G444 R446 G494	G444-D492 PolarHBondContact O-N 3.28Å; R446-D492 WeakPolarHBondContact CD-OD2 3.34Å; R446-D492 IonicContact CZ-OD1 3.84Å; R446-D492 IonicContact CZ-OD2 3.65Å; R446-D492 IonicContact NE-OD2 3.12Å; R446-D492 PolarHBondContact NE-OD2 3.29Å; R446-D492 IonicContact NH1-OD1 3.46Å; R446-D492 PolarHBondContact NH1-OD1 3.02Å; R446-D492 IonicContact NH1-OD2 2.72Å; R446-D492 PolarHBondContact NH1-OD2 3.2Å; R446-D492 IonicContact NH2-OD1 2.72Å; R446-D492 PolarHBondContact NH2-OD1 3.07Å; R446-D492 IonicContact NH2-OD2 3.79Å; R446-D492 PolarHBondContact NH2-OD2 2.89Å; D492-G494 PolarHBondContact O-N 3.12Å
493	D	65.6	Low	76.9	Confident	32 Å²	32	59.9 Å²	59.9	17%	0.171	35%	0.351	C	S	.	.			trans	-74.6	123.6	168.3	96.3	-75.4	0	0	0	108.8	Y491 I495 T496 S497 L498 A500	Y491-D493 HydrophobicContact CE2-CB 4.5Å; D493-I495 PolarHBondContact O-N 2.88Å; D493-I495 WeakPolarHBondContact OD2-CB 3.4Å; D493-I495 PolarHBondContact OD2-N 3.04Å; D493-T496 VanDerWaalsContact CG-OG1 3.29Å; D493-T496 PolarHBondContact OD1-N 3.01Å; D493-T496 PolarHBondContact OD1-OG1 3.25Å; D493-T496 PolarHBondContact OD2-N 2.98Å; D493-T496 PolarHBondContact OD2-OG1 3.05Å; D493-S497 WeakPolarHBondContact O-CA 3.38Å; D493-S497 PolarHBondContact O-N 3.04Å; D493-S497 VanDerWaalsContact O-N 3.09Å; D493-S497 PolarHBondContact OD1-N 3.02Å; D493-S497 VanDerWaalsContact OD1-N 3.16Å; D493-L498 PolarHBondContact N-O 3.16Å; D493-L498 PolarHBondContact OD1-N 3.22Å; D493-A500 HydrophobicContact CB-CB 4.32Å
494	G	62.1	Low	76.5	Confident	87 Å²	87	59.6 Å²	59.6	90%	0.897	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	18.5	-176.4	0	0	0	0	0	115	D492	D492-G494 PolarHBondContact O-N 3.12Å
495	I	63.4	Low	76.3	Confident	160 Å²	160	56.7 Å²	56.7	82%	0.821	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.1	-46.8	-173.3	-57.5	174.4	0	0	0	110.5	D493	D493-I495 PolarHBondContact O-N 2.88Å; D493-I495 WeakPolarHBondContact OD2-CB 3.4Å; D493-I495 PolarHBondContact OD2-N 3.04Å
496	T	64.7	Low	76.1	Confident	80 Å²	80	60.1 Å²	60.1	49%	0.491	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-6	178.2	78.6	0	0	0	0	114.2	D493 L498	D493-T496 VanDerWaalsContact CG-OG1 3.29Å; D493-T496 PolarHBondContact OD1-N 3.01Å; D493-T496 PolarHBondContact OD1-OG1 3.25Å; D493-T496 PolarHBondContact OD2-N 2.98Å; D493-T496 PolarHBondContact OD2-OG1 3.05Å; T496-L498 PolarHBondContact O-N 2.8Å; T496-L498 WeakPolarHBondContact OG1-CB 3.04Å
497	S	60.8	Low	76	Confident	99 Å²	99	59.4 Å²	59.4	69%	0.692	36%	0.358	S	S	*	.			trans	51.9	32.6	-173.5	71	0	0	0	0	114.1	D493	D493-S497 WeakPolarHBondContact O-CA 3.38Å; D493-S497 PolarHBondContact O-N 3.04Å; D493-S497 VanDerWaalsContact O-N 3.09Å; D493-S497 PolarHBondContact OD1-N 3.02Å; D493-S497 VanDerWaalsContact OD1-N 3.16Å
498	L	63.3	Low	76.1	Confident	117 Å²	117	66.2 Å²	66.2	61%	0.613	39%	0.39	S	S	*	.			trans	-101.6	161.1	176.3	-69.6	175.1	0	0	0	111.1	D493 T496 A500	D493-L498 PolarHBondContact N-O 3.16Å; D493-L498 PolarHBondContact OD1-N 3.22Å; T496-L498 PolarHBondContact O-N 2.8Å; T496-L498 WeakPolarHBondContact OG1-CB 3.04Å; L498-A500 PolarHBondContact O-N 3.21Å; L498-A500 VanDerWaalsContact O-N 3.09Å
499	T	71.8	Confident	76.2	Confident	97 Å²	97	66.6 Å²	66.6	60%	0.595	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	90.4	-175.4	67.6	0	0	0	0	111.2
500	A	75.8	Confident	76.4	Confident	26 Å²	26	71 Å²	71	22%	0.215	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	142.6	178.9	0	0	0	0	0	112	I490 Y491 D493 L498	I490-A500 WeakPolarHBondContact CA-O 3.32Å; Y491-A500 HydrophobicContact CD1-CB 4.39Å; Y491-A500 HydrophobicContact CD2-CB 4.16Å; Y491-A500 HydrophobicContact CE1-CB 3.98Å; Y491-A500 HydrophobicContact CE2-CB 3.7Å; Y491-A500 HydrophobicContact CG-CB 4.47Å; Y491-A500 PolarHBondContact N-O 2.8Å; Y491-A500 PolarHBondContact O-N 3.15Å; D493-A500 HydrophobicContact CB-CB 4.32Å; L498-A500 PolarHBondContact O-N 3.21Å; L498-A500 VanDerWaalsContact O-N 3.09Å
501	T	80.1	Confident	76.6	Confident	85 Å²	85	70.5 Å²	70.5	52%	0.521	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.7	176.6	68.2	0	0	0	0	110.8	A489 I490	A489-T501 WeakPolarHBondContact O-CA 3.31Å; I490-T501 HydrophobicContact CD1-CG2 4.39Å; I490-T501 HydrophobicContact CG1-CG2 4.1Å; I490-T501 HydrophobicContact CG2-CG2 4.47Å
502	R	79.6	Confident	76.8	Confident	133 Å²	133	74.9 Å²	74.9	50%	0.502	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	129	178.4	175.2	175.9	-71.5	160.4	-3.3	111.4	L488 A489 Y491 V504	L488-R502 CarbonylContact C-O 3.13Å; L488-R502 WeakPolarHBondContact CA-O 3.29Å; A489-R502 PolarHBondContact N-O 3.41Å; A489-R502 PolarHBondContact O-N 3.01Å; Y491-R502 HydrophobicContact CE1-CB 3.83Å; Y491-R502 PolarHBondContact OH-NH2 3.44Å; R502-V504 PolarHBondContact O-N 2.89Å
503	V	82.1	Confident	77	Confident	84 Å²	84	76.1 Å²	76.1	51%	0.509	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	125.9	174.5	-176	0	0	0	0	110.3	L488	L488-V503 HydrophobicContact CD2-CG2 4.04Å; L488-V503 HydrophobicContact CG-CG2 4.2Å
504	V	79.8	Confident	76.9	Confident	10 Å²	10	80.2 Å²	80.2	6%	0.061	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-38.8	174.1	175.3	0	0	0	0	110.5	V422 F438 F448 V487 A489 R502	V422-V504 HydrophobicContact CG2-CG1 4.28Å; F438-V504 HydrophobicContact CD2-CG1 3.82Å; F438-V504 HydrophobicContact CD2-CG2 4.14Å; F438-V504 HydrophobicContact CE2-CG1 4.26Å; F438-V504 HydrophobicContact CE2-CG2 4.02Å; F448-V504 HydrophobicContact CD1-CG2 4.2Å; F448-V504 HydrophobicContact CE1-CG2 4.15Å; V487-V504 HydrophobicContact CB-CB 4.32Å; V487-V504 HydrophobicContact CG1-CB 4.35Å; V487-V504 HydrophobicContact CG1-CG2 4.48Å; V487-V504 WeakPolarHBondContact O-CB 3.24Å; V487-V504 PolarHBondContact O-N 3.03Å; A489-V504 HydrophobicContact CB-CG2 3.8Å; R502-V504 PolarHBondContact O-N 2.89Å
505	G	82.7	Confident	76.2	Confident	19 Å²	19	85.8 Å²	85.8	20%	0.196	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.3	168.3	173.9	0	0	0	0	0	111.2	V487	V487-G505 PolarHBondContact N-O 2.86Å; V487-G505 PolarHBondContact O-N 3.2Å
506	C	85.8	Confident	75.5	Confident	75 Å²	75	85.1 Å²	85.1	51%	0.507	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	156.2	174.6	-52.9	0	0	0	0	110.8	L485 C486	L485-C506 CarbonylContact O-C 3.17Å; L485-C506 WeakPolarHBondContact O-CA 3.35Å; L485-C506 WeakPolarHBondContact O-CB 3.25Å; C486-C506 HydrophobicContact CB-CB 4.07Å; C486-C506 WeakPolarHBondContact CB-SG 3.39Å; C486-C506 WeakPolarHBondContact SG-CB 3.45Å; C486-C506 CovalentContact SG-SG 2.04Å; C486-C506 PolarHBondContact SG-SG 3.05Å
507	V	86.5	Confident	74.3	Confident	22 Å²	22	91.8 Å²	91.8	13%	0.133	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	137.1	-178.6	61.9	0	0	0	0	109.4	V422 I424 L485	V422-V507 HydrophobicContact CG1-CB 4.43Å; V422-V507 HydrophobicContact CG1-CG1 3.84Å; I424-V507 HydrophobicContact CD1-CG1 3.75Å; I424-V507 HydrophobicContact CD1-CG2 4.01Å; I424-V507 HydrophobicContact CG1-CG1 4.09Å; I424-V507 HydrophobicContact CG1-CG2 4.43Å; L485-V507 HydrophobicContact CB-CG1 4.33Å; L485-V507 HydrophobicContact CD2-CG1 4.06Å; L485-V507 PolarHBondContact N-O 3.22Å; L485-V507 PolarHBondContact O-N 3.41Å
508	Q	88.3	Confident	73.3	Confident	143 Å²	143	92.5 Å²	92.5	67%	0.668	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	141.5	172.4	-49.8	-172.9	-80.1	0	0	108.7	Y483 D484	Y483-Q508 WeakPolarHBondContact O-CA 3.38Å; D484-Q508 VanDerWaalsContact CG-NE2 3.3Å; D484-Q508 WeakPolarHBondContact OD1-CG 3.36Å; D484-Q508 PolarHBondContact OD1-NE2 2.82Å; D484-Q508 PolarHBondContact OD2-NE2 3.04Å; D484-Q508 VanDerWaalsContact OD2-NE2 3.11Å
509	F	87.2	Confident	72	Confident	24 Å²	24	95.2 Å²	95.2	11%	0.105	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	166.9	177.4	71.7	-77.2	0	0	0	112.3	I424 A427 A432 L477 S482 Y483 L485 T511	I424-F509 HydrophobicContact CD1-CB 3.55Å; I424-F509 HydrophobicContact CD1-CD1 3.17Å; I424-F509 HydrophobicContact CD1-CD2 4.06Å; I424-F509 HydrophobicContact CD1-CE1 3.76Å; I424-F509 HydrophobicContact CD1-CG 3.33Å; I424-F509 HydrophobicContact CD1-CZ 4.42Å; A427-F509 HydrophobicContact CB-CD2 4.46Å; A432-F509 HydrophobicContact CB-CD2 4.35Å; A432-F509 HydrophobicContact CB-CE2 3.54Å; A432-F509 HydrophobicContact CB-CZ 3.77Å; L477-F509 HydrophobicContact CD1-CE2 3.82Å; L477-F509 HydrophobicContact CD1-CZ 3.82Å; S482-F509 CarbonylContact C-O 3.52Å; S482-F509 WeakPolarHBondContact CA-O 3.49Å; Y483-F509 HydrophobicContact CD2-CE2 4.1Å; Y483-F509 HydrophobicContact CD2-CZ 4.03Å; Y483-F509 HydrophobicContact CG-CE1 4.28Å; Y483-F509 HydrophobicContact CG-CE2 4.49Å; Y483-F509 HydrophobicContact CG-CZ 4Å; Y483-F509 PolarHBondContact N-O 3.1Å; Y483-F509 WeakPolarHBondContact O-CD1 3.49Å; Y483-F509 PolarHBondContact O-N 3.2Å; L485-F509 HydrophobicContact CB-CE1 4.2Å; L485-F509 HydrophobicContact CD1-CE1 4.28Å; F509-T511 HydrophobicContact CE2-CG2 4.22Å
510	T	87.6	Confident	70.4	Confident	95 Å²	95	98 Å²	98	58%	0.583	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	136	171.3	50.5	0	0	0	0	109.4	T481	T481-T510 WeakPolarHBondContact O-CA 3.45Å
511	T	87.2	Confident	68.4	Low	6 Å²	6	103.8 Å²	103.8	4%	0.037	52%	0.518	C	S	.	.			trans	-69	155.2	167.3	45.9	0	0	0	0	110.7	T428 L477 A478 G480 T481 Y483 F509	T428-T511 WeakPolarHBondContact O-CA 3.43Å; T428-T511 VanDerWaalsContact O-CB 3.32Å; T428-T511 WeakPolarHBondContact O-CB 3.36Å; L477-T511 HydrophobicContact CB-CG2 3.83Å; L477-T511 HydrophobicContact CD1-CG2 3.86Å; A478-T511 WeakPolarHBondContact O-CB 3.46Å; A478-T511 WeakPolarHBondContact O-CG2 3.5Å; A478-T511 PolarHBondContact O-OG1 2.81Å; G480-T511 PolarHBondContact N-OG1 3.43Å; T481-T511 PolarHBondContact N-OG1 3.22Å; T481-T511 PolarHBondContact O-N 3.25Å; T481-T511 PolarHBondContact O-OG1 2.98Å; Y483-T511 HydrophobicContact CD2-CG2 4.13Å; Y483-T511 HydrophobicContact CE2-CG2 3.97Å; F509-T511 HydrophobicContact CE2-CG2 4.22Å
512	E	83.2	Confident	66.5	Low	127 Å²	127	108 Å²	108	59%	0.593	53%	0.532	S	S	*	.			trans	-66	144.6	174.7	-62.5	-166.7	128.5	0	0	110.3	T428 S429 G480 E514	T428-E512 PolarHBondContact O-N 2.96Å; S429-E512 WeakPolarHBondContact CA-O 3.33Å; G480-E512 PolarHBondContact N-O 2.94Å; E512-E514 PolarHBondContact O-N 3.23Å
513	S	78.4	Confident	64.9	Low	77 Å²	77	105 Å²	105	54%	0.538	53%	0.532	S	S	.	.			trans	-76.8	107.8	174.9	42.4	0	0	0	0	109	Y515	S513-Y515 VanDerWaalsContact C-N 3.28Å; S513-Y515 PolarHBondContact O-N 2.86Å
514	E	64.7	Low	63.3	Low	118 Å²	118	108 Å²	108	55%	0.551	54%	0.54	S	S	*	.			trans	-70	91.9	172.4	-164.5	161.4	146.8	0	0	108.9	S429 A479 E512 L516	S429-E514 WeakPolarHBondContact CB-OE2 3.17Å; S429-E514 PolarHBondContact OG-OE2 2.75Å; A479-E514 HydrophobicContact CB-CB 3.78Å; E512-E514 PolarHBondContact O-N 3.23Å; E514-L516 VanDerWaalsContact C-N 3.28Å; E514-L516 PolarHBondContact O-N 2.96Å
515	Y	47.6	Very low	61.6	Low	205 Å²	205	114.5 Å²	114.5	80%	0.804	57%	0.568	S	S	*	*			trans	-59.3	100.3	161.2	-82.9	-89.3	0	0	0	107.5	S513 R517	S513-Y515 VanDerWaalsContact C-N 3.28Å; S513-Y515 PolarHBondContact O-N 2.86Å; Y515-R517 PolarHBondContact O-N 3.43Å
516	L	49.1	Very low	60.1	Low	146 Å²	146	119.4 Å²	119.4	76%	0.764	59%	0.589	S	S	*	*			trans	-56.8	80.5	155.3	-84.4	166.1	0	0	0	107.8	E514 C518	E514-L516 VanDerWaalsContact C-N 3.28Å; E514-L516 PolarHBondContact O-N 2.96Å; L516-C518 PolarHBondContact O-N 3.43Å
517	R	39.3	Very low	58.5	Low	220 Å²	220	117.2 Å²	117.2	83%	0.83	58%	0.579	S	S	*	*			trans	-67.6	84.3	167.3	-177.1	179.1	-170	156.7	3.5	105.1	Y515 H519	Y515-R517 PolarHBondContact O-N 3.43Å; R517-H519 VanDerWaalsContact C-N 3.29Å; R517-H519 PolarHBondContact O-N 2.93Å
518	C	39.3	Very low	57.1	Low	113 Å²	113	117.9 Å²	117.9	76%	0.764	59%	0.59	S	S	*	*			trans	-51.5	94.5	-176.9	-72.2	0	0	0	0	109.5	L516 F520	L516-C518 PolarHBondContact O-N 3.43Å; C518-F520 PolarHBondContact O-N 3.39Å
519	H	37.1	Very low	55.8	Low	175 Å²	175	113.6 Å²	113.6	81%	0.81	57%	0.574	S	S	*	*			trans	-73.7	90	173.7	-145.8	-62.7	0	0	0	105	R517 M521	R517-H519 VanDerWaalsContact C-N 3.29Å; R517-H519 PolarHBondContact O-N 2.93Å; H519-M521 PolarHBondContact O-N 2.9Å
520	F	36.2	Very low	54.4	Low	154 Å²	154	116.8 Å²	116.8	68%	0.675	59%	0.591	S	S	*	*			trans	-47.9	114.6	-174	-173.7	-92.9	0	0	0	108.5	C518 Q522 F525	C518-F520 PolarHBondContact O-N 3.39Å; F520-Q522 VanDerWaalsContact C-N 3.34Å; F520-Q522 PolarHBondContact O-N 2.03Å; F520-F525 HydrophobicContact CE1-CD2 4.43Å
521	M	35.2	Very low	53.6	Low	149 Å²	149	118.2 Å²	118.2	73%	0.734	59%	0.593	S	S	*	*			trans	-65.7	94.5	-172.3	-105.7	-73.9	-177.4	0	0	109	H519 S523	H519-M521 PolarHBondContact O-N 2.9Å; M521-S523 PolarHBondContact O-N 2.85Å
522	Q	39.4	Very low	53	Low	172 Å²	172	124.1 Å²	124.1	80%	0.804	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	40.8	-175.9	-162.7	167.6	-22.8	0	0	111.8	F520	F520-Q522 VanDerWaalsContact C-N 3.34Å; F520-Q522 PolarHBondContact O-N 2.03Å
523	S	46.2	Very low	52.7	Low	71 Å²	71	122.1 Å²	122.1	50%	0.497	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.5	-25.3	175.3	51.8	0	0	0	0	112.1	M521	M521-S523 PolarHBondContact O-N 2.85Å
524	Q	49	Very low	52.7	Low	148 Å²	148	123 Å²	123	69%	0.692	61%	0.613	S	S	*	*	S	Bend	trans	-82	-17.4	-179.6	-73.9	-67.3	-15.6	0	0	114.7	L526 G527 G528	Q524-L526 VanDerWaalsContact C-N 3.29Å; Q524-L526 PolarHBondContact O-N 2.97Å; Q524-G527 PolarHBondContact O-N 3.39Å; Q524-G527 VanDerWaalsContact O-N 3.07Å; Q524-G528 PolarHBondContact O-N 3.08Å
525	F	44.1	Very low	53.5	Low	145 Å²	145	118.9 Å²	118.9	64%	0.636	60%	0.603	S	S	*	*	H	α-helix	trans	-71.8	-21.6	-175.8	-126.8	-87.2	0	0	0	114	F520 T529	F520-F525 HydrophobicContact CE1-CD2 4.43Å; F525-T529 WeakPolarHBondContact O-CG2 3.04Å; F525-T529 PolarHBondContact O-N 2.76Å; F525-T529 PolarHBondContact O-OG1 2.96Å
526	L	51.1	Low	55.3	Low	122 Å²	122	111 Å²	111	64%	0.639	58%	0.584	S	S	*	*	H	α-helix	trans	-73.9	-33.5	168.8	-83.3	148	0	0	0	111.9	Q524 T529 M530	Q524-L526 VanDerWaalsContact C-N 3.29Å; Q524-L526 PolarHBondContact O-N 2.97Å; L526-T529 WeakPolarHBondContact CA-OG1 3.17Å; L526-T529 PolarHBondContact O-OG1 2.86Å; L526-M530 VanDerWaalsContact O-CB 3.32Å; L526-M530 WeakPolarHBondContact O-CB 3.03Å; L526-M530 WeakPolarHBondContact O-CG 3.5Å; L526-M530 PolarHBondContact O-N 3.11Å
527	G	52.8	Low	57.2	Low	29 Å²	29	109.2 Å²	109.2	30%	0.299	57%	0.574	S	S	.	*	H	α-helix	trans	-63.6	-53	174.4	0	0	0	0	0	112	Q524 T529 M530 I531	Q524-G527 PolarHBondContact O-N 3.39Å; Q524-G527 VanDerWaalsContact O-N 3.07Å; G527-T529 PolarHBondContact O-N 2.81Å; G527-M530 PolarHBondContact O-N 3.1Å; G527-I531 WeakPolarHBondContact O-CB 3.37Å; G527-I531 VanDerWaalsContact O-CG1 3.27Å; G527-I531 WeakPolarHBondContact O-CG1 3.35Å; G527-I531 PolarHBondContact O-N 3.49Å
528	G	57.2	Low	59.5	Low	36 Å²	36	103.2 Å²	103.2	37%	0.371	56%	0.558	S	S	.	*	H	α-helix	trans	-60.8	-39.8	-180	0	0	0	0	0	113.8	Q524 I532	Q524-G528 PolarHBondContact O-N 3.08Å; G528-I532 WeakPolarHBondContact O-CG1 3.37Å; G528-I532 PolarHBondContact O-N 2.8Å; G528-I532 VanDerWaalsContact O-N 3.11Å
529	T	60.1	Low	61.9	Low	54 Å²	54	102.2 Å²	102.2	33%	0.331	55%	0.547	S	S	.	.	H	α-helix	trans	-71.3	-40.8	177.1	46.9	0	0	0	0	112.5	F525 L526 G527 I532 I533	F525-T529 WeakPolarHBondContact O-CG2 3.04Å; F525-T529 PolarHBondContact O-N 2.76Å; F525-T529 PolarHBondContact O-OG1 2.96Å; L526-T529 WeakPolarHBondContact CA-OG1 3.17Å; L526-T529 PolarHBondContact O-OG1 2.86Å; G527-T529 PolarHBondContact O-N 2.81Å; T529-I532 PolarHBondContact O-N 2.83Å; T529-I533 WeakPolarHBondContact O-CB 3.47Å; T529-I533 WeakPolarHBondContact O-CD1 3.27Å; T529-I533 VanDerWaalsContact O-CG1 3.27Å; T529-I533 WeakPolarHBondContact O-CG1 3.38Å; T529-I533 PolarHBondContact O-N 2.9Å
530	M	58.4	Low	64.2	Low	91 Å²	91	96.3 Å²	96.3	45%	0.448	53%	0.529	S	S	.	.	H	α-helix	trans	-61.9	-41.9	172.4	-73.7	-64.3	111	0	0	112.2	L526 G527 I532 I533 I534	L526-M530 VanDerWaalsContact O-CB 3.32Å; L526-M530 WeakPolarHBondContact O-CB 3.03Å; L526-M530 WeakPolarHBondContact O-CG 3.5Å; L526-M530 PolarHBondContact O-N 3.11Å; G527-M530 PolarHBondContact O-N 3.1Å; M530-I532 PolarHBondContact O-N 2.86Å; M530-I533 HydrophobicContact CE-CD1 3.99Å; M530-I533 PolarHBondContact O-N 2.79Å; M530-I534 HydrophobicContact CB-CD1 4.39Å; M530-I534 VanDerWaalsContact O-CB 3.3Å; M530-I534 WeakPolarHBondContact O-CB 3.44Å; M530-I534 WeakPolarHBondContact O-CD1 3.11Å; M530-I534 VanDerWaalsContact O-CG1 3.22Å; M530-I534 WeakPolarHBondContact O-CG1 3.32Å; M530-I534 PolarHBondContact O-N 3.41Å
531	I	69.2	Low	66.6	Low	124 Å²	124	92 Å²	92	64%	0.636	52%	0.518	S	S	*	.	H	α-helix	trans	-62.1	-42.9	177.4	-70.2	164.4	0	0	0	111.3	G527 G535	G527-I531 WeakPolarHBondContact O-CB 3.37Å; G527-I531 VanDerWaalsContact O-CG1 3.27Å; G527-I531 WeakPolarHBondContact O-CG1 3.35Å; G527-I531 PolarHBondContact O-N 3.49Å; I531-G535 PolarHBondContact O-N 3.08Å
532	I	74.9	Confident	69.2	Low	130 Å²	130	88.5 Å²	88.5	67%	0.667	51%	0.505	S	S	*	.	H	α-helix	trans	-66.9	-40.5	177	-69.1	167.5	0	0	0	111.5	G528 T529 M530 G536	G528-I532 WeakPolarHBondContact O-CG1 3.37Å; G528-I532 PolarHBondContact O-N 2.8Å; G528-I532 VanDerWaalsContact O-N 3.11Å; T529-I532 PolarHBondContact O-N 2.83Å; M530-I532 PolarHBondContact O-N 2.86Å; I532-G536 PolarHBondContact O-N 3.44Å
533	I	76.9	Confident	71.4	Confident	86 Å²	86	84.9 Å²	84.9	44%	0.441	49%	0.491	S	S	.	.	H	α-helix	trans	-68.4	-48.4	178.8	-70.7	165.3	0	0	0	111	T529 M530 G536 I537	T529-I533 WeakPolarHBondContact O-CB 3.47Å; T529-I533 WeakPolarHBondContact O-CD1 3.27Å; T529-I533 VanDerWaalsContact O-CG1 3.27Å; T529-I533 WeakPolarHBondContact O-CG1 3.38Å; T529-I533 PolarHBondContact O-N 2.9Å; M530-I533 HydrophobicContact CE-CD1 3.99Å; M530-I533 PolarHBondContact O-N 2.79Å; I533-G536 PolarHBondContact O-N 3.41Å; I533-I537 HydrophobicContact CG2-CD1 3.79Å; I533-I537 VanDerWaalsContact O-CG1 3.27Å; I533-I537 WeakPolarHBondContact O-CG1 3.49Å; I533-I537 PolarHBondContact O-N 2.69Å
534	I	79.8	Confident	73.4	Confident	94 Å²	94	85.4 Å²	85.4	48%	0.482	49%	0.491	S	S	.	.	H	α-helix	trans	-64.1	-46.3	178.8	-67.1	165.8	0	0	0	110.2	M530 G536 I537 I538	M530-I534 HydrophobicContact CB-CD1 4.39Å; M530-I534 VanDerWaalsContact O-CB 3.3Å; M530-I534 WeakPolarHBondContact O-CB 3.44Å; M530-I534 WeakPolarHBondContact O-CD1 3.11Å; M530-I534 VanDerWaalsContact O-CG1 3.22Å; M530-I534 WeakPolarHBondContact O-CG1 3.32Å; M530-I534 PolarHBondContact O-N 3.41Å; I534-G536 VanDerWaalsContact C-N 3.34Å; I534-G536 PolarHBondContact O-N 3.06Å; I534-I537 PolarHBondContact O-N 3.01Å; I534-I538 HydrophobicContact CG2-CD1 3.81Å; I534-I538 VanDerWaalsContact O-CG1 3.29Å; I534-I538 WeakPolarHBondContact O-CG1 3.44Å; I534-I538 PolarHBondContact O-N 3.07Å
535	G	79.7	Confident	75.3	Confident	32 Å²	32	84.4 Å²	84.4	33%	0.33	48%	0.484	S	S	.	.	H	α-helix	trans	-60	-42.2	174.7	0	0	0	0	0	112.7	I531 I538 V539	I531-G535 PolarHBondContact O-N 3.08Å; G535-I538 PolarHBondContact O-N 3.04Å; G535-V539 WeakPolarHBondContact O-CG2 3.49Å; G535-V539 PolarHBondContact O-N 3.05Å
536	G	85.4	Confident	77.3	Confident	40 Å²	40	81.5 Å²	81.5	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-62.6	-43.1	175.2	0	0	0	0	0	113.1	I532 I533 I534 V539 A540	I532-G536 PolarHBondContact O-N 3.44Å; I533-G536 PolarHBondContact O-N 3.41Å; I534-G536 VanDerWaalsContact C-N 3.34Å; I534-G536 PolarHBondContact O-N 3.06Å; G536-V539 PolarHBondContact O-N 2.8Å; G536-A540 VanDerWaalsContact O-CB 3.24Å; G536-A540 WeakPolarHBondContact O-CB 3.32Å; G536-A540 PolarHBondContact O-N 3.12Å
537	I	89.3	Confident	78.9	Confident	108 Å²	108	80.1 Å²	80.1	55%	0.554	47%	0.467	S	S	*	.	H	α-helix	trans	-64.8	-41.2	176	-69.6	164.8	0	0	0	110.9	I533 I534 S541	I533-I537 HydrophobicContact CG2-CD1 3.79Å; I533-I537 VanDerWaalsContact O-CG1 3.27Å; I533-I537 WeakPolarHBondContact O-CG1 3.49Å; I533-I537 PolarHBondContact O-N 2.69Å; I534-I537 PolarHBondContact O-N 3.01Å; I537-S541 VanDerWaalsContact O-CB 3.29Å; I537-S541 WeakPolarHBondContact O-CB 3.06Å; I537-S541 PolarHBondContact O-N 2.84Å; I537-S541 PolarHBondContact O-OG 3.03Å
538	I	88.1	Confident	80.4	Confident	95 Å²	95	82.7 Å²	82.7	49%	0.487	47%	0.473	S	S	.	.	H	α-helix	trans	-63.3	-49.4	176	-68.9	165.9	0	0	0	110.5	I534 G535 A540 S541 V542	I534-I538 HydrophobicContact CG2-CD1 3.81Å; I534-I538 VanDerWaalsContact O-CG1 3.29Å; I534-I538 WeakPolarHBondContact O-CG1 3.44Å; I534-I538 PolarHBondContact O-N 3.07Å; G535-I538 PolarHBondContact O-N 3.04Å; I538-A540 PolarHBondContact O-N 3.47Å; I538-S541 PolarHBondContact O-N 2.88Å; I538-S541 PolarHBondContact O-OG 3.16Å; I538-S541 VanDerWaalsContact O-OG 3.08Å; I538-V542 HydrophobicContact CG2-CG2 4.42Å; I538-V542 WeakPolarHBondContact O-CB 3.41Å; I538-V542 VanDerWaalsContact O-CG2 3.27Å; I538-V542 WeakPolarHBondContact O-CG2 3.23Å; I538-V542 PolarHBondContact O-N 3.35Å
539	V	89.3	Confident	81.4	Confident	91 Å²	91	85.1 Å²	85.1	55%	0.552	48%	0.477	S	S	*	.	H	α-helix	trans	-62.8	-42	178.8	171.2	0	0	0	0	111.7	G535 G536 L543	G535-V539 WeakPolarHBondContact O-CG2 3.49Å; G535-V539 PolarHBondContact O-N 3.05Å; G536-V539 PolarHBondContact O-N 2.8Å; V539-L543 HydrophobicContact CG1-CD1 4.07Å; V539-L543 WeakPolarHBondContact O-CB 3.26Å; V539-L543 WeakPolarHBondContact O-CG 3.48Å; V539-L543 PolarHBondContact O-N 2.78Å
540	A	85.9	Confident	82.1	Confident	52 Å²	52	88.5 Å²	88.5	43%	0.43	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-44.5	177.8	0	0	0	0	0	112.4	G536 I538 L543 V544	G536-A540 VanDerWaalsContact O-CB 3.24Å; G536-A540 WeakPolarHBondContact O-CB 3.32Å; G536-A540 PolarHBondContact O-N 3.12Å; I538-A540 PolarHBondContact O-N 3.47Å; A540-L543 PolarHBondContact O-N 3.11Å; A540-V544 WeakPolarHBondContact O-CG2 3.05Å; A540-V544 PolarHBondContact O-N 3.35Å
541	S	87.4	Confident	83	Confident	64 Å²	64	88.9 Å²	88.9	45%	0.448	49%	0.493	S	S	.	.	H	α-helix	trans	-68.8	-37	178.7	55.8	0	0	0	0	112.4	I537 I538 V544 F545	I537-S541 VanDerWaalsContact O-CB 3.29Å; I537-S541 WeakPolarHBondContact O-CB 3.06Å; I537-S541 PolarHBondContact O-N 2.84Å; I537-S541 PolarHBondContact O-OG 3.03Å; I538-S541 PolarHBondContact O-N 2.88Å; I538-S541 PolarHBondContact O-OG 3.16Å; I538-S541 VanDerWaalsContact O-OG 3.08Å; S541-V544 PolarHBondContact O-N 3.35Å; S541-F545 VanDerWaalsContact O-CB 3.31Å; S541-F545 WeakPolarHBondContact O-CB 3Å; S541-F545 PolarHBondContact O-N 2.04Å
542	V	88	Confident	83.1	Confident	74 Å²	74	91.5 Å²	91.5	45%	0.448	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-43.6	171.2	169.4	0	0	0	0	111.3	I538 F545 I546	I538-V542 HydrophobicContact CG2-CG2 4.42Å; I538-V542 WeakPolarHBondContact O-CB 3.41Å; I538-V542 VanDerWaalsContact O-CG2 3.27Å; I538-V542 WeakPolarHBondContact O-CG2 3.23Å; I538-V542 PolarHBondContact O-N 3.35Å; V542-F545 PolarHBondContact O-N 3.34Å; V542-I546 HydrophobicContact CG1-CD1 3.76Å; V542-I546 HydrophobicContact CG1-CG1 4.43Å; V542-I546 WeakPolarHBondContact O-CB 3.31Å; V542-I546 VanDerWaalsContact O-CG1 3.28Å; V542-I546 WeakPolarHBondContact O-CG1 3.38Å; V542-I546 PolarHBondContact O-N 3.21Å
543	L	85.6	Confident	82.7	Confident	96 Å²	96	93.1 Å²	93.1	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-61.9	-44.7	174.7	-84.2	166.8	0	0	0	112.3	V539 A540 F545 I546 I547	V539-L543 HydrophobicContact CG1-CD1 4.07Å; V539-L543 WeakPolarHBondContact O-CB 3.26Å; V539-L543 WeakPolarHBondContact O-CG 3.48Å; V539-L543 PolarHBondContact O-N 2.78Å; A540-L543 PolarHBondContact O-N 3.11Å; L543-F545 VanDerWaalsContact C-N 3.34Å; L543-F545 PolarHBondContact O-N 2.75Å; L543-I546 PolarHBondContact O-N 3.19Å; L543-I547 WeakPolarHBondContact O-CB 3.32Å; L543-I547 VanDerWaalsContact O-CG1 3.26Å; L543-I547 WeakPolarHBondContact O-CG1 3.34Å; L543-I547 PolarHBondContact O-N 2.84Å
544	V	90	Very high	81.8	Confident	83 Å²	83	96.7 Å²	96.7	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-41.1	175.2	168.6	0	0	0	0	111	A540 S541 I547 I548	A540-V544 WeakPolarHBondContact O-CG2 3.05Å; A540-V544 PolarHBondContact O-N 3.35Å; S541-V544 PolarHBondContact O-N 3.35Å; V544-I547 PolarHBondContact O-N 2.72Å; V544-I548 HydrophobicContact CG1-CD1 3.72Å; V544-I548 HydrophobicContact CG1-CG1 4.4Å; V544-I548 WeakPolarHBondContact O-CB 3.19Å; V544-I548 VanDerWaalsContact O-CG1 3.26Å; V544-I548 WeakPolarHBondContact O-CG1 3.41Å; V544-I548 PolarHBondContact O-N 2.7Å
545	F	87.1	Confident	80.6	Confident	127 Å²	127	96.4 Å²	96.4	56%	0.557	51%	0.509	S	S	*	.	H	α-helix	trans	-65	-42.4	176.2	-173.3	-109	0	0	0	112.3	S541 V542 L543 I547 I548 L549	S541-F545 VanDerWaalsContact O-CB 3.31Å; S541-F545 WeakPolarHBondContact O-CB 3Å; S541-F545 PolarHBondContact O-N 2.04Å; V542-F545 PolarHBondContact O-N 3.34Å; L543-F545 VanDerWaalsContact C-N 3.34Å; L543-F545 PolarHBondContact O-N 2.75Å; F545-I547 VanDerWaalsContact C-N 3.35Å; F545-I547 PolarHBondContact O-N 2.97Å; F545-I548 PolarHBondContact O-N 3.23Å; F545-L549 HydrophobicContact CD1-CD1 3.84Å; F545-L549 HydrophobicContact CD1-CG 4.41Å; F545-L549 HydrophobicContact CE1-CD1 3.48Å; F545-L549 VanDerWaalsContact CE1-CD1 3.48Å; F545-L549 HydrophobicContact CE1-CG 4.17Å; F545-L549 HydrophobicContact CZ-CD1 4.01Å; F545-L549 HydrophobicContact CZ-CG 4.3Å; F545-L549 WeakPolarHBondContact O-CB 3.44Å; F545-L549 WeakPolarHBondContact O-CG 3.4Å; F545-L549 PolarHBondContact O-N 3.47Å
546	I	87.1	Confident	79.1	Confident	83 Å²	83	99.1 Å²	99.1	43%	0.426	52%	0.522	S	S	.	.	H	α-helix	trans	-62	-41.8	173.4	-70.3	165.9	0	0	0	110.8	V542 L543 L549 M550	V542-I546 HydrophobicContact CG1-CD1 3.76Å; V542-I546 HydrophobicContact CG1-CG1 4.43Å; V542-I546 WeakPolarHBondContact O-CB 3.31Å; V542-I546 VanDerWaalsContact O-CG1 3.28Å; V542-I546 WeakPolarHBondContact O-CG1 3.38Å; V542-I546 PolarHBondContact O-N 3.21Å; L543-I546 PolarHBondContact O-N 3.19Å; I546-L549 PolarHBondContact O-N 2.96Å; I546-M550 HydrophobicContact CG2-CG 4.37Å; I546-M550 WeakPolarHBondContact O-CB 3.4Å; I546-M550 WeakPolarHBondContact O-CG 3.43Å; I546-M550 PolarHBondContact O-N 3.4Å
547	I	84.9	Confident	77.3	Confident	94 Å²	94	102.9 Å²	102.9	48%	0.482	53%	0.532	S	S	.	.	H	α-helix	trans	-65.8	-42.5	176.3	-70.3	164.5	0	0	0	110.9	L543 V544 F545 L549 M550 I551	L543-I547 WeakPolarHBondContact O-CB 3.32Å; L543-I547 VanDerWaalsContact O-CG1 3.26Å; L543-I547 WeakPolarHBondContact O-CG1 3.34Å; L543-I547 PolarHBondContact O-N 2.84Å; V544-I547 PolarHBondContact O-N 2.72Å; F545-I547 VanDerWaalsContact C-N 3.35Å; F545-I547 PolarHBondContact O-N 2.97Å; I547-L549 VanDerWaalsContact C-N 3.34Å; I547-L549 PolarHBondContact O-N 3.43Å; I547-M550 PolarHBondContact O-N 3.33Å; I547-I551 HydrophobicContact CG2-CD1 3.77Å; I547-I551 HydrophobicContact CG2-CG1 4.45Å; I547-I551 WeakPolarHBondContact O-CB 3.25Å; I547-I551 VanDerWaalsContact O-CG1 3.25Å; I547-I551 WeakPolarHBondContact O-CG1 3.45Å; I547-I551 PolarHBondContact O-N 3.2Å
548	I	83.8	Confident	75.2	Confident	82 Å²	82	102.8 Å²	102.8	42%	0.421	54%	0.537	S	S	.	.	H	α-helix	trans	-63.1	-39.9	174.7	-70.8	166.6	0	0	0	111	V544 F545 I551 R552	V544-I548 HydrophobicContact CG1-CD1 3.72Å; V544-I548 HydrophobicContact CG1-CG1 4.4Å; V544-I548 WeakPolarHBondContact O-CB 3.19Å; V544-I548 VanDerWaalsContact O-CG1 3.26Å; V544-I548 WeakPolarHBondContact O-CG1 3.41Å; V544-I548 PolarHBondContact O-N 2.7Å; F545-I548 PolarHBondContact O-N 3.23Å; I548-I551 PolarHBondContact O-N 2.93Å; I548-R552 WeakPolarHBondContact O-CB 3.21Å; I548-R552 WeakPolarHBondContact O-CG 3.32Å; I548-R552 PolarHBondContact O-N 2.92Å
549	L	78.9	Confident	73.1	Confident	88 Å²	88	103.5 Å²	103.5	46%	0.461	55%	0.546	S	S	.	.	H	α-helix	trans	-66.1	-42.8	173.4	-76.8	177.5	0	0	0	111.9	F545 I546 I547 I551 R552 Y553	F545-L549 HydrophobicContact CD1-CD1 3.84Å; F545-L549 HydrophobicContact CD1-CG 4.41Å; F545-L549 HydrophobicContact CE1-CD1 3.48Å; F545-L549 VanDerWaalsContact CE1-CD1 3.48Å; F545-L549 HydrophobicContact CE1-CG 4.17Å; F545-L549 HydrophobicContact CZ-CD1 4.01Å; F545-L549 HydrophobicContact CZ-CG 4.3Å; F545-L549 WeakPolarHBondContact O-CB 3.44Å; F545-L549 WeakPolarHBondContact O-CG 3.4Å; F545-L549 PolarHBondContact O-N 3.47Å; I546-L549 PolarHBondContact O-N 2.96Å; I547-L549 VanDerWaalsContact C-N 3.34Å; I547-L549 PolarHBondContact O-N 3.43Å; L549-I551 VanDerWaalsContact C-N 3.34Å; L549-I551 PolarHBondContact O-N 2.94Å; L549-R552 PolarHBondContact O-N 3.27Å; L549-Y553 WeakPolarHBondContact O-CB 3.48Å; L549-Y553 PolarHBondContact O-N 2.88Å
550	M	74.9	Confident	70.9	Confident	124 Å²	124	106.2 Å²	106.2	61%	0.611	56%	0.558	S	S	*	*	H	α-helix	trans	-62.7	-40.2	174.9	-70.4	-123.7	75.2	0	0	111.8	I546 I547 K554	I546-M550 HydrophobicContact CG2-CG 4.37Å; I546-M550 WeakPolarHBondContact O-CB 3.4Å; I546-M550 WeakPolarHBondContact O-CG 3.43Å; I546-M550 PolarHBondContact O-N 3.4Å; I547-M550 PolarHBondContact O-N 3.33Å; M550-K554 WeakPolarHBondContact O-CB 3.44Å; M550-K554 PolarHBondContact O-N 3.37Å
551	I	77	Confident	68.4	Low	99 Å²	99	109.8 Å²	109.8	51%	0.508	58%	0.579	S	S	.	*	H	α-helix	trans	-66	-49.7	175	-70	166.7	0	0	0	110.1	I547 I548 L549 Y553 K554 V555	I547-I551 HydrophobicContact CG2-CD1 3.77Å; I547-I551 HydrophobicContact CG2-CG1 4.45Å; I547-I551 WeakPolarHBondContact O-CB 3.25Å; I547-I551 VanDerWaalsContact O-CG1 3.25Å; I547-I551 WeakPolarHBondContact O-CG1 3.45Å; I547-I551 PolarHBondContact O-N 3.2Å; I548-I551 PolarHBondContact O-N 2.93Å; L549-I551 VanDerWaalsContact C-N 3.34Å; L549-I551 PolarHBondContact O-N 2.94Å; I551-Y553 VanDerWaalsContact C-N 3.34Å; I551-Y553 PolarHBondContact O-N 2.88Å; I551-K554 CarbonylContact O-C 3.53Å; I551-K554 PolarHBondContact O-N 3.4Å; I551-V555 HydrophobicContact CG2-CG2 4.35Å; I551-V555 WeakPolarHBondContact O-CB 3.47Å; I551-V555 VanDerWaalsContact O-CG2 3.29Å; I551-V555 WeakPolarHBondContact O-CG2 3.3Å; I551-V555 PolarHBondContact O-N 2.87Å
552	R	70.5	Confident	65.9	Low	179 Å²	179	109.7 Å²	109.7	68%	0.675	59%	0.588	S	S	*	*	H	α-helix	trans	-62.7	-38.5	177.2	-78.4	-168.6	170.7	-151.9	-2.2	112.4	I548 L549 V555 C556	I548-R552 WeakPolarHBondContact O-CB 3.21Å; I548-R552 WeakPolarHBondContact O-CG 3.32Å; I548-R552 PolarHBondContact O-N 2.92Å; L549-R552 PolarHBondContact O-N 3.27Å; R552-V555 PolarHBondContact O-N 3.23Å; R552-C556 WeakPolarHBondContact O-CB 3.49Å; R552-C556 PolarHBondContact O-N 3.46Å; R552-C556 PolarHBondContact O-SG 3.34Å
553	Y	66.4	Low	63.2	Low	164 Å²	164	116.3 Å²	116.3	64%	0.643	61%	0.611	S	S	*	*	H	α-helix	trans	-63.1	-42.7	173.8	-168.7	-99.5	0	0	0	111.3	L549 I551 V555 N557	L549-Y553 WeakPolarHBondContact O-CB 3.48Å; L549-Y553 PolarHBondContact O-N 2.88Å; I551-Y553 VanDerWaalsContact C-N 3.34Å; I551-Y553 PolarHBondContact O-N 2.88Å; Y553-V555 VanDerWaalsContact C-N 3.34Å; Y553-V555 PolarHBondContact O-N 3.31Å; Y553-N557 WeakPolarHBondContact O-CB 3.38Å; Y553-N557 PolarHBondContact O-N 3.29Å
554	K	58.1	Low	60.6	Low	161 Å²	161	114.8 Å²	114.8	70%	0.7	62%	0.618	S	S	*	*	H	α-helix	trans	-69.8	-26.7	176.5	-166.6	169.8	-176.6	176.9	0	113.5	M550 I551 T558	M550-K554 WeakPolarHBondContact O-CB 3.44Å; M550-K554 PolarHBondContact O-N 3.37Å; I551-K554 CarbonylContact O-C 3.53Å; I551-K554 PolarHBondContact O-N 3.4Å; K554-T558 WeakPolarHBondContact O-CG2 3.49Å; K554-T558 PolarHBondContact O-OG1 3.02Å
555	V	55.8	Low	57.8	Low	88 Å²	88	117.1 Å²	117.1	53%	0.533	63%	0.633	S	S	.	*	H	α-helix	trans	-83.2	-38.2	175.1	169.4	0	0	0	0	111.9	I551 R552 Y553 T558	I551-V555 HydrophobicContact CG2-CG2 4.35Å; I551-V555 WeakPolarHBondContact O-CB 3.47Å; I551-V555 VanDerWaalsContact O-CG2 3.29Å; I551-V555 WeakPolarHBondContact O-CG2 3.3Å; I551-V555 PolarHBondContact O-N 2.87Å; R552-V555 PolarHBondContact O-N 3.23Å; Y553-V555 VanDerWaalsContact C-N 3.34Å; Y553-V555 PolarHBondContact O-N 3.31Å; V555-T558 WeakPolarHBondContact CA-OG1 3.46Å; V555-T558 PolarHBondContact O-N 2.89Å; V555-T558 PolarHBondContact O-OG1 2.93Å; V555-T558 VanDerWaalsContact O-OG1 3.05Å
556	C	48.6	Very low	55.2	Low	89 Å²	89	118.4 Å²	118.4	60%	0.601	65%	0.645	S	S	*	*	H	α-helix	trans	-72.6	-31.6	174	-67.9	0	0	0	0	112.4	R552 T558 T559	R552-C556 WeakPolarHBondContact O-CB 3.49Å; R552-C556 PolarHBondContact O-N 3.46Å; R552-C556 PolarHBondContact O-SG 3.34Å; C556-T558 VanDerWaalsContact C-N 3.27Å; C556-T558 PolarHBondContact O-N 3.38Å; C556-T559 PolarHBondContact O-OG1 2.88Å
557	N	46.2	Very low	52.7	Low	119 Å²	119	119.8 Å²	119.8	64%	0.636	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	4.4	177.6	-160.7	42	0	0	0	113.8	Y553	Y553-N557 WeakPolarHBondContact O-CB 3.38Å; Y553-N557 PolarHBondContact O-N 3.29Å
558	T	46	Very low	50.1	Low	106 Å²	106	120.6 Å²	120.6	65%	0.65	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	-1.6	173.8	35.2	0	0	0	0	113.8	K554 V555 C556	K554-T558 WeakPolarHBondContact O-CG2 3.49Å; K554-T558 PolarHBondContact O-OG1 3.02Å; V555-T558 WeakPolarHBondContact CA-OG1 3.46Å; V555-T558 PolarHBondContact O-N 2.89Å; V555-T558 PolarHBondContact O-OG1 2.93Å; V555-T558 VanDerWaalsContact O-OG1 3.05Å; C556-T558 VanDerWaalsContact C-N 3.27Å; C556-T558 PolarHBondContact O-N 3.38Å
559	T	44.1	Very low	47.8	Very low	111 Å²	111	123.4 Å²	123.4	68%	0.681	68%	0.682	S	S	*	*	S	Bend	trans	-112.2	2.6	-176.5	50.1	0	0	0	0	115.3	C556	C556-T559 PolarHBondContact O-OG1 2.88Å
560	N	41.7	Very low	45.6	Very low	148 Å²	148	124.6 Å²	124.6	79%	0.791	69%	0.693	S	S	*	*			trans	-139.3	73.9	-173.2	-128.1	-5.8	0	0	0	115.3
561	S	34.6	Very low	43.7	Very low	126 Å²	126	125.7 Å²	125.7	88%	0.881	70%	0.696	S	S	*	*			trans	-146.2	61.7	165.3	50.5	0	0	0	0	110.9
562	G	34.7	Very low	41.6	Very low	62 Å²	62	125.8 Å²	125.8	64%	0.639	71%	0.706	S	S	*	*			trans	-131.3	-0.2	-154.1	0	0	0	0	0	120.6
563	K	31.8	Very low	39.7	Very low	213 Å²	213	124 Å²	124	93%	0.926	71%	0.705	S	S	*	*			trans	167	133.7	157.8	-95.5	150.5	-169.4	177.2	0	114.1
564	G	30.7	Very low	38.3	Very low	64 Å²	64	121 Å²	121	66%	0.66	70%	0.704	S	S	*	*				70	105.6	128.9	0	0	0	0	0	121.7
565	T	31.7	Very low	37.1	Very low	133 Å²	133	121 Å²	121	82%	0.816	71%	0.712	S	S	*	*				39.2	121.3	126.3	-2.8	0	0	0	0	118.6
566	L	31.1	Very low	35.9	Very low	154 Å²	154	119.9 Å²	119.9	81%	0.806	72%	0.718	S	S	*	*				-160.9	162.1	68.9	-130.8	105.7	0	0	0	115.3
567	V	34.9	Very low	35.1	Very low	112 Å²	112	120.5 Å²	120.5	68%	0.679	73%	0.729	S	S	*	*			trans	-36.4	150	165.6	-131.3	0	0	0	0	113.4
568	T	30.3	Very low	34.4	Very low	110 Å²	110	123 Å²	123	68%	0.675	74%	0.737	S	S	*	*				-163.8	147.5	52	53.4	0	0	0	0	117.6
569	N	35.3	Very low	33.5	Very low	141 Å²	141	123.9 Å²	123.9	75%	0.754	75%	0.747	S	S	*	*			trans	66.1	148.5	138.1	-65.1	-5	0	0	0	120.9
570	V	33.9	Very low	33	Very low	113 Å²	113	127.2 Å²	127.2	69%	0.685	76%	0.755	S	S	*	*			cis	-159.3	142.1	-6.5	118.2	0	0	0	0	112.3
571	H	33.5	Very low	32.3	Very low	148 Å²	148	123.5 Å²	123.5	69%	0.685	75%	0.752	S	S	*	*			trans	55.7	159.2	162.9	-77.4	56.2	0	0	0	119.8	Q573	H571-Q573 PolarHBondContact NE2-NE2 3.02Å
572	S	32.8	Very low	31.8	Very low	101 Å²	101	123.6 Å²	123.6	71%	0.706	75%	0.751	S	S	*	*			cis	-121.6	147.4	0	58.6	0	0	0	0	110.2
573	Q	32.3	Very low	31.3	Very low	140 Å²	140	126.6 Å²	126.6	65%	0.654	76%	0.757	S	S	*	*				51.9	126.1	71	-71.8	-167.4	25.2	0	0	113.2	H571	H571-Q573 PolarHBondContact NE2-NE2 3.02Å
574	T	36.6	Very low	31.1	Very low	103 Å²	103	122.8 Å²	122.8	63%	0.632	75%	0.751	S	S	*	*			cis	-156.4	145.8	9.7	15.1	0	0	0	0	114.2
575	N	32.8	Very low	30.9	Very low	161 Å²	161	125.7 Å²	125.7	86%	0.861	76%	0.757	S	S	*	*			trans	53.7	149.3	143.2	-54.9	-13	0	0	0	121.5
576	G	30.1	Very low	32	Very low	64 Å²	64	124.5 Å²	124.5	66%	0.66	75%	0.751	S	S	*	*			cis	-137.2	162	-0.2	0	0	0	0	0	111.7
577	A	31.9	Very low	31.7	Very low	101 Å²	101	122.6 Å²	122.6	84%	0.835	75%	0.751	S	S	*	*				68.9	131.5	73.3	0	0	0	0	0	112.8
578	Q	30.8	Very low	31.5	Very low	173 Å²	173	123.4 Å²	123.4	81%	0.808	76%	0.756	S	S	*	*			cis	-164.5	148.1	1.3	-145.9	176.4	8.4	0	0	110.6
579	S	28.8	Very low	31.5	Very low	123 Å²	123	122.8 Å²	122.8	86%	0.86	76%	0.756	S	S	*	*			trans	-154.8	152.7	153.9	64.9	0	0	0	0	111
580	Q	32	Very low	31.4	Very low	182 Å²	182	123.9 Å²	123.9	85%	0.85	75%	0.754	S	S	*	*			trans	-126.2	156.1	-172.2	-64.8	175.1	-63.5	0	0	111.7
581	G	27	Very low	31.3	Very low	70 Å²	70	126.2 Å²	126.2	72%	0.722	76%	0.757	S	S	*	*			trans	91.6	146.5	159.9	0	0	0	0	0	115.4
582	C	24.1	Very low	31.1	Very low	127 Å²	127	122.5 Å²	122.5	86%	0.858	75%	0.752	S	S	*	*			cis	-152.1	177.2	-3.4	-110.1	0	0	0	0	112.4
583	T	25.1	Very low	31	Very low	125 Å²	125	126.6 Å²	126.6	77%	0.767	76%	0.763	S	S	*	*			trans	-47.4	161.2	171	44.8	0	0	0	0	113.6
584	V	28.3	Very low	30.9	Very low	133 Å²	133	123.7 Å²	123.7	81%	0.806	77%	0.77	S	S	*	*				-159.8	155.1	62.3	165	0	0	0	0	112.5
585	T	26.1	Very low	30.7	Very low	126 Å²	126	122.2 Å²	122.2	77%	0.773	78%	0.775	S	S	*	*			trans	-130.3	-178	171.6	60.6	0	0	0	0	109.2
586	P	53.7	Low	30.8	Very low	108 Å²	108	119.7 Å²	119.7	70%	0.701	77%	0.77	S	S	*	*			cis	-133	174.1	-18.9	34.4	-15.8	0	0	0	114.8
587	S	25.6	Very low	31.1	Very low	114 Å²	114	124.2 Å²	124.2	80%	0.797	78%	0.779	S	S	*	*			trans	-172.8	127	135.3	15.5	0	0	0	0	108.4
588	V	30.4	Very low	31.1	Very low	129 Å²	129	122.9 Å²	122.9	78%	0.782	78%	0.776	S	S	*	*				68.2	113	52.6	-179.5	0	0	0	0	110.7
589	S	30.3	Very low	31.2	Very low	97 Å²	97	118.9 Å²	118.9	68%	0.678	78%	0.78	S	S	*	*			cis	-156	-151.6	-0	46	0	0	0	0	109.2
590	K	33	Very low	31.4	Very low	163 Å²	163	116.8 Å²	116.8	71%	0.709	78%	0.779	S	S	*	*			cis	-172.7	150.4	15.3	-145.2	174.4	169.2	-174	0	111.3
591	Q	31.2	Very low	31.4	Very low	163 Å²	163	112.4 Å²	112.4	76%	0.762	78%	0.782	S	S	*	*			trans	63.9	155.6	156.8	-76	161	-63.6	0	0	119.2
592	A	30.8	Very low	31.7	Very low	70 Å²	70	112.4 Å²	112.4	58%	0.579	78%	0.782	S	S	*	*			cis	-166.8	155.9	-17	0	0	0	0	0	111.7
593	M	31.1	Very low	31.8	Very low	187 Å²	187	112.1 Å²	112.1	92%	0.921	78%	0.78	S	S	*	*			trans	48.5	147.1	168.5	-79.3	80.4	94	0	0	119
594	G	29.7	Very low	32.3	Very low	79 Å²	79	112.5 Å²	112.5	81%	0.814	78%	0.777	S	S	*	*			cis	121	138.9	11.9	0	0	0	0	0	109.9
595	G	32.3	Very low	32.6	Very low	71 Å²	71	115.2 Å²	115.2	73%	0.732	78%	0.778	S	S	*	*			cis	176.6	175.3	-2.5	0	0	0	0	0	110.4
596	S	35.4	Very low	32.9	Very low	109 Å²	109	112.9 Å²	112.9	76%	0.762	77%	0.772	S	S	*	*			trans	63.6	157.8	174.5	-79.6	0	0	0	0	117.3
597	D	34.6	Very low	31.8	Very low	158 Å²	158	114.9 Å²	114.9	85%	0.845	78%	0.781	S	S	*	*			cis	-152.7	172.9	-13.7	-93.2	-14.3	0	0	0	106.3
598	G	33.3	Very low	31.9	Very low	74 Å²	74	112.3 Å²	112.3	76%	0.763	77%	0.772	S	S	*	*			cis	159.6	139	-3.7	0	0	0	0	0	111.5
599	G	32.6	Very low	31.8	Very low	88 Å²	88	115.3 Å²	115.3	91%	0.907	78%	0.778	S	S	*	*			trans	80	155.5	172	0	0	0	0	0	117.6
600	G	32.3	Very low	31.8	Very low	80 Å²	80	116.2 Å²	116.2	83%	0.825	78%	0.779	S	S	*	*			cis	165.4	126.5	-12.7	0	0	0	0	0	115.3
601	G	32.8	Very low	31.6	Very low	89 Å²	89	113 Å²	113	92%	0.918	78%	0.777	S	S	*	*			trans	73.6	156.6	166.2	0	0	0	0	0	117.8
602	G	32.1	Very low	31.4	Very low	70 Å²	70	111.3 Å²	111.3	72%	0.722	77%	0.773	S	S	*	*			cis	152.4	130.2	-17.8	0	0	0	0	0	115.9
603	C	27.5	Very low	31.2	Very low	122 Å²	122	113.2 Å²	113.2	82%	0.824	78%	0.778	S	S	*	*			trans	65.5	158.4	157.4	-65.2	0	0	0	0	119
604	L	35.9	Very low	31	Very low	132 Å²	132	111.4 Å²	111.4	69%	0.691	77%	0.771	S	S	*	*			cis	-167.7	144.1	-13.6	-107.4	166.4	0	0	0	110.2
605	K	33	Very low	30.8	Very low	190 Å²	190	113.4 Å²	113.4	83%	0.826	77%	0.767	S	S	*	*			trans	60.9	166.6	152.3	-72.9	173.3	177	-178.7	0	119.7
606	A	32.5	Very low	30.6	Very low	78 Å²	78	118.5 Å²	118.5	65%	0.645	77%	0.772	S	S	*	*			cis	-174.4	170.4	-32.5	0	0	0	0	0	111.3
607	V	31.1	Very low	30.3	Very low	150 Å²	150	117.4 Å²	117.4	91%	0.909	76%	0.764	S	S	*	*			trans	71.7	146.3	167	-163.7	0	0	0	0	116.1
608	G	28.6	Very low	30	Very low	59 Å²	59	114.7 Å²	114.7	61%	0.608	76%	0.758	S	S	*	*			cis	151.4	138	-14.5	0	0	0	0	0	114.9
609	H	27.9	Very low	29.8	Very low	193 Å²	193	119.7 Å²	119.7	89%	0.894	76%	0.761	S	S	*	*			trans	66	155.6	171.3	-74.3	-63.6	0	0	0	117.1
610	V	30.7	Very low	29.5	Very low	116 Å²	116	121.4 Å²	121.4	70%	0.703	75%	0.754	S	S	*	*			cis	-162.2	156.7	-10.5	107	0	0	0	0	112.1
611	S	28.3	Very low	29.1	Very low	95 Å²	95	122.9 Å²	122.9	66%	0.664	75%	0.752	S	S	*	*			trans	63.3	154.5	160.4	-79	0	0	0	0	120.1
612	D	27.8	Very low	29.1	Very low	128 Å²	128	126.2 Å²	126.2	68%	0.684	75%	0.748	S	S	*	*			cis	-162.4	178.9	-10.3	-127.2	-56.2	0	0	0	114.6
613	T	24.7	Very low	29.3	Very low	110 Å²	110	129.1 Å²	129.1	68%	0.675	75%	0.754	S	S	*	*			trans	75.5	118.8	151.5	44.9	0	0	0	0	125.5
614	L	27.7	Very low	29.1	Very low	149 Å²	149	130.7 Å²	130.7	78%	0.78	75%	0.754	S	S	*	*				70.4	115.7	125.4	-69.9	168.2	0	0	0	125.1
615	T	25.6	Very low	28.4	Very low	120 Å²	120	129.8 Å²	129.8	74%	0.736	76%	0.757	S	S	*	*				151.3	138.3	107.3	46.2	0	0	0	0	116.5
616	H	28.5	Very low	28	Very low	178 Å²	178	125.5 Å²	125.5	82%	0.824	75%	0.751	S	S	*	*			trans	36.1	153.3	142.1	-70.9	-99	0	0	0	123.6
617	S	27.9	Very low	27.6	Very low	87 Å²	87	128 Å²	128	61%	0.608	76%	0.759	S	S	*	*			cis	-174.8	170.9	-13.9	53.9	0	0	0	0	111.8
618	S	29.6	Very low	27.3	Very low	101 Å²	101	125.2 Å²	125.2	71%	0.706	75%	0.752	S	S	*	*			trans	62.8	150.5	151.6	46.8	0	0	0	0	119.8
619	E	27.8	Very low	27.1	Very low	178 Å²	178	129 Å²	129	83%	0.832	76%	0.763	S	S	*	*			cis	-162.6	-176.4	-9.5	-119.9	179.2	-174.5	0	0	112.5
620	T	26.2	Very low	27	Very low	125 Å²	125	124.3 Å²	124.3	77%	0.767	75%	0.752	S	S	*	*			trans	-18.8	167.6	164.5	7.1	0	0	0	0	121.5
621	S	25.9	Very low	26.8	Very low	110 Å²	110	127.9 Å²	127.9	77%	0.769	76%	0.761	S	S	*	*			cis	-159.2	178.9	16.8	59.2	0	0	0	0	115.8
622	L	30.9	Very low	26.7	Very low	160 Å²	160	129.1 Å²	129.1	84%	0.838	76%	0.764	S	S	*	*			trans	-71.9	171	167.6	-66.8	146.4	0	0	0	113.1
623	P	37.7	Very low	26.6	Very low	130 Å²	130	129.1 Å²	129.1	84%	0.844	77%	0.769	S	S	*	*				-150.1	-176.3	97.9	42.1	-25.2	0	0	0	116.6
624	D	23.1	Very low	26.7	Very low	156 Å²	156	131.9 Å²	131.9	83%	0.834	77%	0.774	S	S	*	*			trans	-107	-174.9	-176.6	-112.7	-51.2	0	0	0	114.1
625	C	21.2	Very low	26.6	Very low	112 Å²	112	128.4 Å²	128.4	76%	0.757	76%	0.762	S	S	*	*			trans	99.1	110.2	152.8	-73.9	0	0	0	0	123.6
626	S	23.7	Very low	26.6	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	77%	0.768	S	S	*	*				68.9	127.2	121.2	71.6	0	0	0	0	125.5
627	T	24.3	Very low	26.5	Very low	131 Å²	131	131.9 Å²	131.9	80%	0.804	77%	0.766	S	S	*	*			trans	65.7	109.1	139.9	45.3	0	0	0	0	123.8
628	A	25.7	Very low	26.7	Very low	92 Å²	92	134.1 Å²	134.1	76%	0.76	78%	0.776	S	S	*	*				57.4	117.8	119.9	0	0	0	0	0	122.9
629	T	24.3	Very low	27.1	Very low	139 Å²	139	135.4 Å²	135.4	85%	0.853	78%	0.782	S	S	*	*			trans	179.9	156.4	139.9	28.5	0	0	0	0	107.1
630	S	25.9	Very low	27	Very low	94 Å²	94	130.8 Å²	130.8	66%	0.657	78%	0.782	S	S	*	*			cis	146.9	90.5	-31.8	63.2	0	0	0	0	110.7
631	Q	26.9	Very low	27.2	Very low	191 Å²	191	130.4 Å²	130.4	89%	0.893	78%	0.784	S	S	*	*			trans	-147.6	133.3	154.4	-67.9	-163.8	-9.2	0	0	106.9
632	V	25.7	Very low	27.3	Very low	121 Å²	121	131 Å²	131	73%	0.733	79%	0.789	S	S	*	*			cis	91.7	88.6	24	-173.6	0	0	0	0	115.1
633	T	24.7	Very low	27.1	Very low	127 Å²	127	127.3 Å²	127.3	78%	0.779	79%	0.789	S	S	*	*			trans	-157.7	116	134	34.1	0	0	0	0	105.9
634	Q	27.6	Very low	26.8	Very low	169 Å²	169	126.5 Å²	126.5	79%	0.79	79%	0.786	S	S	*	*				66.5	139.1	76.2	-76.1	-170.1	-13.1	0	0	115.2
635	S	25.9	Very low	27	Very low	75 Å²	75	125.1 Å²	125.1	52%	0.524	78%	0.778	S	S	.	*			cis	-175	161.8	-23.4	46	0	0	0	0	112.3
636	W	26	Very low	27.3	Very low	227 Å²	227	128.8 Å²	128.8	86%	0.86	78%	0.781	S	S	*	*			trans	97.8	148.1	154	-65.6	-14.4	0	0	0	117.2
637	N	25.1	Very low	27.9	Very low	144 Å²	144	129.3 Å²	129.3	77%	0.77	78%	0.783	S	S	*	*			cis	165.3	156	-24.4	-100.7	-0.4	0	0	0	104.7
638	T	32.3	Very low	28	Very low	135 Å²	135	132 Å²	132	83%	0.828	78%	0.783	S	S	*	*			trans	-85.5	170.6	179.9	57.4	0	0	0	0	112.3
639	P	38.7	Very low	28	Very low	128 Å²	128	138.8 Å²	138.8	83%	0.831	79%	0.789	S	S	*	*				-156.1	-172.8	96.6	42.2	-24	0	0	0	115.3
640	G	26	Very low	28.2	Very low	80 Å²	80	142 Å²	142	83%	0.825	79%	0.791	S	S	*	*			trans	129.5	134	148	0	0	0	0	0	116.4
641	S	28.8	Very low	28.8	Very low	118 Å²	118	143.2 Å²	143.2	83%	0.825	80%	0.797	S	S	*	*			trans	-133.2	163.5	-177.1	-177.5	0	0	0	0	112.8
642	S	30	Very low	29.1	Very low	123 Å²	123	138.6 Å²	138.6	86%	0.86	79%	0.791	S	S	*	*			trans	89.7	136.5	160.4	80.7	0	0	0	0	119.5
643	G	26.6	Very low	29.4	Very low	81 Å²	81	138.6 Å²	138.6	84%	0.835	79%	0.793	S	S	*	*			trans	172.4	95.3	-179.6	0	0	0	0	0	112.4
644	S	30	Very low	30.1	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	80%	0.798	S	S	*	*			trans	-94.2	165	175.4	-97.6	0	0	0	0	110.6
645	L	26.7	Very low	30.8	Very low	126 Å²	126	139.1 Å²	139.1	66%	0.66	79%	0.793	S	S	*	*			cis	-165.9	123.6	15.1	-130	166.5	0	0	0	111.9
646	K	29	Very low	30.9	Very low	189 Å²	189	146.1 Å²	146.1	82%	0.822	81%	0.809	S	S	*	*			trans	55.2	169.3	150.8	-80	171.5	-157.1	164.7	0	118.9
647	P	35.9	Very low	31.2	Very low	112 Å²	112	139.7 Å²	139.7	73%	0.727	81%	0.805	S	S	*	*			cis	-127.4	-174.1	16.2	44.2	-27.1	0	0	0	114.2
648	K	26.4	Very low	31.5	Very low	187 Å²	187	137.5 Å²	137.5	81%	0.813	81%	0.807	S	S	*	*			cis	-159.7	160.9	-13.8	-118.9	165.8	-174.4	171	0	109.2
649	R	25.6	Very low	31.3	Very low	234 Å²	234	135.4 Å²	135.4	88%	0.883	80%	0.803	S	S	*	*			trans	59.6	108	154.6	-75.2	-177.4	167.8	168.1	-5.1	121.6
650	K	28.9	Very low	30.8	Very low	208 Å²	208	133.4 Å²	133.4	90%	0.904	80%	0.797	S	S	*	*				28	155.3	119.8	-78.6	-165.9	173.9	-170.9	0	123
651	P	38.7	Very low	31.1	Very low	119 Å²	119	136 Å²	136	77%	0.773	80%	0.797	S	S	*	*			trans	-105.3	-177.9	-162.1	43.4	-38.3	0	0	0	116.5
652	A	32.7	Very low	31.8	Very low	94 Å²	94	136.5 Å²	136.5	78%	0.777	80%	0.798	S	S	*	*			trans	73.4	148.1	175.6	0	0	0	0	0	115.6
653	P	32.6	Very low	31.7	Very low	120 Å²	120	138.7 Å²	138.7	78%	0.779	80%	0.795	S	S	*	*				-139.6	163.7	88.1	39.9	-27.7	0	0	0	116.1
654	K	38.4	Very low	32.7	Very low	203 Å²	203	140.7 Å²	140.7	88%	0.883	79%	0.793	S	S	*	*			trans	-99.3	147.9	147	-79.4	-173.8	175	-176.6	0	108.5
655	P	42.8	Very low	32.7	Very low	104 Å²	104	142 Å²	142	68%	0.675	79%	0.791	S	S	*	*			trans	-133.6	138.8	140.3	13.8	8.1	0	0	0	114.9
656	Y	28.6	Very low	32.9	Very low	222 Å²	222	142.8 Å²	142.8	87%	0.871	79%	0.794	S	S	*	*			trans	34.2	130.7	130.8	-61.7	-89.3	0	0	0	120.6
657	A	31.5	Very low	33	Very low	92 Å²	92	142.3 Å²	142.3	76%	0.76	80%	0.795	S	S	*	*				76.9	146.3	54.8	0	0	0	0	0	113.4
658	A	31.3	Very low	32.6	Very low	99 Å²	99	141.5 Å²	141.5	82%	0.818	80%	0.797	S	S	*	*			cis	-147.5	-151.5	0.8	0	0	0	0	0	109.2
659	A	28.2	Very low	32.6	Very low	91 Å²	91	140.5 Å²	140.5	75%	0.752	80%	0.8	S	S	*	*			cis	-165.4	167.2	5.4	0	0	0	0	0	113.9
660	A	28.3	Very low	34.1	Very low	85 Å²	85	134 Å²	134	70%	0.702	79%	0.788	S	S	*	*			trans	64.2	109.3	136.3	0	0	0	0	0	125.5
661	T	32.7	Very low	34	Very low	134 Å²	134	131.3 Å²	131.3	82%	0.822	78%	0.784	S	S	*	*				28.9	146.5	109.9	52.4	0	0	0	0	121.5
662	P	42.8	Very low	33.5	Very low	129 Å²	129	129.5 Å²	129.5	84%	0.838	78%	0.779	S	S	*	*				-153	178.4	65.7	43.1	-22.8	0	0	0	120
663	E	29.1	Very low	33.2	Very low	170 Å²	170	133.4 Å²	133.4	79%	0.794	78%	0.781	S	S	*	*			trans	-91	-176.1	168.7	-55.6	177.7	129.3	0	0	112.9
664	P	47.1	Very low	33	Very low	122 Å²	122	133.5 Å²	133.5	79%	0.792	78%	0.78	S	S	*	*			trans	-129.3	157.4	135.4	37.8	-28.6	0	0	0	115.3
665	N	29.7	Very low	32.6	Very low	142 Å²	142	131.8 Å²	131.8	76%	0.759	78%	0.775	S	S	*	*			trans	-78.3	-177.4	-174.5	-55.9	-76.6	0	0	0	114.6
666	I	31	Very low	31.8	Very low	142 Å²	142	132.7 Å²	132.7	73%	0.728	77%	0.774	S	S	*	*				-169.7	133.3	83.2	-91	170.3	0	0	0	112.5
667	E	30.4	Very low	31.9	Very low	179 Å²	179	127.3 Å²	127.3	84%	0.836	76%	0.764	S	S	*	*			trans	53.2	151.7	147.9	-70.2	166.1	-158.6	0	0	122.3
668	A	27.2	Very low	31.8	Very low	95 Å²	95	128.9 Å²	128.9	79%	0.785	76%	0.76	S	S	*	*			cis	-159.9	-179.3	-6.7	0	0	0	0	0	112.6
669	L	27.9	Very low	31.8	Very low	167 Å²	167	133.8 Å²	133.8	87%	0.874	76%	0.757	S	S	*	*			trans	-108.6	175.7	176	-93.3	157.2	0	0	0	110.4
670	P	56.3	Low	31.9	Very low	96 Å²	96	134.2 Å²	134.2	62%	0.623	75%	0.747	S	S	*	*			cis	-138.6	-165.4	-8.1	35.2	-12.4	0	0	0	115.7
671	N	27.2	Very low	32	Very low	152 Å²	152	136.7 Å²	136.7	81%	0.813	75%	0.748	S	S	*	*			trans	98.7	132.4	144.7	-73.8	-6.2	0	0	0	124.2
672	A	28.3	Very low	31.9	Very low	82 Å²	82	134.9 Å²	134.9	68%	0.678	74%	0.741	S	S	*	*			trans	80.8	116.1	134.2	0	0	0	0	0	124.8
673	E	25.9	Very low	31.2	Very low	176 Å²	176	135.2 Å²	135.2	82%	0.822	74%	0.741	S	S	*	*				72.2	151.8	125.6	-64.9	-168.3	138.7	0	0	125.4
674	T	28.3	Very low	31.2	Very low	122 Å²	122	131 Å²	131	75%	0.748	74%	0.735	S	S	*	*			trans	63.4	120.4	159.9	45.2	0	0	0	0	118.8
675	Q	29.8	Very low	30.2	Very low	167 Å²	167	132.1 Å²	132.1	78%	0.78	73%	0.734	S	S	*	*				92.8	121.5	61.6	-85.5	-161	18.5	0	0	115.6
676	N	26.8	Very low	30	Very low	122 Å²	122	133.9 Å²	133.9	65%	0.652	74%	0.738	S	S	*	*			trans	54.3	107.2	137.2	-69.9	-18	0	0	0	123.5
677	T	30.2	Very low	29.9	Very low	109 Å²	109	135.2 Å²	135.2	67%	0.669	74%	0.741	S	S	*	*				72.7	159.2	123.4	68.5	0	0	0	0	121.9
678	N	29.8	Very low	30.1	Very low	125 Å²	125	133 Å²	133	67%	0.668	74%	0.742	S	S	*	*			trans	69.6	151.5	157.3	-65	-50.1	0	0	0	115.5
679	R	31.1	Very low	29.8	Very low	202 Å²	202	133.8 Å²	133.8	76%	0.762	74%	0.74	S	S	*	*			cis	179.2	175.9	-4.2	-105.4	176.5	152.1	163.5	-4.4	103.5
680	N	30.9	Very low	30	Very low	101 Å²	101	130.3 Å²	130.3	54%	0.54	74%	0.736	S	S	.	*			cis	-163.7	153.1	0.7	-122.5	-5.5	0	0	0	107
681	N	29.2	Very low	29.6	Very low	136 Å²	136	131.1 Å²	131.1	73%	0.727	74%	0.741	S	S	*	*			trans	55.1	157.6	140.1	-56.1	-7.2	0	0	0	119.8
682	S	30.8	Very low	29.7	Very low	96 Å²	96	129.5 Å²	129.5	67%	0.671	74%	0.736	S	S	*	*			cis	-157.5	153.6	32.1	-46.4	0	0	0	0	113.5
683	T	29.2	Very low	29.6	Very low	137 Å²	137	133.8 Å²	133.8	84%	0.84	74%	0.74	S	S	*	*			trans	43.5	143.7	137.4	56.4	0	0	0	0	121.9
684	A	27.5	Very low	29.7	Very low	81 Å²	81	133.3 Å²	133.3	67%	0.669	74%	0.737	S	S	*	*			cis	-174.7	-170.1	-7.8	0	0	0	0	0	109.3
685	L	27.5	Very low	29.7	Very low	145 Å²	145	132.2 Å²	132.2	76%	0.759	73%	0.734	S	S	*	*			trans	80.2	104.3	159.7	-67	142.6	0	0	0	119.9
686	E	24.7	Very low	30.7	Very low	180 Å²	180	130.5 Å²	130.5	84%	0.841	74%	0.738	S	S	*	*				68.2	153.9	121.8	-67.5	-177.2	167.1	0	0	123.9
687	Q	28.5	Very low	31	Very low	170 Å²	170	132.3 Å²	132.3	79%	0.794	75%	0.747	S	S	*	*			trans	-92.4	165.7	174.5	-54.9	169.5	-77.4	0	0	110.3
688	P	34.5	Very low	32.2	Very low	132 Å²	132	131.9 Å²	131.9	86%	0.857	75%	0.746	S	S	*	*				-145.7	-171.6	107.4	35.6	-18.5	0	0	0	114.4
689	C	22.2	Very low	32.1	Very low	111 Å²	111	134.7 Å²	134.7	75%	0.75	75%	0.752	S	S	*	*			trans	-130.4	161.6	-168.7	-65.2	0	0	0	0	114.8
690	A	31	Very low	32.2	Very low	95 Å²	95	129.8 Å²	129.8	79%	0.785	75%	0.749	S	S	*	*			trans	71.1	175.9	157.9	0	0	0	0	0	117
691	P	48.5	Very low	32.4	Very low	113 Å²	113	129.8 Å²	129.8	73%	0.734	76%	0.757	S	S	*	*			cis	-140.5	145.6	0.3	35.7	-14.3	0	0	0	120
692	V	28.5	Very low	32.6	Very low	117 Å²	117	129.5 Å²	129.5	71%	0.709	76%	0.76	S	S	*	*			trans	66	153.9	131	-169.9	0	0	0	0	123.1
693	F	27.3	Very low	32.8	Very low	172 Å²	172	132.5 Å²	132.5	75%	0.754	76%	0.761	S	S	*	*			trans	84.8	147.8	170.3	-64.9	-60.5	0	0	0	118.6
694	H	28	Very low	32.8	Very low	167 Å²	167	131.5 Å²	131.5	77%	0.773	75%	0.751	S	S	*	*			cis	-147.2	-176.5	1.3	-122.2	-53.1	0	0	0	111.9
695	S	28.3	Very low	32.9	Very low	98 Å²	98	133.6 Å²	133.6	69%	0.685	76%	0.755	S	S	*	*			trans	-118.6	179.5	-175.5	58.8	0	0	0	0	113.8
696	P	49.6	Very low	33.9	Very low	132 Å²	132	131.5 Å²	131.5	86%	0.857	75%	0.75	S	S	*	*				-150.3	-164.1	96.8	40.8	-21.2	0	0	0	117.1
697	L	33.3	Very low	34.1	Very low	160 Å²	160	130.5 Å²	130.5	84%	0.838	75%	0.749	S	S	*	*			trans	-113.3	-174.4	-160.1	-105.7	168.8	0	0	0	112.3
698	P	54.8	Low	34.2	Very low	100 Å²	100	128.9 Å²	128.9	65%	0.649	75%	0.745	S	S	*	*			cis	-148.5	-169	40.3	48	-26.3	0	0	0	116.8
699	F	28.2	Very low	33.9	Very low	183 Å²	183	132.5 Å²	132.5	80%	0.803	74%	0.742	S	S	*	*			cis	-152.1	141.1	7.8	-129	-57.6	0	0	0	112
700	S	33.9	Very low	34.1	Very low	99 Å²	99	138.2 Å²	138.2	69%	0.692	75%	0.748	S	S	*	*			trans	43.3	147.6	151	53.2	0	0	0	0	124.8
701	S	34.6	Very low	33.8	Very low	101 Å²	101	138.1 Å²	138.1	71%	0.706	75%	0.747	S	S	*	*			cis	-177.7	167.5	-17.7	59.7	0	0	0	0	112.6
702	V	33.7	Very low	33.1	Very low	131 Å²	131	141.7 Å²	141.7	79%	0.794	75%	0.753	S	S	*	*			trans	72.3	131.9	153.8	164.8	0	0	0	0	118.9
703	K	35.8	Very low	33.8	Very low	159 Å²	159	142.3 Å²	142.3	69%	0.691	76%	0.759	S	S	*	*			cis	-171.7	169.2	-20.1	-137.9	171.8	156.4	-87.1	0	113.4
704	D	28.3	Very low	33.9	Very low	116 Å²	116	145.2 Å²	145.2	62%	0.62	77%	0.765	S	S	*	*			trans	75.7	168.2	154.2	-60.6	-33.2	0	0	0	121
705	T	29.5	Very low	35.3	Very low	124 Å²	124	142.9 Å²	142.9	76%	0.761	77%	0.765	S	S	*	*			trans	-159.1	-158.5	-137.8	57.8	0	0	0	0	112.3
706	P	49.3	Very low	35.3	Very low	102 Å²	102	144.4 Å²	144.4	66%	0.662	78%	0.776	S	S	*	*				-126.5	-173	-55.6	27	-5.8	0	0	0	113.1
707	I	29.1	Very low	34.3	Very low	158 Å²	158	143.3 Å²	143.3	81%	0.81	77%	0.771	S	S	*	*				164.3	159.4	125.5	-83.3	164.3	0	0	0	113.2
708	L	29	Very low	34.1	Very low	136 Å²	136	145.4 Å²	145.4	71%	0.712	77%	0.774	S	S	*	*			trans	-95	-171.8	-171.8	-53.8	75.5	0	0	0	112.1
709	R	28.2	Very low	32.9	Very low	209 Å²	209	151 Å²	151	79%	0.789	78%	0.783	S	S	*	*			cis	-171.2	139.2	22	-144.1	168.7	-163.1	-177.3	5.6	114.1
710	R	27.9	Very low	32.9	Very low	231 Å²	231	149.5 Å²	149.5	87%	0.872	78%	0.783	S	S	*	*			trans	39	127.3	139.3	179	-169.9	-84	-174.6	-8.3	122.4
711	A	25.2	Very low	32.6	Very low	93 Å²	93	151 Å²	151	77%	0.769	79%	0.788	S	S	*	*			trans	-170.3	162.1	133.3	0	0	0	0	0	115.5
712	H	33.2	Very low	32.4	Very low	188 Å²	188	153.2 Å²	153.2	87%	0.87	79%	0.791	S	S	*	*			trans	-132.9	170.6	169.8	-89.9	-22.4	0	0	0	107.7
713	P	42	Very low	32.4	Very low	129 Å²	129	153.3 Å²	153.3	84%	0.838	79%	0.794	S	S	*	*			cis	-143.6	-151.9	26.7	43.1	-19.9	0	0	0	116.6
714	R	30.3	Very low	32.3	Very low	234 Å²	234	151.5 Å²	151.5	88%	0.883	80%	0.797	S	S	*	*			trans	-87.7	-172.1	-178.2	-69.2	178.8	173.7	176.7	-3	113.9
715	P	58.3	Low	32.3	Very low	118 Å²	118	155.5 Å²	155.5	77%	0.766	81%	0.812	S	S	*	*			cis	-133.8	-178.3	-47	36.6	-19	0	0	0	114.2
716	S	26.9	Very low	32.3	Very low	130 Å²	130	152.6 Å²	152.6	91%	0.909	81%	0.806	S	S	*	*			trans	-178.1	-177	149.6	44.4	0	0	0	0	113.1
717	S	29.1	Very low	31.2	Very low	109 Å²	109	155 Å²	155	76%	0.762	82%	0.818	S	S	*	*			trans	-143	162.9	-170.9	65.5	0	0	0	0	114.7
718	K	29.2	Very low	31.4	Very low	204 Å²	204	159 Å²	159	89%	0.887	82%	0.823	S	S	*	*			trans	179.9	170.8	143.1	-102.5	166.4	-173.8	-177.8	0	114.7
719	Y	28.9	Very low	31.2	Very low	216 Å²	216	157.5 Å²	157.5	85%	0.847	83%	0.83	S	S	*	*			trans	-88.2	164.3	-178.3	-61.1	-109.5	0	0	0	113.3
720	L	27.8	Very low	31.3	Very low	153 Å²	153	157 Å²	157	80%	0.801	83%	0.834	S	S	*	*				176.9	130.6	114.5	-116	88.4	0	0	0	116.6
721	T	27.8	Very low	31.1	Very low	130 Å²	130	157.5 Å²	157.5	80%	0.798	84%	0.836	S	S	*	*			trans	61.7	158.3	138.3	52.2	0	0	0	0	126.5
722	L	30.3	Very low	31.1	Very low	148 Å²	148	163.7 Å²	163.7	78%	0.775	84%	0.839	S	S	*	*			trans	-75.8	-178.3	179.3	-64.2	156	0	0	0	114.4
723	P	34.9	Very low	30.8	Very low	132 Å²	132	164.6 Å²	164.6	86%	0.857	84%	0.837	S	S	*	*				-133.5	170.7	100	39.8	-32.7	0	0	0	115.4
724	V	33.3	Very low	30	Very low	122 Å²	122	162.5 Å²	162.5	74%	0.739	83%	0.825	S	S	*	*			trans	-139.5	125.6	177.4	170.6	0	0	0	0	110.1
725	E	27.7	Very low	29.8	Very low	200 Å²	200	159.2 Å²	159.2	94%	0.935	82%	0.824	S	S	*	*			trans	-177.3	151.3	159.3	-108.3	171.2	-164.7	0	0	108.1
726	G	29.1	Very low	28.3	Very low	62 Å²	62	160 Å²	160	64%	0.639	82%	0.822	S	S	*	*			cis	174.1	163.8	-8.4	0	0	0	0	0	113.2
727	V	27.3	Very low	28.1	Very low	153 Å²	153	162.7 Å²	162.7	93%	0.927	82%	0.82	S	S	*	*			trans	78	133.8	159.9	-169.3	0	0	0	0	120.5
728	R	32.3	Very low	28	Very low	241 Å²	241	164.8 Å²	164.8	91%	0.909	82%	0.823	S	S	*	*			trans	-69.7	159.1	-179.8	-58.4	158.8	168.3	158.3	-5	114.9
729	A	26.1	Very low	27.9	Very low	105 Å²	105	159.5 Å²	159.5	87%	0.868	81%	0.812	S	S	*	*			trans	-132.7	147.1	146.1	0	0	0	0	0	111.8
730	K	29.5	Very low	27.7	Very low	199 Å²	199	154.6 Å²	154.6	87%	0.865	81%	0.809	S	S	*	*			trans	-144.9	121.7	178.6	-110.6	-170.2	179.4	-177.8	0	110.3
731	R	24.7	Very low	27.5	Very low	241 Å²	241	155.8 Å²	155.8	91%	0.909	81%	0.808	S	S	*	*			trans	172.2	130.4	151.5	-91.9	150.7	-164.6	-146.5	5.9	106.5
732	R	25.2	Very low	27.4	Very low	223 Å²	223	157.4 Å²	157.4	84%	0.842	81%	0.806	S	S	*	*			cis	88	144.5	41	-88.4	-158.5	173.2	-168.4	-0.4	115.2
733	Y	26.3	Very low	27.1	Very low	207 Å²	207	158.7 Å²	158.7	81%	0.812	81%	0.807	S	S	*	*			trans	84.7	149.6	175.9	-58.1	-77.6	0	0	0	117
734	S	24.6	Very low	26.5	Very low	85 Å²	85	158.1 Å²	158.1	59%	0.594	81%	0.806	S	S	*	*			cis	-179.5	153.4	-30.3	-160.9	0	0	0	0	110.5
735	L	26.1	Very low	26	Very low	166 Å²	166	161.8 Å²	161.8	87%	0.869	81%	0.807	S	S	*	*			trans	150.1	116.5	151.7	-82.7	153.4	0	0	0	106.7
736	N	26.6	Very low	25.9	Very low	133 Å²	133	157.8 Å²	157.8	71%	0.711	80%	0.797	S	S	*	*			cis	83.9	102.4	45.1	-79.4	37.2	0	0	0	115.3
737	E	24.1	Very low	25.6	Very low	188 Å²	188	158.6 Å²	158.6	88%	0.879	81%	0.805	S	S	*	*				-164.6	123	125.7	-97.3	175	148.5	0	0	104.9
738	D	27	Very low	25.5	Very low	152 Å²	152	157.5 Å²	157.5	81%	0.813	80%	0.798	S	S	*	*				62.4	131.6	73.6	-85	-35.8	0	0	0	114.7
739	S	25.7	Very low	25.2	Very low	94 Å²	94	153 Å²	153	66%	0.657	80%	0.798	S	S	*	*			cis	-160.7	162.9	-3.9	65.5	0	0	0	0	114.7
740	S	25	Very low	25.1	Very low	113 Å²	113	156.3 Å²	156.3	79%	0.79	80%	0.796	S	S	*	*			trans	94.7	157.5	140.1	82.2	0	0	0	0	121.2
741	K	24.8	Very low	24.8	Very low	177 Å²	177	156.8 Å²	156.8	77%	0.77	80%	0.798	S	S	*	*				-166.4	155.3	-52.1	-145.6	174.8	-173.4	177.1	0	109.8
742	H	24.8	Very low	24.8	Very low	165 Å²	165	148.7 Å²	148.7	76%	0.764	79%	0.789	S	S	*	*			trans	77.8	135.3	179.7	-44.4	92	0	0	0	115.5
743	H	23.7	Very low	24.8	Very low	174 Å²	174	145.4 Å²	145.4	81%	0.806	79%	0.788	S	S	*	*			cis	106.5	132.7	16.6	-86.3	34.1	0	0	0	116.4
744	C	21.9	Very low	24.8	Very low	121 Å²	121	144.7 Å²	144.7	82%	0.818	80%	0.795	S	S	*	*			trans	116.6	144.1	160.9	-70.3	0	0	0	0	115.8
745	Y	23.2	Very low	24.9	Very low	198 Å²	198	150.8 Å²	150.8	78%	0.776	81%	0.805	S	S	*	*			cis	-166.6	137.6	-37.6	-144	-98.5	0	0	0	108
746	V	25.3	Very low	24.9	Very low	117 Å²	117	148.6 Å²	148.6	71%	0.709	80%	0.804	S	S	*	*			trans	30.2	131	161.9	177.8	0	0	0	0	121.1
747	G	24.1	Very low	25	Very low	79 Å²	79	149.7 Å²	149.7	81%	0.814	80%	0.802	S	S	*	*			trans	-155.2	72.2	163.5	0	0	0	0	0	113.6
748	T	24.4	Very low	25.2	Very low	129 Å²	129	152 Å²	152	79%	0.791	80%	0.803	S	S	*	*			trans	-100.1	125.8	178	49.5	0	0	0	0	112.5
749	T	25.1	Very low	25.3	Very low	147 Å²	147	149.6 Å²	149.6	90%	0.902	80%	0.798	S	S	*	*			trans	-130.5	138.2	166.3	46.9	0	0	0	0	110.9
750	Q	24.8	Very low	25.4	Very low	175 Å²	175	153.1 Å²	153.1	82%	0.818	81%	0.806	S	S	*	*			trans	-99.7	-175.9	-174.6	-111	179.5	-19.5	0	0	112.6
751	F	23.6	Very low	25.5	Very low	209 Å²	209	153.1 Å²	153.1	92%	0.917	81%	0.806	S	S	*	*			trans	81.9	141.9	179	-57.1	-81.9	0	0	0	115.6
752	G	25.4	Very low	25.6	Very low	70 Å²	70	153.5 Å²	153.5	72%	0.722	81%	0.813	S	S	*	*			cis	-131.2	151.3	3.8	0	0	0	0	0	113.8
753	N	24.9	Very low	25.8	Very low	154 Å²	154	153.4 Å²	153.4	82%	0.824	82%	0.818	S	S	*	*			trans	-80.9	136	177	-66.5	-40.7	0	0	0	111.6
754	M	26.3	Very low	25.9	Very low	193 Å²	193	149 Å²	149	95%	0.951	82%	0.819	S	S	*	*			trans	-107.5	117.9	152.6	-80.4	-178.4	63.5	0	0	109
755	W	25.9	Very low	26.1	Very low	212 Å²	212	151 Å²	151	80%	0.803	82%	0.82	S	S	*	*			trans	-82.4	131.3	174.2	-80	-9.8	0	0	0	111.1
756	S	26.2	Very low	26.2	Very low	121 Å²	121	147.9 Å²	147.9	85%	0.846	82%	0.821	S	S	*	*			trans	-115	123.4	156.3	-172.9	0	0	0	0	109.5
757	K	28.9	Very low	26.3	Very low	156 Å²	156	150.5 Å²	150.5	68%	0.678	83%	0.83	S	S	*	*			trans	-107.9	146.6	165.8	-69.9	172.7	-179	170.7	0	105.6
758	R	27.4	Very low	26.3	Very low	235 Å²	235	154.6 Å²	154.6	89%	0.887	83%	0.828	S	S	*	*			cis	-156.4	159.5	18.3	-141.1	177.6	-165	176	2.1	109.8
759	S	28.8	Very low	26.3	Very low	102 Å²	102	157.4 Å²	157.4	71%	0.713	83%	0.832	S	S	*	*			trans	-101.3	-162.9	160.3	60.3	0	0	0	0	110.3
760	M	29.3	Very low	26.4	Very low	169 Å²	169	157.9 Å²	157.9	83%	0.833	83%	0.825	S	S	*	*			trans	87.3	109.7	-169.3	-51	-92.6	-74.7	0	0	111
761	S	26.9	Very low	26.5	Very low	112 Å²	112	156.2 Å²	156.2	78%	0.783	82%	0.821	S	S	*	*			cis	60.5	121.9	26.5	-161.6	0	0	0	0	113.6
762	M	26.4	Very low	26.8	Very low	185 Å²	185	153 Å²	153	91%	0.911	81%	0.812	S	S	*	*			trans	-131.8	101.9	-166.9	-174.9	171.8	-179.4	0	0	110.3
763	N	29.3	Very low	26.9	Very low	164 Å²	164	156.9 Å²	156.9	88%	0.877	82%	0.816	S	S	*	*			trans	-129.5	124.2	165	-96.5	-21.3	0	0	0	107.4
764	G	26.5	Very low	27.1	Very low	80 Å²	80	154.3 Å²	154.3	83%	0.825	81%	0.811	S	S	*	*			trans	-90.8	125.4	-174.5	0	0	0	0	0	112.8
765	I	26.1	Very low	27.3	Very low	163 Å²	163	151.9 Å²	151.9	84%	0.836	81%	0.806	S	S	*	*			trans	-129.3	131.6	158.4	-66.1	-179.1	0	0	0	107.1
766	V	25.1	Very low	27.5	Very low	133 Å²	133	151.8 Å²	151.8	81%	0.806	81%	0.811	S	S	*	*			trans	-85.5	126.9	-179.2	176.7	0	0	0	0	109.8
767	L	26	Very low	27.6	Very low	172 Å²	172	149.8 Å²	149.8	90%	0.901	80%	0.802	S	S	*	*			trans	-135.7	152.5	156.2	-80.6	179.5	0	0	0	109.7
768	Q	25.8	Very low	27.6	Very low	165 Å²	165	149.3 Å²	149.3	77%	0.771	81%	0.813	S	S	*	*			trans	-120.3	128	-163.8	177.7	-179.2	-0.9	0	0	109.5
769	Q	24.2	Very low	27.5	Very low	188 Å²	188	147.4 Å²	147.4	88%	0.879	81%	0.811	S	S	*	*			trans	-150.4	142.1	171.2	-160.2	72.6	57.1	0	0	108.3
770	E	26.5	Very low	27.4	Very low	158 Å²	158	147.9 Å²	147.9	74%	0.738	81%	0.814	S	S	*	*			trans	-98.8	162.9	-167.8	-66.9	173.4	129.3	0	0	114.4
771	D	27.6	Very low	27.7	Very low	140 Å²	140	145.4 Å²	145.4	75%	0.749	81%	0.814	S	S	*	*			trans	81.3	132.3	148.9	-92.1	-4.7	0	0	0	124
772	I	28.9	Very low	28.1	Very low	140 Å²	140	144.6 Å²	144.6	72%	0.718	81%	0.808	S	S	*	*			trans	63.8	123	147.9	-58.2	162.3	0	0	0	115.8
773	D	28.2	Very low	28.7	Very low	152 Å²	152	144.2 Å²	144.2	81%	0.813	80%	0.804	S	S	*	*			cis	-149.5	177.3	37.6	-147.3	-27.3	0	0	0	113.7
774	S	29.5	Very low	28.9	Very low	101 Å²	101	148 Å²	148	71%	0.706	81%	0.806	S	S	*	*			trans	-100.3	130.5	-172.2	74.1	0	0	0	0	115.3
775	V	29.9	Very low	29.8	Very low	141 Å²	141	149.3 Å²	149.3	86%	0.855	79%	0.793	S	S	*	*			trans	-139.5	122.4	159.7	-178.4	0	0	0	0	109.6
776	K	30.5	Very low	30.5	Very low	211 Å²	211	147.7 Å²	147.7	92%	0.917	79%	0.785	S	S	*	*			trans	-78.3	121	168.8	-84.4	-179.8	174.2	174.8	0	110.2
777	A	27.8	Very low	31.2	Very low	79 Å²	79	146.4 Å²	146.4	65%	0.653	77%	0.771	S	S	*	*			trans	-119.2	116.4	160.7	0	0	0	0	0	109.1	F779	A777-F779 PolarHBondContact O-N 3.23Å
778	T	28.7	Very low	31.8	Very low	146 Å²	146	140.4 Å²	140.4	90%	0.896	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-75.1	116.3	175.1	30.5	0	0	0	0	110.5
779	F	25.9	Very low	32.4	Very low	194 Å²	194	137.6 Å²	137.6	85%	0.851	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-71	131.5	173.9	-78	-97.4	0	0	0	111.3	A777	A777-F779 PolarHBondContact O-N 3.23Å
780	S	26.5	Very low	33	Very low	112 Å²	112	136 Å²	136	78%	0.783	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-83.6	135	162.3	-171.8	0	0	0	0	109.3
781	S	36.4	Very low	33.4	Very low	118 Å²	118	134.9 Å²	134.9	83%	0.825	74%	0.74	S	S	*	*			trans	-108.8	87.1	-169.3	61.8	0	0	0	0	113.3
782	S	34.3	Very low	33.7	Very low	94 Å²	94	134.6 Å²	134.6	66%	0.657	74%	0.74	S	S	*	*			trans	-158.9	155.2	160.9	46.3	0	0	0	0	111.3
783	E	39	Very low	33.9	Very low	178 Å²	178	134.3 Å²	134.3	83%	0.832	74%	0.741	S	S	*	*			trans	64.2	70.8	173.8	-54.6	-164.5	149.2	0	0	117
784	W	33.5	Very low	34.3	Very low	243 Å²	243	133.3 Å²	133.3	92%	0.92	74%	0.737	S	S	*	*			trans	-105.5	119.5	146	-68.3	94.1	0	0	0	108.7
785	I	44.6	Very low	34.6	Very low	107 Å²	107	135.3 Å²	135.3	55%	0.549	74%	0.739	S	S	.	*			trans	-112.3	125	168.7	-61.6	177.4	0	0	0	107.1
786	L	42.6	Very low	34.9	Very low	129 Å²	129	134.9 Å²	134.9	68%	0.675	73%	0.731	S	S	*	*			trans	-106	115.8	173.8	-105.9	157.9	0	0	0	108.3
787	E	38.3	Very low	35.2	Very low	106 Å²	106	129.5 Å²	129.5	50%	0.495	72%	0.718	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.2	131.2	174.3	179.1	155.5	-123.3	0	0	108.6	R463	R463-E787 IonicContact CZ-OE1 3.61Å; R463-E787 IonicContact NE-OE1 3.53Å; R463-E787 PolarHBondContact NE-OE1 3.19Å; R463-E787 IonicContact NH2-OE1 3.98Å; R463-E787 PolarHBondContact NH2-OE1 2.93Å; R463-E787 IonicContact NH2-OE2 3.63Å
788	S	39.9	Very low	35.8	Very low	47 Å²	47	133.4 Å²	133.4	33%	0.329	72%	0.723	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-150.2	128.4	-177.1	-176.5	0	0	0	0	109.3	Y462	Y462-S788 WeakPolarHBondContact OH-CB 3.47Å; Y462-S788 PolarHBondContact OH-OG 3.25Å
789	T	38	Very low	36.4	Very low	106 Å²	106	132.3 Å²	132.3	65%	0.65	71%	0.708	S	S	*	*			trans	-102.1	135.1	174.9	54	0	0	0	0	109.4
790	V	37.2	Very low	37.3	Very low	154 Å²	154	126.7 Å²	126.7	93%	0.933	70%	0.695	S	S	*	*			trans	-118.8	0	177	174.8	0	0	0	0	109.3	Y462	Y462-V790 HydrophobicContact CE1-CG2 3.89Å

Retrieved 790 of 790 residues in 2094 ms (Link to these results)

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