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Methylosome protein WDR77

Non-catalytic component of the methylosome complex, composed of PRMT5, WDR77 and CLNS1A, which modifies specific arginines to dimethylarginines in several spliceosomal Sm proteins and histones. This modification targets Sm proteins to the survival of motor neurons (SMN) complex for assembly into small nuclear ribonucleoprotein core particles. Might play a role in transcription regulation. The methylosome complex also methylates the Piwi proteins (PIWIL1, PIWIL2 and PIWIL4), methylation of Piwi proteins being required for the interaction with Tudor domain-containing proteins and subsequent localization to the meiotic nuage.

AlphaFold DB , UniProt , Accession A0A2K5ZIT5, Species MANLE (Mandrillus leucophaeus, Drill), Gene WDR77, Length 342 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.2	Very low	45.5	Very low	244 Å²	244	159.3 Å²	159.3	100%	1.202	84%	0.84	S	S	*	*				0	101.7	0	-70.4	177	-172.3	0	0	108
2	R	37.9	Very low	45.6	Very low	242 Å²	242	156.3 Å²	156.3	91%	0.913	84%	0.837	S	S	*	*			trans	-77.2	123	172.1	-78.5	-179.8	174.6	176.1	-2.2	107	E4	R2-E4 PolarHBondContact O-N 3.34Å
3	K	43.1	Very low	45.8	Very low	207 Å²	207	151.2 Å²	151.2	90%	0.9	83%	0.829	S	S	*	*			trans	-70.5	109.7	169	-81.9	-178.4	173.6	-178.7	0	107	T5	K3-T5 PolarHBondContact O-N 3.48Å
4	E	42.3	Very low	46.2	Very low	186 Å²	186	147 Å²	147	87%	0.869	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-72.3	117.9	166.7	-71	-174.3	165	0	0	108.1	R2	R2-E4 PolarHBondContact O-N 3.34Å
5	T	52.9	Low	46.9	Very low	129 Å²	129	147.1 Å²	147.1	79%	0.791	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-68.3	132.9	165.5	33.7	0	0	0	0	108.7	K3	K3-T5 PolarHBondContact O-N 3.48Å
6	P	47	Very low	47.7	Very low	112 Å²	112	148.8 Å²	148.8	73%	0.727	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-62.7	146	174.7	26.7	-31.9	0	0	0	109.6
7	P	48.1	Very low	48.8	Very low	114 Å²	114	148.8 Å²	148.8	74%	0.74	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-61.8	148.4	177.4	27.1	-32.7	0	0	0	109.7	L9	P7-L9 PolarHBondContact O-N 2.84Å
8	P	44.6	Very low	50.3	Low	118 Å²	118	147.3 Å²	147.3	77%	0.766	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-60.8	133.8	176.2	25.8	-31.6	0	0	0	109.1	V10	P8-V10 PolarHBondContact O-N 2.61Å
9	L	49.3	Very low	51.8	Low	171 Å²	171	142.5 Å²	142.5	90%	0.895	76%	0.76	S	S	*	*			trans	-57.6	109.6	168.5	-75.9	157.8	0	0	0	107.5	P7 P11	P7-L9 PolarHBondContact O-N 2.84Å; L9-P11 WeakPolarHBondContact O-CD 3.39Å
10	V	45.8	Very low	53.2	Low	131 Å²	131	136.2 Å²	136.2	79%	0.794	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-61.8	117.1	167.7	-178.3	0	0	0	0	105.6	P8	P8-V10 PolarHBondContact O-N 2.61Å
11	P	44.8	Very low	54.2	Low	98 Å²	98	134 Å²	134	64%	0.636	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-57.9	144.5	173.8	24	-30.6	0	0	0	108.2	L9 A13	L9-P11 WeakPolarHBondContact O-CD 3.39Å; P11-A13 PolarHBondContact O-N 3.03Å
12	P	46.8	Very low	55.8	Low	124 Å²	124	128.7 Å²	128.7	81%	0.805	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-51	125.1	174.4	22.6	-31.4	0	0	0	107.1	A14	P12-A14 PolarHBondContact O-N 3.06Å
13	A	48.8	Very low	58.3	Low	89 Å²	89	118 Å²	118	74%	0.736	66%	0.66	S	S	*	*			trans	-45.1	121.7	-175.4	0	0	0	0	0	108.2	P11 R15	P11-A13 PolarHBondContact O-N 3.03Å; A13-R15 PolarHBondContact O-N 3.15Å
14	A	50.9	Low	60.6	Low	93 Å²	93	109 Å²	109	77%	0.769	62%	0.622	S	S	*	*			trans	-55.2	106.9	173.7	0	0	0	0	0	105.8	P12 E16	P12-A14 PolarHBondContact O-N 3.06Å; A14-E16 PolarHBondContact O-N 3.47Å
15	R	56.3	Low	62.8	Low	149 Å²	149	104 Å²	104	56%	0.562	61%	0.613	S	S	*	*			trans	-63.2	112.2	-179.9	-74.2	-176.7	174.9	172.3	-0	106.1	A13 W17 D63 F72	A13-R15 PolarHBondContact O-N 3.15Å; R15-W17 PolarHBondContact O-N 3.28Å; R15-D63 IonicContact CZ-OD2 3.06Å; R15-D63 IonicContact NH1-OD2 2.62Å; R15-D63 PolarHBondContact NH1-OD2 3.37Å; R15-D63 IonicContact NH2-OD2 3.96Å; R15-D63 PolarHBondContact NH2-OD2 2.77Å; R15-F72 HydrophobicContact CB-CD1 4.01Å; R15-F72 HydrophobicContact CB-CE1 3.5Å; R15-F72 HydrophobicContact CB-CZ 4.35Å
16	E	60.2	Low	64.6	Low	174 Å²	174	101.9 Å²	101.9	81%	0.813	60%	0.603	S	S	*	*			trans	-64	130	175.8	-70.1	-176.3	161.6	0	0	107.9	A14 N18	A14-E16 PolarHBondContact O-N 3.47Å; E16-N18 PolarHBondContact O-N 3.19Å; E16-N18 VanDerWaalsContact O-N 3.12Å
17	W	66.5	Low	66.9	Low	148 Å²	148	96.8 Å²	96.8	56%	0.561	57%	0.569	S	S	*	*			trans	-58.4	115.8	171.9	-178.4	-68.8	0	0	0	108.1	R15 N69	R15-W17 PolarHBondContact O-N 3.28Å; W17-N69 WeakPolarHBondContact CH2-OD1 3.37Å; W17-N69 VanDerWaalsContact CZ3-OD1 3.3Å; W17-N69 WeakPolarHBondContact CZ3-OD1 3.42Å
18	N	76.6	Confident	69.2	Low	122 Å²	122	92.4 Å²	92.4	65%	0.652	54%	0.539	S	S	*	.			trans	-142.5	100	-177.6	-168.1	19.9	0	0	0	109.7	E16 P20 G71	E16-N18 PolarHBondContact O-N 3.19Å; E16-N18 VanDerWaalsContact O-N 3.12Å; N18-P20 WeakPolarHBondContact O-CD 3.27Å; N18-G71 PolarHBondContact N-O 3.29Å; N18-G71 VanDerWaalsContact N-O 3.1Å
19	L	77.6	Confident	71.6	Confident	57 Å²	57	93.1 Å²	93.1	30%	0.298	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-71.1	122.9	175.1	-76.9	163.4	0	0	0	108.9	E70	L19-E70 HydrophobicContact CD2-CB 3.82Å; L19-E70 WeakPolarHBondContact CD2-O 3.29Å
20	P	80.6	Confident	74	Confident	16 Å²	16	85.8 Å²	85.8	10%	0.104	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-64	156.2	177.5	19.8	-23.6	0	0	0	110.9	N18 N22 A23 C73	N18-P20 WeakPolarHBondContact O-CD 3.27Å; P20-N22 PolarHBondContact O-N 3.39Å; P20-A23 HydrophobicContact CG-CB 3.84Å; P20-A23 WeakPolarHBondContact O-CB 3.47Å; P20-A23 PolarHBondContact O-N 3.12Å; P20-A23 VanDerWaalsContact O-N 3.15Å; P20-C73 WeakPolarHBondContact CD-SG 3.33Å; P20-C73 WeakPolarHBondContact CG-SG 3.18Å
21	P	74.9	Confident	76.5	Confident	89 Å²	89	79.6 Å²	79.6	58%	0.578	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	137.1	-179.6	-19.9	30.9	0	0	0	111.1	A23 L114	P21-A23 PolarHBondContact O-N 2.88Å; P21-A23 VanDerWaalsContact O-N 3.14Å; P21-L114 HydrophobicContact CB-CD2 4.17Å; P21-L114 WeakPolarHBondContact O-CD2 3.38Å
22	N	77.8	Confident	79	Confident	134 Å²	134	75.8 Å²	75.8	72%	0.717	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	-0.3	-178.3	-54.6	-20.6	0	0	0	116.7	P20 L114	P20-N22 PolarHBondContact O-N 3.39Å; N22-L114 HydrophobicContact CB-CD2 4.36Å
23	A	89.1	Confident	81.5	Confident	17 Å²	17	69.9 Å²	69.9	14%	0.14	39%	0.385	C	S	.	.			trans	-66.4	137.9	168.6	0	0	0	0	0	110.3	P20 P21 W59 G76	P20-A23 HydrophobicContact CG-CB 3.84Å; P20-A23 WeakPolarHBondContact O-CB 3.47Å; P20-A23 PolarHBondContact O-N 3.12Å; P20-A23 VanDerWaalsContact O-N 3.15Å; P21-A23 PolarHBondContact O-N 2.88Å; P21-A23 VanDerWaalsContact O-N 3.14Å; A23-W59 HydrophobicContact CB-CZ3 4.19Å; A23-G76 WeakPolarHBondContact CA-O 3.3Å
24	P	90.9	Very high	83.8	Confident	17 Å²	17	65.7 Å²	65.7	11%	0.11	35%	0.35	C	S	.	.			trans	-57.3	155.3	172.1	-23.2	34.1	0	0	0	111.3	C26 W59 Q78	P24-C26 VanDerWaalsContact C-N 3.27Å; P24-C26 PolarHBondContact O-N 2.77Å; P24-W59 HydrophobicContact CB-CH2 3.95Å; P24-W59 HydrophobicContact CB-CZ2 3.88Å; P24-W59 HydrophobicContact CG-CH2 4.17Å; P24-W59 HydrophobicContact CG-CZ2 3.9Å; P24-W59 VanDerWaalsContact O-CH2 3.29Å; P24-W59 WeakPolarHBondContact O-CH2 2.96Å; P24-Q78 HydrophobicContact CG-CB 3.98Å
25	A	88.9	Confident	86.1	Confident	82 Å²	82	64 Å²	64	68%	0.678	32%	0.324	S	S	*	.	S	Bend	trans	-74.5	-19.3	178.2	0	0	0	0	0	113.4
26	C	90.5	Very high	88.1	Confident	85 Å²	85	58.1 Å²	58.1	57%	0.574	30%	0.302	S	S	*	.	S	Bend	trans	-148.9	136.3	-176.1	-173.6	0	0	0	0	108.2	P24 E70	P24-C26 VanDerWaalsContact C-N 3.27Å; P24-C26 PolarHBondContact O-N 2.77Å; C26-E70 WeakPolarHBondContact CA-OE1 3.5Å
27	M	95.1	Very high	89.9	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.025	27%	0.265	C	S	.	.			trans	-82.5	141	171.5	-179.6	-173.6	-63	0	0	109.6	L31 L44 A46 W59 F61 P68 E70	M27-L31 HydrophobicContact CG-CD2 4.26Å; M27-L31 HydrophobicContact SD-CD2 3.41Å; M27-L31 WeakPolarHBondContact SD-CD2 3.33Å; M27-L44 HydrophobicContact CE-CD1 4.3Å; M27-A46 HydrophobicContact CG-CB 3.71Å; M27-A46 HydrophobicContact SD-CB 4.33Å; M27-W59 HydrophobicContact CB-CH2 4.45Å; M27-W59 HydrophobicContact CB-CZ2 3.71Å; M27-W59 HydrophobicContact CE-CB 3.9Å; M27-W59 VanDerWaalsContact CE-CD1 3.5Å; M27-W59 HydrophobicContact CE-CD2 3.61Å; M27-W59 HydrophobicContact CE-CE3 4.29Å; M27-W59 HydrophobicContact CE-CG 3.39Å; M27-W59 HydrophobicContact CG-CZ2 4.32Å; M27-F61 HydrophobicContact CE-CE2 3.91Å; M27-F61 HydrophobicContact CE-CZ 4.04Å; M27-P68 HydrophobicContact CE-CB 4.09Å; M27-P68 WeakPolarHBondContact CE-O 3.38Å; M27-P68 HydrophobicContact SD-CB 3.78Å; M27-E70 HydrophobicContact CB-CG 3.89Å; M27-E70 PolarHBondContact N-OE1 2.96Å
28	E	96.5	Very high	91.3	Very high	22 Å²	22	46.7 Å²	46.7	10%	0.103	26%	0.263	C	S	.	.			trans	-63.5	152.8	174.8	-66.2	76.2	-169.3	0	0	112	A46 S47 S57 H320	E28-A46 HydrophobicContact CB-CB 4.28Å; E28-S47 VanDerWaalsContact CB-O 3.3Å; E28-S47 WeakPolarHBondContact CB-O 3.45Å; E28-S57 VanDerWaalsContact OE2-CB 3.22Å; E28-S57 WeakPolarHBondContact OE2-CB 3.35Å; E28-S57 PolarHBondContact OE2-OG 3.27Å; E28-H320 PolarHBondContact O-ND1 2.84Å
29	R	96.4	Very high	92.3	Very high	133 Å²	133	44.4 Å²	44.4	50%	0.502	25%	0.251	S	S	.	.	S	Bend	trans	-66.2	-45.3	-171.4	179	-178.6	170.4	89.5	3.2	112.5	L31 W318 H320	R29-L31 PolarHBondContact O-N 2.81Å; R29-W318 PolarHBondContact NE-O 2.89Å; R29-H320 HydrophobicContact CG-CB 4.17Å; R29-H320 WeakPolarHBondContact O-CB 3.36Å; R29-H320 PolarHBondContact O-ND1 3.47Å
30	Q	98.1	Very high	93.2	Very high	17 Å²	17	41.9 Å²	41.9	8%	0.079	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	103.7	-172.7	-68.4	77.3	35.5	0	0	109.8	A46 S47 L49 W318	Q30-A46 CarbonylContact O-C 3.52Å; Q30-A46 WeakPolarHBondContact O-CA 3.25Å; Q30-S47 WeakPolarHBondContact CB-O 3.35Å; Q30-S47 PolarHBondContact N-O 3.18Å; Q30-S47 PolarHBondContact O-N 3.18Å; Q30-S47 PolarHBondContact OE1-O 2.97Å; Q30-S47 VanDerWaalsContact OE1-O 3.13Å; Q30-L49 HydrophobicContact CB-CD1 4.03Å; Q30-L49 HydrophobicContact CB-CG 4.01Å; Q30-L49 HydrophobicContact CG-CB 4.13Å; Q30-L49 HydrophobicContact CG-CD1 3.95Å; Q30-L49 HydrophobicContact CG-CG 3.98Å; Q30-W318 HydrophobicContact CB-CG 4Å; Q30-W318 HydrophobicContact CG-CB 4.08Å; Q30-W318 HydrophobicContact CG-CD2 4.18Å; Q30-W318 HydrophobicContact CG-CG 3.8Å
31	L	98.5	Very high	94	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	121.6	173.7	-53.7	-178.9	0	0	0	108.8	M27 R29 A46 R301 V316 V322	M27-L31 HydrophobicContact CG-CD2 4.26Å; M27-L31 HydrophobicContact SD-CD2 3.41Å; M27-L31 WeakPolarHBondContact SD-CD2 3.33Å; R29-L31 PolarHBondContact O-N 2.81Å; L31-A46 HydrophobicContact CD2-CB 3.85Å; L31-R301 WeakPolarHBondContact O-CB 3.38Å; L31-R301 VanDerWaalsContact O-CG 3.23Å; L31-R301 WeakPolarHBondContact O-CG 3.38Å; L31-V316 HydrophobicContact CB-CB 3.87Å; L31-V316 HydrophobicContact CB-CG2 4.2Å; L31-V316 HydrophobicContact CD1-CB 4.06Å; L31-V316 HydrophobicContact CD1-CG1 4.16Å; L31-V322 HydrophobicContact CD1-CG2 3.81Å
32	E	98.3	Very high	95.2	Very high	18 Å²	18	37 Å²	37	8%	0.084	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-37.4	-172.3	-150.6	65.5	-151.4	0	0	112.5	G45 V83 A84 R301 W318	E32-G45 PolarHBondContact N-O 3.22Å; E32-V83 WeakPolarHBondContact CB-O 3.41Å; E32-V83 WeakPolarHBondContact CG-O 3.41Å; E32-A84 VanDerWaalsContact CG-O 3.31Å; E32-A84 WeakPolarHBondContact CG-O 3.33Å; E32-R301 WeakPolarHBondContact O-CB 3.26Å; E32-R301 IonicContact OE1-CZ 3.47Å; E32-R301 IonicContact OE1-NE 3.63Å; E32-R301 PolarHBondContact OE1-NE 2.98Å; E32-R301 IonicContact OE1-NH2 3.47Å; E32-R301 PolarHBondContact OE1-NH2 3.47Å; E32-R301 IonicContact OE2-NE 2.71Å; E32-W318 PolarHBondContact OE2-NE1 2.98Å
33	A	98.4	Very high	96.2	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	148.9	-174.2	0	0	0	0	0	112.5	L44 G45 L86	A33-L44 WeakPolarHBondContact O-CA 3.38Å; A33-G45 PolarHBondContact N-O 3.22Å; A33-G45 PolarHBondContact O-N 3.09Å; A33-L86 HydrophobicContact CB-CD1 3.67Å; A33-L86 HydrophobicContact CB-CD2 4.35Å; A33-L86 HydrophobicContact CB-CG 3.6Å
34	A	98.4	Very high	96.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	116.8	176.7	0	0	0	0	0	110.2	L42 L43 L44 D302 T304 V316	A34-L42 HydrophobicContact CB-CD1 4.29Å; A34-L43 CarbonylContact C-O 3.5Å; A34-L43 WeakPolarHBondContact CA-O 3.44Å; A34-L44 HydrophobicContact CB-CD2 3.67Å; A34-D302 PolarHBondContact N-OD2 2.91Å; A34-D302 VanDerWaalsContact O-OD2 3.05Å; A34-T304 HydrophobicContact CB-CG2 4.09Å; A34-T304 WeakPolarHBondContact O-CB 3.47Å; A34-T304 WeakPolarHBondContact O-CG2 3.32Å; A34-V316 HydrophobicContact CB-CB 4.27Å; A34-V316 HydrophobicContact CB-CG1 3.64Å; A34-V316 HydrophobicContact CB-CG2 3.64Å
35	R	98.6	Very high	97	Very high	59 Å²	59	29 Å²	29	22%	0.223	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	117.4	-175.3	-53.9	-65.7	-172.7	-153.9	-5	111.2	L43 D85 L86 W88 D302	R35-L43 PolarHBondContact N-O 3.43Å; R35-L43 WeakPolarHBondContact O-CB 3.25Å; R35-L43 PolarHBondContact O-N 3.07Å; R35-D85 IonicContact NH2-OD1 2.72Å; R35-D85 PolarHBondContact NH2-OD1 2.86Å; R35-L86 HydrophobicContact CB-CD1 4.46Å; R35-L86 HydrophobicContact CG-CD1 3.62Å; R35-L86 PolarHBondContact NE-O 2.79Å; R35-W88 PolarHBondContact O-NE1 2.93Å; R35-D302 IonicContact CZ-OD1 3.4Å; R35-D302 IonicContact CZ-OD2 2.83Å; R35-D302 IonicContact NE-OD2 3.59Å; R35-D302 PolarHBondContact NE-OD2 3.16Å; R35-D302 IonicContact NH1-OD1 3.22Å; R35-D302 PolarHBondContact NH1-OD1 2.93Å; R35-D302 IonicContact NH1-OD2 3.42Å; R35-D302 PolarHBondContact NH1-OD2 3.5Å; R35-D302 IonicContact NH2-OD1 3.18Å; R35-D302 IonicContact NH2-OD2 3.97Å; R35-D302 PolarHBondContact NH2-OD2 2.93Å
36	Y	98.6	Very high	97.4	Very high	24 Å²	24	25 Å²	25	9%	0.094	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	139.2	167.9	-80.6	-62.5	0	0	0	111.8	G40 A41 L42 P64 T304 W305 T314	Y36-G40 WeakPolarHBondContact CD1-O 3.4Å; Y36-G40 WeakPolarHBondContact CE1-O 3.31Å; Y36-A41 CarbonylContact C-O 3.58Å; Y36-A41 WeakPolarHBondContact CA-O 3.18Å; Y36-L42 HydrophobicContact CD1-CB 4.22Å; Y36-L42 HydrophobicContact CD1-CD1 4.16Å; Y36-L42 HydrophobicContact CE1-CB 3.92Å; Y36-L42 HydrophobicContact CE1-CD1 4.05Å; Y36-L42 HydrophobicContact CE1-CG 4.49Å; Y36-L42 HydrophobicContact CE2-CD1 4.47Å; Y36-L42 HydrophobicContact CG-CD1 4.41Å; Y36-P64 HydrophobicContact CE1-CB 3.92Å; Y36-P64 HydrophobicContact CE1-CG 3.55Å; Y36-P64 WeakPolarHBondContact OH-CB 2.95Å; Y36-T304 HydrophobicContact CD2-CG2 3.43Å; Y36-T304 VanDerWaalsContact CD2-CG2 3.43Å; Y36-T304 WeakPolarHBondContact CD2-OG1 3.31Å; Y36-T304 HydrophobicContact CE2-CG2 3.78Å; Y36-T304 HydrophobicContact CG-CG2 4.17Å; Y36-T304 PolarHBondContact N-OG1 2.78Å; Y36-W305 VanDerWaalsContact CD2-O 3.31Å; Y36-W305 WeakPolarHBondContact CD2-O 3.34Å; Y36-T314 WeakPolarHBondContact CE2-OG1 3.25Å; Y36-T314 PolarHBondContact OH-OG1 3.12Å
37	R	97.4	Very high	97.8	Very high	8 Å²	8	21 Å²	21	3%	0.03	10%	0.101	C	C	.	.			trans	-90.2	161.7	163.4	-172.9	172	67	172	6.2	110.1	D39 G40 A41 W88 E91 E112 P307	R37-D39 WeakPolarHBondContact CB-OD1 3.25Å; R37-D39 IonicContact CZ-OD1 2.69Å; R37-D39 IonicContact CZ-OD2 3.15Å; R37-D39 IonicContact NE-OD1 3.24Å; R37-D39 PolarHBondContact NE-OD1 2.8Å; R37-D39 IonicContact NE-OD2 2.73Å; R37-D39 PolarHBondContact NE-OD2 2.9Å; R37-D39 IonicContact NH2-OD1 2.85Å; R37-D39 IonicContact NH2-OD2 2.97Å; R37-D39 PolarHBondContact NH2-OD2 3.38Å; R37-D39 PolarHBondContact O-N 2.81Å; R37-D39 VanDerWaalsContact O-N 3.09Å; R37-G40 WeakPolarHBondContact O-CA 3.38Å; R37-G40 PolarHBondContact O-N 2.88Å; R37-A41 HydrophobicContact CB-CB 4.45Å; R37-A41 PolarHBondContact N-O 3.25Å; R37-W88 HydrophobicContact CB-CD2 4.45Å; R37-W88 HydrophobicContact CB-CZ2 3.86Å; R37-W88 HydrophobicContact CG-CZ2 4.49Å; R37-E91 WeakPolarHBondContact CD-O 3.37Å; R37-E91 WeakPolarHBondContact CD-OE2 3.44Å; R37-E91 WeakPolarHBondContact CG-OE2 3.09Å; R37-E91 IonicContact NE-OE2 2.66Å; R37-E91 PolarHBondContact NH1-O 3.02Å; R37-E112 IonicContact CZ-OE1 2.75Å; R37-E112 VanDerWaalsContact CZ-OE1 3.29Å; R37-E112 IonicContact NH1-OE1 3.8Å; R37-E112 PolarHBondContact NH1-OE1 3.44Å; R37-E112 IonicContact NH1-OE2 2.92Å; R37-E112 VanDerWaalsContact NH2-CD 3.33Å; R37-E112 IonicContact NH2-OE1 2.97Å; R37-E112 PolarHBondContact NH2-OE1 3.16Å; R37-E112 IonicContact NH2-OE2 3.86Å; R37-E112 PolarHBondContact NH2-OE2 2.98Å; R37-P307 VanDerWaalsContact O-CG 3.25Å; R37-P307 WeakPolarHBondContact O-CG 3.44Å
38	S	96.6	Very high	97.7	Very high	74 Å²	74	22.1 Å²	22.1	52%	0.517	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-31.2	-175.4	66.3	0	0	0	0	114.7	G40 E91	S38-G40 VanDerWaalsContact C-N 3.29Å; S38-G40 PolarHBondContact O-N 3.25Å; S38-E91 WeakPolarHBondContact CB-OE1 3.49Å; S38-E91 PolarHBondContact OG-OE1 2.91Å; S38-E91 PolarHBondContact OG-OE2 2.95Å
39	D	96.4	Very high	97.4	Very high	75 Å²	75	24.5 Å²	24.5	40%	0.401	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-1.9	177.2	70.1	-21.4	0	0	0	114.5	R37 A41	R37-D39 WeakPolarHBondContact CB-OD1 3.25Å; R37-D39 IonicContact CZ-OD1 2.69Å; R37-D39 IonicContact CZ-OD2 3.15Å; R37-D39 IonicContact NE-OD1 3.24Å; R37-D39 PolarHBondContact NE-OD1 2.8Å; R37-D39 IonicContact NE-OD2 2.73Å; R37-D39 PolarHBondContact NE-OD2 2.9Å; R37-D39 IonicContact NH2-OD1 2.85Å; R37-D39 IonicContact NH2-OD2 2.97Å; R37-D39 PolarHBondContact NH2-OD2 3.38Å; R37-D39 PolarHBondContact O-N 2.81Å; R37-D39 VanDerWaalsContact O-N 3.09Å; D39-A41 VanDerWaalsContact OD1-CB 3.31Å; D39-A41 WeakPolarHBondContact OD1-CB 3.43Å; D39-A41 PolarHBondContact OD1-N 3.44Å; D39-A41 VanDerWaalsContact OD1-N 3.09Å
40	G	97.3	Very high	96.8	Very high	4 Å²	4	21.4 Å²	21.4	4%	0.041	12%	0.121	C	C	.	.	S	Bend	trans	88.7	3	-177.9	0	0	0	0	0	114.6	Y36 R37 S38 P64	Y36-G40 WeakPolarHBondContact CD1-O 3.4Å; Y36-G40 WeakPolarHBondContact CE1-O 3.31Å; R37-G40 WeakPolarHBondContact O-CA 3.38Å; R37-G40 PolarHBondContact O-N 2.88Å; S38-G40 VanDerWaalsContact C-N 3.29Å; S38-G40 PolarHBondContact O-N 3.25Å; G40-P64 VanDerWaalsContact O-CG 3.25Å; G40-P64 WeakPolarHBondContact O-CG 3.19Å
41	A	97.9	Very high	96	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.008	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-66	138.7	171.2	0	0	0	0	0	110.5	Y36 R37 D39 L60 F61	Y36-A41 CarbonylContact C-O 3.58Å; Y36-A41 WeakPolarHBondContact CA-O 3.18Å; R37-A41 HydrophobicContact CB-CB 4.45Å; R37-A41 PolarHBondContact N-O 3.25Å; D39-A41 VanDerWaalsContact OD1-CB 3.31Å; D39-A41 WeakPolarHBondContact OD1-CB 3.43Å; D39-A41 PolarHBondContact OD1-N 3.44Å; D39-A41 VanDerWaalsContact OD1-N 3.09Å; A41-L60 HydrophobicContact CB-CD1 4Å; A41-F61 CarbonylContact C-O 3.57Å; A41-F61 WeakPolarHBondContact CA-O 3.43Å
42	L	98.6	Very high	95	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.6	-179.2	-178.4	65.1	0	0	0	110.2	A34 Y36 L44 F61 P64 A67 T304 T314 V322	A34-L42 HydrophobicContact CB-CD1 4.29Å; Y36-L42 HydrophobicContact CD1-CB 4.22Å; Y36-L42 HydrophobicContact CD1-CD1 4.16Å; Y36-L42 HydrophobicContact CE1-CB 3.92Å; Y36-L42 HydrophobicContact CE1-CD1 4.05Å; Y36-L42 HydrophobicContact CE1-CG 4.49Å; Y36-L42 HydrophobicContact CE2-CD1 4.47Å; Y36-L42 HydrophobicContact CG-CD1 4.41Å; L42-L44 HydrophobicContact CD1-CD2 4.37Å; L42-L44 HydrophobicContact CD2-CD2 4.02Å; L42-L44 HydrophobicContact CD2-CG 4.39Å; L42-L44 HydrophobicContact CG-CD2 4Å; L42-L44 HydrophobicContact CG-CG 4.31Å; L42-F61 HydrophobicContact CB-CB 4.38Å; L42-F61 PolarHBondContact N-O 2.77Å; L42-F61 PolarHBondContact O-N 3.31Å; L42-P64 HydrophobicContact CB-CB 4.01Å; L42-P64 HydrophobicContact CB-CG 4.1Å; L42-P64 HydrophobicContact CD2-CB 4.13Å; L42-A67 HydrophobicContact CD2-CB 4.24Å; L42-T304 HydrophobicContact CD1-CG2 3.87Å; L42-T314 HydrophobicContact CD2-CG2 4.22Å; L42-V322 HydrophobicContact CD2-CG1 4.12Å
43	L	98.8	Very high	94	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	133.2	168.3	173.7	66.7	0	0	0	109.8	A34 R35 W59 L86 W88 I94	A34-L43 CarbonylContact C-O 3.5Å; A34-L43 WeakPolarHBondContact CA-O 3.44Å; R35-L43 PolarHBondContact N-O 3.43Å; R35-L43 WeakPolarHBondContact O-CB 3.25Å; R35-L43 PolarHBondContact O-N 3.07Å; L43-W59 CarbonylContact C-O 3.45Å; L43-W59 WeakPolarHBondContact CA-O 3Å; L43-L86 HydrophobicContact CD2-CD1 3.68Å; L43-L86 HydrophobicContact CD2-CD2 4.29Å; L43-L86 HydrophobicContact CG-CD1 4.05Å; L43-L86 HydrophobicContact CG-CD2 4.27Å; L43-W88 HydrophobicContact CB-CH2 4.34Å; L43-W88 HydrophobicContact CB-CZ2 3.47Å; L43-W88 VanDerWaalsContact CB-CZ2 3.47Å; L43-W88 HydrophobicContact CD2-CD2 4.09Å; L43-W88 HydrophobicContact CD2-CH2 4.49Å; L43-W88 HydrophobicContact CD2-CZ2 4.04Å; L43-W88 HydrophobicContact CG-CZ2 4.27Å; L43-I94 HydrophobicContact CD1-CD1 3.79Å; L43-I94 HydrophobicContact CD1-CG1 4.37Å; L43-I94 HydrophobicContact CD1-CG2 4.45Å; L43-I94 HydrophobicContact CD2-CB 4.45Å; L43-I94 HydrophobicContact CD2-CD1 4.31Å; L43-I94 HydrophobicContact CD2-CG1 3.98Å; L43-I94 HydrophobicContact CD2-CG2 3.73Å
44	L	98.8	Very high	93.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.3	173.3	-61.9	-176.2	0	0	0	111	M27 A33 A34 L42 L58 W59 F61 A67 V316 V322	M27-L44 HydrophobicContact CE-CD1 4.3Å; A33-L44 WeakPolarHBondContact O-CA 3.38Å; A34-L44 HydrophobicContact CB-CD2 3.67Å; L42-L44 HydrophobicContact CD1-CD2 4.37Å; L42-L44 HydrophobicContact CD2-CD2 4.02Å; L42-L44 HydrophobicContact CD2-CG 4.39Å; L42-L44 HydrophobicContact CG-CD2 4Å; L42-L44 HydrophobicContact CG-CG 4.31Å; L44-L58 WeakPolarHBondContact O-CA 3.04Å; L44-W59 HydrophobicContact CB-CB 4.35Å; L44-W59 PolarHBondContact N-O 2.98Å; L44-W59 PolarHBondContact O-N 3.33Å; L44-F61 HydrophobicContact CD1-CD2 4.17Å; L44-F61 HydrophobicContact CD1-CE2 3.92Å; L44-F61 HydrophobicContact CG-CD2 4.44Å; L44-A67 HydrophobicContact CD1-CB 3.94Å; L44-V316 HydrophobicContact CD2-CG1 3.85Å; L44-V322 HydrophobicContact CD1-CG2 3.92Å
45	G	98.6	Very high	93	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.1	166.2	0	0	0	0	0	109.5	E32 A33	E32-G45 PolarHBondContact N-O 3.22Å; A33-G45 PolarHBondContact N-O 3.22Å; A33-G45 PolarHBondContact O-N 3.09Å
46	A	98.3	Very high	92.9	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	153	179.7	0	0	0	0	0	111.1	M27 E28 Q30 L31 G56 S57	M27-A46 HydrophobicContact CG-CB 3.71Å; M27-A46 HydrophobicContact SD-CB 4.33Å; E28-A46 HydrophobicContact CB-CB 4.28Å; Q30-A46 CarbonylContact O-C 3.52Å; Q30-A46 WeakPolarHBondContact O-CA 3.25Å; L31-A46 HydrophobicContact CD2-CB 3.85Å; A46-G56 CarbonylContact O-C 3.57Å; A46-G56 WeakPolarHBondContact O-CA 3.18Å; A46-S57 PolarHBondContact N-O 3.02Å; A46-S57 PolarHBondContact O-N 2.87Å
47	S	97.7	Very high	92.8	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.007	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	146.6	-177.1	-67.2	0	0	0	0	110.8	E28 Q30 G82 V83	E28-S47 VanDerWaalsContact CB-O 3.3Å; E28-S47 WeakPolarHBondContact CB-O 3.45Å; Q30-S47 WeakPolarHBondContact CB-O 3.35Å; Q30-S47 PolarHBondContact N-O 3.18Å; Q30-S47 PolarHBondContact O-N 3.18Å; Q30-S47 PolarHBondContact OE1-O 2.97Å; Q30-S47 VanDerWaalsContact OE1-O 3.13Å; S47-G82 WeakPolarHBondContact OG-CA 3.21Å; S47-V83 PolarHBondContact OG-N 2.99Å; S47-V83 PolarHBondContact OG-O 3.04Å
48	S	94.6	Very high	92.9	Very high	28 Å²	28	44.4 Å²	44.4	20%	0.196	24%	0.243	C	C	.	.			trans	-96.8	90.9	170	-174.3	0	0	0	0	109.2	S50 C53 A55	S48-S50 PolarHBondContact O-N 2.79Å; S48-S50 PolarHBondContact OG-O 2.83Å; S48-C53 PolarHBondContact OG-O 3.19Å; S48-A55 PolarHBondContact N-O 3.01Å
49	L	89.9	Confident	93	Very high	72 Å²	72	40.9 Å²	40.9	38%	0.377	22%	0.218	S	C	.	.			trans	-81.3	5.5	179	-54.5	-174.8	0	0	0	112.8	Q30 W318	Q30-L49 HydrophobicContact CB-CD1 4.03Å; Q30-L49 HydrophobicContact CB-CG 4.01Å; Q30-L49 HydrophobicContact CG-CB 4.13Å; Q30-L49 HydrophobicContact CG-CD1 3.95Å; Q30-L49 HydrophobicContact CG-CG 3.98Å; L49-W318 HydrophobicContact CD1-CD2 4.44Å; L49-W318 HydrophobicContact CD1-CH2 3.97Å; L49-W318 HydrophobicContact CD1-CZ2 3.46Å; L49-W318 VanDerWaalsContact CD1-CZ2 3.46Å
50	S	83.8	Confident	93	Very high	67 Å²	67	37.3 Å²	37.3	47%	0.469	20%	0.199	S	C	.	.	S	Bend	trans	-142.8	166.2	-179.4	65.5	0	0	0	0	110.9	S48	S48-S50 PolarHBondContact O-N 2.79Å; S48-S50 PolarHBondContact OG-O 2.83Å
51	G	79.8	Confident	93.1	Very high	69 Å²	69	37.1 Å²	37.1	71%	0.711	20%	0.197	S	C	*	.	S	Bend	trans	87.6	-156.8	178.2	0	0	0	0	0	114.2
52	R	78.2	Confident	93	Very high	256 Å²	256	42 Å²	42	97%	0.966	22%	0.218	S	C	*	.	S	Bend	trans	-89.1	-24.1	-169.2	-80.5	-169.9	-89.3	-136.8	-3.1	114.7
53	C	77.1	Confident	92.8	Very high	91 Å²	91	44.3 Å²	44.3	62%	0.615	23%	0.231	S	C	*	.			trans	-130.2	124.1	-176.5	-61.2	0	0	0	0	108.2	S48 A55	S48-C53 PolarHBondContact OG-O 3.19Å; C53-A55 PolarHBondContact O-N 2.78Å
54	W	85	Confident	92.7	Very high	182 Å²	182	45.3 Å²	45.3	69%	0.689	24%	0.237	S	C	*	.			trans	-93.9	85.4	171.8	-63.1	-3.8	0	0	0	107.4
55	A	91.8	Very high	92.5	Very high	13 Å²	13	49.8 Å²	49.8	11%	0.107	27%	0.268	C	S	.	.			trans	-113.6	165.8	174.7	0	0	0	0	0	109.1	S48 C53	S48-A55 PolarHBondContact N-O 3.01Å; C53-A55 PolarHBondContact O-N 2.78Å
56	G	95.8	Very high	92.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	176.4	171.9	0	0	0	0	0	111.6	A46 Q78 T79 A81	A46-G56 CarbonylContact O-C 3.57Å; A46-G56 WeakPolarHBondContact O-CA 3.18Å; G56-Q78 VanDerWaalsContact O-CG 3.3Å; G56-Q78 WeakPolarHBondContact O-CG 3.39Å; G56-T79 WeakPolarHBondContact CA-OG1 3.3Å; G56-T79 PolarHBondContact N-OG1 2.82Å; G56-T79 PolarHBondContact O-N 2.9Å; G56-T79 PolarHBondContact O-OG1 3.47Å; G56-T79 VanDerWaalsContact O-OG1 3.07Å; G56-A81 WeakPolarHBondContact CA-O 3.38Å; G56-A81 PolarHBondContact N-O 3.28Å
57	S	97.5	Very high	92.2	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	154.7	177	58.9	0	0	0	0	112	E28 A46 W59 V77	E28-S57 VanDerWaalsContact OE2-CB 3.22Å; E28-S57 WeakPolarHBondContact OE2-CB 3.35Å; E28-S57 PolarHBondContact OE2-OG 3.27Å; A46-S57 PolarHBondContact N-O 3.02Å; A46-S57 PolarHBondContact O-N 2.87Å; S57-W59 VanDerWaalsContact CB-NE1 3.32Å; S57-W59 PolarHBondContact OG-NE1 3.37Å; S57-V77 CarbonylContact C-O 3.5Å; S57-V77 VanDerWaalsContact CA-O 3.23Å; S57-V77 WeakPolarHBondContact CA-O 3.47Å; S57-V77 VanDerWaalsContact CB-O 3.32Å; S57-V77 WeakPolarHBondContact CB-O 3.44Å
58	L	98.3	Very high	92.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.4	176.3	-51	173.7	0	0	0	108.9	L44 G76 V77 T79 V83 L86 I94 V96 W106 I115	L44-L58 WeakPolarHBondContact O-CA 3.04Å; L58-G76 CarbonylContact O-C 3.59Å; L58-G76 VanDerWaalsContact O-CA 3.25Å; L58-G76 WeakPolarHBondContact O-CA 3.23Å; L58-V77 HydrophobicContact CB-CG1 3.99Å; L58-V77 HydrophobicContact CD1-CG1 4.13Å; L58-V77 HydrophobicContact CG-CG1 4.3Å; L58-V77 PolarHBondContact N-O 2.93Å; L58-V77 PolarHBondContact O-N 2.87Å; L58-T79 HydrophobicContact CD1-CG2 4.27Å; L58-T79 HydrophobicContact CG-CG2 4.02Å; L58-V83 HydrophobicContact CD2-CG2 3.96Å; L58-L86 HydrophobicContact CD2-CD2 3.59Å; L58-I94 HydrophobicContact CD1-CG2 4.29Å; L58-V96 HydrophobicContact CD1-CG2 3.84Å; L58-V96 HydrophobicContact CD2-CG2 3.84Å; L58-V96 HydrophobicContact CG-CG2 4.45Å; L58-W106 HydrophobicContact CD1-CB 4.32Å; L58-W106 HydrophobicContact CD1-CD2 4.17Å; L58-W106 HydrophobicContact CD1-CG 3.83Å; L58-I115 HydrophobicContact CB-CD1 4.13Å; L58-I115 HydrophobicContact CD1-CG2 4.31Å
59	W	98.4	Very high	92.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	134.3	-177.1	-56.8	82.6	0	0	0	111.8	A23 P24 M27 L43 L44 S57 F61 E70 C73	A23-W59 HydrophobicContact CB-CZ3 4.19Å; P24-W59 HydrophobicContact CB-CH2 3.95Å; P24-W59 HydrophobicContact CB-CZ2 3.88Å; P24-W59 HydrophobicContact CG-CH2 4.17Å; P24-W59 HydrophobicContact CG-CZ2 3.9Å; P24-W59 VanDerWaalsContact O-CH2 3.29Å; P24-W59 WeakPolarHBondContact O-CH2 2.96Å; M27-W59 HydrophobicContact CB-CH2 4.45Å; M27-W59 HydrophobicContact CB-CZ2 3.71Å; M27-W59 HydrophobicContact CE-CB 3.9Å; M27-W59 VanDerWaalsContact CE-CD1 3.5Å; M27-W59 HydrophobicContact CE-CD2 3.61Å; M27-W59 HydrophobicContact CE-CE3 4.29Å; M27-W59 HydrophobicContact CE-CG 3.39Å; M27-W59 HydrophobicContact CG-CZ2 4.32Å; L43-W59 CarbonylContact C-O 3.45Å; L43-W59 WeakPolarHBondContact CA-O 3Å; L44-W59 HydrophobicContact CB-CB 4.35Å; L44-W59 PolarHBondContact N-O 2.98Å; L44-W59 PolarHBondContact O-N 3.33Å; S57-W59 VanDerWaalsContact CB-NE1 3.32Å; S57-W59 PolarHBondContact OG-NE1 3.37Å; W59-F61 HydrophobicContact CB-CD2 4.28Å; W59-F61 HydrophobicContact CB-CE2 3.68Å; W59-E70 HydrophobicContact CH2-CB 3.87Å; W59-E70 HydrophobicContact CH2-CG 3.58Å; W59-E70 HydrophobicContact CZ2-CG 4.2Å; W59-E70 HydrophobicContact CZ3-CB 3.74Å; W59-E70 HydrophobicContact CZ3-CG 3.85Å; W59-C73 HydrophobicContact CE3-CB 3.97Å
60	L	98	Very high	92.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	129	174.9	-177.5	67.7	0	0	0	110.2	A41 S74 A75 W88 L108 E112	A41-L60 HydrophobicContact CB-CD1 4Å; L60-S74 WeakPolarHBondContact O-CB 3.12Å; L60-S74 PolarHBondContact O-N 2.86Å; L60-A75 HydrophobicContact CB-CB 4.19Å; L60-A75 PolarHBondContact N-O 3.48Å; L60-A75 PolarHBondContact O-N 3.07Å; L60-W88 HydrophobicContact CD1-CH2 3.8Å; L60-W88 HydrophobicContact CD1-CZ2 3.9Å; L60-L108 HydrophobicContact CD2-CD1 3.72Å; L60-L108 HydrophobicContact CD2-CD2 3.72Å; L60-L108 HydrophobicContact CD2-CG 4.4Å; L60-E112 HydrophobicContact CD2-CB 4.31Å
61	F	97.8	Very high	92.7	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	111.7	174.6	-70.4	-93.1	0	0	0	110.2	M27 A41 L42 L44 W59 D63 A66 A67 N69 C73	M27-F61 HydrophobicContact CE-CE2 3.91Å; M27-F61 HydrophobicContact CE-CZ 4.04Å; A41-F61 CarbonylContact C-O 3.57Å; A41-F61 WeakPolarHBondContact CA-O 3.43Å; L42-F61 HydrophobicContact CB-CB 4.38Å; L42-F61 PolarHBondContact N-O 2.77Å; L42-F61 PolarHBondContact O-N 3.31Å; L44-F61 HydrophobicContact CD1-CD2 4.17Å; L44-F61 HydrophobicContact CD1-CE2 3.92Å; L44-F61 HydrophobicContact CG-CD2 4.44Å; W59-F61 HydrophobicContact CB-CD2 4.28Å; W59-F61 HydrophobicContact CB-CE2 3.68Å; F61-D63 VanDerWaalsContact C-N 3.26Å; F61-A66 HydrophobicContact CD1-CB 4.49Å; F61-A67 HydrophobicContact CD1-CB 3.94Å; F61-A67 HydrophobicContact CD2-CB 3.9Å; F61-A67 HydrophobicContact CE1-CB 4.07Å; F61-A67 HydrophobicContact CE2-CB 4.03Å; F61-A67 HydrophobicContact CG-CB 3.86Å; F61-A67 HydrophobicContact CZ-CB 4.11Å; F61-N69 VanDerWaalsContact CE1-O 3.31Å; F61-N69 WeakPolarHBondContact CE1-O 3.23Å; F61-C73 HydrophobicContact CD1-CB 4.14Å; F61-C73 HydrophobicContact CE1-CB 3.69Å; F61-C73 HydrophobicContact CE2-CB 4.18Å; F61-C73 HydrophobicContact CZ-CB 3.71Å
62	K	96.1	Very high	93.4	Very high	102 Å²	102	48 Å²	48	44%	0.443	24%	0.236	S	C	.	.	S	Bend	trans	-70.7	-26.5	170.5	-78.2	175.6	179.4	-176.5	0	112.1	P64 S74 E112	K62-P64 WeakPolarHBondContact O-CD 3.45Å; K62-S74 VanDerWaalsContact CB-OG 3.31Å; K62-S74 WeakPolarHBondContact CB-OG 3.26Å; K62-S74 WeakPolarHBondContact CG-OG 3.33Å; K62-S74 PolarHBondContact N-OG 2.7Å; K62-E112 WeakPolarHBondContact CE-OE2 3.21Å; K62-E112 IonicContact NZ-OE2 3.72Å; K62-E112 PolarHBondContact NZ-OE2 2.88Å
63	D	95.8	Very high	94.2	Very high	50 Å²	50	36.3 Å²	36.3	27%	0.267	19%	0.193	S	C	.	.	S	Bend	trans	-109	100.2	167.2	-177.3	3.6	0	0	0	109.8	R15 F61 C65 A66	R15-D63 IonicContact CZ-OD2 3.06Å; R15-D63 IonicContact NH1-OD2 2.62Å; R15-D63 PolarHBondContact NH1-OD2 3.37Å; R15-D63 IonicContact NH2-OD2 3.96Å; R15-D63 PolarHBondContact NH2-OD2 2.77Å; F61-D63 VanDerWaalsContact C-N 3.26Å; D63-C65 PolarHBondContact O-N 2.84Å; D63-C65 WeakPolarHBondContact OD1-CB 3.44Å; D63-C65 PolarHBondContact OD1-N 3.29Å; D63-A66 HydrophobicContact CB-CB 4.42Å; D63-A66 WeakPolarHBondContact O-CB 3.38Å; D63-A66 PolarHBondContact O-N 2.86Å; D63-A66 VanDerWaalsContact O-N 3.1Å
64	P	95.6	Very high	95.1	Very high	20 Å²	20	33.1 Å²	33.1	13%	0.13	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-58.2	-31.3	-178.2	-25.3	35.3	0	0	0	113.6	Y36 G40 L42 K62 A66 A67 H324	Y36-P64 HydrophobicContact CE1-CB 3.92Å; Y36-P64 HydrophobicContact CE1-CG 3.55Å; Y36-P64 WeakPolarHBondContact OH-CB 2.95Å; G40-P64 VanDerWaalsContact O-CG 3.25Å; G40-P64 WeakPolarHBondContact O-CG 3.19Å; L42-P64 HydrophobicContact CB-CB 4.01Å; L42-P64 HydrophobicContact CB-CG 4.1Å; L42-P64 HydrophobicContact CD2-CB 4.13Å; K62-P64 WeakPolarHBondContact O-CD 3.45Å; P64-A66 PolarHBondContact O-N 2.6Å; P64-A67 WeakPolarHBondContact O-CB 3.36Å; P64-A67 PolarHBondContact O-N 2.88Å; P64-A67 VanDerWaalsContact O-N 3.14Å; P64-H324 PolarHBondContact O-NE2 2.62Å
65	C	95.1	Very high	95.6	Very high	95 Å²	95	24.5 Å²	24.5	64%	0.642	14%	0.139	S	C	*	.	G	3₁₀ helix	trans	-68.7	-14.5	-178.8	-64.9	0	0	0	0	113.2	D63	D63-C65 PolarHBondContact O-N 2.84Å; D63-C65 WeakPolarHBondContact OD1-CB 3.44Å; D63-C65 PolarHBondContact OD1-N 3.29Å
66	A	94.8	Very high	95.8	Very high	14 Å²	14	23.9 Å²	23.9	12%	0.116	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-86.7	-14.7	176.8	0	0	0	0	0	112.8	F61 D63 P64 N69 F72	F61-A66 HydrophobicContact CD1-CB 4.49Å; D63-A66 HydrophobicContact CB-CB 4.42Å; D63-A66 WeakPolarHBondContact O-CB 3.38Å; D63-A66 PolarHBondContact O-N 2.86Å; D63-A66 VanDerWaalsContact O-N 3.1Å; P64-A66 PolarHBondContact O-N 2.6Å; A66-N69 WeakPolarHBondContact O-CB 3.3Å; A66-N69 PolarHBondContact O-N 3.39Å; A66-F72 HydrophobicContact CB-CB 3.69Å; A66-F72 HydrophobicContact CB-CG 4.39Å
67	A	95.9	Very high	95.9	Very high	12 Å²	12	24.8 Å²	24.8	10%	0.099	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	147.2	177.8	0	0	0	0	0	111.2	L42 L44 F61 P64 V322	L42-A67 HydrophobicContact CD2-CB 4.24Å; L44-A67 HydrophobicContact CD1-CB 3.94Å; F61-A67 HydrophobicContact CD1-CB 3.94Å; F61-A67 HydrophobicContact CD2-CB 3.9Å; F61-A67 HydrophobicContact CE1-CB 4.07Å; F61-A67 HydrophobicContact CE2-CB 4.03Å; F61-A67 HydrophobicContact CG-CB 3.86Å; F61-A67 HydrophobicContact CZ-CB 4.11Å; P64-A67 WeakPolarHBondContact O-CB 3.36Å; P64-A67 PolarHBondContact O-N 2.88Å; P64-A67 VanDerWaalsContact O-N 3.14Å; A67-V322 HydrophobicContact CB-CB 4.35Å; A67-V322 HydrophobicContact CB-CG1 4.18Å; A67-V322 HydrophobicContact CB-CG2 4.02Å
68	P	96	Very high	95.9	Very high	25 Å²	25	30 Å²	30	16%	0.162	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	cis	-92.4	19.4	2.6	35.5	-33.4	0	0	0	114.6	M27 E70 V322	M27-P68 HydrophobicContact CE-CB 4.09Å; M27-P68 WeakPolarHBondContact CE-O 3.38Å; M27-P68 HydrophobicContact SD-CB 3.78Å; P68-E70 PolarHBondContact O-N 2.83Å; P68-V322 HydrophobicContact CB-CG2 3.86Å; P68-V322 HydrophobicContact CG-CG2 4.08Å
69	N	95	Very high	95.8	Very high	52 Å²	52	30.2 Å²	30.2	28%	0.278	17%	0.166	S	C	.	.			trans	-69.3	116.3	-173.5	-175.3	-36.5	0	0	0	112.3	W17 F61 A66 G71 F72	W17-N69 WeakPolarHBondContact CH2-OD1 3.37Å; W17-N69 VanDerWaalsContact CZ3-OD1 3.3Å; W17-N69 WeakPolarHBondContact CZ3-OD1 3.42Å; F61-N69 VanDerWaalsContact CE1-O 3.31Å; F61-N69 WeakPolarHBondContact CE1-O 3.23Å; A66-N69 WeakPolarHBondContact O-CB 3.3Å; A66-N69 PolarHBondContact O-N 3.39Å; N69-G71 VanDerWaalsContact C-N 3.28Å; N69-G71 PolarHBondContact O-N 2.84Å; N69-G71 PolarHBondContact OD1-N 2.82Å; N69-F72 HydrophobicContact CB-CD2 3.88Å; N69-F72 HydrophobicContact CB-CE2 4.48Å; N69-F72 WeakPolarHBondContact ND2-CE2 3.42Å; N69-F72 PolarHBondContact O-N 2.82Å; N69-F72 VanDerWaalsContact O-N 3.13Å
70	E	93.7	Very high	95.7	Very high	26 Å²	26	35.3 Å²	35.3	12%	0.121	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-62.1	-34.2	-172.2	-53.8	89.3	157.3	0	0	112.5	L19 C26 M27 W59 P68 F72 C73	L19-E70 HydrophobicContact CD2-CB 3.82Å; L19-E70 WeakPolarHBondContact CD2-O 3.29Å; C26-E70 WeakPolarHBondContact CA-OE1 3.5Å; M27-E70 HydrophobicContact CB-CG 3.89Å; M27-E70 PolarHBondContact N-OE1 2.96Å; W59-E70 HydrophobicContact CH2-CB 3.87Å; W59-E70 HydrophobicContact CH2-CG 3.58Å; W59-E70 HydrophobicContact CZ2-CG 4.2Å; W59-E70 HydrophobicContact CZ3-CB 3.74Å; W59-E70 HydrophobicContact CZ3-CG 3.85Å; P68-E70 PolarHBondContact O-N 2.83Å; E70-F72 PolarHBondContact O-N 2.86Å; E70-F72 VanDerWaalsContact O-N 3.08Å; E70-C73 PolarHBondContact O-N 2.8Å; E70-C73 PolarHBondContact O-SG 3.13Å
71	G	91.5	Very high	95.6	Very high	2 Å²	2	36 Å²	36	2%	0.021	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-67.5	-7.3	-179.9	0	0	0	0	0	114.7	N18 N69	N18-G71 PolarHBondContact N-O 3.29Å; N18-G71 VanDerWaalsContact N-O 3.1Å; N69-G71 VanDerWaalsContact C-N 3.28Å; N69-G71 PolarHBondContact O-N 2.84Å; N69-G71 PolarHBondContact OD1-N 2.82Å
72	F	93.9	Very high	95.6	Very high	68 Å²	68	36 Å²	36	30%	0.298	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-121.9	10.4	179.1	-56.5	-56	0	0	0	113.3	R15 A66 N69 E70	R15-F72 HydrophobicContact CB-CD1 4.01Å; R15-F72 HydrophobicContact CB-CE1 3.5Å; R15-F72 HydrophobicContact CB-CZ 4.35Å; A66-F72 HydrophobicContact CB-CB 3.69Å; A66-F72 HydrophobicContact CB-CG 4.39Å; N69-F72 HydrophobicContact CB-CD2 3.88Å; N69-F72 HydrophobicContact CB-CE2 4.48Å; N69-F72 WeakPolarHBondContact ND2-CE2 3.42Å; N69-F72 PolarHBondContact O-N 2.82Å; N69-F72 VanDerWaalsContact O-N 3.13Å; E70-F72 PolarHBondContact O-N 2.86Å; E70-F72 VanDerWaalsContact O-N 3.08Å
73	C	95.4	Very high	95.7	Very high	10 Å²	10	31.2 Å²	31.2	7%	0.068	18%	0.175	C	C	.	.			trans	-72.6	154.2	173.5	77.7	0	0	0	0	111	P20 W59 F61 E70	P20-C73 WeakPolarHBondContact CD-SG 3.33Å; P20-C73 WeakPolarHBondContact CG-SG 3.18Å; W59-C73 HydrophobicContact CE3-CB 3.97Å; F61-C73 HydrophobicContact CD1-CB 4.14Å; F61-C73 HydrophobicContact CE1-CB 3.69Å; F61-C73 HydrophobicContact CE2-CB 4.18Å; F61-C73 HydrophobicContact CZ-CB 3.71Å; E70-C73 PolarHBondContact O-N 2.8Å; E70-C73 PolarHBondContact O-SG 3.13Å
74	S	95	Very high	95.8	Very high	25 Å²	25	30 Å²	30	18%	0.175	17%	0.171	C	C	.	.	S	Bend	trans	-82.2	-39.4	173.8	-56.3	0	0	0	0	111.4	L60 K62 T113	L60-S74 WeakPolarHBondContact O-CB 3.12Å; L60-S74 PolarHBondContact O-N 2.86Å; K62-S74 VanDerWaalsContact CB-OG 3.31Å; K62-S74 WeakPolarHBondContact CB-OG 3.26Å; K62-S74 WeakPolarHBondContact CG-OG 3.33Å; K62-S74 PolarHBondContact N-OG 2.7Å; S74-T113 WeakPolarHBondContact O-CA 3.45Å
75	A	96.4	Very high	96	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	151.8	177.5	0	0	0	0	0	109.5	L60 L108 T113 I115	L60-A75 HydrophobicContact CB-CB 4.19Å; L60-A75 PolarHBondContact N-O 3.48Å; L60-A75 PolarHBondContact O-N 3.07Å; A75-L108 HydrophobicContact CB-CD2 4.38Å; A75-T113 VanDerWaalsContact CB-C 3.5Å; A75-T113 WeakPolarHBondContact CB-O 3.13Å; A75-I115 HydrophobicContact CB-CD1 4.17Å; A75-I115 HydrophobicContact CB-CG1 3.93Å
76	G	96.8	Very high	96.1	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.01	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	152.3	173.9	0	0	0	0	0	111	A23 L58	A23-G76 WeakPolarHBondContact CA-O 3.3Å; L58-G76 CarbonylContact O-C 3.59Å; L58-G76 VanDerWaalsContact O-CA 3.25Å; L58-G76 WeakPolarHBondContact O-CA 3.23Å
77	V	97.4	Very high	96.3	Very high	19 Å²	19	26.4 Å²	26.4	12%	0.115	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	147.4	174.4	68.5	0	0	0	0	110.8	S57 L58 W106 I115	S57-V77 CarbonylContact C-O 3.5Å; S57-V77 VanDerWaalsContact CA-O 3.23Å; S57-V77 WeakPolarHBondContact CA-O 3.47Å; S57-V77 VanDerWaalsContact CB-O 3.32Å; S57-V77 WeakPolarHBondContact CB-O 3.44Å; L58-V77 HydrophobicContact CB-CG1 3.99Å; L58-V77 HydrophobicContact CD1-CG1 4.13Å; L58-V77 HydrophobicContact CG-CG1 4.3Å; L58-V77 PolarHBondContact N-O 2.93Å; L58-V77 PolarHBondContact O-N 2.87Å; V77-W106 HydrophobicContact CB-CZ3 4.47Å; V77-W106 HydrophobicContact CG1-CE3 4.07Å; V77-W106 HydrophobicContact CG1-CZ3 4.04Å; V77-W106 HydrophobicContact CG2-CE3 4.44Å; V77-W106 HydrophobicContact CG2-CH2 4.06Å; V77-W106 HydrophobicContact CG2-CZ3 3.66Å; V77-I115 HydrophobicContact CB-CB 4.06Å; V77-I115 HydrophobicContact CG1-CB 3.61Å; V77-I115 HydrophobicContact CG1-CD1 4.1Å; V77-I115 HydrophobicContact CG1-CG1 4.45Å; V77-I115 HydrophobicContact CG1-CG2 3.59Å
78	Q	96.8	Very high	96.4	Very high	108 Å²	108	27.1 Å²	27.1	51%	0.505	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	134.3	172.5	-157.8	166.4	20	0	0	110.6	P24 G56	P24-Q78 HydrophobicContact CG-CB 3.98Å; G56-Q78 VanDerWaalsContact O-CG 3.3Å; G56-Q78 WeakPolarHBondContact O-CG 3.39Å
79	T	96.9	Very high	96.5	Very high	5 Å²	5	27.1 Å²	27.1	3%	0.031	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	160.2	169.8	57.5	0	0	0	0	109.7	G56 L58 A81 V83 W106	G56-T79 WeakPolarHBondContact CA-OG1 3.3Å; G56-T79 PolarHBondContact N-OG1 2.82Å; G56-T79 PolarHBondContact O-N 2.9Å; G56-T79 PolarHBondContact O-OG1 3.47Å; G56-T79 VanDerWaalsContact O-OG1 3.07Å; L58-T79 HydrophobicContact CD1-CG2 4.27Å; L58-T79 HydrophobicContact CG-CG2 4.02Å; T79-A81 VanDerWaalsContact C-N 3.3Å; T79-A81 PolarHBondContact O-N 3.05Å; T79-A81 PolarHBondContact OG1-O 3.03Å; T79-V83 HydrophobicContact CG2-CG2 4.24Å; T79-W106 HydrophobicContact CG2-CZ2 4.1Å
80	E	94.8	Very high	96.6	Very high	108 Å²	108	27.2 Å²	27.2	51%	0.505	16%	0.157	S	C	.	.	S	Bend	trans	-70.1	-27.6	-178	59.8	169.1	-156.7	0	0	113.8	S100 Y122	E80-S100 WeakPolarHBondContact OE1-CB 3.37Å; E80-S100 PolarHBondContact OE1-OG 2.95Å; E80-S100 VanDerWaalsContact OE1-OG 3.07Å; E80-Y122 WeakPolarHBondContact OE1-CE1 3.25Å; E80-Y122 VanDerWaalsContact OE1-CZ 3.26Å; E80-Y122 PolarHBondContact OE1-OH 2.99Å; E80-Y122 PolarHBondContact OE2-OH 2.96Å
81	A	96.6	Very high	96.7	Very high	13 Å²	13	30.4 Å²	30.4	11%	0.107	17%	0.172	C	C	.	.	S	Bend	trans	-138.7	173.5	-177.1	0	0	0	0	0	109.9	G56 T79 D99	G56-A81 WeakPolarHBondContact CA-O 3.38Å; G56-A81 PolarHBondContact N-O 3.28Å; T79-A81 VanDerWaalsContact C-N 3.3Å; T79-A81 PolarHBondContact O-N 3.05Å; T79-A81 PolarHBondContact OG1-O 3.03Å; A81-D99 HydrophobicContact CB-CB 4.16Å
82	G	97.6	Very high	97	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.01	19%	0.189	C	C	.	.			trans	-59.3	145.2	177.8	0	0	0	0	0	112.5	S47 D99	S47-G82 WeakPolarHBondContact OG-CA 3.21Å; G82-D99 WeakPolarHBondContact CA-OD2 3.29Å; G82-D99 PolarHBondContact O-N 3.23Å
83	V	98.4	Very high	97.2	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	116.5	171.4	175.8	0	0	0	0	107.9	E32 S47 L58 T79 L86 V96	E32-V83 WeakPolarHBondContact CB-O 3.41Å; E32-V83 WeakPolarHBondContact CG-O 3.41Å; S47-V83 PolarHBondContact OG-N 2.99Å; S47-V83 PolarHBondContact OG-O 3.04Å; L58-V83 HydrophobicContact CD2-CG2 3.96Å; T79-V83 HydrophobicContact CG2-CG2 4.24Å; V83-L86 HydrophobicContact CG1-CB 4.47Å; V83-L86 HydrophobicContact CG1-CD2 4.16Å; V83-L86 HydrophobicContact CG1-CG 4.43Å; V83-V96 HydrophobicContact CB-CG1 4.46Å; V83-V96 HydrophobicContact CG1-CG1 4.07Å; V83-V96 HydrophobicContact CG2-CG1 4.03Å
84	A	98.3	Very high	97.3	Very high	23 Å²	23	31.9 Å²	31.9	19%	0.19	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-35.1	177.3	0	0	0	0	0	112.4	E32 A97 I127 V128	E32-A84 VanDerWaalsContact CG-O 3.31Å; E32-A84 WeakPolarHBondContact CG-O 3.33Å; A84-A97 PolarHBondContact N-O 2.8Å; A84-I127 HydrophobicContact CB-CG2 4.44Å; A84-V128 VanDerWaalsContact CB-O 3.25Å; A84-V128 WeakPolarHBondContact CB-O 3.46Å
85	D	98.8	Very high	97.5	Very high	22 Å²	22	30.7 Å²	30.7	12%	0.118	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	157.2	176	-170.9	14.8	0	0	0	109.4	R35 A97 T130 V131	R35-D85 IonicContact NH2-OD1 2.72Å; R35-D85 PolarHBondContact NH2-OD1 2.86Å; D85-A97 HydrophobicContact CB-CB 4.01Å; D85-A97 PolarHBondContact O-N 3.41Å; D85-T130 WeakPolarHBondContact OD2-CA 3.38Å; D85-V131 HydrophobicContact CB-CG1 4.46Å; D85-V131 PolarHBondContact OD2-N 3.04Å
86	L	98.6	Very high	97.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	158.6	172.3	58.7	68.5	0	0	0	112.7	A33 R35 L43 L58 V83 L95 V96	A33-L86 HydrophobicContact CB-CD1 3.67Å; A33-L86 HydrophobicContact CB-CD2 4.35Å; A33-L86 HydrophobicContact CB-CG 3.6Å; R35-L86 HydrophobicContact CB-CD1 4.46Å; R35-L86 HydrophobicContact CG-CD1 3.62Å; R35-L86 PolarHBondContact NE-O 2.79Å; L43-L86 HydrophobicContact CD2-CD1 3.68Å; L43-L86 HydrophobicContact CD2-CD2 4.29Å; L43-L86 HydrophobicContact CG-CD1 4.05Å; L43-L86 HydrophobicContact CG-CD2 4.27Å; L58-L86 HydrophobicContact CD2-CD2 3.59Å; V83-L86 HydrophobicContact CG1-CB 4.47Å; V83-L86 HydrophobicContact CG1-CD2 4.16Å; V83-L86 HydrophobicContact CG1-CG 4.43Å; L86-L95 CarbonylContact C-O 3.58Å; L86-L95 WeakPolarHBondContact CA-O 3.49Å; L86-L95 WeakPolarHBondContact CB-O 3.34Å; L86-V96 HydrophobicContact CB-CG2 4.32Å
87	T	98.6	Very high	97.7	Very high	32 Å²	32	30.6 Å²	30.6	20%	0.196	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	154.7	177.4	-168.2	0	0	0	0	112.1	L95 V131 V133	T87-L95 HydrophobicContact CG2-CB 4.08Å; T87-L95 HydrophobicContact CG2-CD2 4.48Å; T87-L95 PolarHBondContact N-O 3.38Å; T87-L95 PolarHBondContact O-N 2.86Å; T87-V131 HydrophobicContact CG2-CG1 4.25Å; T87-V133 HydrophobicContact CG2-CG2 3.63Å
88	W	98.6	Very high	97.8	Very high	28 Å²	28	29.7 Å²	29.7	11%	0.106	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	139	175	-76	111.2	0	0	0	111.1	R35 R37 L43 L60 G93 I94 L108	R35-W88 PolarHBondContact O-NE1 2.93Å; R37-W88 HydrophobicContact CB-CD2 4.45Å; R37-W88 HydrophobicContact CB-CZ2 3.86Å; R37-W88 HydrophobicContact CG-CZ2 4.49Å; L43-W88 HydrophobicContact CB-CH2 4.34Å; L43-W88 HydrophobicContact CB-CZ2 3.47Å; L43-W88 VanDerWaalsContact CB-CZ2 3.47Å; L43-W88 HydrophobicContact CD2-CD2 4.09Å; L43-W88 HydrophobicContact CD2-CH2 4.49Å; L43-W88 HydrophobicContact CD2-CZ2 4.04Å; L43-W88 HydrophobicContact CG-CZ2 4.27Å; L60-W88 HydrophobicContact CD1-CH2 3.8Å; L60-W88 HydrophobicContact CD1-CZ2 3.9Å; W88-G93 VanDerWaalsContact CE3-O 3.29Å; W88-I94 HydrophobicContact CE3-CG1 3.92Å; W88-I94 HydrophobicContact CH2-CD1 4.41Å; W88-I94 HydrophobicContact CH2-CG1 4.3Å; W88-I94 HydrophobicContact CZ3-CD1 4.15Å; W88-I94 HydrophobicContact CZ3-CG1 3.65Å; W88-L108 HydrophobicContact CH2-CD1 3.93Å; W88-L108 HydrophobicContact CZ3-CD1 3.97Å
89	V	98.2	Very high	97.9	Very high	24 Å²	24	26.7 Å²	26.7	15%	0.145	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	97.2	168.1	-177	0	0	0	0	107.5	G93 L95 L105 V133 L154	V89-G93 PolarHBondContact N-O 3.48Å; V89-G93 WeakPolarHBondContact O-CA 3.44Å; V89-G93 PolarHBondContact O-N 2.82Å; V89-L95 HydrophobicContact CG2-CB 3.69Å; V89-L105 HydrophobicContact CB-CD1 4.37Å; V89-L105 HydrophobicContact CG2-CD1 3.96Å; V89-V133 HydrophobicContact CG2-CG2 3.72Å; V89-L154 HydrophobicContact CG1-CD1 3.72Å; V89-L154 HydrophobicContact CG2-CD1 4.02Å
90	G	95.9	Very high	97.9	Very high	54 Å²	54	28.5 Å²	28.5	56%	0.557	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	-140.6	-169.4	0	0	0	0	0	111.3
91	E	96.4	Very high	98.1	Very high	94 Å²	94	23.4 Å²	23.4	44%	0.439	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-15.2	-174.8	-66	-63	144.1	0	0	113.9	R37 S38	R37-E91 WeakPolarHBondContact CD-O 3.37Å; R37-E91 WeakPolarHBondContact CD-OE2 3.44Å; R37-E91 WeakPolarHBondContact CG-OE2 3.09Å; R37-E91 IonicContact NE-OE2 2.66Å; R37-E91 PolarHBondContact NH1-O 3.02Å; S38-E91 WeakPolarHBondContact CB-OE1 3.49Å; S38-E91 PolarHBondContact OG-OE1 2.91Å; S38-E91 PolarHBondContact OG-OE2 2.95Å
92	R	97.3	Very high	98.2	Very high	103 Å²	103	22.8 Å²	22.8	39%	0.389	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129	-23.9	-173.6	-68.6	-172.6	179.4	-176.5	-4.1	114.8	E107 L108	R92-E107 HydrophobicContact CB-CG 4.03Å; R92-E107 WeakPolarHBondContact O-CA 3.29Å; R92-L108 HydrophobicContact CB-CB 4.21Å; R92-L108 HydrophobicContact CG-CB 4.34Å; R92-L108 PolarHBondContact O-N 3.05Å
93	G	98.3	Very high	98.2	Very high	7 Å²	7	22.8 Å²	22.8	7%	0.072	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	143.9	-179.7	0	0	0	0	0	111	W88 V89 W106	W88-G93 VanDerWaalsContact CE3-O 3.29Å; V89-G93 PolarHBondContact N-O 3.48Å; V89-G93 WeakPolarHBondContact O-CA 3.44Å; V89-G93 PolarHBondContact O-N 2.82Å; G93-W106 CarbonylContact C-O 3.56Å; G93-W106 VanDerWaalsContact CA-O 3.3Å; G93-W106 WeakPolarHBondContact CA-O 3.2Å
94	I	98.8	Very high	98.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	116.9	176.7	-58.7	162.3	0	0	0	106.7	L43 L58 W88 V96 W106 I115	L43-I94 HydrophobicContact CD1-CD1 3.79Å; L43-I94 HydrophobicContact CD1-CG1 4.37Å; L43-I94 HydrophobicContact CD1-CG2 4.45Å; L43-I94 HydrophobicContact CD2-CB 4.45Å; L43-I94 HydrophobicContact CD2-CD1 4.31Å; L43-I94 HydrophobicContact CD2-CG1 3.98Å; L43-I94 HydrophobicContact CD2-CG2 3.73Å; L58-I94 HydrophobicContact CD1-CG2 4.29Å; W88-I94 HydrophobicContact CE3-CG1 3.92Å; W88-I94 HydrophobicContact CH2-CD1 4.41Å; W88-I94 HydrophobicContact CH2-CG1 4.3Å; W88-I94 HydrophobicContact CZ3-CD1 4.15Å; W88-I94 HydrophobicContact CZ3-CG1 3.65Å; I94-V96 HydrophobicContact CG2-CG2 4.06Å; I94-W106 HydrophobicContact CB-CB 4.28Å; I94-W106 PolarHBondContact N-O 3.43Å; I94-W106 PolarHBondContact O-N 3.13Å; I94-I115 HydrophobicContact CD1-CG2 4.22Å
95	L	98.8	Very high	98.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.1	177	-167.3	69.7	0	0	0	109.1	L86 T87 V89 V103 E104 L105 F119 V131 V133 A140 L154	L86-L95 CarbonylContact C-O 3.58Å; L86-L95 WeakPolarHBondContact CA-O 3.49Å; L86-L95 WeakPolarHBondContact CB-O 3.34Å; T87-L95 HydrophobicContact CG2-CB 4.08Å; T87-L95 HydrophobicContact CG2-CD2 4.48Å; T87-L95 PolarHBondContact N-O 3.38Å; T87-L95 PolarHBondContact O-N 2.86Å; V89-L95 HydrophobicContact CG2-CB 3.69Å; L95-V103 HydrophobicContact CD1-CG1 3.65Å; L95-V103 HydrophobicContact CG-CG1 4.17Å; L95-E104 CarbonylContact C-O 3.58Å; L95-E104 WeakPolarHBondContact CA-O 3.29Å; L95-L105 HydrophobicContact CD1-CB 4.24Å; L95-L105 HydrophobicContact CD1-CD1 4.24Å; L95-F119 HydrophobicContact CD1-CZ 4.26Å; L95-V131 HydrophobicContact CD2-CG2 3.36Å; L95-V131 HydrophobicContact CG-CG2 3.87Å; L95-V133 HydrophobicContact CD2-CG2 4.16Å; L95-A140 HydrophobicContact CD2-CB 3.37Å; L95-L154 HydrophobicContact CD1-CD2 3.89Å; L95-L154 HydrophobicContact CD2-CD2 4.22Å
96	V	98.9	Very high	98.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	134.3	-172.1	178.6	0	0	0	0	110.1	L58 V83 L86 I94 E104	L58-V96 HydrophobicContact CD1-CG2 3.84Å; L58-V96 HydrophobicContact CD2-CG2 3.84Å; L58-V96 HydrophobicContact CG-CG2 4.45Å; V83-V96 HydrophobicContact CB-CG1 4.46Å; V83-V96 HydrophobicContact CG1-CG1 4.07Å; V83-V96 HydrophobicContact CG2-CG1 4.03Å; L86-V96 HydrophobicContact CB-CG2 4.32Å; I94-V96 HydrophobicContact CG2-CG2 4.06Å; V96-E104 HydrophobicContact CB-CB 4.2Å; V96-E104 PolarHBondContact N-O 2.63Å; V96-E104 PolarHBondContact O-N 3.16Å
97	A	98.8	Very high	98.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	116	166.1	0	0	0	0	0	108.7	A84 D85 V128 V131	A84-A97 PolarHBondContact N-O 2.8Å; D85-A97 HydrophobicContact CB-CB 4.01Å; D85-A97 PolarHBondContact O-N 3.41Å; A97-V128 HydrophobicContact CB-CB 3.9Å; A97-V128 HydrophobicContact CB-CG1 3.64Å; A97-V128 WeakPolarHBondContact CB-O 3.4Å; A97-V131 HydrophobicContact CB-CB 4.15Å; A97-V131 HydrophobicContact CB-CG1 4.04Å
98	S	98.6	Very high	98.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	145.9	-170.1	-164.9	0	0	0	0	112	S100 G101 A102 E104 V128	S98-S100 PolarHBondContact O-N 3.17Å; S98-S100 PolarHBondContact OG-OG 2.64Å; S98-G101 PolarHBondContact O-N 3.23Å; S98-A102 VanDerWaalsContact CB-O 3.25Å; S98-A102 WeakPolarHBondContact CB-O 3.25Å; S98-A102 PolarHBondContact N-O 3.44Å; S98-A102 VanDerWaalsContact N-O 3.09Å; S98-E104 VanDerWaalsContact CB-OE1 3.26Å; S98-E104 WeakPolarHBondContact CB-OE1 3.26Å; S98-E104 PolarHBondContact OG-OE1 3.21Å; S98-V128 PolarHBondContact O-N 3.27Å
99	D	98.3	Very high	98	Very high	45 Å²	45	24.4 Å²	24.4	24%	0.241	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-20.4	172.3	-80.2	-25.2	0	0	0	112.8	A81 G82 G101 I127	A81-D99 HydrophobicContact CB-CB 4.16Å; G82-D99 WeakPolarHBondContact CA-OD2 3.29Å; G82-D99 PolarHBondContact O-N 3.23Å; D99-G101 PolarHBondContact O-N 2.78Å; D99-I127 HydrophobicContact CB-CG1 4.31Å; D99-I127 WeakPolarHBondContact O-CG1 3.32Å; D99-I127 WeakPolarHBondContact OD1-CG2 3.23Å
100	S	97.9	Very high	97.8	Very high	43 Å²	43	31.1 Å²	31.1	30%	0.301	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-3.6	178.6	67.2	0	0	0	0	114.3	E80 S98 A102 Y122	E80-S100 WeakPolarHBondContact OE1-CB 3.37Å; E80-S100 PolarHBondContact OE1-OG 2.95Å; E80-S100 VanDerWaalsContact OE1-OG 3.07Å; S98-S100 PolarHBondContact O-N 3.17Å; S98-S100 PolarHBondContact OG-OG 2.64Å; S100-A102 WeakPolarHBondContact OG-CB 3.25Å; S100-A102 PolarHBondContact OG-N 3.12Å; S100-Y122 WeakPolarHBondContact OG-CE1 3.21Å
101	G	98.1	Very high	97.7	Very high	1 Å²	1	34 Å²	34	1%	0.01	17%	0.167	C	C	.	.	S	Bend	trans	81.2	4.7	-168.8	0	0	0	0	0	113	S98 D99 H124 D126	S98-G101 PolarHBondContact O-N 3.23Å; D99-G101 PolarHBondContact O-N 2.78Å; G101-H124 WeakPolarHBondContact O-CB 3.48Å; G101-H124 PolarHBondContact O-N 2.87Å; G101-D126 VanDerWaalsContact CA-O 3.31Å; G101-D126 WeakPolarHBondContact CA-O 3.44Å
102	A	98.6	Very high	97.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	145.6	174.5	0	0	0	0	0	112.9	S98 S100 E104 C120 K121 Y122 V128	S98-A102 VanDerWaalsContact CB-O 3.25Å; S98-A102 WeakPolarHBondContact CB-O 3.25Å; S98-A102 PolarHBondContact N-O 3.44Å; S98-A102 VanDerWaalsContact N-O 3.09Å; S100-A102 WeakPolarHBondContact OG-CB 3.25Å; S100-A102 PolarHBondContact OG-N 3.12Å; A102-E104 HydrophobicContact CB-CG 4.12Å; A102-C120 VanDerWaalsContact CB-SG 3.56Å; A102-K121 VanDerWaalsContact CA-O 3.27Å; A102-K121 WeakPolarHBondContact CA-O 3.39Å; A102-Y122 HydrophobicContact CB-CD1 3.79Å; A102-Y122 HydrophobicContact CB-CE1 3.86Å; A102-Y122 HydrophobicContact CB-CG 4.29Å; A102-V128 WeakPolarHBondContact O-CG2 3.33Å
103	V	98.8	Very high	97.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.4	153.5	176.8	0	0	0	0	107.3	L95 F119 K121 V128 W152	L95-V103 HydrophobicContact CD1-CG1 3.65Å; L95-V103 HydrophobicContact CG-CG1 4.17Å; V103-F119 HydrophobicContact CG1-CE2 4.31Å; V103-F119 WeakPolarHBondContact O-CE2 3.49Å; V103-K121 PolarHBondContact N-O 3.37Å; V103-K121 PolarHBondContact O-N 2.75Å; V103-V128 HydrophobicContact CG2-CG1 4.15Å; V103-V128 HydrophobicContact CG2-CG2 4.27Å; V103-W152 HydrophobicContact CB-CH2 3.88Å; V103-W152 HydrophobicContact CB-CZ2 3.7Å; V103-W152 HydrophobicContact CB-CZ3 4.46Å; V103-W152 HydrophobicContact CG1-CZ2 4.48Å; V103-W152 HydrophobicContact CG2-CH2 4.06Å; V103-W152 HydrophobicContact CG2-CZ2 3.39Å
104	E	98.7	Very high	97.2	Very high	3 Å²	3	30.4 Å²	30.4	1%	0.014	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.4	-176.9	-48.2	174.3	-157.2	0	0	110.1	L95 V96 S98 A102 W106 F119 C120	L95-E104 CarbonylContact C-O 3.58Å; L95-E104 WeakPolarHBondContact CA-O 3.29Å; V96-E104 HydrophobicContact CB-CB 4.2Å; V96-E104 PolarHBondContact N-O 2.63Å; V96-E104 PolarHBondContact O-N 3.16Å; S98-E104 VanDerWaalsContact CB-OE1 3.26Å; S98-E104 WeakPolarHBondContact CB-OE1 3.26Å; S98-E104 PolarHBondContact OG-OE1 3.21Å; A102-E104 HydrophobicContact CB-CG 4.12Å; E104-W106 WeakPolarHBondContact OE2-CZ2 3.18Å; E104-W106 PolarHBondContact OE2-NE1 3.03Å; E104-F119 WeakPolarHBondContact CA-O 3.05Å; E104-C120 HydrophobicContact CG-CB 4.21Å
105	L	98.7	Very high	97.1	Very high	15 Å²	15	30.9 Å²	30.9	8%	0.079	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.3	169	-179.7	66.5	0	0	0	108.6	V89 L95 K118 F119	V89-L105 HydrophobicContact CB-CD1 4.37Å; V89-L105 HydrophobicContact CG2-CD1 3.96Å; L95-L105 HydrophobicContact CD1-CB 4.24Å; L95-L105 HydrophobicContact CD1-CD1 4.24Å; L105-K118 HydrophobicContact CB-CB 4.36Å; L105-K118 HydrophobicContact CD2-CB 4.19Å; L105-K118 HydrophobicContact CG-CB 4.13Å; L105-K118 WeakPolarHBondContact O-CA 3.39Å; L105-K118 WeakPolarHBondContact O-CB 3.44Å; L105-K118 PolarHBondContact O-N 2.78Å; L105-F119 HydrophobicContact CB-CD1 3.49Å; L105-F119 VanDerWaalsContact CB-CD1 3.49Å; L105-F119 HydrophobicContact CB-CD2 4.27Å; L105-F119 HydrophobicContact CB-CE1 3.25Å; L105-F119 HydrophobicContact CB-CE2 4.06Å; L105-F119 HydrophobicContact CB-CG 4.02Å; L105-F119 HydrophobicContact CB-CZ 3.56Å; L105-F119 HydrophobicContact CD2-CD1 3.89Å; L105-F119 HydrophobicContact CD2-CE1 3.55Å; L105-F119 HydrophobicContact CD2-CZ 4.48Å; L105-F119 HydrophobicContact CG-CD1 4.32Å; L105-F119 HydrophobicContact CG-CE1 4.03Å; L105-F119 PolarHBondContact N-O 2.86Å; L105-F119 PolarHBondContact O-N 3.45Å; L105-F119 VanDerWaalsContact O-N 3.16Å
106	W	98.6	Very high	97.1	Very high	25 Å²	25	34.6 Å²	34.6	10%	0.095	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	157.5	174.2	-62.4	81.3	0	0	0	109.5	L58 V77 T79 G93 I94 E104 I115 V116 S117	L58-W106 HydrophobicContact CD1-CB 4.32Å; L58-W106 HydrophobicContact CD1-CD2 4.17Å; L58-W106 HydrophobicContact CD1-CG 3.83Å; V77-W106 HydrophobicContact CB-CZ3 4.47Å; V77-W106 HydrophobicContact CG1-CE3 4.07Å; V77-W106 HydrophobicContact CG1-CZ3 4.04Å; V77-W106 HydrophobicContact CG2-CE3 4.44Å; V77-W106 HydrophobicContact CG2-CH2 4.06Å; V77-W106 HydrophobicContact CG2-CZ3 3.66Å; T79-W106 HydrophobicContact CG2-CZ2 4.1Å; G93-W106 CarbonylContact C-O 3.56Å; G93-W106 VanDerWaalsContact CA-O 3.3Å; G93-W106 WeakPolarHBondContact CA-O 3.2Å; I94-W106 HydrophobicContact CB-CB 4.28Å; I94-W106 PolarHBondContact N-O 3.43Å; I94-W106 PolarHBondContact O-N 3.13Å; E104-W106 WeakPolarHBondContact OE2-CZ2 3.18Å; E104-W106 PolarHBondContact OE2-NE1 3.03Å; W106-I115 HydrophobicContact CB-CG2 3.7Å; W106-I115 HydrophobicContact CD2-CG2 4.26Å; W106-I115 HydrophobicContact CE3-CG2 3.9Å; W106-I115 HydrophobicContact CG-CG2 4.23Å; W106-V116 CarbonylContact C-O 3.6Å; W106-V116 WeakPolarHBondContact CA-O 3.43Å; W106-V116 VanDerWaalsContact CE3-C 3.45Å; W106-S117 VanDerWaalsContact CE3-CA 3.45Å
107	E	98	Very high	97	Very high	61 Å²	61	37.3 Å²	37.3	29%	0.285	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	139.4	176.7	-165.3	170	124.4	0	0	111	R92 V116 K118	R92-E107 HydrophobicContact CB-CG 4.03Å; R92-E107 WeakPolarHBondContact O-CA 3.29Å; E107-V116 PolarHBondContact N-O 2.92Å; E107-V116 PolarHBondContact O-N 3.14Å; E107-K118 HydrophobicContact CB-CD 4.38Å; E107-K118 HydrophobicContact CB-CG 3.78Å; E107-K118 IonicContact OE1-NZ 2.88Å; E107-K118 PolarHBondContact OE1-NZ 3.31Å; E107-K118 WeakPolarHBondContact OE2-CE 3.36Å; E107-K118 IonicContact OE2-NZ 2.6Å; E107-K118 PolarHBondContact OE2-NZ 3.26Å
108	L	97.4	Very high	96.9	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	136.6	170.3	-68	170.1	0	0	0	110.7	L60 A75 W88 R92 E112 L114 I115	L60-L108 HydrophobicContact CD2-CD1 3.72Å; L60-L108 HydrophobicContact CD2-CD2 3.72Å; L60-L108 HydrophobicContact CD2-CG 4.4Å; A75-L108 HydrophobicContact CB-CD2 4.38Å; W88-L108 HydrophobicContact CH2-CD1 3.93Å; W88-L108 HydrophobicContact CZ3-CD1 3.97Å; R92-L108 HydrophobicContact CB-CB 4.21Å; R92-L108 HydrophobicContact CG-CB 4.34Å; R92-L108 PolarHBondContact O-N 3.05Å; L108-E112 HydrophobicContact CB-CG 4.36Å; L108-E112 HydrophobicContact CD1-CB 4.41Å; L108-E112 HydrophobicContact CD1-CG 4.33Å; L108-L114 WeakPolarHBondContact CA-O 3.33Å; L108-I115 HydrophobicContact CD2-CG1 3.65Å
109	D	96.1	Very high	96.9	Very high	35 Å²	35	42.6 Å²	42.6	19%	0.187	23%	0.225	C	C	.	.			trans	-65.6	174.6	170.9	81.8	-46.8	0	0	0	112	N111 E112 T113 L114	D109-N111 PolarHBondContact O-N 2.73Å; D109-N111 VanDerWaalsContact O-N 3.16Å; D109-E112 PolarHBondContact O-N 3.18Å; D109-E112 WeakPolarHBondContact OD1-CA 3.43Å; D109-E112 PolarHBondContact OD1-N 2.79Å; D109-T113 PolarHBondContact OD1-N 3.02Å; D109-T113 PolarHBondContact OD2-OG1 3.15Å; D109-L114 HydrophobicContact CB-CB 4.06Å; D109-L114 PolarHBondContact N-O 3.2Å; D109-L114 PolarHBondContact OD1-N 3.41Å
110	E	93.4	Very high	96.9	Very high	164 Å²	164	42.4 Å²	42.4	77%	0.766	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-32.3	-175.8	-65.7	-176.9	176	0	0	113.6
111	N	92.9	Very high	97	Very high	114 Å²	114	43.8 Å²	43.8	61%	0.61	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-6.6	-179.8	-59.4	-43.4	0	0	0	113.2	D109 T113	D109-N111 PolarHBondContact O-N 2.73Å; D109-N111 VanDerWaalsContact O-N 3.16Å; N111-T113 VanDerWaalsContact C-N 3.27Å; N111-T113 HydrophobicContact CB-CG2 4.1Å; N111-T113 PolarHBondContact O-N 2.98Å
112	E	93.6	Very high	97	Very high	29 Å²	29	49.8 Å²	49.8	14%	0.136	25%	0.25	C	S	.	.	S	Bend	trans	55.5	42	-174.1	-49.1	178.6	148.4	0	0	112.9	R37 L60 K62 L108 D109	R37-E112 IonicContact CZ-OE1 2.75Å; R37-E112 VanDerWaalsContact CZ-OE1 3.29Å; R37-E112 IonicContact NH1-OE1 3.8Å; R37-E112 PolarHBondContact NH1-OE1 3.44Å; R37-E112 IonicContact NH1-OE2 2.92Å; R37-E112 VanDerWaalsContact NH2-CD 3.33Å; R37-E112 IonicContact NH2-OE1 2.97Å; R37-E112 PolarHBondContact NH2-OE1 3.16Å; R37-E112 IonicContact NH2-OE2 3.86Å; R37-E112 PolarHBondContact NH2-OE2 2.98Å; L60-E112 HydrophobicContact CD2-CB 4.31Å; K62-E112 WeakPolarHBondContact CE-OE2 3.21Å; K62-E112 IonicContact NZ-OE2 3.72Å; K62-E112 PolarHBondContact NZ-OE2 2.88Å; L108-E112 HydrophobicContact CB-CG 4.36Å; L108-E112 HydrophobicContact CD1-CB 4.41Å; L108-E112 HydrophobicContact CD1-CG 4.33Å; D109-E112 PolarHBondContact O-N 3.18Å; D109-E112 WeakPolarHBondContact OD1-CA 3.43Å; D109-E112 PolarHBondContact OD1-N 2.79Å
113	T	93.8	Very high	97	Very high	53 Å²	53	53.9 Å²	53.9	33%	0.325	27%	0.269	S	S	.	.	S	Bend	trans	-113.2	-15.5	177.3	57.4	0	0	0	0	112.8	S74 A75 D109 N111	S74-T113 WeakPolarHBondContact O-CA 3.45Å; A75-T113 VanDerWaalsContact CB-C 3.5Å; A75-T113 WeakPolarHBondContact CB-O 3.13Å; D109-T113 PolarHBondContact OD1-N 3.02Å; D109-T113 PolarHBondContact OD2-OG1 3.15Å; N111-T113 VanDerWaalsContact C-N 3.27Å; N111-T113 HydrophobicContact CB-CG2 4.1Å; N111-T113 PolarHBondContact O-N 2.98Å
114	L	95	Very high	97	Very high	47 Å²	47	54.3 Å²	54.3	25%	0.246	27%	0.271	C	S	.	.			trans	-127.8	142.6	177.2	-62.5	174.5	0	0	0	110	P21 N22 L108 D109 V116	P21-L114 HydrophobicContact CB-CD2 4.17Å; P21-L114 WeakPolarHBondContact O-CD2 3.38Å; N22-L114 HydrophobicContact CB-CD2 4.36Å; L108-L114 WeakPolarHBondContact CA-O 3.33Å; D109-L114 HydrophobicContact CB-CB 4.06Å; D109-L114 PolarHBondContact N-O 3.2Å; D109-L114 PolarHBondContact OD1-N 3.41Å; L114-V116 HydrophobicContact CB-CG2 4.22Å
115	I	97.2	Very high	97	Very high	11 Å²	11	61.3 Å²	61.3	6%	0.056	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	117.6	169.5	-58	164.6	0	0	0	106.7	L58 A75 V77 I94 W106 L108	L58-I115 HydrophobicContact CB-CD1 4.13Å; L58-I115 HydrophobicContact CD1-CG2 4.31Å; A75-I115 HydrophobicContact CB-CD1 4.17Å; A75-I115 HydrophobicContact CB-CG1 3.93Å; V77-I115 HydrophobicContact CB-CB 4.06Å; V77-I115 HydrophobicContact CG1-CB 3.61Å; V77-I115 HydrophobicContact CG1-CD1 4.1Å; V77-I115 HydrophobicContact CG1-CG1 4.45Å; V77-I115 HydrophobicContact CG1-CG2 3.59Å; I94-I115 HydrophobicContact CD1-CG2 4.22Å; W106-I115 HydrophobicContact CB-CG2 3.7Å; W106-I115 HydrophobicContact CD2-CG2 4.26Å; W106-I115 HydrophobicContact CE3-CG2 3.9Å; W106-I115 HydrophobicContact CG-CG2 4.23Å; L108-I115 HydrophobicContact CD2-CG1 3.65Å
116	V	97.3	Very high	97	Very high	78 Å²	78	64.2 Å²	64.2	47%	0.473	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	131.3	-171.4	-175.6	0	0	0	0	110.3	W106 E107 L114 K118	W106-V116 CarbonylContact C-O 3.6Å; W106-V116 WeakPolarHBondContact CA-O 3.43Å; W106-V116 VanDerWaalsContact CE3-C 3.45Å; E107-V116 PolarHBondContact N-O 2.92Å; E107-V116 PolarHBondContact O-N 3.14Å; L114-V116 HydrophobicContact CB-CG2 4.22Å; V116-K118 PolarHBondContact O-N 3.02Å
117	S	97.5	Very high	97	Very high	57 Å²	57	64.8 Å²	64.8	40%	0.399	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	128	178.4	-175.1	0	0	0	0	110.5	W106	W106-S117 VanDerWaalsContact CE3-CA 3.45Å
118	K	97.5	Very high	97	Very high	102 Å²	102	61.9 Å²	61.9	44%	0.443	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-44.9	172.3	-74.7	-94.5	168.4	137.2	0	111	L105 E107 V116	L105-K118 HydrophobicContact CB-CB 4.36Å; L105-K118 HydrophobicContact CD2-CB 4.19Å; L105-K118 HydrophobicContact CG-CB 4.13Å; L105-K118 WeakPolarHBondContact O-CA 3.39Å; L105-K118 WeakPolarHBondContact O-CB 3.44Å; L105-K118 PolarHBondContact O-N 2.78Å; E107-K118 HydrophobicContact CB-CD 4.38Å; E107-K118 HydrophobicContact CB-CG 3.78Å; E107-K118 IonicContact OE1-NZ 2.88Å; E107-K118 PolarHBondContact OE1-NZ 3.31Å; E107-K118 WeakPolarHBondContact OE2-CE 3.36Å; E107-K118 IonicContact OE2-NZ 2.6Å; E107-K118 PolarHBondContact OE2-NZ 3.26Å; V116-K118 PolarHBondContact O-N 3.02Å
119	F	98.3	Very high	97.1	Very high	9 Å²	9	63 Å²	63	4%	0.039	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	156.5	169.4	71.6	-109.1	0	0	0	111.9	L95 V103 E104 L105 K121 L154 Q157	L95-F119 HydrophobicContact CD1-CZ 4.26Å; V103-F119 HydrophobicContact CG1-CE2 4.31Å; V103-F119 WeakPolarHBondContact O-CE2 3.49Å; E104-F119 WeakPolarHBondContact CA-O 3.05Å; L105-F119 HydrophobicContact CB-CD1 3.49Å; L105-F119 VanDerWaalsContact CB-CD1 3.49Å; L105-F119 HydrophobicContact CB-CD2 4.27Å; L105-F119 HydrophobicContact CB-CE1 3.25Å; L105-F119 HydrophobicContact CB-CE2 4.06Å; L105-F119 HydrophobicContact CB-CG 4.02Å; L105-F119 HydrophobicContact CB-CZ 3.56Å; L105-F119 HydrophobicContact CD2-CD1 3.89Å; L105-F119 HydrophobicContact CD2-CE1 3.55Å; L105-F119 HydrophobicContact CD2-CZ 4.48Å; L105-F119 HydrophobicContact CG-CD1 4.32Å; L105-F119 HydrophobicContact CG-CE1 4.03Å; L105-F119 PolarHBondContact N-O 2.86Å; L105-F119 PolarHBondContact O-N 3.45Å; L105-F119 VanDerWaalsContact O-N 3.16Å; F119-K121 HydrophobicContact CD2-CB 4.31Å; F119-K121 HydrophobicContact CD2-CG 3.63Å; F119-K121 HydrophobicContact CE2-CG 4.15Å; F119-K121 HydrophobicContact CG-CG 4.31Å; F119-L154 HydrophobicContact CZ-CD2 4.27Å; F119-Q157 HydrophobicContact CB-CB 4.45Å; F119-Q157 HydrophobicContact CB-CG 4.43Å; F119-Q157 HydrophobicContact CD1-CB 3.87Å; F119-Q157 HydrophobicContact CD1-CG 3.62Å; F119-Q157 HydrophobicContact CE1-CB 4.33Å; F119-Q157 HydrophobicContact CE1-CG 4.22Å; F119-Q157 HydrophobicContact CG-CB 4.25Å; F119-Q157 HydrophobicContact CG-CG 4.32Å
120	C	98.3	Very high	97.2	Very high	40 Å²	40	61.7 Å²	61.7	27%	0.27	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	120.2	165.4	174.4	0	0	0	0	107.3	A102 E104 Y122	A102-C120 VanDerWaalsContact CB-SG 3.56Å; E104-C120 HydrophobicContact CG-CB 4.21Å; C120-Y122 VanDerWaalsContact SG-CZ 3.56Å
121	K	98.6	Very high	97.5	Very high	73 Å²	73	54.1 Å²	54.1	32%	0.317	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	111.8	-173.5	-63.7	-65.2	-177.7	-178.6	0	111.3	A102 V103 F119 E123 W152 Q157	A102-K121 VanDerWaalsContact CA-O 3.27Å; A102-K121 WeakPolarHBondContact CA-O 3.39Å; V103-K121 PolarHBondContact N-O 3.37Å; V103-K121 PolarHBondContact O-N 2.75Å; F119-K121 HydrophobicContact CD2-CB 4.31Å; F119-K121 HydrophobicContact CD2-CG 3.63Å; F119-K121 HydrophobicContact CE2-CG 4.15Å; F119-K121 HydrophobicContact CG-CG 4.31Å; K121-E123 HydrophobicContact CB-CG 4.26Å; K121-E123 PolarHBondContact O-N 2.78Å; K121-E123 VanDerWaalsContact O-N 3.15Å; K121-W152 HydrophobicContact CB-CH2 4.02Å; K121-W152 HydrophobicContact CB-CZ3 3.81Å; K121-W152 HydrophobicContact CG-CZ3 4.32Å; K121-Q157 WeakPolarHBondContact CE-O 3.39Å
122	Y	98.4	Very high	97.7	Very high	126 Å²	126	49.3 Å²	49.3	49%	0.494	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	78	177.7	-53.1	-91.1	0	0	0	110.8	E80 S100 A102 C120	E80-Y122 WeakPolarHBondContact OE1-CE1 3.25Å; E80-Y122 VanDerWaalsContact OE1-CZ 3.26Å; E80-Y122 PolarHBondContact OE1-OH 2.99Å; E80-Y122 PolarHBondContact OE2-OH 2.96Å; S100-Y122 WeakPolarHBondContact OG-CE1 3.21Å; A102-Y122 HydrophobicContact CB-CD1 3.79Å; A102-Y122 HydrophobicContact CB-CE1 3.86Å; A102-Y122 HydrophobicContact CB-CG 4.29Å; C120-Y122 VanDerWaalsContact SG-CZ 3.56Å
123	E	98.6	Very high	97.9	Very high	87 Å²	87	49.3 Å²	49.3	41%	0.407	26%	0.259	S	S	.	.			trans	-104.7	-18.3	-178.7	-67.4	-73.6	153.9	0	0	112.7	K121 K150 W152 V159	K121-E123 HydrophobicContact CB-CG 4.26Å; K121-E123 PolarHBondContact O-N 2.78Å; K121-E123 VanDerWaalsContact O-N 3.15Å; E123-K150 HydrophobicContact CB-CD 3.97Å; E123-K150 WeakPolarHBondContact O-CE 3.33Å; E123-K150 PolarHBondContact O-NZ 2.89Å; E123-W152 HydrophobicContact CB-CH2 3.61Å; E123-W152 HydrophobicContact CB-CZ2 4.11Å; E123-W152 HydrophobicContact CG-CH2 3.55Å; E123-W152 HydrophobicContact CG-CZ2 4.48Å; E123-W152 HydrophobicContact CG-CZ3 4.01Å; E123-V159 HydrophobicContact CB-CG2 3.95Å; E123-V159 HydrophobicContact CG-CG2 3.67Å
124	H	98.7	Very high	98.1	Very high	8 Å²	8	47 Å²	47	4%	0.037	25%	0.245	C	C	.	.			trans	-93.8	145.3	173.2	-74.1	-77.4	0	0	0	110.9	G101 D126 V128 S142 S144 D146 K150	G101-H124 WeakPolarHBondContact O-CB 3.48Å; G101-H124 PolarHBondContact O-N 2.87Å; H124-D126 VanDerWaalsContact C-N 3.32Å; H124-V128 HydrophobicContact CB-CG2 4.07Å; H124-S142 PolarHBondContact NE2-OG 3.23Å; H124-S144 WeakPolarHBondContact ND1-CB 3.18Å; H124-D146 WeakPolarHBondContact CA-OD2 3.33Å; H124-D146 WeakPolarHBondContact CB-OD2 3.44Å; H124-D146 IonicContact CE1-OD1 3.87Å; H124-D146 IonicContact CE1-OD2 3.99Å; H124-D146 IonicContact CG-OD2 3.5Å; H124-D146 VanDerWaalsContact ND1-CG 3.3Å; H124-D146 IonicContact ND1-OD1 3.19Å; H124-D146 PolarHBondContact ND1-OD1 3.39Å; H124-D146 IonicContact ND1-OD2 2.83Å; H124-D146 PolarHBondContact ND1-OD2 3.47Å; H124-K150 WeakPolarHBondContact ND1-CE 3.49Å
125	D	98.6	Very high	98.1	Very high	150 Å²	150	47.7 Å²	47.7	80%	0.802	25%	0.253	S	S	*	.	S	Bend	trans	-88.4	-0	-178.1	-64.9	-38.2	0	0	0	113	D146	D125-D146 HydrophobicContact CB-CB 4.17Å; D125-D146 PolarHBondContact N-OD2 3.43Å
126	D	98.6	Very high	97.9	Very high	76 Å²	76	49.8 Å²	49.8	41%	0.406	27%	0.269	S	S	.	.	S	Bend	trans	-154.6	174.8	179.1	-154	-26.9	0	0	0	109.3	G101 H124 V128 S144 K145 D146	G101-D126 VanDerWaalsContact CA-O 3.31Å; G101-D126 WeakPolarHBondContact CA-O 3.44Å; H124-D126 VanDerWaalsContact C-N 3.32Å; D126-V128 PolarHBondContact O-N 2.69Å; D126-S144 PolarHBondContact O-OG 2.82Å; D126-K145 HydrophobicContact CB-CB 3.95Å; D126-D146 HydrophobicContact CB-CB 4.03Å
127	I	98.6	Very high	97.7	Very high	38 Å²	38	47.6 Å²	47.6	20%	0.195	26%	0.262	C	S	.	.			trans	-44.8	128.5	-178.4	-64.2	168	0	0	0	111.2	A84 D99 S129 S144 K145	A84-I127 HydrophobicContact CB-CG2 4.44Å; D99-I127 HydrophobicContact CB-CG1 4.31Å; D99-I127 WeakPolarHBondContact O-CG1 3.32Å; D99-I127 WeakPolarHBondContact OD1-CG2 3.23Å; I127-S129 PolarHBondContact O-N 3.1Å; I127-S144 WeakPolarHBondContact O-CA 3.29Å; I127-S144 WeakPolarHBondContact O-CB 3.3Å; I127-S144 PolarHBondContact O-OG 2.85Å; I127-K145 HydrophobicContact CB-CD 4.01Å; I127-K145 HydrophobicContact CB-CG 4.24Å; I127-K145 HydrophobicContact CD1-CD 4.21Å; I127-K145 PolarHBondContact O-N 3.07Å
128	V	98.9	Very high	97.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	113	168.8	-168.7	0	0	0	0	107.2	A84 A97 S98 A102 V103 H124 D126 G143	A84-V128 VanDerWaalsContact CB-O 3.25Å; A84-V128 WeakPolarHBondContact CB-O 3.46Å; A97-V128 HydrophobicContact CB-CB 3.9Å; A97-V128 HydrophobicContact CB-CG1 3.64Å; A97-V128 WeakPolarHBondContact CB-O 3.4Å; S98-V128 PolarHBondContact O-N 3.27Å; A102-V128 WeakPolarHBondContact O-CG2 3.33Å; V103-V128 HydrophobicContact CG2-CG1 4.15Å; V103-V128 HydrophobicContact CG2-CG2 4.27Å; H124-V128 HydrophobicContact CB-CG2 4.07Å; D126-V128 PolarHBondContact O-N 2.69Å; V128-G143 WeakPolarHBondContact CG1-O 3.22Å
129	S	98.6	Very high	97.7	Very high	26 Å²	26	45.8 Å²	45.8	18%	0.182	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-23	-171.2	46.7	0	0	0	0	113.4	I127 G143 V170	I127-S129 PolarHBondContact O-N 3.1Å; S129-G143 PolarHBondContact N-O 3.34Å; S129-G143 PolarHBondContact OG-O 3.4Å; S129-V170 PolarHBondContact OG-O 3.08Å
130	T	98.8	Very high	97.7	Very high	7 Å²	7	45.3 Å²	45.3	4%	0.043	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	144.3	-172	177.9	0	0	0	0	111	D85 S142 G143 V170 V173	D85-T130 WeakPolarHBondContact OD2-CA 3.38Å; T130-S142 WeakPolarHBondContact O-CA 3.2Å; T130-G143 PolarHBondContact N-O 3.34Å; T130-G143 PolarHBondContact O-N 2.83Å; T130-V170 HydrophobicContact CG2-CG1 4.47Å; T130-V173 HydrophobicContact CG2-CB 4.31Å; T130-V173 HydrophobicContact CG2-CG1 4.07Å; T130-V173 HydrophobicContact CG2-CG2 3.81Å; T130-V173 PolarHBondContact OG1-N 3.2Å
131	V	98.8	Very high	97.7	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.03	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	142.2	176.8	69.2	0	0	0	0	111.5	D85 T87 L95 A97 V141	D85-V131 HydrophobicContact CB-CG1 4.46Å; D85-V131 PolarHBondContact OD2-N 3.04Å; T87-V131 HydrophobicContact CG2-CG1 4.25Å; L95-V131 HydrophobicContact CD2-CG2 3.36Å; L95-V131 HydrophobicContact CG-CG2 3.87Å; A97-V131 HydrophobicContact CB-CB 4.15Å; A97-V131 HydrophobicContact CB-CG1 4.04Å; V131-V141 WeakPolarHBondContact CA-O 3.34Å
132	C	98.4	Very high	97.7	Very high	14 Å²	14	40 Å²	40	10%	0.095	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	151.4	173	68	0	0	0	0	111.6	A140 V141 V173 A175	C132-A140 CarbonylContact O-C 3.56Å; C132-A140 VanDerWaalsContact O-CA 3.23Å; C132-A140 WeakPolarHBondContact O-CA 3.37Å; C132-A140 WeakPolarHBondContact O-CB 3.46Å; C132-V141 PolarHBondContact N-O 2.94Å; C132-V141 PolarHBondContact O-N 2.83Å; C132-V173 HydrophobicContact CB-CG2 4.41Å; C132-A175 HydrophobicContact CB-CB 4.24Å; C132-A175 PolarHBondContact SG-N 3.44Å; C132-A175 VanDerWaalsContact SG-N 3.35Å
133	V	98.3	Very high	97.7	Very high	29 Å²	29	34 Å²	34	18%	0.176	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	132.3	175.7	174.6	0	0	0	0	108.6	T87 V89 L95 A175	T87-V133 HydrophobicContact CG2-CG2 3.63Å; V89-V133 HydrophobicContact CG2-CG2 3.72Å; L95-V133 HydrophobicContact CD2-CG2 4.16Å; V133-A175 WeakPolarHBondContact O-CB 3.45Å
134	L	97.8	Very high	97.7	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.026	18%	0.181	C	C	.	.			trans	-71.1	159	176.5	-66.3	176.2	0	0	0	110.8	S136 G137 Q139 V141 V151 A175 D180 F183	L134-S136 PolarHBondContact O-N 2.9Å; L134-G137 PolarHBondContact O-N 2.96Å; L134-Q139 HydrophobicContact CB-CB 4.28Å; L134-Q139 HydrophobicContact CD1-CB 3.64Å; L134-Q139 HydrophobicContact CG-CB 4.32Å; L134-Q139 PolarHBondContact N-O 2.84Å; L134-V141 HydrophobicContact CD1-CG2 4.15Å; L134-V141 HydrophobicContact CD2-CG2 3.79Å; L134-V141 HydrophobicContact CG-CG2 4Å; L134-V151 HydrophobicContact CD1-CG1 4.4Å; L134-A175 HydrophobicContact CD2-CB 3.82Å; L134-D180 WeakPolarHBondContact CB-OD1 3.4Å; L134-D180 VanDerWaalsContact CD1-O 3.3Å; L134-D180 WeakPolarHBondContact CD1-O 3.31Å; L134-D180 WeakPolarHBondContact CD2-O 3.34Å; L134-F183 HydrophobicContact CD2-CB 4.42Å; L134-F183 HydrophobicContact CD2-CD1 4.5Å
135	S	93.4	Very high	97.7	Very high	61 Å²	61	32.8 Å²	32.8	43%	0.427	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.8	-171.5	62.3	0	0	0	0	115.4	G137 D180	S135-G137 VanDerWaalsContact C-N 3.26Å; S135-G137 PolarHBondContact O-N 3.35Å; S135-D180 PolarHBondContact N-OD1 3.25Å; S135-D180 WeakPolarHBondContact OG-CA 3.42Å; S135-D180 WeakPolarHBondContact OG-CB 3.41Å; S135-D180 PolarHBondContact OG-N 2.59Å; S135-D180 VanDerWaalsContact OG-N 3.1Å; S135-D180 PolarHBondContact OG-OD1 2.81Å
136	S	93.3	Very high	97.7	Very high	54 Å²	54	26.1 Å²	26.1	38%	0.378	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-20.1	174.3	61.2	0	0	0	0	113.8	L134 T138 D180	L134-S136 PolarHBondContact O-N 2.9Å; S136-T138 PolarHBondContact O-N 3.36Å; S136-T138 PolarHBondContact OG-N 2.91Å; S136-T138 PolarHBondContact OG-OG1 2.86Å; S136-D180 WeakPolarHBondContact CA-OD1 3.1Å; S136-D180 WeakPolarHBondContact CB-OD1 3.23Å; S136-D180 PolarHBondContact N-OD1 2.72Å; S136-D180 PolarHBondContact OG-OD1 2.48Å; S136-D180 PolarHBondContact OG-OD2 2.94Å
137	G	94.4	Very high	97.7	Very high	32 Å²	32	25.8 Å²	25.8	33%	0.33	15%	0.154	S	C	.	.	S	Bend	trans	72.9	-0	-172	0	0	0	0	0	114.5	L134 S135	L134-G137 PolarHBondContact O-N 2.96Å; S135-G137 VanDerWaalsContact C-N 3.26Å; S135-G137 PolarHBondContact O-N 3.35Å
138	T	95.8	Very high	97.7	Very high	77 Å²	77	24.4 Å²	24.4	47%	0.472	15%	0.147	S	C	.	.	S	Bend	trans	-105	-18.9	-175.9	64.1	0	0	0	0	113.4	S136 L154	S136-T138 PolarHBondContact O-N 3.36Å; S136-T138 PolarHBondContact OG-N 2.91Å; S136-T138 PolarHBondContact OG-OG1 2.86Å; T138-L154 WeakPolarHBondContact O-CB 3.46Å; T138-L154 PolarHBondContact O-N 3.31Å
139	Q	97.8	Very high	97.7	Very high	44 Å²	44	24.5 Å²	24.5	21%	0.206	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	156.2	178.5	-64	-174.7	-10.1	0	0	110.7	L134 W152 L160	L134-Q139 HydrophobicContact CB-CB 4.28Å; L134-Q139 HydrophobicContact CD1-CB 3.64Å; L134-Q139 HydrophobicContact CG-CB 4.32Å; L134-Q139 PolarHBondContact N-O 2.84Å; Q139-W152 WeakPolarHBondContact CA-O 3.29Å; Q139-W152 VanDerWaalsContact CB-O 3.26Å; Q139-W152 WeakPolarHBondContact CB-O 2.98Å; Q139-L160 HydrophobicContact CG-CD1 4.38Å; Q139-L160 VanDerWaalsContact NE2-CD1 3.3Å
140	A	98.6	Very high	97.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	162.9	175.9	0	0	0	0	0	111.1	L95 C132 V151 W152 L154	L95-A140 HydrophobicContact CD2-CB 3.37Å; C132-A140 CarbonylContact O-C 3.56Å; C132-A140 VanDerWaalsContact O-CA 3.23Å; C132-A140 WeakPolarHBondContact O-CA 3.37Å; C132-A140 WeakPolarHBondContact O-CB 3.46Å; A140-V151 CarbonylContact O-C 3.6Å; A140-V151 WeakPolarHBondContact O-CA 3.49Å; A140-W152 HydrophobicContact CB-CB 4.35Å; A140-W152 PolarHBondContact N-O 2.93Å; A140-W152 VanDerWaalsContact N-O 3.13Å; A140-W152 PolarHBondContact O-N 2.83Å; A140-L154 HydrophobicContact CB-CD1 4.27Å; A140-L154 HydrophobicContact CB-CD2 3.88Å; A140-L154 HydrophobicContact CB-CG 4.27Å
141	V	98.8	Very high	97.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.1	173.9	-176.8	0	0	0	0	108.5	V131 C132 L134 I149 K150 V151 V173 F183	V131-V141 WeakPolarHBondContact CA-O 3.34Å; C132-V141 PolarHBondContact N-O 2.94Å; C132-V141 PolarHBondContact O-N 2.83Å; L134-V141 HydrophobicContact CD1-CG2 4.15Å; L134-V141 HydrophobicContact CD2-CG2 3.79Å; L134-V141 HydrophobicContact CG-CG2 4Å; V141-I149 HydrophobicContact CG1-CG2 3.47Å; V141-I149 VanDerWaalsContact CG1-CG2 3.47Å; V141-K150 CarbonylContact C-O 3.58Å; V141-K150 VanDerWaalsContact CA-O 3.29Å; V141-K150 WeakPolarHBondContact CA-O 3.42Å; V141-V151 HydrophobicContact CG2-CG2 4.3Å; V141-V173 HydrophobicContact CG1-CB 4.35Å; V141-V173 HydrophobicContact CG1-CG1 4.35Å; V141-V173 HydrophobicContact CG1-CG2 4.38Å; V141-F183 HydrophobicContact CG1-CD2 4.05Å; V141-F183 HydrophobicContact CG1-CE2 3.87Å; V141-F183 HydrophobicContact CG1-CG 4.5Å; V141-F183 HydrophobicContact CG1-CZ 4.16Å; V141-F183 HydrophobicContact CG2-CD1 3.96Å; V141-F183 HydrophobicContact CG2-CE1 4.13Å; V141-F183 HydrophobicContact CG2-CG 4.16Å; V141-F183 HydrophobicContact CG2-CZ 4.5Å
142	S	98.9	Very high	97.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	146	171.6	62.1	0	0	0	0	111	H124 T130 I149 K150 W152	H124-S142 PolarHBondContact NE2-OG 3.23Å; T130-S142 WeakPolarHBondContact O-CA 3.2Å; S142-I149 CarbonylContact O-C 3.53Å; S142-I149 VanDerWaalsContact O-CA 3.25Å; S142-I149 WeakPolarHBondContact O-CA 3.32Å; S142-K150 PolarHBondContact N-O 2.82Å; S142-K150 PolarHBondContact O-N 3.41Å; S142-W152 PolarHBondContact OG-NE1 2.82Å
143	G	98.8	Very high	97.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	147.9	167.6	0	0	0	0	0	110.3	V128 S129 T130	V128-G143 WeakPolarHBondContact CG1-O 3.22Å; S129-G143 PolarHBondContact N-O 3.34Å; S129-G143 PolarHBondContact OG-O 3.4Å; T130-G143 PolarHBondContact N-O 3.34Å; T130-G143 PolarHBondContact O-N 2.83Å
144	S	98.8	Very high	97.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	162.7	-175.5	166.6	0	0	0	0	112.5	H124 D126 I127 D146 F147 C148 V170	H124-S144 WeakPolarHBondContact ND1-CB 3.18Å; D126-S144 PolarHBondContact O-OG 2.82Å; I127-S144 WeakPolarHBondContact O-CA 3.29Å; I127-S144 WeakPolarHBondContact O-CB 3.3Å; I127-S144 PolarHBondContact O-OG 2.85Å; S144-D146 VanDerWaalsContact CB-OD1 3.25Å; S144-D146 WeakPolarHBondContact CB-OD1 3.47Å; S144-D146 PolarHBondContact O-N 3.13Å; S144-D146 VanDerWaalsContact OG-CG 3.32Å; S144-D146 PolarHBondContact OG-N 3.21Å; S144-D146 PolarHBondContact OG-OD1 3.18Å; S144-F147 PolarHBondContact O-N 3.24Å; S144-C148 PolarHBondContact N-O 2.85Å; S144-V170 PolarHBondContact O-N 2.91Å; S144-V170 VanDerWaalsContact O-N 3.12Å
145	K	98.8	Very high	97.6	Very high	70 Å²	70	27.2 Å²	27.2	30%	0.304	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-11.3	167.2	-62.4	-166.9	177.1	178.9	0	113.5	D126 I127 F147 Q169	D126-K145 HydrophobicContact CB-CB 3.95Å; I127-K145 HydrophobicContact CB-CD 4.01Å; I127-K145 HydrophobicContact CB-CG 4.24Å; I127-K145 HydrophobicContact CD1-CD 4.21Å; I127-K145 PolarHBondContact O-N 3.07Å; K145-F147 WeakPolarHBondContact O-CD1 3.35Å; K145-F147 WeakPolarHBondContact O-CE1 3.44Å; K145-F147 PolarHBondContact O-N 2.84Å; K145-Q169 HydrophobicContact CB-CG 4.11Å; K145-Q169 VanDerWaalsContact CE-OE1 3.27Å; K145-Q169 HydrophobicContact CG-CB 4.47Å; K145-Q169 HydrophobicContact CG-CG 4.18Å; K145-Q169 VanDerWaalsContact CG-OE1 3.25Å
146	D	98.6	Very high	97.8	Very high	11 Å²	11	30.6 Å²	30.6	6%	0.059	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	0.9	172	77.3	-2.9	0	0	0	114.1	H124 D125 D126 S144 C148 R164	H124-D146 WeakPolarHBondContact CA-OD2 3.33Å; H124-D146 WeakPolarHBondContact CB-OD2 3.44Å; H124-D146 IonicContact CE1-OD1 3.87Å; H124-D146 IonicContact CE1-OD2 3.99Å; H124-D146 IonicContact CG-OD2 3.5Å; H124-D146 VanDerWaalsContact ND1-CG 3.3Å; H124-D146 IonicContact ND1-OD1 3.19Å; H124-D146 PolarHBondContact ND1-OD1 3.39Å; H124-D146 IonicContact ND1-OD2 2.83Å; H124-D146 PolarHBondContact ND1-OD2 3.47Å; D125-D146 HydrophobicContact CB-CB 4.17Å; D125-D146 PolarHBondContact N-OD2 3.43Å; D126-D146 HydrophobicContact CB-CB 4.03Å; S144-D146 VanDerWaalsContact CB-OD1 3.25Å; S144-D146 WeakPolarHBondContact CB-OD1 3.47Å; S144-D146 PolarHBondContact O-N 3.13Å; S144-D146 VanDerWaalsContact OG-CG 3.32Å; S144-D146 PolarHBondContact OG-N 3.21Å; S144-D146 PolarHBondContact OG-OD1 3.18Å; D146-C148 PolarHBondContact O-N 2.81Å; D146-C148 WeakPolarHBondContact OD1-CA 3.32Å; D146-C148 WeakPolarHBondContact OD1-CB 3.24Å; D146-C148 PolarHBondContact OD1-N 2.69Å; D146-R164 VanDerWaalsContact O-CZ 3.23Å; D146-R164 PolarHBondContact O-NH1 2.77Å; D146-R164 VanDerWaalsContact O-NH1 3.12Å; D146-R164 PolarHBondContact O-NH2 2.73Å
147	F	98.6	Very high	98	Very high	69 Å²	69	31.2 Å²	31.2	30%	0.303	18%	0.175	S	C	.	.	S	Bend	trans	73.6	4.4	-179.9	-40.3	-21.3	0	0	0	114.2	S144 K145 A168 Q169	S144-F147 PolarHBondContact O-N 3.24Å; K145-F147 WeakPolarHBondContact O-CD1 3.35Å; K145-F147 WeakPolarHBondContact O-CE1 3.44Å; K145-F147 PolarHBondContact O-N 2.84Å; F147-A168 WeakPolarHBondContact CB-O 3.31Å; F147-A168 VanDerWaalsContact CD1-O 3.23Å; F147-A168 WeakPolarHBondContact CD1-O 3.43Å; F147-A168 WeakPolarHBondContact CG-O 3.34Å; F147-Q169 HydrophobicContact CD1-CG 4.45Å; F147-Q169 VanDerWaalsContact CD1-N 3.33Å; F147-Q169 HydrophobicContact CE1-CG 3.99Å
148	C	98.6	Very high	98.2	Very high	9 Å²	9	32.7 Å²	32.7	6%	0.061	18%	0.177	C	C	.	.			trans	-93.7	149.1	178.6	-58.9	0	0	0	0	111.4	S144 D146 Y163 R164	S144-C148 PolarHBondContact N-O 2.85Å; D146-C148 PolarHBondContact O-N 2.81Å; D146-C148 WeakPolarHBondContact OD1-CA 3.32Å; D146-C148 WeakPolarHBondContact OD1-CB 3.24Å; D146-C148 PolarHBondContact OD1-N 2.69Å; C148-Y163 CarbonylContact C-O 3.56Å; C148-Y163 WeakPolarHBondContact CA-O 3.31Å; C148-R164 PolarHBondContact SG-NH1 3.41Å
149	I	98.8	Very high	98.4	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.01	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129.4	164.3	-66.4	175.9	0	0	0	107.4	V141 S142 Y163 V170 V173 F183 S185 W195	V141-I149 HydrophobicContact CG1-CG2 3.47Å; V141-I149 VanDerWaalsContact CG1-CG2 3.47Å; S142-I149 CarbonylContact O-C 3.53Å; S142-I149 VanDerWaalsContact O-CA 3.25Å; S142-I149 WeakPolarHBondContact O-CA 3.32Å; I149-Y163 PolarHBondContact N-O 3.1Å; I149-Y163 PolarHBondContact O-N 3.12Å; I149-V170 HydrophobicContact CD1-CG1 4.25Å; I149-V170 HydrophobicContact CD1-CG2 4.46Å; I149-V170 HydrophobicContact CG1-CG1 4.13Å; I149-V170 HydrophobicContact CG1-CG2 3.94Å; I149-V173 HydrophobicContact CD1-CG1 4.35Å; I149-V173 HydrophobicContact CG1-CG1 4.48Å; I149-F183 HydrophobicContact CG2-CE2 3.85Å; I149-F183 HydrophobicContact CG2-CZ 4.06Å; I149-S185 VanDerWaalsContact CD1-OG 3.29Å; I149-S185 WeakPolarHBondContact CD1-OG 3.34Å; I149-W195 HydrophobicContact CD1-CH2 4.47Å; I149-W195 HydrophobicContact CD1-CZ2 3.65Å
150	K	98.8	Very high	98.4	Very high	17 Å²	17	31.8 Å²	31.8	7%	0.074	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138.4	178.6	-67.6	177.1	-166.6	-95.8	0	110.7	E123 H124 V141 S142 W152 V159 N161 S162	E123-K150 HydrophobicContact CB-CD 3.97Å; E123-K150 WeakPolarHBondContact O-CE 3.33Å; E123-K150 PolarHBondContact O-NZ 2.89Å; H124-K150 WeakPolarHBondContact ND1-CE 3.49Å; V141-K150 CarbonylContact C-O 3.58Å; V141-K150 VanDerWaalsContact CA-O 3.29Å; V141-K150 WeakPolarHBondContact CA-O 3.42Å; S142-K150 PolarHBondContact N-O 2.82Å; S142-K150 PolarHBondContact O-N 3.41Å; K150-W152 HydrophobicContact CB-CZ2 4.39Å; K150-W152 HydrophobicContact CD-CZ2 4.15Å; K150-V159 HydrophobicContact CB-CG1 4.03Å; K150-V159 HydrophobicContact CD-CG1 4.22Å; K150-V159 HydrophobicContact CD-CG2 4.08Å; K150-V159 HydrophobicContact CG-CG1 4.13Å; K150-N161 CarbonylContact C-O 3.6Å; K150-N161 VanDerWaalsContact CA-O 3.31Å; K150-N161 WeakPolarHBondContact CA-O 3.1Å; K150-S162 PolarHBondContact NZ-OG 2.94Å
151	V	98.6	Very high	98.3	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.012	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.7	172.2	-176.1	0	0	0	0	108.1	L134 A140 V141 V159 L160 N161 Y163 F183	L134-V151 HydrophobicContact CD1-CG1 4.4Å; A140-V151 CarbonylContact O-C 3.6Å; A140-V151 WeakPolarHBondContact O-CA 3.49Å; V141-V151 HydrophobicContact CG2-CG2 4.3Å; V151-V159 CarbonylContact O-C 3.57Å; V151-L160 HydrophobicContact CG1-CD1 4.49Å; V151-L160 PolarHBondContact O-N 2.9Å; V151-N161 HydrophobicContact CB-CB 4.36Å; V151-N161 PolarHBondContact N-O 2.73Å; V151-N161 PolarHBondContact O-N 3Å; V151-Y163 HydrophobicContact CG2-CD2 4.36Å; V151-Y163 HydrophobicContact CG2-CE2 3.74Å; V151-F183 HydrophobicContact CG2-CE1 4.31Å
152	W	98.7	Very high	98.3	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.4	-170.8	-61.2	82.9	0	0	0	111.2	V103 K121 E123 Q139 A140 S142 K150 L154 V159	V103-W152 HydrophobicContact CB-CH2 3.88Å; V103-W152 HydrophobicContact CB-CZ2 3.7Å; V103-W152 HydrophobicContact CB-CZ3 4.46Å; V103-W152 HydrophobicContact CG1-CZ2 4.48Å; V103-W152 HydrophobicContact CG2-CH2 4.06Å; V103-W152 HydrophobicContact CG2-CZ2 3.39Å; K121-W152 HydrophobicContact CB-CH2 4.02Å; K121-W152 HydrophobicContact CB-CZ3 3.81Å; K121-W152 HydrophobicContact CG-CZ3 4.32Å; E123-W152 HydrophobicContact CB-CH2 3.61Å; E123-W152 HydrophobicContact CB-CZ2 4.11Å; E123-W152 HydrophobicContact CG-CH2 3.55Å; E123-W152 HydrophobicContact CG-CZ2 4.48Å; E123-W152 HydrophobicContact CG-CZ3 4.01Å; Q139-W152 WeakPolarHBondContact CA-O 3.29Å; Q139-W152 VanDerWaalsContact CB-O 3.26Å; Q139-W152 WeakPolarHBondContact CB-O 2.98Å; A140-W152 HydrophobicContact CB-CB 4.35Å; A140-W152 PolarHBondContact N-O 2.93Å; A140-W152 VanDerWaalsContact N-O 3.13Å; A140-W152 PolarHBondContact O-N 2.83Å; S142-W152 PolarHBondContact OG-NE1 2.82Å; K150-W152 HydrophobicContact CB-CZ2 4.39Å; K150-W152 HydrophobicContact CD-CZ2 4.15Å; W152-L154 HydrophobicContact CB-CD2 4.42Å; W152-V159 HydrophobicContact CD2-CG2 3.96Å; W152-V159 HydrophobicContact CE3-CG2 3.66Å; W152-V159 HydrophobicContact CH2-CG2 3.58Å; W152-V159 HydrophobicContact CZ2-CG2 3.83Å; W152-V159 HydrophobicContact CZ3-CG2 3.47Å; W152-V159 VanDerWaalsContact CZ3-CG2 3.47Å
153	D	98.2	Very high	98.3	Very high	25 Å²	25	40.2 Å²	40.2	13%	0.134	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	112	160.3	-173.3	-51.1	0	0	0	108.1	A155 Q156 Q157 V158 L160	D153-A155 VanDerWaalsContact C-N 3.31Å; D153-A155 PolarHBondContact O-N 3.37Å; D153-A155 PolarHBondContact OD1-N 3.07Å; D153-Q156 HydrophobicContact CB-CB 4.13Å; D153-Q156 PolarHBondContact OD1-N 3.08Å; D153-Q157 WeakPolarHBondContact O-CA 3.47Å; D153-Q157 PolarHBondContact O-N 3.11Å; D153-V158 HydrophobicContact CB-CG2 4.27Å; D153-V158 PolarHBondContact N-O 3.06Å; D153-V158 PolarHBondContact O-N 3.27Å; D153-L160 HydrophobicContact CB-CD1 3.99Å; D153-L160 HydrophobicContact CB-CD2 3.91Å; D153-L160 HydrophobicContact CB-CG 3.87Å
154	L	97.8	Very high	98.2	Very high	12 Å²	12	47.7 Å²	47.7	6%	0.063	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-26.2	-174.5	-60.6	178.7	0	0	0	112.5	V89 L95 F119 T138 A140 W152	V89-L154 HydrophobicContact CG1-CD1 3.72Å; V89-L154 HydrophobicContact CG2-CD1 4.02Å; L95-L154 HydrophobicContact CD1-CD2 3.89Å; L95-L154 HydrophobicContact CD2-CD2 4.22Å; F119-L154 HydrophobicContact CZ-CD2 4.27Å; T138-L154 WeakPolarHBondContact O-CB 3.46Å; T138-L154 PolarHBondContact O-N 3.31Å; A140-L154 HydrophobicContact CB-CD1 4.27Å; A140-L154 HydrophobicContact CB-CD2 3.88Å; A140-L154 HydrophobicContact CB-CG 4.27Å; W152-L154 HydrophobicContact CB-CD2 4.42Å
155	A	96.4	Very high	98.2	Very high	86 Å²	86	49.3 Å²	49.3	71%	0.711	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-42.2	180	0	0	0	0	0	111.5	D153 Q157	D153-A155 VanDerWaalsContact C-N 3.31Å; D153-A155 PolarHBondContact O-N 3.37Å; D153-A155 PolarHBondContact OD1-N 3.07Å; A155-Q157 VanDerWaalsContact C-N 3.33Å
156	Q	97.5	Very high	98.1	Very high	131 Å²	131	46.3 Å²	46.3	61%	0.612	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-15.3	176.9	-63	-175.4	19.1	0	0	112.7	D153 V158	D153-Q156 HydrophobicContact CB-CB 4.13Å; D153-Q156 PolarHBondContact OD1-N 3.08Å; Q156-V158 VanDerWaalsContact C-N 3.32Å; Q156-V158 HydrophobicContact CB-CG2 3.8Å; Q156-V158 PolarHBondContact O-N 2.95Å
157	Q	97.8	Very high	98.1	Very high	68 Å²	68	49.3 Å²	49.3	32%	0.318	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	39.7	179.6	-44.7	-179.1	-12	0	0	112.5	F119 K121 D153 A155	F119-Q157 HydrophobicContact CB-CB 4.45Å; F119-Q157 HydrophobicContact CB-CG 4.43Å; F119-Q157 HydrophobicContact CD1-CB 3.87Å; F119-Q157 HydrophobicContact CD1-CG 3.62Å; F119-Q157 HydrophobicContact CE1-CB 4.33Å; F119-Q157 HydrophobicContact CE1-CG 4.22Å; F119-Q157 HydrophobicContact CG-CB 4.25Å; F119-Q157 HydrophobicContact CG-CG 4.32Å; K121-Q157 WeakPolarHBondContact CE-O 3.39Å; D153-Q157 WeakPolarHBondContact O-CA 3.47Å; D153-Q157 PolarHBondContact O-N 3.11Å; A155-Q157 VanDerWaalsContact C-N 3.33Å
158	V	98.3	Very high	98.1	Very high	63 Å²	63	47 Å²	47	38%	0.382	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	155.4	-177.2	-62.2	0	0	0	0	111.6	D153 Q156 L160	D153-V158 HydrophobicContact CB-CG2 4.27Å; D153-V158 PolarHBondContact N-O 3.06Å; D153-V158 PolarHBondContact O-N 3.27Å; Q156-V158 VanDerWaalsContact C-N 3.32Å; Q156-V158 HydrophobicContact CB-CG2 3.8Å; Q156-V158 PolarHBondContact O-N 2.95Å; V158-L160 HydrophobicContact CG2-CD2 4.45Å
159	V	98.6	Very high	98	Very high	37 Å²	37	49.1 Å²	49.1	22%	0.224	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	120.6	167.6	179.1	0	0	0	0	108.7	E123 K150 V151 W152 N161	E123-V159 HydrophobicContact CB-CG2 3.95Å; E123-V159 HydrophobicContact CG-CG2 3.67Å; K150-V159 HydrophobicContact CB-CG1 4.03Å; K150-V159 HydrophobicContact CD-CG1 4.22Å; K150-V159 HydrophobicContact CD-CG2 4.08Å; K150-V159 HydrophobicContact CG-CG1 4.13Å; V151-V159 CarbonylContact O-C 3.57Å; W152-V159 HydrophobicContact CD2-CG2 3.96Å; W152-V159 HydrophobicContact CE3-CG2 3.66Å; W152-V159 HydrophobicContact CH2-CG2 3.58Å; W152-V159 HydrophobicContact CZ2-CG2 3.83Å; W152-V159 HydrophobicContact CZ3-CG2 3.47Å; W152-V159 VanDerWaalsContact CZ3-CG2 3.47Å; V159-N161 VanDerWaalsContact CG1-O 3.29Å; V159-N161 WeakPolarHBondContact CG1-O 3.47Å
160	L	97.9	Very high	98	Very high	65 Å²	65	49.1 Å²	49.1	34%	0.34	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-44.3	174.6	-65.1	177.5	0	0	0	111.3	Q139 V151 D153 V158	Q139-L160 HydrophobicContact CG-CD1 4.38Å; Q139-L160 VanDerWaalsContact NE2-CD1 3.3Å; V151-L160 HydrophobicContact CG1-CD1 4.49Å; V151-L160 PolarHBondContact O-N 2.9Å; D153-L160 HydrophobicContact CB-CD1 3.99Å; D153-L160 HydrophobicContact CB-CD2 3.91Å; D153-L160 HydrophobicContact CB-CG 3.87Å; V158-L160 HydrophobicContact CG2-CD2 4.45Å
161	N	97.8	Very high	98	Very high	71 Å²	71	50.5 Å²	50.5	38%	0.38	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	144.7	-177.7	-61.5	104.6	0	0	0	110.9	K150 V151 V159 Y163	K150-N161 CarbonylContact C-O 3.6Å; K150-N161 VanDerWaalsContact CA-O 3.31Å; K150-N161 WeakPolarHBondContact CA-O 3.1Å; V151-N161 HydrophobicContact CB-CB 4.36Å; V151-N161 PolarHBondContact N-O 2.73Å; V151-N161 PolarHBondContact O-N 3Å; V159-N161 VanDerWaalsContact CG1-O 3.29Å; V159-N161 WeakPolarHBondContact CG1-O 3.47Å; N161-Y163 HydrophobicContact CB-CD2 4.43Å; N161-Y163 HydrophobicContact CB-CE1 4.1Å; N161-Y163 HydrophobicContact CB-CE2 3.68Å; N161-Y163 VanDerWaalsContact CB-CZ 3.48Å; N161-Y163 WeakPolarHBondContact CB-OH 3.21Å
162	S	98.3	Very high	98	Very high	66 Å²	66	51.4 Å²	51.4	46%	0.462	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	120.2	173.3	-169	0	0	0	0	108.5	K150	K150-S162 PolarHBondContact NZ-OG 2.94Å
163	Y	98.4	Very high	98	Very high	39 Å²	39	51.7 Å²	51.7	15%	0.153	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.5	-176	-55.8	-66.3	0	0	0	110.7	C148 I149 V151 N161 W195 P202	C148-Y163 CarbonylContact C-O 3.56Å; C148-Y163 WeakPolarHBondContact CA-O 3.31Å; I149-Y163 PolarHBondContact N-O 3.1Å; I149-Y163 PolarHBondContact O-N 3.12Å; V151-Y163 HydrophobicContact CG2-CD2 4.36Å; V151-Y163 HydrophobicContact CG2-CE2 3.74Å; N161-Y163 HydrophobicContact CB-CD2 4.43Å; N161-Y163 HydrophobicContact CB-CE1 4.1Å; N161-Y163 HydrophobicContact CB-CE2 3.68Å; N161-Y163 VanDerWaalsContact CB-CZ 3.48Å; N161-Y163 WeakPolarHBondContact CB-OH 3.21Å; Y163-W195 HydrophobicContact CD1-CZ3 4.04Å; Y163-W195 HydrophobicContact CD2-CE3 4.22Å; Y163-W195 HydrophobicContact CD2-CH2 4.4Å; Y163-W195 AromaticContact CD2-CZ3 3.73Å; Y163-W195 HydrophobicContact CD2-CZ3 3.73Å; Y163-W195 HydrophobicContact CE2-CZ3 4.37Å; Y163-W195 HydrophobicContact CG-CE3 4.42Å; Y163-W195 HydrophobicContact CG-CH2 4.06Å; Y163-W195 AromaticContact CG-CZ3 3.52Å; Y163-W195 HydrophobicContact CG-CZ3 3.52Å; Y163-P202 HydrophobicContact CD1-CG 4.08Å; Y163-P202 HydrophobicContact CE1-CG 3.69Å
164	R	98	Very high	98	Very high	157 Å²	157	51.1 Å²	51.1	59%	0.592	29%	0.293	S	S	*	.			trans	-111.6	69.9	173.3	-163.4	179.1	-164.2	97.7	8.1	110	D146 C148	D146-R164 VanDerWaalsContact O-CZ 3.23Å; D146-R164 PolarHBondContact O-NH1 2.77Å; D146-R164 VanDerWaalsContact O-NH1 3.12Å; D146-R164 PolarHBondContact O-NH2 2.73Å; C148-R164 PolarHBondContact SG-NH1 3.41Å
165	A	97.1	Very high	98	Very high	35 Å²	35	51.5 Å²	51.5	29%	0.289	30%	0.298	S	S	.	.			trans	-95.8	-26.9	-178.8	0	0	0	0	0	113.5	L193 W195 A203	A165-L193 HydrophobicContact CB-CD1 3.84Å; A165-W195 HydrophobicContact CB-CH2 3.43Å; A165-W195 VanDerWaalsContact CB-CH2 3.43Å; A165-W195 HydrophobicContact CB-CZ2 3.79Å; A165-W195 HydrophobicContact CB-CZ3 4.5Å; A165-A203 HydrophobicContact CB-CB 4.39Å
166	H	97.8	Very high	98.1	Very high	7 Å²	7	47.5 Å²	47.5	3%	0.032	27%	0.265	C	S	.	.			trans	-82	150.2	173.9	-73.8	-68.7	0	0	0	111.4	V170 S185 S187 D189	H166-V170 HydrophobicContact CB-CG2 4.37Å; H166-S185 PolarHBondContact NE2-OG 3.05Å; H166-S187 VanDerWaalsContact CE1-CB 3.45Å; H166-S187 WeakPolarHBondContact CE1-CB 3.11Å; H166-S187 WeakPolarHBondContact ND1-CB 3.4Å; H166-D189 WeakPolarHBondContact CA-OD2 3.46Å; H166-D189 IonicContact CE1-OD1 3.46Å; H166-D189 IonicContact CG-OD2 3.46Å; H166-D189 IonicContact ND1-OD1 3.74Å; H166-D189 PolarHBondContact ND1-OD1 3.14Å; H166-D189 IonicContact ND1-OD2 2.98Å; H166-D189 PolarHBondContact ND1-OD2 3.15Å; H166-D189 VanDerWaalsContact ND1-OD2 3.13Å
167	A	97.8	Very high	97.9	Very high	73 Å²	73	44.1 Å²	44.1	60%	0.603	26%	0.255	S	S	*	.	S	Bend	trans	-100.3	-1.9	178.3	0	0	0	0	0	113.7	D189	A167-D189 HydrophobicContact CB-CB 4.04Å; A167-D189 PolarHBondContact N-OD2 3.26Å
168	A	98.1	Very high	97.6	Very high	20 Å²	20	45.2 Å²	45.2	17%	0.165	26%	0.26	C	S	.	.	S	Bend	trans	-146.3	-173	177.9	0	0	0	0	0	110.1	F147 V170 S187 E188 D189	F147-A168 WeakPolarHBondContact CB-O 3.31Å; F147-A168 VanDerWaalsContact CD1-O 3.23Å; F147-A168 WeakPolarHBondContact CD1-O 3.43Å; F147-A168 WeakPolarHBondContact CG-O 3.34Å; A168-V170 PolarHBondContact O-N 3.05Å; A168-S187 PolarHBondContact O-OG 3.2Å; A168-E188 HydrophobicContact CB-CB 3.82Å; A168-D189 HydrophobicContact CB-CB 3.99Å
169	Q	98.4	Very high	97.4	Very high	55 Å²	55	45.3 Å²	45.3	26%	0.257	26%	0.255	S	S	.	.			trans	-55.5	134.2	-176.6	-60.9	175.3	70.3	0	0	110.9	K145 F147 S187 E188	K145-Q169 HydrophobicContact CB-CG 4.11Å; K145-Q169 VanDerWaalsContact CE-OE1 3.27Å; K145-Q169 HydrophobicContact CG-CB 4.47Å; K145-Q169 HydrophobicContact CG-CG 4.18Å; K145-Q169 VanDerWaalsContact CG-OE1 3.25Å; F147-Q169 HydrophobicContact CD1-CG 4.45Å; F147-Q169 VanDerWaalsContact CD1-N 3.33Å; F147-Q169 HydrophobicContact CE1-CG 3.99Å; Q169-S187 VanDerWaalsContact O-CA 3.26Å; Q169-S187 WeakPolarHBondContact O-CA 3.44Å; Q169-S187 WeakPolarHBondContact O-CB 3.4Å; Q169-S187 PolarHBondContact O-OG 3.22Å; Q169-E188 HydrophobicContact CB-CG 4.31Å; Q169-E188 VanDerWaalsContact NE2-CD 3.32Å; Q169-E188 PolarHBondContact NE2-OE1 2.86Å; Q169-E188 PolarHBondContact NE2-OE2 2.82Å; Q169-E188 PolarHBondContact O-N 3.08Å; Q169-E188 VanDerWaalsContact O-N 3.16Å
170	V	98.8	Very high	97.2	Very high	1 Å²	1	46 Å²	46	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.3	172.6	-175.7	0	0	0	0	107.9	S129 T130 S144 I149 H166 A168 V173	S129-V170 PolarHBondContact OG-O 3.08Å; T130-V170 HydrophobicContact CG2-CG1 4.47Å; S144-V170 PolarHBondContact O-N 2.91Å; S144-V170 VanDerWaalsContact O-N 3.12Å; I149-V170 HydrophobicContact CD1-CG1 4.25Å; I149-V170 HydrophobicContact CD1-CG2 4.46Å; I149-V170 HydrophobicContact CG1-CG1 4.13Å; I149-V170 HydrophobicContact CG1-CG2 3.94Å; H166-V170 HydrophobicContact CB-CG2 4.37Å; A168-V170 PolarHBondContact O-N 3.05Å; V170-V173 HydrophobicContact CG1-CG1 3.97Å
171	T	98.3	Very high	97.1	Very high	47 Å²	47	43.8 Å²	43.8	29%	0.288	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-41.3	-172.8	-40.9	0	0	0	0	111.9	C186 S187 T216	T171-C186 PolarHBondContact N-O 3.48Å; T171-S187 WeakPolarHBondContact OG1-CA 3.47Å; T171-T216 WeakPolarHBondContact CG2-O 3.5Å
172	C	98.6	Very high	97.1	Very high	20 Å²	20	40.8 Å²	40.8	14%	0.135	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	142.7	-178.5	-172.9	0	0	0	0	110.5	S185 C186 L218	C172-S185 CarbonylContact O-C 3.58Å; C172-S185 VanDerWaalsContact O-CA 3.24Å; C172-S185 WeakPolarHBondContact O-CA 3.38Å; C172-C186 PolarHBondContact N-O 3.45Å; C172-C186 PolarHBondContact O-N 3.22Å; C172-L218 HydrophobicContact CB-CD1 4.33Å; C172-L218 HydrophobicContact CB-CG 4.42Å
173	V	98.8	Very high	97.1	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.042	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.4	166.1	-62.5	0	0	0	0	109.7	T130 C132 V141 I149 V170 L184	T130-V173 HydrophobicContact CG2-CB 4.31Å; T130-V173 HydrophobicContact CG2-CG1 4.07Å; T130-V173 HydrophobicContact CG2-CG2 3.81Å; T130-V173 PolarHBondContact OG1-N 3.2Å; C132-V173 HydrophobicContact CB-CG2 4.41Å; V141-V173 HydrophobicContact CG1-CB 4.35Å; V141-V173 HydrophobicContact CG1-CG1 4.35Å; V141-V173 HydrophobicContact CG1-CG2 4.38Å; I149-V173 HydrophobicContact CD1-CG1 4.35Å; I149-V173 HydrophobicContact CG1-CG1 4.48Å; V170-V173 HydrophobicContact CG1-CG1 3.97Å; V173-L184 CarbonylContact C-O 3.33Å; V173-L184 VanDerWaalsContact CA-O 3.31Å; V173-L184 WeakPolarHBondContact CA-O 3.32Å
174	A	98.5	Very high	97.1	Very high	13 Å²	13	35.8 Å²	35.8	11%	0.107	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	111.4	-178.8	0	0	0	0	0	111.4	F183 L184 L218 W220	A174-F183 CarbonylContact O-C 3.56Å; A174-F183 VanDerWaalsContact O-CA 3.31Å; A174-F183 WeakPolarHBondContact O-CA 3.5Å; A174-F183 WeakPolarHBondContact O-CB 3.3Å; A174-L184 HydrophobicContact CB-CB 4.47Å; A174-L184 PolarHBondContact N-O 2.72Å; A174-L184 PolarHBondContact O-N 2.96Å; A174-L218 HydrophobicContact CB-CB 3.99Å; A174-W220 PolarHBondContact O-NE1 3.09Å
175	A	98.1	Very high	97.1	Very high	20 Å²	20	28.3 Å²	28.3	17%	0.165	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	140.4	175.4	0	0	0	0	0	111.7	C132 V133 L134	C132-A175 HydrophobicContact CB-CB 4.24Å; C132-A175 PolarHBondContact SG-N 3.44Å; C132-A175 VanDerWaalsContact SG-N 3.35Å; V133-A175 WeakPolarHBondContact O-CB 3.45Å; L134-A175 HydrophobicContact CD2-CB 3.82Å
176	S	96.9	Very high	97.2	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.014	16%	0.16	C	C	.	.			trans	-67.7	133.5	172.5	-176.5	0	0	0	0	110.2	H178 V182	S176-H178 PolarHBondContact O-N 2.9Å; S176-V182 WeakPolarHBondContact CB-O 3.48Å; S176-V182 PolarHBondContact N-O 2.82Å
177	P	94.4	Very high	97.2	Very high	60 Å²	60	26.3 Å²	26.3	39%	0.39	16%	0.159	S	C	.	.	S	Bend	trans	-70.7	-13.2	178.8	26.9	-33.5	0	0	0	113.3	W220	P177-W220 HydrophobicContact CG-CB 4.09Å
178	H	90.1	Very high	97.2	Very high	91 Å²	91	27.1 Å²	27.1	42%	0.421	15%	0.15	S	C	.	.	S	Bend	trans	-119.3	-14.4	-173.2	-53.6	-61.3	0	0	0	114.5	S176 P222	S176-H178 PolarHBondContact O-N 2.9Å; H178-P222 PolarHBondContact CE1-O 3.04Å; H178-P222 VanDerWaalsContact CE1-O 3.3Å; H178-P222 PolarHBondContact NE2-O 2.91Å
179	K	94.6	Very high	97.1	Very high	65 Å²	65	27.6 Å²	27.6	28%	0.283	15%	0.15	S	C	.	.			trans	-138	109.3	-169.1	-65.3	175.5	-169	164.6	0	110.2	S181 V182 E226	K179-S181 VanDerWaalsContact C-N 3.27Å; K179-S181 PolarHBondContact O-N 3.39Å; K179-V182 HydrophobicContact CB-CB 3.84Å; K179-V182 HydrophobicContact CB-CG2 3.86Å; K179-V182 HydrophobicContact CD-CB 4.35Å; K179-V182 HydrophobicContact CD-CG2 3.9Å; K179-V182 PolarHBondContact O-N 3.24Å; K179-E226 IonicContact NZ-OE1 3.34Å; K179-E226 PolarHBondContact NZ-OE1 3.31Å
180	D	95.2	Very high	96.9	Very high	52 Å²	52	28.5 Å²	28.5	28%	0.278	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-32.9	-175.3	-161.9	59	0	0	0	113.9	L134 S135 S136 V182	L134-D180 WeakPolarHBondContact CB-OD1 3.4Å; L134-D180 VanDerWaalsContact CD1-O 3.3Å; L134-D180 WeakPolarHBondContact CD1-O 3.31Å; L134-D180 WeakPolarHBondContact CD2-O 3.34Å; S135-D180 PolarHBondContact N-OD1 3.25Å; S135-D180 WeakPolarHBondContact OG-CA 3.42Å; S135-D180 WeakPolarHBondContact OG-CB 3.41Å; S135-D180 PolarHBondContact OG-N 2.59Å; S135-D180 VanDerWaalsContact OG-N 3.1Å; S135-D180 PolarHBondContact OG-OD1 2.81Å; S136-D180 WeakPolarHBondContact CA-OD1 3.1Å; S136-D180 WeakPolarHBondContact CB-OD1 3.23Å; S136-D180 PolarHBondContact N-OD1 2.72Å; S136-D180 PolarHBondContact OG-OD1 2.48Å; S136-D180 PolarHBondContact OG-OD2 2.94Å; D180-V182 VanDerWaalsContact C-N 3.3Å; D180-V182 PolarHBondContact O-N 3.28Å
181	S	95.9	Very high	96.7	Very high	18 Å²	18	33.1 Å²	33.1	13%	0.126	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.9	179.6	70.3	0	0	0	0	114.5	K179 D196 T197 R198	K179-S181 VanDerWaalsContact C-N 3.27Å; K179-S181 PolarHBondContact O-N 3.39Å; S181-D196 WeakPolarHBondContact O-CA 3.23Å; S181-D196 PolarHBondContact OG-OD1 2.85Å; S181-T197 WeakPolarHBondContact CB-OG1 3.33Å; S181-T197 PolarHBondContact O-N 2.86Å; S181-T197 PolarHBondContact O-OG1 2.75Å; S181-R198 WeakPolarHBondContact OG-CD 3.18Å; S181-R198 PolarHBondContact OG-NE 2.82Å; S181-R198 VanDerWaalsContact OG-NE 3.08Å
182	V	97.6	Very high	96.6	Very high	9 Å²	9	31.3 Å²	31.3	6%	0.055	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.9	-170.1	178.2	0	0	0	0	111.4	S176 K179 D180 L194 W195 D196 W220	S176-V182 WeakPolarHBondContact CB-O 3.48Å; S176-V182 PolarHBondContact N-O 2.82Å; K179-V182 HydrophobicContact CB-CB 3.84Å; K179-V182 HydrophobicContact CB-CG2 3.86Å; K179-V182 HydrophobicContact CD-CB 4.35Å; K179-V182 HydrophobicContact CD-CG2 3.9Å; K179-V182 PolarHBondContact O-N 3.24Å; D180-V182 VanDerWaalsContact C-N 3.3Å; D180-V182 PolarHBondContact O-N 3.28Å; V182-L194 HydrophobicContact CG1-CD1 3.78Å; V182-W195 VanDerWaalsContact CA-O 3.23Å; V182-W195 WeakPolarHBondContact CA-O 3.42Å; V182-W195 WeakPolarHBondContact CG1-O 3.39Å; V182-D196 HydrophobicContact CG2-CB 4.35Å; V182-W220 HydrophobicContact CG1-CH2 4.45Å; V182-W220 HydrophobicContact CG1-CZ2 4.1Å
183	F	98.4	Very high	96.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	165.7	173.5	61.9	-88.8	0	0	0	110.7	L134 V141 I149 V151 A174 W195 T197	L134-F183 HydrophobicContact CD2-CB 4.42Å; L134-F183 HydrophobicContact CD2-CD1 4.5Å; V141-F183 HydrophobicContact CG1-CD2 4.05Å; V141-F183 HydrophobicContact CG1-CE2 3.87Å; V141-F183 HydrophobicContact CG1-CG 4.5Å; V141-F183 HydrophobicContact CG1-CZ 4.16Å; V141-F183 HydrophobicContact CG2-CD1 3.96Å; V141-F183 HydrophobicContact CG2-CE1 4.13Å; V141-F183 HydrophobicContact CG2-CG 4.16Å; V141-F183 HydrophobicContact CG2-CZ 4.5Å; I149-F183 HydrophobicContact CG2-CE2 3.85Å; I149-F183 HydrophobicContact CG2-CZ 4.06Å; V151-F183 HydrophobicContact CG2-CE1 4.31Å; A174-F183 CarbonylContact O-C 3.56Å; A174-F183 VanDerWaalsContact O-CA 3.31Å; A174-F183 WeakPolarHBondContact O-CA 3.5Å; A174-F183 WeakPolarHBondContact O-CB 3.3Å; F183-W195 HydrophobicContact CD1-CB 3.72Å; F183-W195 HydrophobicContact CD1-CG 4.39Å; F183-W195 HydrophobicContact CD2-CB 3.8Å; F183-W195 AromaticContact CD2-CD1 3.48Å; F183-W195 VanDerWaalsContact CD2-CD1 3.48Å; F183-W195 HydrophobicContact CD2-CD2 4.5Å; F183-W195 AromaticContact CD2-CG 3.67Å; F183-W195 HydrophobicContact CD2-CG 3.67Å; F183-W195 HydrophobicContact CE1-CB 3.49Å; F183-W195 VanDerWaalsContact CE1-CB 3.49Å; F183-W195 HydrophobicContact CE1-CD2 4.44Å; F183-W195 AromaticContact CE1-CG 3.96Å; F183-W195 HydrophobicContact CE1-CG 3.96Å; F183-W195 HydrophobicContact CE2-CB 3.57Å; F183-W195 AromaticContact CE2-CD1 3.2Å; F183-W195 AromaticContact CE2-CD2 3.55Å; F183-W195 HydrophobicContact CE2-CD2 3.55Å; F183-W195 AromaticContact CE2-CE2 3.87Å; F183-W195 HydrophobicContact CE2-CE3 4.32Å; F183-W195 AromaticContact CE2-CG 3.14Å; F183-W195 HydrophobicContact CE2-CG 3.14Å; F183-W195 AromaticContact CE2-NE1 3.63Å; F183-W195 HydrophobicContact CG-CB 3.88Å; F183-W195 HydrophobicContact CG-CG 4.26Å; F183-W195 HydrophobicContact CZ-CB 3.41Å; F183-W195 VanDerWaalsContact CZ-CB 3.41Å; F183-W195 AromaticContact CZ-CD1 3.89Å; F183-W195 AromaticContact CZ-CD2 3.51Å; F183-W195 HydrophobicContact CZ-CD2 3.51Å; F183-W195 AromaticContact CZ-CE3 3.84Å; F183-W195 HydrophobicContact CZ-CE3 3.84Å; F183-W195 AromaticContact CZ-CG 3.31Å; F183-W195 HydrophobicContact CZ-CG 3.31Å; F183-W195 PolarHBondContact N-O 3.46Å; F183-W195 WeakPolarHBondContact O-CB 3.4Å; F183-W195 PolarHBondContact O-N 2.92Å; F183-T197 HydrophobicContact CE1-CG2 3.97Å
184	L	98.4	Very high	96.4	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	154.3	171.5	-69.7	163.9	0	0	0	109.9	V173 A174 I192 L193 L194 I206 L218 W220 F228	V173-L184 CarbonylContact C-O 3.33Å; V173-L184 VanDerWaalsContact CA-O 3.31Å; V173-L184 WeakPolarHBondContact CA-O 3.32Å; A174-L184 HydrophobicContact CB-CB 4.47Å; A174-L184 PolarHBondContact N-O 2.72Å; A174-L184 PolarHBondContact O-N 2.96Å; L184-I192 HydrophobicContact CD2-CG2 4.34Å; L184-L193 CarbonylContact C-O 3.54Å; L184-L193 WeakPolarHBondContact CA-O 3.22Å; L184-L194 HydrophobicContact CD2-CB 4.16Å; L184-L194 HydrophobicContact CD2-CD1 3.84Å; L184-L194 HydrophobicContact CG-CD1 4.47Å; L184-I206 HydrophobicContact CD2-CD1 3.93Å; L184-L218 HydrophobicContact CB-CD1 3.84Å; L184-W220 HydrophobicContact CD1-CD2 3.89Å; L184-W220 HydrophobicContact CD1-CE3 4.41Å; L184-W220 HydrophobicContact CD1-CG 4.42Å; L184-W220 HydrophobicContact CD1-CH2 4.11Å; L184-W220 HydrophobicContact CD1-CZ2 3.58Å; L184-W220 HydrophobicContact CD1-CZ3 4.49Å; L184-W220 HydrophobicContact CD2-CH2 4.43Å; L184-W220 HydrophobicContact CD2-CZ2 4.07Å; L184-W220 HydrophobicContact CG-CH2 4.15Å; L184-W220 HydrophobicContact CG-CZ2 3.4Å; L184-W220 VanDerWaalsContact CG-CZ2 3.4Å; L184-F228 HydrophobicContact CD1-CB 3.7Å; L184-F228 HydrophobicContact CD1-CD1 3.94Å; L184-F228 HydrophobicContact CD1-CD2 3.65Å; L184-F228 HydrophobicContact CD1-CE1 4.49Å; L184-F228 HydrophobicContact CD1-CE2 4.23Å; L184-F228 HydrophobicContact CD1-CG 3.48Å; L184-F228 VanDerWaalsContact CD1-CG 3.48Å; L184-F228 HydrophobicContact CD2-CE1 4.49Å
185	S	98.5	Very high	96.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	151.2	163.6	67.8	0	0	0	0	111.5	I149 H166 C172 I192 L193 W195	I149-S185 VanDerWaalsContact CD1-OG 3.29Å; I149-S185 WeakPolarHBondContact CD1-OG 3.34Å; H166-S185 PolarHBondContact NE2-OG 3.05Å; C172-S185 CarbonylContact O-C 3.58Å; C172-S185 VanDerWaalsContact O-CA 3.24Å; C172-S185 WeakPolarHBondContact O-CA 3.38Å; S185-I192 CarbonylContact O-C 3.5Å; S185-I192 WeakPolarHBondContact O-CA 3.31Å; S185-L193 PolarHBondContact N-O 3.23Å; S185-L193 PolarHBondContact O-N 3.33Å; S185-W195 PolarHBondContact OG-NE1 3.09Å
186	C	97.9	Very high	96.3	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	158.3	170.2	76.6	0	0	0	0	111.5	T171 C172 R191 I192 P215 L218	T171-C186 PolarHBondContact N-O 3.48Å; C172-C186 PolarHBondContact N-O 3.45Å; C172-C186 PolarHBondContact O-N 3.22Å; C186-R191 WeakPolarHBondContact CA-O 3.31Å; C186-I192 HydrophobicContact CB-CG1 4.03Å; C186-P215 HydrophobicContact CB-CB 3.8Å; C186-P215 HydrophobicContact CB-CG 3.74Å; C186-P215 PolarHBondContact SG-O 3.29Å; C186-P215 VanDerWaalsContact SG-O 3.33Å; C186-L218 HydrophobicContact CB-CD1 3.79Å; C186-L218 HydrophobicContact CB-CD2 4.34Å; C186-L218 HydrophobicContact CB-CG 4.12Å
187	S	97.8	Very high	96.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	160.4	-170.6	171.5	0	0	0	0	112.1	H166 A168 Q169 T171 D189 N190 R191	H166-S187 VanDerWaalsContact CE1-CB 3.45Å; H166-S187 WeakPolarHBondContact CE1-CB 3.11Å; H166-S187 WeakPolarHBondContact ND1-CB 3.4Å; A168-S187 PolarHBondContact O-OG 3.2Å; Q169-S187 VanDerWaalsContact O-CA 3.26Å; Q169-S187 WeakPolarHBondContact O-CA 3.44Å; Q169-S187 WeakPolarHBondContact O-CB 3.4Å; Q169-S187 PolarHBondContact O-OG 3.22Å; T171-S187 WeakPolarHBondContact OG1-CA 3.47Å; S187-D189 VanDerWaalsContact CB-OD1 3.29Å; S187-D189 WeakPolarHBondContact CB-OD1 3.48Å; S187-D189 PolarHBondContact O-N 2.69Å; S187-D189 VanDerWaalsContact O-N 3.08Å; S187-D189 PolarHBondContact OG-N 3.28Å; S187-D189 PolarHBondContact OG-OD1 3.49Å; S187-N190 PolarHBondContact O-N 2.85Å; S187-N190 VanDerWaalsContact O-N 3.07Å; S187-R191 PolarHBondContact N-O 2.71Å
188	E	97.3	Very high	96.3	Very high	89 Å²	89	39.8 Å²	39.8	42%	0.416	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-8.5	168	-64.6	-178.3	172.6	0	0	114	A168 Q169 N190 L214	A168-E188 HydrophobicContact CB-CB 3.82Å; Q169-E188 HydrophobicContact CB-CG 4.31Å; Q169-E188 VanDerWaalsContact NE2-CD 3.32Å; Q169-E188 PolarHBondContact NE2-OE1 2.86Å; Q169-E188 PolarHBondContact NE2-OE2 2.82Å; Q169-E188 PolarHBondContact O-N 3.08Å; Q169-E188 VanDerWaalsContact O-N 3.16Å; E188-N190 PolarHBondContact O-N 3.14Å; E188-L214 HydrophobicContact CB-CD1 4.33Å; E188-L214 HydrophobicContact CG-CD1 4.44Å; E188-L214 VanDerWaalsContact O-CD2 3.29Å; E188-L214 WeakPolarHBondContact O-CD2 3.47Å
189	D	95.9	Very high	96.5	Very high	31 Å²	31	38.2 Å²	38.2	17%	0.166	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	8.4	170.1	76.6	-5.3	0	0	0	113.6	H166 A167 A168 S187 R191	H166-D189 WeakPolarHBondContact CA-OD2 3.46Å; H166-D189 IonicContact CE1-OD1 3.46Å; H166-D189 IonicContact CG-OD2 3.46Å; H166-D189 IonicContact ND1-OD1 3.74Å; H166-D189 PolarHBondContact ND1-OD1 3.14Å; H166-D189 IonicContact ND1-OD2 2.98Å; H166-D189 PolarHBondContact ND1-OD2 3.15Å; H166-D189 VanDerWaalsContact ND1-OD2 3.13Å; A167-D189 HydrophobicContact CB-CB 4.04Å; A167-D189 PolarHBondContact N-OD2 3.26Å; A168-D189 HydrophobicContact CB-CB 3.99Å; S187-D189 VanDerWaalsContact CB-OD1 3.29Å; S187-D189 WeakPolarHBondContact CB-OD1 3.48Å; S187-D189 PolarHBondContact O-N 2.69Å; S187-D189 VanDerWaalsContact O-N 3.08Å; S187-D189 PolarHBondContact OG-N 3.28Å; S187-D189 PolarHBondContact OG-OD1 3.49Å; D189-R191 PolarHBondContact O-N 2.67Å; D189-R191 WeakPolarHBondContact OD1-CB 3.25Å; D189-R191 WeakPolarHBondContact OD1-CG 3.5Å; D189-R191 PolarHBondContact OD1-N 2.94Å
190	N	94.1	Very high	96.4	Very high	73 Å²	73	41.8 Å²	41.8	39%	0.39	22%	0.215	S	C	.	.	S	Bend	trans	63.4	26.2	179.8	-154.1	10.8	0	0	0	113.8	S187 E188 G212 Y213 L214	S187-N190 PolarHBondContact O-N 2.85Å; S187-N190 VanDerWaalsContact O-N 3.07Å; E188-N190 PolarHBondContact O-N 3.14Å; N190-G212 PolarHBondContact ND2-O 3.08Å; N190-G212 VanDerWaalsContact ND2-O 3.11Å; N190-Y213 PolarHBondContact OD1-O 2.88Å; N190-Y213 VanDerWaalsContact OD1-O 3.14Å; N190-L214 HydrophobicContact CB-CD2 3.77Å
191	R	94.7	Very high	96.3	Very high	99 Å²	99	48.2 Å²	48.2	37%	0.374	24%	0.24	S	C	.	.			trans	-110.5	137.9	176.3	-58.8	-179.8	173	167.3	-1.4	111.2	C186 S187 D189 L193	C186-R191 WeakPolarHBondContact CA-O 3.31Å; S187-R191 PolarHBondContact N-O 2.71Å; D189-R191 PolarHBondContact O-N 2.67Å; D189-R191 WeakPolarHBondContact OD1-CB 3.25Å; D189-R191 WeakPolarHBondContact OD1-CG 3.5Å; D189-R191 PolarHBondContact OD1-N 2.94Å; R191-L193 HydrophobicContact CB-CD2 4.16Å; R191-L193 HydrophobicContact CB-CG 4.33Å
192	I	95.9	Very high	96.3	Very high	8 Å²	8	48.5 Å²	48.5	4%	0.041	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.5	157.6	-58.3	178.1	0	0	0	106.8	L184 S185 C186 I206 P215 L218 F228 F230	L184-I192 HydrophobicContact CD2-CG2 4.34Å; S185-I192 CarbonylContact O-C 3.5Å; S185-I192 WeakPolarHBondContact O-CA 3.31Å; C186-I192 HydrophobicContact CB-CG1 4.03Å; I192-I206 HydrophobicContact CG2-CD1 4.48Å; I192-I206 PolarHBondContact O-N 3.47Å; I192-P215 HydrophobicContact CD1-CB 3.9Å; I192-P215 HydrophobicContact CD1-CG 4.44Å; I192-P215 HydrophobicContact CG1-CB 3.79Å; I192-P215 HydrophobicContact CG1-CG 3.84Å; I192-L218 HydrophobicContact CD1-CD2 4.33Å; I192-L218 HydrophobicContact CG2-CD2 4.12Å; I192-F228 HydrophobicContact CD1-CE2 4.47Å; I192-F228 HydrophobicContact CG2-CE2 4.17Å; I192-F228 HydrophobicContact CG2-CZ 4.23Å; I192-F230 HydrophobicContact CD1-CB 3.98Å; I192-F230 HydrophobicContact CD1-CD1 3.86Å; I192-F230 HydrophobicContact CD1-CD2 3.79Å; I192-F230 HydrophobicContact CD1-CE1 4.26Å; I192-F230 HydrophobicContact CD1-CE2 4.22Å; I192-F230 HydrophobicContact CD1-CG 3.6Å; I192-F230 HydrophobicContact CD1-CZ 4.43Å
193	L	96.8	Very high	96.3	Very high	8 Å²	8	49.8 Å²	49.8	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.6	-179.9	-59.4	-178.3	0	0	0	110.2	A165 L184 S185 R191 W195 A203 S204 Q205	A165-L193 HydrophobicContact CB-CD1 3.84Å; L184-L193 CarbonylContact C-O 3.54Å; L184-L193 WeakPolarHBondContact CA-O 3.22Å; S185-L193 PolarHBondContact N-O 3.23Å; S185-L193 PolarHBondContact O-N 3.33Å; R191-L193 HydrophobicContact CB-CD2 4.16Å; R191-L193 HydrophobicContact CB-CG 4.33Å; L193-W195 HydrophobicContact CB-CZ2 4.42Å; L193-W195 HydrophobicContact CD1-CZ2 3.78Å; L193-A203 HydrophobicContact CD1-CB 4.2Å; L193-S204 WeakPolarHBondContact CA-O 3.31Å; L193-Q205 HydrophobicContact CD2-CB 3.92Å; L193-Q205 HydrophobicContact CD2-CG 4.34Å
194	L	97.4	Very high	96.1	Very high	33 Å²	33	52.7 Å²	52.7	17%	0.173	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.8	166.3	178.4	66	0	0	0	109.3	V182 L184 S204 I206 W220 T242	V182-L194 HydrophobicContact CG1-CD1 3.78Å; L184-L194 HydrophobicContact CD2-CB 4.16Å; L184-L194 HydrophobicContact CD2-CD1 3.84Å; L184-L194 HydrophobicContact CG-CD1 4.47Å; L194-S204 PolarHBondContact N-O 3.07Å; L194-S204 PolarHBondContact O-N 3.09Å; L194-S204 PolarHBondContact O-OG 2.92Å; L194-I206 HydrophobicContact CB-CD1 3.97Å; L194-I206 HydrophobicContact CB-CG1 4.11Å; L194-W220 HydrophobicContact CD1-CH2 3.77Å; L194-W220 HydrophobicContact CD1-CZ2 3.85Å; L194-T242 HydrophobicContact CD2-CG2 4.27Å
195	W	98.1	Very high	95.8	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137.8	-177.3	-62.4	82.2	0	0	0	111.3	I149 Y163 A165 V182 F183 S185 L193 P202 A203	I149-W195 HydrophobicContact CD1-CH2 4.47Å; I149-W195 HydrophobicContact CD1-CZ2 3.65Å; Y163-W195 HydrophobicContact CD1-CZ3 4.04Å; Y163-W195 HydrophobicContact CD2-CE3 4.22Å; Y163-W195 HydrophobicContact CD2-CH2 4.4Å; Y163-W195 AromaticContact CD2-CZ3 3.73Å; Y163-W195 HydrophobicContact CD2-CZ3 3.73Å; Y163-W195 HydrophobicContact CE2-CZ3 4.37Å; Y163-W195 HydrophobicContact CG-CE3 4.42Å; Y163-W195 HydrophobicContact CG-CH2 4.06Å; Y163-W195 AromaticContact CG-CZ3 3.52Å; Y163-W195 HydrophobicContact CG-CZ3 3.52Å; A165-W195 HydrophobicContact CB-CH2 3.43Å; A165-W195 VanDerWaalsContact CB-CH2 3.43Å; A165-W195 HydrophobicContact CB-CZ2 3.79Å; A165-W195 HydrophobicContact CB-CZ3 4.5Å; V182-W195 VanDerWaalsContact CA-O 3.23Å; V182-W195 WeakPolarHBondContact CA-O 3.42Å; V182-W195 WeakPolarHBondContact CG1-O 3.39Å; F183-W195 HydrophobicContact CD1-CB 3.72Å; F183-W195 HydrophobicContact CD1-CG 4.39Å; F183-W195 HydrophobicContact CD2-CB 3.8Å; F183-W195 AromaticContact CD2-CD1 3.48Å; F183-W195 VanDerWaalsContact CD2-CD1 3.48Å; F183-W195 HydrophobicContact CD2-CD2 4.5Å; F183-W195 AromaticContact CD2-CG 3.67Å; F183-W195 HydrophobicContact CD2-CG 3.67Å; F183-W195 HydrophobicContact CE1-CB 3.49Å; F183-W195 VanDerWaalsContact CE1-CB 3.49Å; F183-W195 HydrophobicContact CE1-CD2 4.44Å; F183-W195 AromaticContact CE1-CG 3.96Å; F183-W195 HydrophobicContact CE1-CG 3.96Å; F183-W195 HydrophobicContact CE2-CB 3.57Å; F183-W195 AromaticContact CE2-CD1 3.2Å; F183-W195 AromaticContact CE2-CD2 3.55Å; F183-W195 HydrophobicContact CE2-CD2 3.55Å; F183-W195 AromaticContact CE2-CE2 3.87Å; F183-W195 HydrophobicContact CE2-CE3 4.32Å; F183-W195 AromaticContact CE2-CG 3.14Å; F183-W195 HydrophobicContact CE2-CG 3.14Å; F183-W195 AromaticContact CE2-NE1 3.63Å; F183-W195 HydrophobicContact CG-CB 3.88Å; F183-W195 HydrophobicContact CG-CG 4.26Å; F183-W195 HydrophobicContact CZ-CB 3.41Å; F183-W195 VanDerWaalsContact CZ-CB 3.41Å; F183-W195 AromaticContact CZ-CD1 3.89Å; F183-W195 AromaticContact CZ-CD2 3.51Å; F183-W195 HydrophobicContact CZ-CD2 3.51Å; F183-W195 AromaticContact CZ-CE3 3.84Å; F183-W195 HydrophobicContact CZ-CE3 3.84Å; F183-W195 AromaticContact CZ-CG 3.31Å; F183-W195 HydrophobicContact CZ-CG 3.31Å; F183-W195 PolarHBondContact N-O 3.46Å; F183-W195 WeakPolarHBondContact O-CB 3.4Å; F183-W195 PolarHBondContact O-N 2.92Å; S185-W195 PolarHBondContact OG-NE1 3.09Å; L193-W195 HydrophobicContact CB-CZ2 4.42Å; L193-W195 HydrophobicContact CD1-CZ2 3.78Å; W195-P202 CarbonylContact C-O 3.53Å; W195-P202 VanDerWaalsContact CA-O 3.25Å; W195-P202 WeakPolarHBondContact CA-O 3.33Å; W195-P202 HydrophobicContact CE3-CB 4.05Å; W195-P202 HydrophobicContact CE3-CG 4.11Å; W195-P202 HydrophobicContact CZ3-CB 4.46Å; W195-P202 HydrophobicContact CZ3-CG 4.01Å; W195-A203 HydrophobicContact CD2-CB 4.01Å; W195-A203 HydrophobicContact CE3-CB 3.89Å; W195-A203 HydrophobicContact CH2-CB 3.83Å; W195-A203 HydrophobicContact CZ2-CB 3.91Å; W195-A203 HydrophobicContact CZ3-CB 3.81Å
196	D	96.9	Very high	95.3	Very high	33 Å²	33	58.9 Å²	58.9	18%	0.176	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	105.8	163.2	-169.1	-16.9	0	0	0	108.8	S181 V182 R198 C199 P202	S181-D196 WeakPolarHBondContact O-CA 3.23Å; S181-D196 PolarHBondContact OG-OD1 2.85Å; V182-D196 HydrophobicContact CG2-CB 4.35Å; D196-R198 PolarHBondContact O-N 3.13Å; D196-R198 WeakPolarHBondContact OD1-CB 3.35Å; D196-R198 WeakPolarHBondContact OD1-CG 3.19Å; D196-R198 IonicContact OD1-CZ 3.71Å; D196-R198 PolarHBondContact OD1-N 2.82Å; D196-R198 IonicContact OD1-NE 3.62Å; D196-R198 PolarHBondContact OD1-NE 2.96Å; D196-R198 IonicContact OD1-NH2 3.03Å; D196-R198 IonicContact OD2-CZ 3.13Å; D196-R198 IonicContact OD2-NE 3.43Å; D196-R198 PolarHBondContact OD2-NE 2.86Å; D196-R198 IonicContact OD2-NH2 3.77Å; D196-R198 PolarHBondContact OD2-NH2 3.02Å; D196-C199 WeakPolarHBondContact O-CB 3.3Å; D196-C199 PolarHBondContact O-N 3.37Å; D196-P202 PolarHBondContact N-O 3.06Å; D196-P202 WeakPolarHBondContact O-CA 3.45Å; D196-P202 WeakPolarHBondContact O-CB 3.33Å
197	T	95	Very high	94.2	Very high	47 Å²	47	60.8 Å²	60.8	29%	0.288	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-10.2	-174.4	58.9	0	0	0	0	113.6	S181 F183 C199	S181-T197 WeakPolarHBondContact CB-OG1 3.33Å; S181-T197 PolarHBondContact O-N 2.86Å; S181-T197 PolarHBondContact O-OG1 2.75Å; F183-T197 HydrophobicContact CE1-CG2 3.97Å; T197-C199 VanDerWaalsContact C-N 3.32Å
198	R	94.9	Very high	92.6	Very high	178 Å²	178	62.7 Å²	62.7	67%	0.672	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-18	174.6	-56.3	172.8	-61.5	-178.8	0.8	112.7	S181 D196	S181-R198 WeakPolarHBondContact OG-CD 3.18Å; S181-R198 PolarHBondContact OG-NE 2.82Å; S181-R198 VanDerWaalsContact OG-NE 3.08Å; D196-R198 PolarHBondContact O-N 3.13Å; D196-R198 WeakPolarHBondContact OD1-CB 3.35Å; D196-R198 WeakPolarHBondContact OD1-CG 3.19Å; D196-R198 IonicContact OD1-CZ 3.71Å; D196-R198 PolarHBondContact OD1-N 2.82Å; D196-R198 IonicContact OD1-NE 3.62Å; D196-R198 PolarHBondContact OD1-NE 2.96Å; D196-R198 IonicContact OD1-NH2 3.03Å; D196-R198 IonicContact OD2-CZ 3.13Å; D196-R198 IonicContact OD2-NE 3.43Å; D196-R198 PolarHBondContact OD2-NE 2.86Å; D196-R198 IonicContact OD2-NH2 3.77Å; D196-R198 PolarHBondContact OD2-NH2 3.02Å
199	C	94.6	Very high	90.5	Very high	58 Å²	58	62.8 Å²	62.8	39%	0.392	35%	0.345	S	S	.	.	S	Bend	trans	-88.7	142.8	-177.4	-66	0	0	0	0	111.6	D196 T197 K201	D196-C199 WeakPolarHBondContact O-CB 3.3Å; D196-C199 PolarHBondContact O-N 3.37Å; T197-C199 VanDerWaalsContact C-N 3.32Å; C199-K201 PolarHBondContact O-N 3.3Å
200	P	92.1	Very high	88.5	Confident	140 Å²	140	62.5 Å²	62.5	91%	0.909	35%	0.347	S	S	*	.	S	Bend	trans	-60	-33	176.5	-24.4	33.5	0	0	0	113.8
201	K	94.8	Very high	86.6	Confident	187 Å²	187	63 Å²	63	81%	0.813	36%	0.355	S	S	*	.	S	Bend	trans	-109.6	96.8	166.2	-70.5	-175	178	-176.4	0	106.6	C199 A203	C199-K201 PolarHBondContact O-N 3.3Å; K201-A203 PolarHBondContact O-N 3.01Å
202	P	95.3	Very high	85.8	Confident	24 Å²	24	61.3 Å²	61.3	16%	0.156	37%	0.368	C	S	.	.			trans	-74.7	-26.3	-166.7	27.6	-35.2	0	0	0	113	Y163 W195 D196	Y163-P202 HydrophobicContact CD1-CG 4.08Å; Y163-P202 HydrophobicContact CE1-CG 3.69Å; W195-P202 CarbonylContact C-O 3.53Å; W195-P202 VanDerWaalsContact CA-O 3.25Å; W195-P202 WeakPolarHBondContact CA-O 3.33Å; W195-P202 HydrophobicContact CE3-CB 4.05Å; W195-P202 HydrophobicContact CE3-CG 4.11Å; W195-P202 HydrophobicContact CZ3-CB 4.46Å; W195-P202 HydrophobicContact CZ3-CG 4.01Å; D196-P202 PolarHBondContact N-O 3.06Å; D196-P202 WeakPolarHBondContact O-CA 3.45Å; D196-P202 WeakPolarHBondContact O-CB 3.33Å
203	A	96.8	Very high	85.6	Confident	36 Å²	36	65.7 Å²	65.7	30%	0.298	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135	-179.2	0	0	0	0	0	112.5	A165 L193 W195 K201	A165-A203 HydrophobicContact CB-CB 4.39Å; L193-A203 HydrophobicContact CD1-CB 4.2Å; W195-A203 HydrophobicContact CD2-CB 4.01Å; W195-A203 HydrophobicContact CE3-CB 3.89Å; W195-A203 HydrophobicContact CH2-CB 3.83Å; W195-A203 HydrophobicContact CZ2-CB 3.91Å; W195-A203 HydrophobicContact CZ3-CB 3.81Å; K201-A203 PolarHBondContact O-N 3.01Å
204	S	94.6	Very high	85.5	Confident	61 Å²	61	67.3 Å²	67.3	43%	0.427	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.1	167.2	58.5	0	0	0	0	110.1	L193 L194	L193-S204 WeakPolarHBondContact CA-O 3.31Å; L194-S204 PolarHBondContact N-O 3.07Å; L194-S204 PolarHBondContact O-N 3.09Å; L194-S204 PolarHBondContact O-OG 2.92Å
205	Q	92.4	Very high	85.5	Confident	118 Å²	118	66 Å²	66	55%	0.551	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	129.5	179.8	-176.7	178.3	-12.4	0	0	110.2	L193	L193-Q205 HydrophobicContact CD2-CB 3.92Å; L193-Q205 HydrophobicContact CD2-CG 4.34Å
206	I	88.4	Confident	85.5	Confident	12 Å²	12	67.1 Å²	67.1	6%	0.062	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	118.1	169.8	-57.7	-177.6	0	0	0	107.7	L184 I192 L194 C208 F228 V240 T242	L184-I206 HydrophobicContact CD2-CD1 3.93Å; I192-I206 HydrophobicContact CG2-CD1 4.48Å; I192-I206 PolarHBondContact O-N 3.47Å; L194-I206 HydrophobicContact CB-CD1 3.97Å; L194-I206 HydrophobicContact CB-CG1 4.11Å; I206-C208 PolarHBondContact O-N 3.46Å; I206-F228 HydrophobicContact CD1-CE1 3.52Å; I206-F228 HydrophobicContact CD1-CZ 3.64Å; I206-F228 HydrophobicContact CG2-CZ 4.38Å; I206-V240 HydrophobicContact CG2-CG1 4.1Å; I206-T242 HydrophobicContact CD1-CG2 4.21Å
207	G	74.8	Confident	85.5	Confident	40 Å²	40	65.8 Å²	65.8	41%	0.412	39%	0.387	S	S	.	.			trans	-76.3	105.5	173.2	0	0	0	0	0	110
208	C	63.5	Low	85.7	Confident	39 Å²	39	64 Å²	64	26%	0.264	38%	0.376	S	S	.	.			trans	-92.2	122.5	171	-58.2	0	0	0	0	108.4	I206 A210 F230	I206-C208 PolarHBondContact O-N 3.46Å; C208-A210 PolarHBondContact O-N 3.08Å; C208-A210 VanDerWaalsContact O-N 3.08Å; C208-F230 HydrophobicContact CB-CE1 4.21Å; C208-F230 HydrophobicContact CB-CZ 4.05Å
209	S	54.6	Low	85.8	Confident	91 Å²	91	56.1 Å²	56.1	64%	0.636	35%	0.348	S	S	*	.			trans	-74.1	13.6	175.3	57	0	0	0	0	113.6	C247	S209-C247 PolarHBondContact OG-N 3.25Å
210	A	53.8	Low	86	Confident	25 Å²	25	54.3 Å²	54.3	21%	0.207	33%	0.333	C	S	.	.	S	Bend	trans	-70.5	151.8	179.1	0	0	0	0	0	110.2	C208 G212 F230	C208-A210 PolarHBondContact O-N 3.08Å; C208-A210 VanDerWaalsContact O-N 3.08Å; A210-G212 PolarHBondContact O-N 2.97Å; A210-F230 HydrophobicContact CB-CZ 4.11Å
211	P	54	Low	86.2	Confident	84 Å²	84	48.5 Å²	48.5	55%	0.545	29%	0.294	S	S	.	.			trans	-53.3	133.2	172.6	23.7	-32.1	0	0	0	108.2	Y213	P211-Y213 HydrophobicContact CB-CD2 3.94Å; P211-Y213 HydrophobicContact CB-CE2 3.89Å; P211-Y213 HydrophobicContact CG-CD2 3.95Å; P211-Y213 HydrophobicContact CG-CE2 4.07Å; P211-Y213 PolarHBondContact O-N 2.75Å
212	G	77.4	Confident	86.2	Confident	63 Å²	63	42 Å²	42	65%	0.649	27%	0.27	S	S	*	.	S	Bend	trans	-66.1	40.9	-161.9	0	0	0	0	0	117.9	N190 A210	N190-G212 PolarHBondContact ND2-O 3.08Å; N190-G212 VanDerWaalsContact ND2-O 3.11Å; A210-G212 PolarHBondContact O-N 2.97Å
213	Y	92.2	Very high	86.1	Confident	100 Å²	100	45.8 Å²	45.8	39%	0.392	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-74.5	150.6	168.5	-64.4	-66.4	0	0	0	111.1	N190 P211 E233 N234	N190-Y213 PolarHBondContact OD1-O 2.88Å; N190-Y213 VanDerWaalsContact OD1-O 3.14Å; P211-Y213 HydrophobicContact CB-CD2 3.94Å; P211-Y213 HydrophobicContact CB-CE2 3.89Å; P211-Y213 HydrophobicContact CG-CD2 3.95Å; P211-Y213 HydrophobicContact CG-CE2 4.07Å; P211-Y213 PolarHBondContact O-N 2.75Å; Y213-E233 HydrophobicContact CD1-CG 4.25Å; Y213-E233 HydrophobicContact CG-CG 4.49Å; Y213-N234 HydrophobicContact CD1-CB 3.99Å; Y213-N234 HydrophobicContact CD2-CB 3.84Å; Y213-N234 HydrophobicContact CE1-CB 4.2Å; Y213-N234 HydrophobicContact CE2-CB 4.06Å; Y213-N234 HydrophobicContact CG-CB 3.81Å
214	L	95	Very high	86	Confident	43 Å²	43	48.7 Å²	48.7	23%	0.225	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-68.2	134	-176.3	-59.6	178.6	0	0	0	111.8	E188 N190 D232 E233	E188-L214 HydrophobicContact CB-CD1 4.33Å; E188-L214 HydrophobicContact CG-CD1 4.44Å; E188-L214 VanDerWaalsContact O-CD2 3.29Å; E188-L214 WeakPolarHBondContact O-CD2 3.47Å; N190-L214 HydrophobicContact CB-CD2 3.77Å; L214-D232 CarbonylContact O-C 3.56Å; L214-D232 VanDerWaalsContact O-CA 3.3Å; L214-D232 WeakPolarHBondContact O-CA 3.19Å; L214-D232 WeakPolarHBondContact O-CB 3.4Å; L214-E233 HydrophobicContact CB-CG 4.19Å; L214-E233 PolarHBondContact N-OE1 2.84Å; L214-E233 VanDerWaalsContact N-OE1 3.15Å; L214-E233 PolarHBondContact O-N 2.93Å
215	P	96.1	Very high	85.9	Confident	4 Å²	4	47.9 Å²	47.9	3%	0.026	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	128.6	172.4	30.8	-34.8	0	0	0	111.1	C186 I192 F230	C186-P215 HydrophobicContact CB-CB 3.8Å; C186-P215 HydrophobicContact CB-CG 3.74Å; C186-P215 PolarHBondContact SG-O 3.29Å; C186-P215 VanDerWaalsContact SG-O 3.33Å; I192-P215 HydrophobicContact CD1-CB 3.9Å; I192-P215 HydrophobicContact CD1-CG 4.44Å; I192-P215 HydrophobicContact CG1-CB 3.79Å; I192-P215 HydrophobicContact CG1-CG 3.84Å; P215-F230 HydrophobicContact CB-CD2 4.26Å
216	T	98	Very high	85.9	Confident	27 Å²	27	44 Å²	44	17%	0.166	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-27.6	-172.8	54.5	0	0	0	0	114.3	T171 G231 E233 C257 V258	T171-T216 WeakPolarHBondContact CG2-O 3.5Å; T216-G231 PolarHBondContact N-O 2.99Å; T216-G231 PolarHBondContact OG1-O 2.8Å; T216-E233 HydrophobicContact CG2-CB 3.99Å; T216-C257 HydrophobicContact CG2-CB 4.38Å; T216-V258 WeakPolarHBondContact CB-O 3.31Å; T216-V258 PolarHBondContact OG1-O 3.24Å
217	S	98	Very high	86.1	Confident	4 Å²	4	44.1 Å²	44.1	3%	0.028	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	152.1	-178	51.5	0	0	0	0	112.1	F230 G231 V258	S217-F230 CarbonylContact O-C 3.57Å; S217-F230 WeakPolarHBondContact O-CA 3.42Å; S217-F230 WeakPolarHBondContact O-CB 3.5Å; S217-G231 PolarHBondContact N-O 2.74Å; S217-G231 PolarHBondContact O-N 3.21Å; S217-V258 WeakPolarHBondContact OG-CG1 3.38Å; S217-V258 PolarHBondContact OG-O 2.78Å
218	L	98.3	Very high	87.1	Confident	11 Å²	11	42.2 Å²	42.2	6%	0.058	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	140.4	-177.1	-65.8	168.1	0	0	0	110.6	C172 A174 L184 C186 I192 F228 F230	C172-L218 HydrophobicContact CB-CD1 4.33Å; C172-L218 HydrophobicContact CB-CG 4.42Å; A174-L218 HydrophobicContact CB-CB 3.99Å; L184-L218 HydrophobicContact CB-CD1 3.84Å; C186-L218 HydrophobicContact CB-CD1 3.79Å; C186-L218 HydrophobicContact CB-CD2 4.34Å; C186-L218 HydrophobicContact CB-CG 4.12Å; I192-L218 HydrophobicContact CD1-CD2 4.33Å; I192-L218 HydrophobicContact CG2-CD2 4.12Å; L218-F228 HydrophobicContact CD2-CD2 4.22Å; L218-F228 HydrophobicContact CD2-CE2 4.15Å; L218-F230 HydrophobicContact CD2-CB 3.7Å
219	A	98.3	Very high	88.7	Confident	12 Å²	12	40.4 Å²	40.4	10%	0.099	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	127.9	167.9	0	0	0	0	0	111.7	F228 V229 L261 F263	A219-F228 CarbonylContact O-C 3.56Å; A219-F228 VanDerWaalsContact O-CA 3.31Å; A219-F228 WeakPolarHBondContact O-CA 3.31Å; A219-F228 WeakPolarHBondContact O-CB 3.25Å; A219-V229 HydrophobicContact CB-CG2 3.84Å; A219-V229 PolarHBondContact N-O 3.36Å; A219-V229 WeakPolarHBondContact O-CG2 3.37Å; A219-V229 PolarHBondContact O-N 3.28Å; A219-L261 HydrophobicContact CB-CB 3.87Å; A219-L261 WeakPolarHBondContact CB-O 3.49Å; A219-F263 HydrophobicContact CB-CD2 4.17Å; A219-F263 HydrophobicContact CB-CE2 4.13Å
220	W	98	Very high	90.7	Very high	20 Å²	20	36.4 Å²	36.4	8%	0.076	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	141.1	171.8	-76.9	101.3	0	0	0	111.1	A174 P177 V182 L184 L194 F228 T242 F263	A174-W220 PolarHBondContact O-NE1 3.09Å; P177-W220 HydrophobicContact CG-CB 4.09Å; V182-W220 HydrophobicContact CG1-CH2 4.45Å; V182-W220 HydrophobicContact CG1-CZ2 4.1Å; L184-W220 HydrophobicContact CD1-CD2 3.89Å; L184-W220 HydrophobicContact CD1-CE3 4.41Å; L184-W220 HydrophobicContact CD1-CG 4.42Å; L184-W220 HydrophobicContact CD1-CH2 4.11Å; L184-W220 HydrophobicContact CD1-CZ2 3.58Å; L184-W220 HydrophobicContact CD1-CZ3 4.49Å; L184-W220 HydrophobicContact CD2-CH2 4.43Å; L184-W220 HydrophobicContact CD2-CZ2 4.07Å; L184-W220 HydrophobicContact CG-CH2 4.15Å; L184-W220 HydrophobicContact CG-CZ2 3.4Å; L184-W220 VanDerWaalsContact CG-CZ2 3.4Å; L194-W220 HydrophobicContact CD1-CH2 3.77Å; L194-W220 HydrophobicContact CD1-CZ2 3.85Å; W220-F228 HydrophobicContact CD2-CB 4.3Å; W220-F228 HydrophobicContact CE3-CB 4Å; W220-F228 HydrophobicContact CZ3-CB 4.46Å; W220-T242 HydrophobicContact CH2-CG2 4.11Å; W220-T242 HydrophobicContact CZ3-CG2 4.18Å; W220-F263 WeakPolarHBondContact O-CD2 3.29Å; W220-F263 WeakPolarHBondContact O-CE2 3.32Å
221	H	96.8	Very high	92.8	Very high	18 Å²	18	35.2 Å²	35.2	8%	0.083	20%	0.2	C	C	.	.			trans	-66.3	129.9	170.2	-169.8	-84.7	0	0	0	109.4	Q223 Q224 V227 F263 P269	H221-Q223 PolarHBondContact ND1-N 3.14Å; H221-Q223 PolarHBondContact O-N 2.97Å; H221-Q223 VanDerWaalsContact O-N 3.12Å; H221-Q224 HydrophobicContact CB-CB 4.07Å; H221-Q224 WeakPolarHBondContact ND1-CB 3.45Å; H221-Q224 PolarHBondContact ND1-N 3.04Å; H221-V227 HydrophobicContact CB-CB 3.98Å; H221-V227 HydrophobicContact CB-CG1 4.07Å; H221-V227 VanDerWaalsContact CB-O 3.25Å; H221-V227 WeakPolarHBondContact CB-O 3.06Å; H221-V227 PolarHBondContact N-O 3.4Å; H221-F263 HydrophobicContact CB-CE2 4.43Å; H221-F263 HydrophobicContact CB-CZ 4.39Å; H221-F263 AromaticContact CD2-CE1 3.9Å; H221-F263 AromaticContact CD2-CZ 3.9Å; H221-P269 WeakPolarHBondContact NE2-CG 3.3Å
222	P	95.3	Very high	94.8	Very high	49 Å²	49	31.3 Å²	31.3	32%	0.318	18%	0.175	S	C	.	.	S	Bend	trans	-68.6	-17.1	-169.8	25.8	-35.6	0	0	0	114.2	H178 F263 P269	H178-P222 PolarHBondContact CE1-O 3.04Å; H178-P222 VanDerWaalsContact CE1-O 3.3Å; H178-P222 PolarHBondContact NE2-O 2.91Å; P222-F263 HydrophobicContact CG-CB 4.07Å; P222-F263 HydrophobicContact CG-CG 4.3Å; P222-P269 HydrophobicContact CG-CB 3.96Å; P222-P269 HydrophobicContact CG-CG 3.86Å
223	Q	93.2	Very high	95.7	Very high	104 Å²	104	32.2 Å²	32.2	49%	0.486	16%	0.162	S	C	.	.	S	Bend	trans	-120.5	-19.8	-175.9	-59.7	166.7	-2.6	0	0	113.8	H221 H266 S267	H221-Q223 PolarHBondContact ND1-N 3.14Å; H221-Q223 PolarHBondContact O-N 2.97Å; H221-Q223 VanDerWaalsContact O-N 3.12Å; Q223-H266 PolarHBondContact NE2-O 2.82Å; Q223-S267 VanDerWaalsContact NE2-C 3.3Å; Q223-S267 PolarHBondContact NE2-O 2.86Å; Q223-S267 PolarHBondContact OE1-O 3.23Å
224	Q	93.1	Very high	95.9	Very high	98 Å²	98	31 Å²	31	46%	0.458	16%	0.163	S	C	.	.			trans	-112	100.7	-173.2	-70.2	177.7	-16.3	0	0	107.1	H221 E226 V227	H221-Q224 HydrophobicContact CB-CB 4.07Å; H221-Q224 WeakPolarHBondContact ND1-CB 3.45Å; H221-Q224 PolarHBondContact ND1-N 3.04Å; Q224-E226 PolarHBondContact O-N 2.95Å; Q224-V227 HydrophobicContact CB-CB 3.81Å; Q224-V227 HydrophobicContact CB-CG2 3.88Å; Q224-V227 PolarHBondContact O-N 2.88Å
225	S	92.4	Very high	95.9	Very high	44 Å²	44	29 Å²	29	31%	0.308	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.4	-167.6	62.9	0	0	0	0	116.3
226	E	92.2	Very high	95.9	Very high	37 Å²	37	29.6 Å²	29.6	17%	0.173	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	4.8	-179	-58	-59	143.5	0	0	111.3	K179 Q224 D241 T242 K243	K179-E226 IonicContact NZ-OE1 3.34Å; K179-E226 PolarHBondContact NZ-OE1 3.31Å; Q224-E226 PolarHBondContact O-N 2.95Å; E226-D241 CarbonylContact O-C 3.58Å; E226-D241 WeakPolarHBondContact O-CA 3.07Å; E226-T242 VanDerWaalsContact CB-OG1 3.29Å; E226-T242 WeakPolarHBondContact CB-OG1 3.19Å; E226-T242 WeakPolarHBondContact O-CG2 3.36Å; E226-T242 PolarHBondContact O-N 3.12Å; E226-T242 PolarHBondContact O-OG1 3.38Å; E226-T242 PolarHBondContact OE2-OG1 3.04Å; E226-K243 HydrophobicContact CB-CG 4.4Å; E226-K243 VanDerWaalsContact CD-NZ 3.31Å; E226-K243 HydrophobicContact CG-CG 4.33Å; E226-K243 IonicContact OE1-NZ 3.7Å; E226-K243 IonicContact OE2-NZ 2.69Å; E226-K243 PolarHBondContact OE2-NZ 3.49Å
227	V	94.1	Very high	95.9	Very high	13 Å²	13	28.3 Å²	28.3	8%	0.079	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.4	-178.5	178.4	0	0	0	0	109.6	H221 Q224 L239 V240 D241	H221-V227 HydrophobicContact CB-CB 3.98Å; H221-V227 HydrophobicContact CB-CG1 4.07Å; H221-V227 VanDerWaalsContact CB-O 3.25Å; H221-V227 WeakPolarHBondContact CB-O 3.06Å; H221-V227 PolarHBondContact N-O 3.4Å; Q224-V227 HydrophobicContact CB-CB 3.81Å; Q224-V227 HydrophobicContact CB-CG2 3.88Å; Q224-V227 PolarHBondContact O-N 2.88Å; V227-L239 HydrophobicContact CG1-CD1 4.26Å; V227-L239 HydrophobicContact CG1-CD2 3.84Å; V227-L239 HydrophobicContact CG1-CG 3.94Å; V227-V240 WeakPolarHBondContact CA-O 3.5Å; V227-D241 HydrophobicContact CG2-CB 4.47Å
228	F	95.8	Very high	95.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	163.6	172.4	70.8	-81.3	0	0	0	109.8	L184 I192 I206 L218 A219 W220 F230 V240 T242	L184-F228 HydrophobicContact CD1-CB 3.7Å; L184-F228 HydrophobicContact CD1-CD1 3.94Å; L184-F228 HydrophobicContact CD1-CD2 3.65Å; L184-F228 HydrophobicContact CD1-CE1 4.49Å; L184-F228 HydrophobicContact CD1-CE2 4.23Å; L184-F228 HydrophobicContact CD1-CG 3.48Å; L184-F228 VanDerWaalsContact CD1-CG 3.48Å; L184-F228 HydrophobicContact CD2-CE1 4.49Å; I192-F228 HydrophobicContact CD1-CE2 4.47Å; I192-F228 HydrophobicContact CG2-CE2 4.17Å; I192-F228 HydrophobicContact CG2-CZ 4.23Å; I206-F228 HydrophobicContact CD1-CE1 3.52Å; I206-F228 HydrophobicContact CD1-CZ 3.64Å; I206-F228 HydrophobicContact CG2-CZ 4.38Å; L218-F228 HydrophobicContact CD2-CD2 4.22Å; L218-F228 HydrophobicContact CD2-CE2 4.15Å; A219-F228 CarbonylContact O-C 3.56Å; A219-F228 VanDerWaalsContact O-CA 3.31Å; A219-F228 WeakPolarHBondContact O-CA 3.31Å; A219-F228 WeakPolarHBondContact O-CB 3.25Å; W220-F228 HydrophobicContact CD2-CB 4.3Å; W220-F228 HydrophobicContact CE3-CB 4Å; W220-F228 HydrophobicContact CZ3-CB 4.46Å; F228-F230 HydrophobicContact CE2-CB 4.29Å; F228-F230 HydrophobicContact CE2-CD1 4.18Å; F228-V240 HydrophobicContact CD1-CB 4.17Å; F228-V240 HydrophobicContact CD1-CG1 4.47Å; F228-V240 HydrophobicContact CE1-CB 3.61Å; F228-V240 HydrophobicContact CE1-CG1 3.55Å; F228-V240 HydrophobicContact CE2-CB 4.11Å; F228-V240 HydrophobicContact CE2-CG2 4.32Å; F228-V240 HydrophobicContact CZ-CB 3.59Å; F228-V240 HydrophobicContact CZ-CG1 3.64Å; F228-V240 HydrophobicContact CZ-CG2 4.08Å; F228-V240 PolarHBondContact N-O 3.46Å; F228-V240 PolarHBondContact O-N 2.99Å; F228-T242 HydrophobicContact CD1-CG2 4.01Å; F228-T242 HydrophobicContact CE1-CG2 3.97Å
229	V	96.6	Very high	95.5	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	148.1	170.5	-65.9	0	0	0	0	109.3	A219 S238 L239 L261 F263 L271	A219-V229 HydrophobicContact CB-CG2 3.84Å; A219-V229 PolarHBondContact N-O 3.36Å; A219-V229 WeakPolarHBondContact O-CG2 3.37Å; A219-V229 PolarHBondContact O-N 3.28Å; V229-S238 CarbonylContact C-O 3.53Å; V229-S238 WeakPolarHBondContact CA-O 3.4Å; V229-L239 HydrophobicContact CG1-CB 4.05Å; V229-L239 HydrophobicContact CG1-CD1 4.15Å; V229-L239 HydrophobicContact CG1-CG 4.11Å; V229-L261 HydrophobicContact CB-CD1 4.38Å; V229-L261 HydrophobicContact CG2-CB 4.39Å; V229-L261 HydrophobicContact CG2-CD1 3.97Å; V229-F263 HydrophobicContact CG1-CZ 3.9Å; V229-F263 HydrophobicContact CG2-CE2 3.68Å; V229-F263 HydrophobicContact CG2-CZ 3.78Å; V229-L271 HydrophobicContact CB-CD2 4.19Å; V229-L271 HydrophobicContact CG1-CD2 4.04Å; V229-L271 HydrophobicContact CG2-CD1 3.97Å; V229-L271 HydrophobicContact CG2-CD2 3.87Å
230	F	96.3	Very high	95.2	Very high	7 Å²	7	28.4 Å²	28.4	3%	0.031	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	148.9	171.2	78.3	-88.6	0	0	0	110.5	I192 C208 A210 P215 S217 L218 F228 S238 V240	I192-F230 HydrophobicContact CD1-CB 3.98Å; I192-F230 HydrophobicContact CD1-CD1 3.86Å; I192-F230 HydrophobicContact CD1-CD2 3.79Å; I192-F230 HydrophobicContact CD1-CE1 4.26Å; I192-F230 HydrophobicContact CD1-CE2 4.22Å; I192-F230 HydrophobicContact CD1-CG 3.6Å; I192-F230 HydrophobicContact CD1-CZ 4.43Å; C208-F230 HydrophobicContact CB-CE1 4.21Å; C208-F230 HydrophobicContact CB-CZ 4.05Å; A210-F230 HydrophobicContact CB-CZ 4.11Å; P215-F230 HydrophobicContact CB-CD2 4.26Å; S217-F230 CarbonylContact O-C 3.57Å; S217-F230 WeakPolarHBondContact O-CA 3.42Å; S217-F230 WeakPolarHBondContact O-CB 3.5Å; L218-F230 HydrophobicContact CD2-CB 3.7Å; F228-F230 HydrophobicContact CE2-CB 4.29Å; F228-F230 HydrophobicContact CE2-CD1 4.18Å; F230-S238 PolarHBondContact N-O 2.99Å; F230-S238 PolarHBondContact O-N 2.9Å; F230-V240 HydrophobicContact CD1-CG2 3.62Å; F230-V240 HydrophobicContact CE1-CG2 3.47Å; F230-V240 VanDerWaalsContact CE1-CG2 3.47Å
231	G	97.1	Very high	94.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	150.6	173.1	0	0	0	0	0	110.3	T216 S217 T236 L261	T216-G231 PolarHBondContact N-O 2.99Å; T216-G231 PolarHBondContact OG1-O 2.8Å; S217-G231 PolarHBondContact N-O 2.74Å; S217-G231 PolarHBondContact O-N 3.21Å; G231-T236 WeakPolarHBondContact CA-O 3.47Å; G231-L261 VanDerWaalsContact N-CD1 3.35Å
232	D	96.3	Very high	94.4	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.011	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	169.7	176.2	70.9	25.8	0	0	0	113.2	L214 N234 G235 T236 V258	L214-D232 CarbonylContact O-C 3.56Å; L214-D232 VanDerWaalsContact O-CA 3.3Å; L214-D232 WeakPolarHBondContact O-CA 3.19Å; L214-D232 WeakPolarHBondContact O-CB 3.4Å; D232-N234 PolarHBondContact O-N 3.4Å; D232-N234 VanDerWaalsContact OD1-C 3.29Å; D232-N234 WeakPolarHBondContact OD1-CA 3.18Å; D232-N234 PolarHBondContact OD1-N 3.36Å; D232-G235 PolarHBondContact O-N 3.16Å; D232-G235 PolarHBondContact OD1-N 3.28Å; D232-T236 PolarHBondContact N-O 2.87Å; D232-T236 PolarHBondContact OD1-N 2.69Å; D232-T236 PolarHBondContact OD1-OG1 3.38Å; D232-T236 WeakPolarHBondContact OD2-CB 3.4Å; D232-T236 PolarHBondContact OD2-OG1 3.38Å; D232-V258 PolarHBondContact O-N 2.83Å
233	E	96.6	Very high	93.9	Very high	83 Å²	83	34.6 Å²	34.6	39%	0.388	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.1	177.7	65.3	179	171.7	0	0	114.1	Y213 L214 T216 C257	Y213-E233 HydrophobicContact CD1-CG 4.25Å; Y213-E233 HydrophobicContact CG-CG 4.49Å; L214-E233 HydrophobicContact CB-CG 4.19Å; L214-E233 PolarHBondContact N-OE1 2.84Å; L214-E233 VanDerWaalsContact N-OE1 3.15Å; L214-E233 PolarHBondContact O-N 2.93Å; T216-E233 HydrophobicContact CG2-CB 3.99Å; E233-C257 HydrophobicContact CB-CB 4.33Å; E233-C257 VanDerWaalsContact O-CA 3.3Å; E233-C257 WeakPolarHBondContact O-CA 3.49Å; E233-C257 PolarHBondContact O-N 3.4Å
234	N	96	Very high	92.9	Very high	74 Å²	74	32.4 Å²	32.4	40%	0.396	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	3.2	-179	-170.9	74.6	0	0	0	112.6	Y213 D232	Y213-N234 HydrophobicContact CD1-CB 3.99Å; Y213-N234 HydrophobicContact CD2-CB 3.84Å; Y213-N234 HydrophobicContact CE1-CB 4.2Å; Y213-N234 HydrophobicContact CE2-CB 4.06Å; Y213-N234 HydrophobicContact CG-CB 3.81Å; D232-N234 PolarHBondContact O-N 3.4Å; D232-N234 VanDerWaalsContact OD1-C 3.29Å; D232-N234 WeakPolarHBondContact OD1-CA 3.18Å; D232-N234 PolarHBondContact OD1-N 3.36Å
235	G	96.6	Very high	91.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	87.3	11.4	176.4	0	0	0	0	0	115	D232 V253 H254 Q256	D232-G235 PolarHBondContact O-N 3.16Å; D232-G235 PolarHBondContact OD1-N 3.28Å; G235-V253 PolarHBondContact O-N 3.25Å; G235-H254 PolarHBondContact O-N 2.83Å; G235-Q256 WeakPolarHBondContact CA-O 3.49Å; G235-Q256 PolarHBondContact N-O 2.99Å
236	T	96.3	Very high	90	Very high	17 Å²	17	32.9 Å²	32.9	10%	0.104	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	135.8	173.9	-35.4	0	0	0	0	110	G231 D232 S251	G231-T236 WeakPolarHBondContact CA-O 3.47Å; D232-T236 PolarHBondContact N-O 2.87Å; D232-T236 PolarHBondContact OD1-N 2.69Å; D232-T236 PolarHBondContact OD1-OG1 3.38Å; D232-T236 WeakPolarHBondContact OD2-CB 3.4Å; D232-T236 PolarHBondContact OD2-OG1 3.38Å; T236-S251 WeakPolarHBondContact CA-O 3.34Å; T236-S251 VanDerWaalsContact CG2-O 3.29Å; T236-S251 WeakPolarHBondContact CG2-O 3.06Å
237	V	97.1	Very high	88.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.9	167.3	-179.2	0	0	0	0	108.1	S250 S251 V253 V258 L261 L271 L283 L287	V237-S250 CarbonylContact O-C 3.57Å; V237-S250 WeakPolarHBondContact O-CA 3.01Å; V237-S251 PolarHBondContact N-O 3.11Å; V237-S251 PolarHBondContact O-N 2.65Å; V237-V253 HydrophobicContact CB-CG2 3.95Å; V237-V253 HydrophobicContact CG2-CB 4.02Å; V237-V253 HydrophobicContact CG2-CG2 3.8Å; V237-V258 HydrophobicContact CG2-CG1 4.36Å; V237-V258 HydrophobicContact CG2-CG2 4.13Å; V237-L261 HydrophobicContact CG1-CD1 4.48Å; V237-L261 HydrophobicContact CG1-CD2 4.04Å; V237-L261 HydrophobicContact CG2-CD2 4.09Å; V237-L271 HydrophobicContact CG1-CD2 3.92Å; V237-L283 HydrophobicContact CB-CD1 4.45Å; V237-L283 HydrophobicContact CG1-CD1 4.37Å; V237-L287 HydrophobicContact CG1-CD2 4.06Å; V237-L287 WeakPolarHBondContact O-CD1 3.18Å
238	S	94.3	Very high	87.6	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	139.6	-176.1	-66.3	0	0	0	0	111.5	V229 F230 L249 S250	V229-S238 CarbonylContact C-O 3.53Å; V229-S238 WeakPolarHBondContact CA-O 3.4Å; F230-S238 PolarHBondContact N-O 2.99Å; F230-S238 PolarHBondContact O-N 2.9Å; S238-L249 CarbonylContact C-O 3.59Å; S238-L249 VanDerWaalsContact CA-O 3.31Å; S238-L249 WeakPolarHBondContact CA-O 3.27Å; S238-S250 WeakPolarHBondContact OG-CB 3.25Å
239	L	93.7	Very high	87.1	Confident	28 Å²	28	39 Å²	39	15%	0.147	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.3	175.7	-173.2	148.6	0	0	0	110.1	V227 V229 V248 L249 L287	V227-L239 HydrophobicContact CG1-CD1 4.26Å; V227-L239 HydrophobicContact CG1-CD2 3.84Å; V227-L239 HydrophobicContact CG1-CG 3.94Å; V229-L239 HydrophobicContact CG1-CB 4.05Å; V229-L239 HydrophobicContact CG1-CD1 4.15Å; V229-L239 HydrophobicContact CG1-CG 4.11Å; L239-V248 HydrophobicContact CD2-CB 3.93Å; L239-V248 HydrophobicContact CD2-CG1 4.24Å; L239-V248 HydrophobicContact CD2-CG2 4.33Å; L239-V248 WeakPolarHBondContact O-CB 3.19Å; L239-V248 PolarHBondContact O-N 3.2Å; L239-L249 HydrophobicContact CB-CB 4.34Å; L239-L249 PolarHBondContact N-O 3.25Å; L239-L249 PolarHBondContact O-N 3.12Å; L239-L287 HydrophobicContact CB-CD1 4.23Å
240	V	92.6	Very high	86.9	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	136.4	-172.6	-175.9	0	0	0	0	110.1	I206 V227 F228 F230	I206-V240 HydrophobicContact CG2-CG1 4.1Å; V227-V240 WeakPolarHBondContact CA-O 3.5Å; F228-V240 HydrophobicContact CD1-CB 4.17Å; F228-V240 HydrophobicContact CD1-CG1 4.47Å; F228-V240 HydrophobicContact CE1-CB 3.61Å; F228-V240 HydrophobicContact CE1-CG1 3.55Å; F228-V240 HydrophobicContact CE2-CB 4.11Å; F228-V240 HydrophobicContact CE2-CG2 4.32Å; F228-V240 HydrophobicContact CZ-CB 3.59Å; F228-V240 HydrophobicContact CZ-CG1 3.64Å; F228-V240 HydrophobicContact CZ-CG2 4.08Å; F228-V240 PolarHBondContact N-O 3.46Å; F228-V240 PolarHBondContact O-N 2.99Å; F230-V240 HydrophobicContact CD1-CG2 3.62Å; F230-V240 HydrophobicContact CE1-CG2 3.47Å; F230-V240 VanDerWaalsContact CE1-CG2 3.47Å
241	D	90.4	Very high	86.8	Confident	49 Å²	49	44 Å²	44	26%	0.262	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126.9	167.1	-173.9	-33.7	0	0	0	108.5	E226 V227 K243 S244 V248	E226-D241 CarbonylContact O-C 3.58Å; E226-D241 WeakPolarHBondContact O-CA 3.07Å; V227-D241 HydrophobicContact CG2-CB 4.47Å; D241-K243 PolarHBondContact O-N 3.04Å; D241-K243 VanDerWaalsContact OD1-CB 3.32Å; D241-K243 WeakPolarHBondContact OD1-CB 3.37Å; D241-K243 PolarHBondContact OD1-N 2.86Å; D241-S244 CarbonylContact O-C 3.52Å; D241-S244 PolarHBondContact O-N 2.85Å; D241-V248 HydrophobicContact CB-CG2 4.13Å
242	T	86.6	Confident	86.8	Confident	19 Å²	19	48.2 Å²	48.2	12%	0.117	29%	0.287	C	S	.	.	S	Bend	trans	-65.3	-21.2	-179.9	61.1	0	0	0	0	112.8	L194 I206 W220 E226 F228	L194-T242 HydrophobicContact CD2-CG2 4.27Å; I206-T242 HydrophobicContact CD1-CG2 4.21Å; W220-T242 HydrophobicContact CH2-CG2 4.11Å; W220-T242 HydrophobicContact CZ3-CG2 4.18Å; E226-T242 VanDerWaalsContact CB-OG1 3.29Å; E226-T242 WeakPolarHBondContact CB-OG1 3.19Å; E226-T242 WeakPolarHBondContact O-CG2 3.36Å; E226-T242 PolarHBondContact O-N 3.12Å; E226-T242 PolarHBondContact O-OG1 3.38Å; E226-T242 PolarHBondContact OE2-OG1 3.04Å; F228-T242 HydrophobicContact CD1-CG2 4.01Å; F228-T242 HydrophobicContact CE1-CG2 3.97Å
243	K	84.2	Confident	86.8	Confident	148 Å²	148	48.7 Å²	48.7	64%	0.643	29%	0.29	S	S	*	.	S	Bend	trans	-83.6	-38.2	177.8	-60.4	-57.5	-171.3	-124.3	0	112.6	E226 D241	E226-K243 HydrophobicContact CB-CG 4.4Å; E226-K243 VanDerWaalsContact CD-NZ 3.31Å; E226-K243 HydrophobicContact CG-CG 4.33Å; E226-K243 IonicContact OE1-NZ 3.7Å; E226-K243 IonicContact OE2-NZ 2.69Å; E226-K243 PolarHBondContact OE2-NZ 3.49Å; D241-K243 PolarHBondContact O-N 3.04Å; D241-K243 VanDerWaalsContact OD1-CB 3.32Å; D241-K243 WeakPolarHBondContact OD1-CB 3.37Å; D241-K243 PolarHBondContact OD1-N 2.86Å
244	S	73.3	Confident	86.9	Confident	58 Å²	58	45.4 Å²	45.4	41%	0.406	28%	0.275	S	S	.	.	S	Bend	trans	-103.8	93.8	176.5	-168.9	0	0	0	0	107.3	D241 S246	D241-S244 CarbonylContact O-C 3.52Å; D241-S244 PolarHBondContact O-N 2.85Å; S244-S246 PolarHBondContact O-N 3.45Å; S244-S246 PolarHBondContact OG-OG 3.19Å; S244-S246 VanDerWaalsContact OG-OG 3.07Å
245	T	62.5	Low	87	Confident	98 Å²	98	46.3 Å²	46.3	60%	0.601	29%	0.287	S	S	*	.			trans	-67.7	35.3	-177.6	60.8	0	0	0	0	113.8
246	S	62.5	Low	87.1	Confident	55 Å²	55	50.5 Å²	50.5	39%	0.385	31%	0.307	S	S	.	.	S	Bend	trans	-117.2	133.6	172.2	56	0	0	0	0	107.3	S244 V248	S244-S246 PolarHBondContact O-N 3.45Å; S244-S246 PolarHBondContact OG-OG 3.19Å; S244-S246 VanDerWaalsContact OG-OG 3.07Å; S246-V248 PolarHBondContact O-N 2.95Å; S246-V248 VanDerWaalsContact O-N 3.15Å
247	C	63.2	Low	87.1	Confident	27 Å²	27	50.5 Å²	50.5	18%	0.182	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	123.3	171.4	-174.1	0	0	0	0	108.8	S209 L249	S209-C247 PolarHBondContact OG-N 3.25Å; C247-L249 PolarHBondContact SG-O 2.91Å
248	V	71.3	Confident	87.2	Confident	83 Å²	83	50.5 Å²	50.5	50%	0.503	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-41.3	-174	-178.8	0	0	0	0	109.5	L239 D241 S246	L239-V248 HydrophobicContact CD2-CB 3.93Å; L239-V248 HydrophobicContact CD2-CG1 4.24Å; L239-V248 HydrophobicContact CD2-CG2 4.33Å; L239-V248 WeakPolarHBondContact O-CB 3.19Å; L239-V248 PolarHBondContact O-N 3.2Å; D241-V248 HydrophobicContact CB-CG2 4.13Å; S246-V248 PolarHBondContact O-N 2.95Å; S246-V248 VanDerWaalsContact O-N 3.15Å
249	L	85.8	Confident	87.4	Confident	68 Å²	68	52 Å²	52	36%	0.356	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	141.7	-174.5	-168.6	63.7	0	0	0	109.9	S238 L239 C247 S286 L287	S238-L249 CarbonylContact C-O 3.59Å; S238-L249 VanDerWaalsContact CA-O 3.31Å; S238-L249 WeakPolarHBondContact CA-O 3.27Å; L239-L249 HydrophobicContact CB-CB 4.34Å; L239-L249 PolarHBondContact N-O 3.25Å; L239-L249 PolarHBondContact O-N 3.12Å; C247-L249 PolarHBondContact SG-O 2.91Å; L249-S286 VanDerWaalsContact CD2-C 3.46Å; L249-S286 VanDerWaalsContact CD2-O 3.25Å; L249-S286 WeakPolarHBondContact CD2-O 3.3Å; L249-L287 HydrophobicContact CB-CD1 4.29Å; L249-L287 HydrophobicContact CD2-CB 4.29Å; L249-L287 HydrophobicContact CD2-CD1 4.17Å; L249-L287 HydrophobicContact CD2-CG 4.01Å; L249-L287 HydrophobicContact CG-CD1 4.03Å; L249-L287 HydrophobicContact CG-CG 4.4Å
250	S	91.6	Very high	87.6	Confident	75 Å²	75	51.1 Å²	51.1	52%	0.524	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	141.9	175.3	60.9	0	0	0	0	110.6	V237 S238	V237-S250 CarbonylContact O-C 3.57Å; V237-S250 WeakPolarHBondContact O-CA 3.01Å; S238-S250 WeakPolarHBondContact OG-CB 3.25Å
251	S	95.2	Very high	87.9	Confident	39 Å²	39	51.7 Å²	51.7	27%	0.273	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	135.5	178	-172.4	0	0	0	0	109.8	T236 V237 V253 L287	T236-S251 WeakPolarHBondContact CA-O 3.34Å; T236-S251 VanDerWaalsContact CG2-O 3.29Å; T236-S251 WeakPolarHBondContact CG2-O 3.06Å; V237-S251 PolarHBondContact N-O 3.11Å; V237-S251 PolarHBondContact O-N 2.65Å; S251-V253 PolarHBondContact O-N 3.19Å; S251-L287 PolarHBondContact OG-O 3.15Å
252	A	95.9	Very high	88.3	Confident	88 Å²	88	50.8 Å²	50.8	73%	0.727	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	92.6	173.4	0	0	0	0	0	108.7
253	V	97.6	Very high	88.8	Confident	11 Å²	11	51.5 Å²	51.5	7%	0.067	32%	0.315	C	S	.	.			trans	-93	-33.5	-168.6	-179.8	0	0	0	0	111.8	G235 V237 S251 A281 L283 R292	G235-V253 PolarHBondContact O-N 3.25Å; V237-V253 HydrophobicContact CB-CG2 3.95Å; V237-V253 HydrophobicContact CG2-CB 4.02Å; V237-V253 HydrophobicContact CG2-CG2 3.8Å; S251-V253 PolarHBondContact O-N 3.19Å; V253-A281 HydrophobicContact CG1-CB 3.55Å; V253-L283 HydrophobicContact CG1-CD1 4.3Å; V253-L283 HydrophobicContact CG1-CD2 3.98Å; V253-L283 HydrophobicContact CG2-CD1 3.76Å; V253-L283 HydrophobicContact CG2-CD2 4.2Å; V253-R292 PolarHBondContact O-NH1 3.45Å; V253-R292 PolarHBondContact O-NH2 2.9Å
254	H	98.4	Very high	89.5	Confident	14 Å²	14	44.6 Å²	44.6	7%	0.065	29%	0.285	C	S	.	.			trans	-125.3	165.2	-175.9	-67	-81.4	0	0	0	111.2	G235 S273 S275 D277 S279	G235-H254 PolarHBondContact O-N 2.83Å; H254-S273 PolarHBondContact CD2-OG 2.88Å; H254-S273 VanDerWaalsContact CD2-OG 3.24Å; H254-S273 WeakPolarHBondContact NE2-CB 3.43Å; H254-S273 PolarHBondContact NE2-O 3.04Å; H254-S273 PolarHBondContact NE2-OG 2.86Å; H254-S275 VanDerWaalsContact CG-CB 3.43Å; H254-S275 WeakPolarHBondContact ND1-CB 3.47Å; H254-D277 WeakPolarHBondContact CA-OD2 3.37Å; H254-D277 WeakPolarHBondContact CB-OD2 3.19Å; H254-D277 IonicContact CG-OD2 3.29Å; H254-D277 IonicContact ND1-OD1 3Å; H254-D277 PolarHBondContact ND1-OD1 3.32Å; H254-D277 IonicContact ND1-OD2 2.9Å; H254-D277 PolarHBondContact ND1-OD2 2.89Å; H254-S279 PolarHBondContact ND1-OG 3.31Å
255	S	97.6	Very high	90.4	Very high	93 Å²	93	44.8 Å²	44.8	65%	0.65	29%	0.285	S	S	*	.	S	Bend	trans	-99.5	-6.7	176.9	58	0	0	0	0	114	D277	S255-D277 PolarHBondContact N-OD2 2.82Å; S255-D277 VanDerWaalsContact OG-CB 3.25Å; S255-D277 WeakPolarHBondContact OG-CB 3.5Å; S255-D277 PolarHBondContact OG-OD2 3.47Å
256	Q	98.1	Very high	91.9	Very high	89 Å²	89	42 Å²	42	42%	0.416	27%	0.265	S	S	.	.	S	Bend	trans	-140.2	-176	175.4	-62.2	-165.2	6.4	0	0	109.5	G235 S275 E276 D277	G235-Q256 WeakPolarHBondContact CA-O 3.49Å; G235-Q256 PolarHBondContact N-O 2.99Å; Q256-S275 PolarHBondContact O-OG 2.9Å; Q256-E276 HydrophobicContact CB-CB 4.22Å; Q256-D277 HydrophobicContact CB-CB 4.1Å; Q256-D277 HydrophobicContact CG-CB 4.12Å
257	C	97.9	Very high	93.2	Very high	16 Å²	16	44.2 Å²	44.2	11%	0.108	28%	0.281	C	S	.	.			trans	-54.7	142.4	-173.3	79.7	0	0	0	0	113	T216 E233 T259 S275 E276	T216-C257 HydrophobicContact CG2-CB 4.38Å; E233-C257 HydrophobicContact CB-CB 4.33Å; E233-C257 VanDerWaalsContact O-CA 3.3Å; E233-C257 WeakPolarHBondContact O-CA 3.49Å; E233-C257 PolarHBondContact O-N 3.4Å; C257-T259 PolarHBondContact O-N 2.73Å; C257-S275 VanDerWaalsContact O-CA 3.25Å; C257-S275 WeakPolarHBondContact O-CA 3.39Å; C257-S275 WeakPolarHBondContact O-CB 3.45Å; C257-S275 PolarHBondContact O-OG 2.7Å; C257-E276 PolarHBondContact O-N 2.76Å; C257-E276 WeakPolarHBondContact SG-CG 3.45Å; C257-E276 PolarHBondContact SG-OE1 2.81Å; C257-E276 PolarHBondContact SG-OE2 3.38Å
258	V	98.6	Very high	94.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	105.7	173.7	-174.5	0	0	0	0	108.4	T216 S217 D232 V237 L261 L274	T216-V258 WeakPolarHBondContact CB-O 3.31Å; T216-V258 PolarHBondContact OG1-O 3.24Å; S217-V258 WeakPolarHBondContact OG-CG1 3.38Å; S217-V258 PolarHBondContact OG-O 2.78Å; D232-V258 PolarHBondContact O-N 2.83Å; V237-V258 HydrophobicContact CG2-CG1 4.36Å; V237-V258 HydrophobicContact CG2-CG2 4.13Å; V258-L261 HydrophobicContact CG1-CD2 3.94Å; V258-L261 HydrophobicContact CG1-CG 4Å; V258-L274 CarbonylContact C-O 3.56Å
259	T	98.4	Very high	95.7	Very high	31 Å²	31	44 Å²	44	19%	0.19	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-25.4	-175.2	37.2	0	0	0	0	113	C257 L274 S275 E276 V300	C257-T259 PolarHBondContact O-N 2.73Å; T259-L274 PolarHBondContact N-O 2.82Å; T259-L274 VanDerWaalsContact OG1-C 3.26Å; T259-L274 WeakPolarHBondContact OG1-CD1 3.39Å; T259-L274 PolarHBondContact OG1-O 3.47Å; T259-L274 VanDerWaalsContact OG1-O 3.11Å; T259-S275 VanDerWaalsContact OG1-CA 3.27Å; T259-S275 WeakPolarHBondContact OG1-CA 3.15Å; T259-S275 PolarHBondContact OG1-N 3.2Å; T259-E276 HydrophobicContact CG2-CG 3.71Å; T259-V300 PolarHBondContact OG1-O 3.37Å
260	G	98.2	Very high	96.2	Very high	11 Å²	11	42.4 Å²	42.4	11%	0.113	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	152.6	-176.5	0	0	0	0	0	113.4	L274	G260-L274 PolarHBondContact N-O 3.1Å; G260-L274 PolarHBondContact O-N 2.66Å; G260-L274 VanDerWaalsContact O-N 3.12Å
261	L	98.8	Very high	96.6	Very high	13 Å²	13	39 Å²	39	7%	0.068	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	124.2	-178.2	-72	173	0	0	0	108.9	A219 V229 G231 V237 V258 L271 A272	A219-L261 HydrophobicContact CB-CB 3.87Å; A219-L261 WeakPolarHBondContact CB-O 3.49Å; V229-L261 HydrophobicContact CB-CD1 4.38Å; V229-L261 HydrophobicContact CG2-CB 4.39Å; V229-L261 HydrophobicContact CG2-CD1 3.97Å; G231-L261 VanDerWaalsContact N-CD1 3.35Å; V237-L261 HydrophobicContact CG1-CD1 4.48Å; V237-L261 HydrophobicContact CG1-CD2 4.04Å; V237-L261 HydrophobicContact CG2-CD2 4.09Å; V258-L261 HydrophobicContact CG1-CD2 3.94Å; V258-L261 HydrophobicContact CG1-CG 4Å; L261-L271 HydrophobicContact CB-CD1 4.2Å; L261-L271 HydrophobicContact CD2-CD1 4.2Å; L261-L271 HydrophobicContact CD2-CD2 4.22Å; L261-L271 HydrophobicContact CD2-CG 4.29Å; L261-A272 WeakPolarHBondContact CA-O 3.25Å
262	V	98.6	Very high	96.7	Very high	30 Å²	30	37.1 Å²	37.1	18%	0.182	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	114.3	-174.1	-172.1	0	0	0	0	110.9	A272 A303 W305	V262-A272 PolarHBondContact N-O 3.17Å; V262-A272 WeakPolarHBondContact O-CB 3.26Å; V262-A272 PolarHBondContact O-N 3.12Å; V262-A303 HydrophobicContact CG2-CB 4.46Å; V262-A303 WeakPolarHBondContact CG2-O 3.47Å; V262-W305 PolarHBondContact O-NE1 2.89Å
263	F	98.2	Very high	96.9	Very high	34 Å²	34	32.9 Å²	32.9	15%	0.149	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	144.3	174.6	-76.1	-75.8	0	0	0	112	A219 W220 H221 P222 V229 P269 F270 L271 W305	A219-F263 HydrophobicContact CB-CD2 4.17Å; A219-F263 HydrophobicContact CB-CE2 4.13Å; W220-F263 WeakPolarHBondContact O-CD2 3.29Å; W220-F263 WeakPolarHBondContact O-CE2 3.32Å; H221-F263 HydrophobicContact CB-CE2 4.43Å; H221-F263 HydrophobicContact CB-CZ 4.39Å; H221-F263 AromaticContact CD2-CE1 3.9Å; H221-F263 AromaticContact CD2-CZ 3.9Å; P222-F263 HydrophobicContact CG-CB 4.07Å; P222-F263 HydrophobicContact CG-CG 4.3Å; V229-F263 HydrophobicContact CG1-CZ 3.9Å; V229-F263 HydrophobicContact CG2-CE2 3.68Å; V229-F263 HydrophobicContact CG2-CZ 3.78Å; F263-P269 HydrophobicContact CB-CB 4.34Å; F263-P269 HydrophobicContact CD1-CB 3.93Å; F263-P269 HydrophobicContact CD1-CG 4.13Å; F263-F270 CarbonylContact C-O 3.6Å; F263-F270 WeakPolarHBondContact CA-O 3.35Å; F263-L271 HydrophobicContact CD1-CB 4.17Å; F263-L271 HydrophobicContact CD1-CD1 4.09Å; F263-L271 HydrophobicContact CD2-CD1 4.28Å; F263-L271 HydrophobicContact CE1-CB 4.05Å; F263-L271 HydrophobicContact CE1-CD1 4.07Å; F263-L271 HydrophobicContact CE1-CG 4.48Å; F263-L271 HydrophobicContact CE2-CD1 4.25Å; F263-L271 HydrophobicContact CG-CD1 4.22Å; F263-L271 HydrophobicContact CZ-CD1 4.15Å; F263-W305 VanDerWaalsContact O-CD1 3.3Å
264	S	97.3	Very high	96.9	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.021	19%	0.194	C	C	.	.			trans	-75.1	157.5	173.5	79.4	0	0	0	0	111.9	H266 P269 F270 W305	S264-H266 VanDerWaalsContact CB-ND1 3.35Å; S264-H266 WeakPolarHBondContact CB-ND1 3.31Å; S264-H266 PolarHBondContact O-N 3.14Å; S264-H266 PolarHBondContact OG-ND1 2.89Å; S264-P269 WeakPolarHBondContact O-CB 3.33Å; S264-P269 WeakPolarHBondContact OG-CA 3.45Å; S264-F270 PolarHBondContact N-O 3.2Å; S264-F270 PolarHBondContact OG-N 2.88Å; S264-F270 PolarHBondContact OG-O 3.25Å; S264-W305 VanDerWaalsContact CB-CE2 3.43Å
265	P	93.8	Very high	96.9	Very high	63 Å²	63	31.7 Å²	31.7	41%	0.409	19%	0.191	S	C	.	.	S	Bend	trans	-77.8	4.4	179.9	32.4	-36.9	0	0	0	114.4	W305 H310	P265-W305 HydrophobicContact CG-CB 4.29Å; P265-H310 HydrophobicContact CG-CB 4.08Å
266	H	92.6	Very high	97	Very high	39 Å²	39	30.2 Å²	30.2	18%	0.181	17%	0.173	C	C	.	.	S	Bend	trans	-66.6	159.7	-178.8	-60.5	93.7	0	0	0	112.9	Q223 S264 V268 F270 H310	Q223-H266 PolarHBondContact NE2-O 2.82Å; S264-H266 VanDerWaalsContact CB-ND1 3.35Å; S264-H266 WeakPolarHBondContact CB-ND1 3.31Å; S264-H266 PolarHBondContact O-N 3.14Å; S264-H266 PolarHBondContact OG-ND1 2.89Å; H266-V268 WeakPolarHBondContact CB-O 3.42Å; H266-V268 PolarHBondContact O-N 2.78Å; H266-F270 AromaticContact ND1-CD2 3.83Å; H266-H310 PolarHBondContact CE1-O 2.85Å; H266-H310 WeakPolarHBondContact NE2-CB 3.35Å; H266-H310 PolarHBondContact NE2-O 2.8Å
267	S	89.7	Confident	97	Very high	101 Å²	101	27 Å²	27	71%	0.706	16%	0.159	S	C	*	.	S	Bend	trans	-65.6	-26.2	172.3	60.6	0	0	0	0	113.2	Q223	Q223-S267 VanDerWaalsContact NE2-C 3.3Å; Q223-S267 PolarHBondContact NE2-O 2.86Å; Q223-S267 PolarHBondContact OE1-O 3.23Å
268	V	92.6	Very high	97	Very high	97 Å²	97	27.9 Å²	27.9	59%	0.588	17%	0.165	S	C	*	.	S	Bend	trans	-118.5	101.4	164.6	179.5	0	0	0	0	105.2	H266 F270	H266-V268 WeakPolarHBondContact CB-O 3.42Å; H266-V268 PolarHBondContact O-N 2.78Å; V268-F270 PolarHBondContact O-N 2.81Å
269	P	95.1	Very high	97	Very high	9 Å²	9	27.9 Å²	27.9	6%	0.058	17%	0.165	C	C	.	.			trans	-76.2	130.4	-166.7	31	-36	0	0	0	110.8	H221 P222 F263 S264	H221-P269 WeakPolarHBondContact NE2-CG 3.3Å; P222-P269 HydrophobicContact CG-CB 3.96Å; P222-P269 HydrophobicContact CG-CG 3.86Å; F263-P269 HydrophobicContact CB-CB 4.34Å; F263-P269 HydrophobicContact CD1-CB 3.93Å; F263-P269 HydrophobicContact CD1-CG 4.13Å; S264-P269 WeakPolarHBondContact O-CB 3.33Å; S264-P269 WeakPolarHBondContact OG-CA 3.45Å
270	F	97	Very high	97	Very high	34 Å²	34	26.5 Å²	26.5	15%	0.149	16%	0.156	C	C	.	.			trans	-72.8	156.9	158.4	-60.9	-70.3	0	0	0	110.5	F263 S264 H266 V268 V282 L283 V290 W305 T329	F263-F270 CarbonylContact C-O 3.6Å; F263-F270 WeakPolarHBondContact CA-O 3.35Å; S264-F270 PolarHBondContact N-O 3.2Å; S264-F270 PolarHBondContact OG-N 2.88Å; S264-F270 PolarHBondContact OG-O 3.25Å; H266-F270 AromaticContact ND1-CD2 3.83Å; V268-F270 PolarHBondContact O-N 2.81Å; F270-V282 HydrophobicContact CB-CG1 3.61Å; F270-V282 HydrophobicContact CG-CG1 4.2Å; F270-L283 CarbonylContact C-O 3.58Å; F270-L283 WeakPolarHBondContact CA-O 3.25Å; F270-V290 HydrophobicContact CD1-CG2 4.47Å; F270-V290 HydrophobicContact CE1-CG2 4.32Å; F270-W305 HydrophobicContact CB-CH2 4.33Å; F270-W305 HydrophobicContact CB-CZ2 4.31Å; F270-T329 HydrophobicContact CE2-CG2 4.4Å
271	L	98.3	Very high	97	Very high	3 Å²	3	26 Å²	26	2%	0.016	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	113.9	175.7	176.3	61.8	0	0	0	110	V229 V237 L261 F263 V282 L283 L287	V229-L271 HydrophobicContact CB-CD2 4.19Å; V229-L271 HydrophobicContact CG1-CD2 4.04Å; V229-L271 HydrophobicContact CG2-CD1 3.97Å; V229-L271 HydrophobicContact CG2-CD2 3.87Å; V237-L271 HydrophobicContact CG1-CD2 3.92Å; L261-L271 HydrophobicContact CB-CD1 4.2Å; L261-L271 HydrophobicContact CD2-CD1 4.2Å; L261-L271 HydrophobicContact CD2-CD2 4.22Å; L261-L271 HydrophobicContact CD2-CG 4.29Å; F263-L271 HydrophobicContact CD1-CB 4.17Å; F263-L271 HydrophobicContact CD1-CD1 4.09Å; F263-L271 HydrophobicContact CD2-CD1 4.28Å; F263-L271 HydrophobicContact CE1-CB 4.05Å; F263-L271 HydrophobicContact CE1-CD1 4.07Å; F263-L271 HydrophobicContact CE1-CG 4.48Å; F263-L271 HydrophobicContact CE2-CD1 4.25Å; F263-L271 HydrophobicContact CG-CD1 4.22Å; F263-L271 HydrophobicContact CZ-CD1 4.15Å; L271-V282 CarbonylContact O-C 3.56Å; L271-V282 WeakPolarHBondContact O-CA 3.43Å; L271-L283 HydrophobicContact CB-CB 4.37Å; L271-L283 HydrophobicContact CD2-CD1 4.33Å; L271-L283 PolarHBondContact N-O 3.24Å; L271-L283 PolarHBondContact O-N 2.81Å; L271-L287 HydrophobicContact CD2-CD2 3.91Å
272	A	98.6	Very high	97	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	132.3	167.5	0	0	0	0	0	109.6	L261 V262 L280 A281 V282 W305 L313	L261-A272 WeakPolarHBondContact CA-O 3.25Å; V262-A272 PolarHBondContact N-O 3.17Å; V262-A272 WeakPolarHBondContact O-CB 3.26Å; V262-A272 PolarHBondContact O-N 3.12Å; A272-L280 HydrophobicContact CB-CD1 4.2Å; A272-A281 CarbonylContact C-O 3.47Å; A272-A281 WeakPolarHBondContact CA-O 3.42Å; A272-V282 HydrophobicContact CB-CG2 4.47Å; A272-W305 HydrophobicContact CB-CZ2 4.09Å; A272-L313 HydrophobicContact CB-CD1 4.42Å; A272-L313 HydrophobicContact CB-CD2 3.79Å
273	S	98.6	Very high	97	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.7	177.7	178.5	0	0	0	0	109.1	H254 A281	H254-S273 PolarHBondContact CD2-OG 2.88Å; H254-S273 VanDerWaalsContact CD2-OG 3.24Å; H254-S273 WeakPolarHBondContact NE2-CB 3.43Å; H254-S273 PolarHBondContact NE2-O 3.04Å; H254-S273 PolarHBondContact NE2-OG 2.86Å; S273-A281 PolarHBondContact N-O 3.28Å; S273-A281 PolarHBondContact O-N 3.1Å
274	L	98.6	Very high	96.8	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.4	-176.8	52.2	89.2	0	0	0	110.7	V258 T259 G260 V300 R301 A303	V258-L274 CarbonylContact C-O 3.56Å; T259-L274 PolarHBondContact N-O 2.82Å; T259-L274 VanDerWaalsContact OG1-C 3.26Å; T259-L274 WeakPolarHBondContact OG1-CD1 3.39Å; T259-L274 PolarHBondContact OG1-O 3.47Å; T259-L274 VanDerWaalsContact OG1-O 3.11Å; G260-L274 PolarHBondContact N-O 3.1Å; G260-L274 PolarHBondContact O-N 2.66Å; G260-L274 VanDerWaalsContact O-N 3.12Å; L274-V300 HydrophobicContact CB-CB 4.05Å; L274-V300 HydrophobicContact CB-CG1 3.71Å; L274-V300 HydrophobicContact CD2-CG1 4.29Å; L274-V300 HydrophobicContact CG-CG1 4.42Å; L274-R301 WeakPolarHBondContact CD1-O 3.45Å; L274-A303 HydrophobicContact CD2-CB 3.39Å; L274-A303 VanDerWaalsContact CD2-N 3.34Å
275	S	98.8	Very high	96.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	160	-166.9	177.2	0	0	0	0	113.7	H254 Q256 C257 T259 D277 C278 S279	H254-S275 VanDerWaalsContact CG-CB 3.43Å; H254-S275 WeakPolarHBondContact ND1-CB 3.47Å; Q256-S275 PolarHBondContact O-OG 2.9Å; C257-S275 VanDerWaalsContact O-CA 3.25Å; C257-S275 WeakPolarHBondContact O-CA 3.39Å; C257-S275 WeakPolarHBondContact O-CB 3.45Å; C257-S275 PolarHBondContact O-OG 2.7Å; T259-S275 VanDerWaalsContact OG1-CA 3.27Å; T259-S275 WeakPolarHBondContact OG1-CA 3.15Å; T259-S275 PolarHBondContact OG1-N 3.2Å; S275-D277 WeakPolarHBondContact CB-OD1 3.5Å; S275-D277 PolarHBondContact O-N 2.77Å; S275-D277 PolarHBondContact OG-N 3.15Å; S275-D277 VanDerWaalsContact OG-N 3.12Å; S275-C278 PolarHBondContact O-N 2.87Å; S275-C278 VanDerWaalsContact O-N 3.16Å; S275-S279 PolarHBondContact N-O 3.12Å
276	E	98.5	Very high	96.5	Very high	61 Å²	61	28.4 Å²	28.4	29%	0.285	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-14.2	166.6	-72.5	178.8	177.4	0	0	113.3	Q256 C257 T259 C278 F299	Q256-E276 HydrophobicContact CB-CB 4.22Å; C257-E276 PolarHBondContact O-N 2.76Å; C257-E276 WeakPolarHBondContact SG-CG 3.45Å; C257-E276 PolarHBondContact SG-OE1 2.81Å; C257-E276 PolarHBondContact SG-OE2 3.38Å; T259-E276 HydrophobicContact CG2-CG 3.71Å; E276-C278 PolarHBondContact O-N 2.99Å; E276-C278 PolarHBondContact O-SG 3.24Å; E276-F299 HydrophobicContact CB-CD1 3.98Å; E276-F299 HydrophobicContact CB-CD2 4.43Å; E276-F299 HydrophobicContact CB-CE1 4.03Å; E276-F299 HydrophobicContact CB-CE2 4.47Å; E276-F299 HydrophobicContact CB-CG 4.19Å; E276-F299 HydrophobicContact CB-CZ 4.28Å; E276-F299 HydrophobicContact CG-CB 4.44Å; E276-F299 HydrophobicContact CG-CD1 4.22Å; E276-F299 HydrophobicContact CG-CD2 3.8Å; E276-F299 HydrophobicContact CG-CE1 4.41Å; E276-F299 HydrophobicContact CG-CE2 4.01Å; E276-F299 HydrophobicContact CG-CG 3.92Å; E276-F299 HydrophobicContact CG-CZ 4.32Å; E276-F299 WeakPolarHBondContact O-CD1 3.44Å; E276-F299 WeakPolarHBondContact O-CE1 3.45Å
277	D	98.3	Very high	96.6	Very high	23 Å²	23	26.7 Å²	26.7	12%	0.123	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	9	168.2	79.3	5.9	0	0	0	114.4	H254 S255 Q256 S275 S279	H254-D277 WeakPolarHBondContact CA-OD2 3.37Å; H254-D277 WeakPolarHBondContact CB-OD2 3.19Å; H254-D277 IonicContact CG-OD2 3.29Å; H254-D277 IonicContact ND1-OD1 3Å; H254-D277 PolarHBondContact ND1-OD1 3.32Å; H254-D277 IonicContact ND1-OD2 2.9Å; H254-D277 PolarHBondContact ND1-OD2 2.89Å; S255-D277 PolarHBondContact N-OD2 2.82Å; S255-D277 VanDerWaalsContact OG-CB 3.25Å; S255-D277 WeakPolarHBondContact OG-CB 3.5Å; S255-D277 PolarHBondContact OG-OD2 3.47Å; Q256-D277 HydrophobicContact CB-CB 4.1Å; Q256-D277 HydrophobicContact CG-CB 4.12Å; S275-D277 WeakPolarHBondContact CB-OD1 3.5Å; S275-D277 PolarHBondContact O-N 2.77Å; S275-D277 PolarHBondContact OG-N 3.15Å; S275-D277 VanDerWaalsContact OG-N 3.12Å; D277-S279 PolarHBondContact O-N 3.07Å; D277-S279 VanDerWaalsContact OD1-CB 3.28Å; D277-S279 WeakPolarHBondContact OD1-CB 3.36Å; D277-S279 PolarHBondContact OD1-N 3.4Å; D277-S279 VanDerWaalsContact OD1-N 3.12Å; D277-S279 PolarHBondContact OD1-OG 3.26Å
278	C	98.5	Very high	96.9	Very high	34 Å²	34	24.7 Å²	24.7	23%	0.23	15%	0.15	C	C	.	.	S	Bend	trans	64.4	19.3	176.5	-52.8	0	0	0	0	113.3	S275 E276 D298	S275-C278 PolarHBondContact O-N 2.87Å; S275-C278 VanDerWaalsContact O-N 3.16Å; E276-C278 PolarHBondContact O-N 2.99Å; E276-C278 PolarHBondContact O-SG 3.24Å; C278-D298 PolarHBondContact SG-O 3.2Å; C278-D298 VanDerWaalsContact SG-O 3.4Å
279	S	98.5	Very high	97.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.147	C	C	.	.			trans	-116.2	151.8	179.8	80.7	0	0	0	0	113.4	H254 S275 D277 S293	H254-S279 PolarHBondContact ND1-OG 3.31Å; S275-S279 PolarHBondContact N-O 3.12Å; D277-S279 PolarHBondContact O-N 3.07Å; D277-S279 VanDerWaalsContact OD1-CB 3.28Å; D277-S279 WeakPolarHBondContact OD1-CB 3.36Å; D277-S279 PolarHBondContact OD1-N 3.4Å; D277-S279 VanDerWaalsContact OD1-N 3.12Å; D277-S279 PolarHBondContact OD1-OG 3.26Å; S279-S293 WeakPolarHBondContact CA-O 3.39Å
280	L	98.7	Very high	97.1	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129	168.2	165.4	72.5	0	0	0	108.3	A272 F291 R292 S293 L313 T315	A272-L280 HydrophobicContact CB-CD1 4.2Å; L280-F291 HydrophobicContact CD2-CE1 4.05Å; L280-R292 CarbonylContact O-C 3.57Å; L280-R292 WeakPolarHBondContact O-CA 3.45Å; L280-R292 WeakPolarHBondContact O-CD 3.31Å; L280-S293 PolarHBondContact N-O 3.22Å; L280-S293 PolarHBondContact O-N 3.42Å; L280-L313 HydrophobicContact CD1-CD2 4.04Å; L280-L313 HydrophobicContact CD2-CD2 3.82Å; L280-L313 HydrophobicContact CD2-CG 4.48Å; L280-L313 HydrophobicContact CG-CD2 4.46Å; L280-T315 HydrophobicContact CD1-CG2 4.07Å; L280-T315 HydrophobicContact CD2-CG2 3.73Å; L280-T315 HydrophobicContact CG-CG2 4.32Å
281	A	98.6	Very high	97.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	148.3	167.6	0	0	0	0	0	110.3	V253 A272 S273 L283 F291 R292	V253-A281 HydrophobicContact CG1-CB 3.55Å; A272-A281 CarbonylContact C-O 3.47Å; A272-A281 WeakPolarHBondContact CA-O 3.42Å; S273-A281 PolarHBondContact N-O 3.28Å; S273-A281 PolarHBondContact O-N 3.1Å; A281-L283 HydrophobicContact CB-CD2 4.24Å; A281-F291 CarbonylContact C-O 3.55Å; A281-F291 WeakPolarHBondContact CA-O 3.48Å; A281-R292 VanDerWaalsContact CB-NH1 3.33Å
282	V	98.5	Very high	97.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129	162.4	-177.1	0	0	0	0	108.6	F270 L271 A272 V290 F291 W305 L313 V327	F270-V282 HydrophobicContact CB-CG1 3.61Å; F270-V282 HydrophobicContact CG-CG1 4.2Å; L271-V282 CarbonylContact O-C 3.56Å; L271-V282 WeakPolarHBondContact O-CA 3.43Å; A272-V282 HydrophobicContact CB-CG2 4.47Å; V282-V290 PolarHBondContact O-N 3.2Å; V282-F291 HydrophobicContact CB-CB 4.08Å; V282-F291 HydrophobicContact CG2-CB 4.35Å; V282-F291 HydrophobicContact CG2-CD1 3.97Å; V282-F291 PolarHBondContact N-O 2.98Å; V282-F291 PolarHBondContact O-N 3.03Å; V282-W305 HydrophobicContact CG1-CH2 4.04Å; V282-W305 HydrophobicContact CG1-CZ2 4.11Å; V282-W305 HydrophobicContact CG2-CH2 4.39Å; V282-W305 HydrophobicContact CG2-CZ2 4.42Å; V282-L313 HydrophobicContact CG2-CD2 3.82Å; V282-V327 HydrophobicContact CB-CG1 4.27Å; V282-V327 HydrophobicContact CG1-CG1 4.04Å; V282-V327 HydrophobicContact CG2-CG1 4.22Å; V282-V327 HydrophobicContact CG2-CG2 4.09Å
283	L	97.9	Very high	97.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	152.1	-173.6	-46.3	174.5	0	0	0	110.9	V237 V253 F270 L271 A281 L287 S288 E289	V237-L283 HydrophobicContact CB-CD1 4.45Å; V237-L283 HydrophobicContact CG1-CD1 4.37Å; V253-L283 HydrophobicContact CG1-CD1 4.3Å; V253-L283 HydrophobicContact CG1-CD2 3.98Å; V253-L283 HydrophobicContact CG2-CD1 3.76Å; V253-L283 HydrophobicContact CG2-CD2 4.2Å; F270-L283 CarbonylContact C-O 3.58Å; F270-L283 WeakPolarHBondContact CA-O 3.25Å; L271-L283 HydrophobicContact CB-CB 4.37Å; L271-L283 HydrophobicContact CD2-CD1 4.33Å; L271-L283 PolarHBondContact N-O 3.24Å; L271-L283 PolarHBondContact O-N 2.81Å; A281-L283 HydrophobicContact CB-CD2 4.24Å; L283-L287 HydrophobicContact CD1-CB 4.44Å; L283-L287 HydrophobicContact CD1-CD2 4.02Å; L283-S288 CarbonylContact C-O 3.55Å; L283-S288 VanDerWaalsContact CA-O 3.23Å; L283-S288 WeakPolarHBondContact CA-O 3.42Å; L283-E289 HydrophobicContact CD2-CB 4.27Å
284	D	95.2	Very high	97.1	Very high	50 Å²	50	40 Å²	40	27%	0.267	21%	0.209	S	C	.	.			trans	-83.1	-176.1	167.9	71.9	14.5	0	0	0	112.5	S286 L287 S288 V290	D284-S286 PolarHBondContact O-N 3.27Å; D284-S286 VanDerWaalsContact O-N 3.12Å; D284-S286 VanDerWaalsContact OD1-CA 3.28Å; D284-S286 WeakPolarHBondContact OD1-CA 3.29Å; D284-S286 WeakPolarHBondContact OD1-CB 3.44Å; D284-S286 PolarHBondContact OD1-N 3.42Å; D284-S286 PolarHBondContact OD1-OG 3.22Å; D284-S286 PolarHBondContact OD2-OG 2.89Å; D284-L287 PolarHBondContact O-N 3.49Å; D284-L287 PolarHBondContact OD1-N 2.81Å; D284-S288 PolarHBondContact N-O 2.93Å; D284-S288 WeakPolarHBondContact OD1-CB 3.36Å; D284-S288 PolarHBondContact OD1-N 3.15Å; D284-V290 HydrophobicContact CB-CG2 3.95Å
285	S	91.6	Very high	97	Very high	88 Å²	88	41.9 Å²	41.9	62%	0.615	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.9	178.7	55.8	0	0	0	0	114.4
286	S	92.7	Very high	97	Very high	55 Å²	55	42.4 Å²	42.4	39%	0.385	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	11.8	176.1	73.8	0	0	0	0	112.9	L249 D284 S288	L249-S286 VanDerWaalsContact CD2-C 3.46Å; L249-S286 VanDerWaalsContact CD2-O 3.25Å; L249-S286 WeakPolarHBondContact CD2-O 3.3Å; D284-S286 PolarHBondContact O-N 3.27Å; D284-S286 VanDerWaalsContact O-N 3.12Å; D284-S286 VanDerWaalsContact OD1-CA 3.28Å; D284-S286 WeakPolarHBondContact OD1-CA 3.29Å; D284-S286 WeakPolarHBondContact OD1-CB 3.44Å; D284-S286 PolarHBondContact OD1-N 3.42Å; D284-S286 PolarHBondContact OD1-OG 3.22Å; D284-S286 PolarHBondContact OD2-OG 2.89Å; S286-S288 PolarHBondContact O-N 2.91Å; S286-S288 PolarHBondContact OG-OG 2.9Å
287	L	95.1	Very high	97	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.021	25%	0.253	C	S	.	.	S	Bend	trans	57.1	25.8	-173.4	-55.3	178.7	0	0	0	113.2	V237 L239 L249 S251 L271 L283 D284	V237-L287 HydrophobicContact CG1-CD2 4.06Å; V237-L287 WeakPolarHBondContact O-CD1 3.18Å; L239-L287 HydrophobicContact CB-CD1 4.23Å; L249-L287 HydrophobicContact CB-CD1 4.29Å; L249-L287 HydrophobicContact CD2-CB 4.29Å; L249-L287 HydrophobicContact CD2-CD1 4.17Å; L249-L287 HydrophobicContact CD2-CG 4.01Å; L249-L287 HydrophobicContact CG-CD1 4.03Å; L249-L287 HydrophobicContact CG-CG 4.4Å; S251-L287 PolarHBondContact OG-O 3.15Å; L271-L287 HydrophobicContact CD2-CD2 3.91Å; L283-L287 HydrophobicContact CD1-CB 4.44Å; L283-L287 HydrophobicContact CD1-CD2 4.02Å; D284-L287 PolarHBondContact O-N 3.49Å; D284-L287 PolarHBondContact OD1-N 2.81Å
288	S	95	Very high	97	Very high	58 Å²	58	51.1 Å²	51.1	41%	0.406	26%	0.26	S	S	.	.			trans	-87.6	138	172.9	-60.9	0	0	0	0	109.9	L283 D284 S286 V290	L283-S288 CarbonylContact C-O 3.55Å; L283-S288 VanDerWaalsContact CA-O 3.23Å; L283-S288 WeakPolarHBondContact CA-O 3.42Å; D284-S288 PolarHBondContact N-O 2.93Å; D284-S288 WeakPolarHBondContact OD1-CB 3.36Å; D284-S288 PolarHBondContact OD1-N 3.15Å; S286-S288 PolarHBondContact O-N 2.91Å; S286-S288 PolarHBondContact OG-OG 2.9Å; S288-V290 PolarHBondContact O-N 3.01Å
289	E	96.2	Very high	97	Very high	111 Å²	111	52.1 Å²	52.1	52%	0.519	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	128.4	-178.1	-175.8	-176.2	133.1	0	0	112.1	L283 R292	L283-E289 HydrophobicContact CD2-CB 4.27Å; E289-R292 VanDerWaalsContact CD-NE 3.35Å; E289-R292 VanDerWaalsContact OE1-CB 3.27Å; E289-R292 WeakPolarHBondContact OE1-CB 3.36Å; E289-R292 IonicContact OE1-NE 2.59Å; E289-R292 IonicContact OE2-CZ 2.73Å; E289-R292 IonicContact OE2-NE 3.31Å; E289-R292 PolarHBondContact OE2-NE 3.34Å; E289-R292 IonicContact OE2-NH2 3.7Å; E289-R292 PolarHBondContact OE2-NH2 3.05Å
290	V	96.3	Very high	97.1	Very high	49 Å²	49	52.1 Å²	52.1	30%	0.297	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-33.1	175.6	-177.8	0	0	0	0	111.2	F270 V282 D284 S288 P328	F270-V290 HydrophobicContact CD1-CG2 4.47Å; F270-V290 HydrophobicContact CE1-CG2 4.32Å; V282-V290 PolarHBondContact O-N 3.2Å; D284-V290 HydrophobicContact CB-CG2 3.95Å; S288-V290 PolarHBondContact O-N 3.01Å; V290-P328 HydrophobicContact CG1-CG 4.43Å
291	F	97.4	Very high	97.1	Very high	44 Å²	44	54.8 Å²	54.8	19%	0.193	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	148.8	-178.9	173.4	-94.3	0	0	0	111.1	L280 A281 V282 H325 V327	L280-F291 HydrophobicContact CD2-CE1 4.05Å; A281-F291 CarbonylContact C-O 3.55Å; A281-F291 WeakPolarHBondContact CA-O 3.48Å; V282-F291 HydrophobicContact CB-CB 4.08Å; V282-F291 HydrophobicContact CG2-CB 4.35Å; V282-F291 HydrophobicContact CG2-CD1 3.97Å; V282-F291 PolarHBondContact N-O 2.98Å; V282-F291 PolarHBondContact O-N 3.03Å; F291-H325 HydrophobicContact CE1-CB 4.06Å; F291-H325 HydrophobicContact CZ-CB 3.99Å; F291-H325 AromaticContact CZ-ND1 3.97Å; F291-V327 HydrophobicContact CB-CG1 4.23Å; F291-V327 HydrophobicContact CD1-CG2 4.48Å
292	R	98.2	Very high	97.1	Very high	57 Å²	57	55.2 Å²	55.2	22%	0.215	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	133.5	176.9	-172.7	71	64.7	165.3	-2.4	110.3	V253 L280 A281 E289	V253-R292 PolarHBondContact O-NH1 3.45Å; V253-R292 PolarHBondContact O-NH2 2.9Å; L280-R292 CarbonylContact O-C 3.57Å; L280-R292 WeakPolarHBondContact O-CA 3.45Å; L280-R292 WeakPolarHBondContact O-CD 3.31Å; A281-R292 VanDerWaalsContact CB-NH1 3.33Å; E289-R292 VanDerWaalsContact CD-NE 3.35Å; E289-R292 VanDerWaalsContact OE1-CB 3.27Å; E289-R292 WeakPolarHBondContact OE1-CB 3.36Å; E289-R292 IonicContact OE1-NE 2.59Å; E289-R292 IonicContact OE2-CZ 2.73Å; E289-R292 IonicContact OE2-NE 3.31Å; E289-R292 PolarHBondContact OE2-NE 3.34Å; E289-R292 IonicContact OE2-NH2 3.7Å; E289-R292 PolarHBondContact OE2-NH2 3.05Å
293	S	98.3	Very high	97.1	Very high	19 Å²	19	55.2 Å²	55.2	13%	0.133	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140	174.3	-171.3	0	0	0	0	111	S279 L280 A295 H325	S279-S293 WeakPolarHBondContact CA-O 3.39Å; L280-S293 PolarHBondContact N-O 3.22Å; L280-S293 PolarHBondContact O-N 3.42Å; S293-A295 PolarHBondContact OG-N 2.74Å; S293-H325 PolarHBondContact OG-CE1 3.35Å; S293-H325 PolarHBondContact OG-ND1 3.34Å
294	R	97.9	Very high	97.1	Very high	184 Å²	184	55.9 Å²	55.9	69%	0.694	28%	0.276	S	S	*	.			trans	-124.3	35.3	174	-61.6	-178.5	-177.4	-89.3	-1.1	110.3	H296	R294-H296 VanDerWaalsContact C-N 3.34Å
295	A	97.9	Very high	97.3	Very high	40 Å²	40	54.2 Å²	54.2	33%	0.331	27%	0.267	S	S	.	.			trans	-71.6	-30.7	-177.6	0	0	0	0	0	112.7	S293 Q321 V323	S293-A295 PolarHBondContact OG-N 2.74Å; A295-Q321 PolarHBondContact O-NE2 3.48Å; A295-Q321 VanDerWaalsContact O-NE2 3.15Å; A295-V323 HydrophobicContact CB-CG1 4.03Å; A295-V323 HydrophobicContact CB-CG2 4.37Å
296	H	98.6	Very high	97.6	Very high	12 Å²	12	50.3 Å²	50.3	6%	0.056	24%	0.239	C	C	.	.			trans	-75.3	147.4	177.9	-72.3	-82.5	0	0	0	111.6	R294 V300 T315 D319	R294-H296 VanDerWaalsContact C-N 3.34Å; H296-V300 HydrophobicContact CB-CG2 3.85Å; H296-T315 PolarHBondContact NE2-OG1 3Å; H296-D319 WeakPolarHBondContact CA-OD2 3.37Å; H296-D319 WeakPolarHBondContact CB-OD2 3.39Å; H296-D319 IonicContact CE1-OD1 3.83Å; H296-D319 IonicContact CG-OD2 3.55Å; H296-D319 IonicContact ND1-OD1 3.19Å; H296-D319 PolarHBondContact ND1-OD1 3.05Å; H296-D319 IonicContact ND1-OD2 2.99Å; H296-D319 PolarHBondContact ND1-OD2 2.67Å
297	R	98.2	Very high	97.7	Very high	218 Å²	218	49.9 Å²	49.9	82%	0.823	24%	0.235	S	C	*	.	S	Bend	trans	-108.3	-1.6	179.9	-59	-179.8	-174.3	178.4	3.2	112.8	D319	R297-D319 HydrophobicContact CB-CB 4.23Å; R297-D319 PolarHBondContact N-OD2 3.11Å
298	D	98.6	Very high	97.8	Very high	48 Å²	48	55.9 Å²	55.9	26%	0.257	27%	0.266	S	S	.	.	S	Bend	trans	-149.2	-179.2	179.9	-150.3	-29.2	0	0	0	107.6	C278 V300 W318 D319	C278-D298 PolarHBondContact SG-O 3.2Å; C278-D298 VanDerWaalsContact SG-O 3.4Å; D298-V300 PolarHBondContact O-N 3.48Å; D298-W318 HydrophobicContact CB-CB 4.13Å; D298-D319 HydrophobicContact CB-CB 3.73Å
299	F	98.7	Very high	97.8	Very high	56 Å²	56	56.7 Å²	56.7	25%	0.246	27%	0.266	C	S	.	.			trans	-57.1	131.8	-171.8	-59	-13.9	0	0	0	112.5	E276 G317 W318	E276-F299 HydrophobicContact CB-CD1 3.98Å; E276-F299 HydrophobicContact CB-CD2 4.43Å; E276-F299 HydrophobicContact CB-CE1 4.03Å; E276-F299 HydrophobicContact CB-CE2 4.47Å; E276-F299 HydrophobicContact CB-CG 4.19Å; E276-F299 HydrophobicContact CB-CZ 4.28Å; E276-F299 HydrophobicContact CG-CB 4.44Å; E276-F299 HydrophobicContact CG-CD1 4.22Å; E276-F299 HydrophobicContact CG-CD2 3.8Å; E276-F299 HydrophobicContact CG-CE1 4.41Å; E276-F299 HydrophobicContact CG-CE2 4.01Å; E276-F299 HydrophobicContact CG-CG 3.92Å; E276-F299 HydrophobicContact CG-CZ 4.32Å; E276-F299 WeakPolarHBondContact O-CD1 3.44Å; E276-F299 WeakPolarHBondContact O-CE1 3.45Å; F299-G317 CarbonylContact O-C 3.57Å; F299-G317 WeakPolarHBondContact O-CA 3.33Å; F299-W318 HydrophobicContact CB-CD2 4.39Å; F299-W318 HydrophobicContact CB-CE3 4.23Å; F299-W318 HydrophobicContact CD2-CD2 4.38Å; F299-W318 AromaticContact CD2-CE3 3.52Å; F299-W318 HydrophobicContact CD2-CE3 3.52Å; F299-W318 HydrophobicContact CD2-CH2 4.11Å; F299-W318 AromaticContact CD2-CZ3 3.38Å; F299-W318 HydrophobicContact CD2-CZ3 3.38Å; F299-W318 HydrophobicContact CE2-CE3 4.22Å; F299-W318 AromaticContact CE2-CZ3 3.77Å; F299-W318 HydrophobicContact CE2-CZ3 3.77Å; F299-W318 HydrophobicContact CG-CE3 4.14Å; F299-W318 HydrophobicContact CG-CZ3 4.4Å; F299-W318 PolarHBondContact O-N 2.97Å
300	V	98.8	Very high	97.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	124.5	172.4	-169.9	0	0	0	0	107.5	T259 L274 H296 D298 T315	T259-V300 PolarHBondContact OG1-O 3.37Å; L274-V300 HydrophobicContact CB-CB 4.05Å; L274-V300 HydrophobicContact CB-CG1 3.71Å; L274-V300 HydrophobicContact CD2-CG1 4.29Å; L274-V300 HydrophobicContact CG-CG1 4.42Å; H296-V300 HydrophobicContact CB-CG2 3.85Å; D298-V300 PolarHBondContact O-N 3.48Å; V300-T315 HydrophobicContact CG1-CG2 4.42Å
301	R	98.6	Very high	97.7	Very high	57 Å²	57	54 Å²	54	22%	0.215	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	-40.1	-170.4	-60.5	-54.5	-63.7	148.4	3.8	113.6	L31 E32 L274 V316 W318	L31-R301 WeakPolarHBondContact O-CB 3.38Å; L31-R301 VanDerWaalsContact O-CG 3.23Å; L31-R301 WeakPolarHBondContact O-CG 3.38Å; E32-R301 WeakPolarHBondContact O-CB 3.26Å; E32-R301 IonicContact OE1-CZ 3.47Å; E32-R301 IonicContact OE1-NE 3.63Å; E32-R301 PolarHBondContact OE1-NE 2.98Å; E32-R301 IonicContact OE1-NH2 3.47Å; E32-R301 PolarHBondContact OE1-NH2 3.47Å; E32-R301 IonicContact OE2-NE 2.71Å; L274-R301 WeakPolarHBondContact CD1-O 3.45Å; R301-V316 PolarHBondContact N-O 2.94Å; R301-W318 VanDerWaalsContact CD-NE1 3.33Å; R301-W318 HydrophobicContact CG-CG 4.11Å
302	D	98.8	Very high	97.7	Very high	8 Å²	8	53.7 Å²	53.7	4%	0.043	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	159.5	-179.6	-159.7	11.9	0	0	0	112.3	A34 R35 T315 V316	A34-D302 PolarHBondContact N-OD2 2.91Å; A34-D302 VanDerWaalsContact O-OD2 3.05Å; R35-D302 IonicContact CZ-OD1 3.4Å; R35-D302 IonicContact CZ-OD2 2.83Å; R35-D302 IonicContact NE-OD2 3.59Å; R35-D302 PolarHBondContact NE-OD2 3.16Å; R35-D302 IonicContact NH1-OD1 3.22Å; R35-D302 PolarHBondContact NH1-OD1 2.93Å; R35-D302 IonicContact NH1-OD2 3.42Å; R35-D302 PolarHBondContact NH1-OD2 3.5Å; R35-D302 IonicContact NH2-OD1 3.18Å; R35-D302 IonicContact NH2-OD2 3.97Å; R35-D302 PolarHBondContact NH2-OD2 2.93Å; D302-T315 VanDerWaalsContact O-CA 3.31Å; D302-T315 WeakPolarHBondContact O-CA 3.35Å; D302-V316 HydrophobicContact CB-CG2 4.03Å; D302-V316 PolarHBondContact O-N 2.62Å; D302-V316 VanDerWaalsContact O-N 3.08Å
303	A	98.6	Very high	97.7	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	144.5	175.8	0	0	0	0	0	110.9	V262 L274 L313 T314 T315	V262-A303 HydrophobicContact CG2-CB 4.46Å; V262-A303 WeakPolarHBondContact CG2-O 3.47Å; L274-A303 HydrophobicContact CD2-CB 3.39Å; L274-A303 VanDerWaalsContact CD2-N 3.34Å; A303-L313 HydrophobicContact CB-CD1 3.99Å; A303-T314 CarbonylContact C-O 3.54Å; A303-T314 VanDerWaalsContact CA-O 3.26Å; A303-T314 WeakPolarHBondContact CA-O 3.28Å; A303-T315 HydrophobicContact CB-CG2 3.83Å
304	T	98.7	Very high	97.7	Very high	15 Å²	15	50.1 Å²	50.1	9%	0.092	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	129.6	176.6	-175.4	0	0	0	0	111.1	A34 Y36 L42 T314	A34-T304 HydrophobicContact CB-CG2 4.09Å; A34-T304 WeakPolarHBondContact O-CB 3.47Å; A34-T304 WeakPolarHBondContact O-CG2 3.32Å; Y36-T304 HydrophobicContact CD2-CG2 3.43Å; Y36-T304 VanDerWaalsContact CD2-CG2 3.43Å; Y36-T304 WeakPolarHBondContact CD2-OG1 3.31Å; Y36-T304 HydrophobicContact CE2-CG2 3.78Å; Y36-T304 HydrophobicContact CG-CG2 4.17Å; Y36-T304 PolarHBondContact N-OG1 2.78Å; L42-T304 HydrophobicContact CD1-CG2 3.87Å; T304-T314 PolarHBondContact N-O 2.98Å; T304-T314 PolarHBondContact O-N 3.28Å
305	W	98.4	Very high	97.8	Very high	16 Å²	16	41.3 Å²	41.3	6%	0.061	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	135.4	177.1	-66.7	90.1	0	0	0	110	Y36 V262 F263 S264 P265 F270 A272 V282 H310 L313 V327	Y36-W305 VanDerWaalsContact CD2-O 3.31Å; Y36-W305 WeakPolarHBondContact CD2-O 3.34Å; V262-W305 PolarHBondContact O-NE1 2.89Å; F263-W305 VanDerWaalsContact O-CD1 3.3Å; S264-W305 VanDerWaalsContact CB-CE2 3.43Å; P265-W305 HydrophobicContact CG-CB 4.29Å; F270-W305 HydrophobicContact CB-CH2 4.33Å; F270-W305 HydrophobicContact CB-CZ2 4.31Å; A272-W305 HydrophobicContact CB-CZ2 4.09Å; V282-W305 HydrophobicContact CG1-CH2 4.04Å; V282-W305 HydrophobicContact CG1-CZ2 4.11Å; V282-W305 HydrophobicContact CG2-CH2 4.39Å; V282-W305 HydrophobicContact CG2-CZ2 4.42Å; W305-H310 VanDerWaalsContact CE3-O 3.26Å; W305-H310 WeakPolarHBondContact CZ3-O 3.43Å; W305-L313 HydrophobicContact CD2-CB 4.31Å; W305-L313 HydrophobicContact CD2-CD1 3.79Å; W305-L313 HydrophobicContact CD2-CG 4.48Å; W305-L313 HydrophobicContact CE3-CB 4.01Å; W305-L313 HydrophobicContact CE3-CD1 4.35Å; W305-L313 HydrophobicContact CG-CD1 3.91Å; W305-L313 HydrophobicContact CH2-CB 4.46Å; W305-L313 HydrophobicContact CH2-CD2 4.18Å; W305-L313 HydrophobicContact CZ2-CD1 4.4Å; W305-L313 HydrophobicContact CZ2-CD2 3.93Å; W305-L313 HydrophobicContact CZ3-CB 4.1Å; W305-V327 HydrophobicContact CH2-CB 4.13Å; W305-V327 HydrophobicContact CH2-CG1 4.12Å; W305-V327 HydrophobicContact CH2-CG2 3.82Å; W305-V327 HydrophobicContact CZ3-CB 4.09Å; W305-V327 HydrophobicContact CZ3-CG2 3.87Å
306	S	97.9	Very high	97.8	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.042	19%	0.188	C	C	.	.			trans	-68.1	131.4	176.8	-178.9	0	0	0	0	110.5	L308 N309 L312	S306-L308 PolarHBondContact O-N 2.89Å; S306-L308 PolarHBondContact OG-N 3.26Å; S306-N309 WeakPolarHBondContact CB-O 3.32Å; S306-N309 CarbonylContact O-C 3.57Å; S306-N309 PolarHBondContact OG-N 3.32Å; S306-L312 PolarHBondContact N-O 3.48Å
307	P	96.4	Very high	97.8	Very high	46 Å²	46	38.9 Å²	38.9	30%	0.299	19%	0.185	S	C	.	.	S	Bend	trans	-75.6	-15.9	174.9	29.3	-32.4	0	0	0	112.5	R37	R37-P307 VanDerWaalsContact O-CG 3.25Å; R37-P307 WeakPolarHBondContact O-CG 3.44Å
308	L	95.9	Very high	97.8	Very high	129 Å²	129	31 Å²	31	68%	0.675	16%	0.155	S	C	*	.	S	Bend	trans	-89.9	-36.6	179.7	-55.6	-177.6	0	0	0	112.1	S306	S306-L308 PolarHBondContact O-N 2.89Å; S306-L308 PolarHBondContact OG-N 3.26Å
309	N	95.6	Very high	97.8	Very high	75 Å²	75	29.5 Å²	29.5	40%	0.401	15%	0.147	S	C	.	.			trans	-129.6	102.7	175.3	177.8	2.1	0	0	0	109.5	S306 S311 L312	S306-N309 WeakPolarHBondContact CB-O 3.32Å; S306-N309 CarbonylContact O-C 3.57Å; S306-N309 PolarHBondContact OG-N 3.32Å; N309-S311 PolarHBondContact ND2-OG 3.15Å; N309-S311 PolarHBondContact O-N 2.75Å; N309-S311 PolarHBondContact OD1-N 3.5Å; N309-S311 VanDerWaalsContact OD1-N 3.11Å; N309-S311 PolarHBondContact OD1-OG 2.87Å; N309-L312 HydrophobicContact CB-CB 4.05Å; N309-L312 WeakPolarHBondContact O-CB 3.39Å; N309-L312 PolarHBondContact O-N 2.89Å
310	H	94.1	Very high	97.8	Very high	82 Å²	82	29.2 Å²	29.2	38%	0.38	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.8	-174.4	-60.2	176.8	0	0	0	114.2	P265 H266 W305	P265-H310 HydrophobicContact CG-CB 4.08Å; H266-H310 PolarHBondContact CE1-O 2.85Å; H266-H310 WeakPolarHBondContact NE2-CB 3.35Å; H266-H310 PolarHBondContact NE2-O 2.8Å; W305-H310 VanDerWaalsContact CE3-O 3.26Å; W305-H310 WeakPolarHBondContact CZ3-O 3.43Å
311	S	95.1	Very high	97.8	Very high	23 Å²	23	32 Å²	32	16%	0.161	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-13.3	172.9	68.2	0	0	0	0	113.7	N309 V327	N309-S311 PolarHBondContact ND2-OG 3.15Å; N309-S311 PolarHBondContact O-N 2.75Å; N309-S311 PolarHBondContact OD1-N 3.5Å; N309-S311 VanDerWaalsContact OD1-N 3.11Å; N309-S311 PolarHBondContact OD1-OG 2.87Å; S311-V327 PolarHBondContact O-N 3Å
312	L	97.8	Very high	97.8	Very high	37 Å²	37	30.2 Å²	30.2	19%	0.194	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	121.9	-178.5	-172.6	70.7	0	0	0	110	S306 N309 H324 H325	S306-L312 PolarHBondContact N-O 3.48Å; N309-L312 HydrophobicContact CB-CB 4.05Å; N309-L312 WeakPolarHBondContact O-CB 3.39Å; N309-L312 PolarHBondContact O-N 2.89Å; L312-H324 HydrophobicContact CD1-CB 4.02Å; L312-H325 WeakPolarHBondContact CA-O 3.27Å
313	L	98.5	Very high	97.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	126.7	176.6	177.1	58.2	0	0	0	109	A272 L280 V282 A303 W305 H325 V327	A272-L313 HydrophobicContact CB-CD1 4.42Å; A272-L313 HydrophobicContact CB-CD2 3.79Å; L280-L313 HydrophobicContact CD1-CD2 4.04Å; L280-L313 HydrophobicContact CD2-CD2 3.82Å; L280-L313 HydrophobicContact CD2-CG 4.48Å; L280-L313 HydrophobicContact CG-CD2 4.46Å; V282-L313 HydrophobicContact CG2-CD2 3.82Å; A303-L313 HydrophobicContact CB-CD1 3.99Å; W305-L313 HydrophobicContact CD2-CB 4.31Å; W305-L313 HydrophobicContact CD2-CD1 3.79Å; W305-L313 HydrophobicContact CD2-CG 4.48Å; W305-L313 HydrophobicContact CE3-CB 4.01Å; W305-L313 HydrophobicContact CE3-CD1 4.35Å; W305-L313 HydrophobicContact CG-CD1 3.91Å; W305-L313 HydrophobicContact CH2-CB 4.46Å; W305-L313 HydrophobicContact CH2-CD2 4.18Å; W305-L313 HydrophobicContact CZ2-CD1 4.4Å; W305-L313 HydrophobicContact CZ2-CD2 3.93Å; W305-L313 HydrophobicContact CZ3-CB 4.1Å; L313-H325 PolarHBondContact N-O 2.8Å; L313-H325 PolarHBondContact O-CD2 3.02Å; L313-H325 VanDerWaalsContact O-CD2 3.32Å; L313-H325 PolarHBondContact O-N 2.89Å; L313-V327 HydrophobicContact CB-CG2 3.9Å; L313-V327 HydrophobicContact CD2-CG2 4.17Å
314	T	98.8	Very high	97.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	134	177.6	-60.8	0	0	0	0	109.7	Y36 L42 A303 T304 V322 V323 H324	Y36-T314 WeakPolarHBondContact CE2-OG1 3.25Å; Y36-T314 PolarHBondContact OH-OG1 3.12Å; L42-T314 HydrophobicContact CD2-CG2 4.22Å; A303-T314 CarbonylContact C-O 3.54Å; A303-T314 VanDerWaalsContact CA-O 3.26Å; A303-T314 WeakPolarHBondContact CA-O 3.28Å; T304-T314 PolarHBondContact N-O 2.98Å; T304-T314 PolarHBondContact O-N 3.28Å; T314-V322 HydrophobicContact CG2-CG1 3.68Å; T314-V323 CarbonylContact C-O 3.55Å; T314-V323 VanDerWaalsContact CA-O 3.3Å; T314-V323 WeakPolarHBondContact CA-O 3.23Å; T314-H324 PolarHBondContact OG1-ND1 3.31Å
315	T	98.9	Very high	97.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	151.2	173.7	59	0	0	0	0	111.9	L280 H296 V300 D302 A303 V323 H325	L280-T315 HydrophobicContact CD1-CG2 4.07Å; L280-T315 HydrophobicContact CD2-CG2 3.73Å; L280-T315 HydrophobicContact CG-CG2 4.32Å; H296-T315 PolarHBondContact NE2-OG1 3Å; V300-T315 HydrophobicContact CG1-CG2 4.42Å; D302-T315 VanDerWaalsContact O-CA 3.31Å; D302-T315 WeakPolarHBondContact O-CA 3.35Å; A303-T315 HydrophobicContact CB-CG2 3.83Å; T315-V323 PolarHBondContact N-O 3.2Å; T315-V323 PolarHBondContact O-N 2.98Å; T315-H325 PolarHBondContact OG1-NE2 2.57Å
316	V	98.8	Very high	97.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	154.3	173.4	-62.2	0	0	0	0	111.1	L31 A34 L44 R301 D302 Q321 V322	L31-V316 HydrophobicContact CB-CB 3.87Å; L31-V316 HydrophobicContact CB-CG2 4.2Å; L31-V316 HydrophobicContact CD1-CB 4.06Å; L31-V316 HydrophobicContact CD1-CG1 4.16Å; A34-V316 HydrophobicContact CB-CB 4.27Å; A34-V316 HydrophobicContact CB-CG1 3.64Å; A34-V316 HydrophobicContact CB-CG2 3.64Å; L44-V316 HydrophobicContact CD2-CG1 3.85Å; R301-V316 PolarHBondContact N-O 2.94Å; D302-V316 HydrophobicContact CB-CG2 4.03Å; D302-V316 PolarHBondContact O-N 2.62Å; D302-V316 VanDerWaalsContact O-N 3.08Å; V316-Q321 WeakPolarHBondContact CA-O 3.28Å; V316-V322 HydrophobicContact CG1-CB 4.38Å; V316-V322 HydrophobicContact CG1-CG1 4.23Å; V316-V322 HydrophobicContact CG1-CG2 3.96Å
317	G	98.6	Very high	97.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	172.6	-179.7	0	0	0	0	0	113.7	F299 D319 H320 Q321	F299-G317 CarbonylContact O-C 3.57Å; F299-G317 WeakPolarHBondContact O-CA 3.33Å; G317-D319 PolarHBondContact O-N 2.99Å; G317-D319 VanDerWaalsContact O-N 3.14Å; G317-H320 PolarHBondContact O-N 3.4Å; G317-H320 VanDerWaalsContact O-N 3.09Å; G317-Q321 PolarHBondContact N-O 2.81Å
318	W	98.6	Very high	97.2	Very high	53 Å²	53	38.8 Å²	38.8	20%	0.201	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-5.5	-179.6	-74	-2.1	0	0	0	114.7	R29 Q30 E32 L49 D298 F299 R301 H320	R29-W318 PolarHBondContact NE-O 2.89Å; Q30-W318 HydrophobicContact CB-CG 4Å; Q30-W318 HydrophobicContact CG-CB 4.08Å; Q30-W318 HydrophobicContact CG-CD2 4.18Å; Q30-W318 HydrophobicContact CG-CG 3.8Å; E32-W318 PolarHBondContact OE2-NE1 2.98Å; L49-W318 HydrophobicContact CD1-CD2 4.44Å; L49-W318 HydrophobicContact CD1-CH2 3.97Å; L49-W318 HydrophobicContact CD1-CZ2 3.46Å; L49-W318 VanDerWaalsContact CD1-CZ2 3.46Å; D298-W318 HydrophobicContact CB-CB 4.13Å; F299-W318 HydrophobicContact CB-CD2 4.39Å; F299-W318 HydrophobicContact CB-CE3 4.23Å; F299-W318 HydrophobicContact CD2-CD2 4.38Å; F299-W318 AromaticContact CD2-CE3 3.52Å; F299-W318 HydrophobicContact CD2-CE3 3.52Å; F299-W318 HydrophobicContact CD2-CH2 4.11Å; F299-W318 AromaticContact CD2-CZ3 3.38Å; F299-W318 HydrophobicContact CD2-CZ3 3.38Å; F299-W318 HydrophobicContact CE2-CE3 4.22Å; F299-W318 AromaticContact CE2-CZ3 3.77Å; F299-W318 HydrophobicContact CE2-CZ3 3.77Å; F299-W318 HydrophobicContact CG-CE3 4.14Å; F299-W318 HydrophobicContact CG-CZ3 4.4Å; F299-W318 PolarHBondContact O-N 2.97Å; R301-W318 VanDerWaalsContact CD-NE1 3.33Å; R301-W318 HydrophobicContact CG-CG 4.11Å; W318-H320 PolarHBondContact O-N 3.27Å
319	D	98.3	Very high	96.2	Very high	16 Å²	16	36.2 Å²	36.2	9%	0.086	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	4.3	169.6	58.6	-5.3	0	0	0	113.4	H296 R297 D298 G317 Q321	H296-D319 WeakPolarHBondContact CA-OD2 3.37Å; H296-D319 WeakPolarHBondContact CB-OD2 3.39Å; H296-D319 IonicContact CE1-OD1 3.83Å; H296-D319 IonicContact CG-OD2 3.55Å; H296-D319 IonicContact ND1-OD1 3.19Å; H296-D319 PolarHBondContact ND1-OD1 3.05Å; H296-D319 IonicContact ND1-OD2 2.99Å; H296-D319 PolarHBondContact ND1-OD2 2.67Å; R297-D319 HydrophobicContact CB-CB 4.23Å; R297-D319 PolarHBondContact N-OD2 3.11Å; D298-D319 HydrophobicContact CB-CB 3.73Å; G317-D319 PolarHBondContact O-N 2.99Å; G317-D319 VanDerWaalsContact O-N 3.14Å; D319-Q321 HydrophobicContact CB-CG 4.41Å; D319-Q321 PolarHBondContact O-N 3.35Å; D319-Q321 PolarHBondContact OD1-N 3.26Å; D319-Q321 PolarHBondContact OD2-NE2 2.92Å
320	H	98.1	Very high	94.6	Very high	50 Å²	50	40 Å²	40	23%	0.231	20%	0.203	C	C	.	.	S	Bend	trans	61.4	27.2	-177.2	-162.7	74.3	0	0	0	112.7	E28 R29 G317 W318	E28-H320 PolarHBondContact O-ND1 2.84Å; R29-H320 HydrophobicContact CG-CB 4.17Å; R29-H320 WeakPolarHBondContact O-CB 3.36Å; R29-H320 PolarHBondContact O-ND1 3.47Å; G317-H320 PolarHBondContact O-N 3.4Å; G317-H320 VanDerWaalsContact O-N 3.09Å; W318-H320 PolarHBondContact O-N 3.27Å
321	Q	98.4	Very high	92.5	Very high	60 Å²	60	41.8 Å²	41.8	28%	0.28	22%	0.222	S	C	.	.			trans	-96.9	136.2	174.6	-65.4	-166.4	83.1	0	0	110.8	A295 V316 G317 D319 V323	A295-Q321 PolarHBondContact O-NE2 3.48Å; A295-Q321 VanDerWaalsContact O-NE2 3.15Å; V316-Q321 WeakPolarHBondContact CA-O 3.28Å; G317-Q321 PolarHBondContact N-O 2.81Å; D319-Q321 HydrophobicContact CB-CG 4.41Å; D319-Q321 PolarHBondContact O-N 3.35Å; D319-Q321 PolarHBondContact OD1-N 3.26Å; D319-Q321 PolarHBondContact OD2-NE2 2.92Å; Q321-V323 HydrophobicContact CB-CG2 3.88Å
322	V	98.6	Very high	90.1	Very high	19 Å²	19	47.9 Å²	47.9	12%	0.115	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	109.9	161.9	-176.4	0	0	0	0	106.3	L31 L42 L44 A67 P68 T314 V316	L31-V322 HydrophobicContact CD1-CG2 3.81Å; L42-V322 HydrophobicContact CD2-CG1 4.12Å; L44-V322 HydrophobicContact CD1-CG2 3.92Å; A67-V322 HydrophobicContact CB-CB 4.35Å; A67-V322 HydrophobicContact CB-CG1 4.18Å; A67-V322 HydrophobicContact CB-CG2 4.02Å; P68-V322 HydrophobicContact CB-CG2 3.86Å; P68-V322 HydrophobicContact CG-CG2 4.08Å; T314-V322 HydrophobicContact CG2-CG1 3.68Å; V316-V322 HydrophobicContact CG1-CB 4.38Å; V316-V322 HydrophobicContact CG1-CG1 4.23Å; V316-V322 HydrophobicContact CG1-CG2 3.96Å
323	V	98.6	Very high	87.2	Confident	24 Å²	24	51.8 Å²	51.8	15%	0.145	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.4	-173.6	-172.4	0	0	0	0	109.8	A295 T314 T315 Q321 H325	A295-V323 HydrophobicContact CB-CG1 4.03Å; A295-V323 HydrophobicContact CB-CG2 4.37Å; T314-V323 CarbonylContact C-O 3.55Å; T314-V323 VanDerWaalsContact CA-O 3.3Å; T314-V323 WeakPolarHBondContact CA-O 3.23Å; T315-V323 PolarHBondContact N-O 3.2Å; T315-V323 PolarHBondContact O-N 2.98Å; Q321-V323 HydrophobicContact CB-CG2 3.88Å; V323-H325 WeakPolarHBondContact CG1-CE1 3.45Å
324	H	98.3	Very high	84.5	Confident	59 Å²	59	55.8 Å²	55.8	27%	0.273	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	117.1	175.1	-53.8	-66.2	0	0	0	110.1	P64 L312 T314	P64-H324 PolarHBondContact O-NE2 2.62Å; L312-H324 HydrophobicContact CD1-CB 4.02Å; T314-H324 PolarHBondContact OG1-ND1 3.31Å
325	H	98.1	Very high	81.9	Confident	11 Å²	11	62 Å²	62	5%	0.051	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	137.8	-179	-49.7	-90.3	0	0	0	110.1	F291 S293 L312 L313 T315 V323	F291-H325 HydrophobicContact CE1-CB 4.06Å; F291-H325 HydrophobicContact CZ-CB 3.99Å; F291-H325 AromaticContact CZ-ND1 3.97Å; S293-H325 PolarHBondContact OG-CE1 3.35Å; S293-H325 PolarHBondContact OG-ND1 3.34Å; L312-H325 WeakPolarHBondContact CA-O 3.27Å; L313-H325 PolarHBondContact N-O 2.8Å; L313-H325 PolarHBondContact O-CD2 3.02Å; L313-H325 VanDerWaalsContact O-CD2 3.32Å; L313-H325 PolarHBondContact O-N 2.89Å; T315-H325 PolarHBondContact OG1-NE2 2.57Å; V323-H325 WeakPolarHBondContact CG1-CE1 3.45Å
326	I	96.9	Very high	79.3	Confident	130 Å²	130	64.8 Å²	64.8	67%	0.667	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	106.5	168.9	-57.2	177.1	0	0	0	107.1
327	V	95.4	Very high	76.7	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.012	42%	0.421	C	S	.	.			trans	-84.5	126.6	-178.9	-176.2	0	0	0	0	109.1	V282 F291 W305 S311 L313 T329	V282-V327 HydrophobicContact CB-CG1 4.27Å; V282-V327 HydrophobicContact CG1-CG1 4.04Å; V282-V327 HydrophobicContact CG2-CG1 4.22Å; V282-V327 HydrophobicContact CG2-CG2 4.09Å; F291-V327 HydrophobicContact CB-CG1 4.23Å; F291-V327 HydrophobicContact CD1-CG2 4.48Å; W305-V327 HydrophobicContact CH2-CB 4.13Å; W305-V327 HydrophobicContact CH2-CG1 4.12Å; W305-V327 HydrophobicContact CH2-CG2 3.82Å; W305-V327 HydrophobicContact CZ3-CB 4.09Å; W305-V327 HydrophobicContact CZ3-CG2 3.87Å; S311-V327 PolarHBondContact O-N 3Å; L313-V327 HydrophobicContact CB-CG2 3.9Å; L313-V327 HydrophobicContact CD2-CG2 4.17Å; V327-T329 PolarHBondContact O-N 3.19Å
328	P	89.5	Confident	74.2	Confident	45 Å²	45	75.1 Å²	75.1	29%	0.292	46%	0.456	S	S	.	.			trans	-66.3	122	176.5	27.6	-32.7	0	0	0	109.9	V290	V290-P328 HydrophobicContact CG1-CG 4.43Å
329	T	75.1	Confident	71.5	Confident	75 Å²	75	77.5 Å²	77.5	46%	0.46	48%	0.481	S	S	.	.	S	Bend	trans	-90.8	-11.4	178.9	53.8	0	0	0	0	113.2	F270 V327	F270-T329 HydrophobicContact CE2-CG2 4.4Å; V327-T329 PolarHBondContact O-N 3.19Å
330	E	63.1	Low	69.2	Low	155 Å²	155	83.2 Å²	83.2	72%	0.724	52%	0.516	S	S	*	.	S	Bend	trans	-113.3	143.9	171.3	-69.6	-173.6	172.4	0	0	109.7	L332	E330-L332 PolarHBondContact O-N 3.41Å
331	P	48.1	Very low	66.9	Low	118 Å²	118	86.7 Å²	86.7	77%	0.766	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-59.6	133.5	173.3	23.6	-30.3	0	0	0	109.3
332	L	45	Very low	64.5	Low	151 Å²	151	96.7 Å²	96.7	79%	0.791	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-50.4	132.6	171.1	-76.3	162	0	0	0	108.7	E330 A334	E330-L332 PolarHBondContact O-N 3.41Å; L332-A334 PolarHBondContact O-N 3.27Å
333	P	38.2	Very low	62.8	Low	120 Å²	120	100.6 Å²	100.6	78%	0.779	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-56.1	129.7	175.6	21.2	-29.9	0	0	0	108.4
334	A	41	Very low	60.9	Low	84 Å²	84	104.6 Å²	104.6	69%	0.694	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-49	138.6	175.8	0	0	0	0	0	109	L332 G336	L332-A334 PolarHBondContact O-N 3.27Å; A334-G336 PolarHBondContact O-N 2.89Å
335	P	44.3	Very low	58.8	Low	130 Å²	130	107.1 Å²	107.1	84%	0.844	66%	0.656	S	S	*	*			trans	-54.4	114.5	175.4	21.7	-30.6	0	0	0	107.6
336	G	45.3	Very low	56.5	Low	58 Å²	58	112.8 Å²	112.8	60%	0.598	69%	0.692	S	S	*	*			trans	-54.6	149	179.8	0	0	0	0	0	109.7	A334 A338	A334-G336 PolarHBondContact O-N 2.89Å; G336-A338 PolarHBondContact O-N 3.1Å; G336-A338 VanDerWaalsContact O-N 3.1Å
337	P	43.3	Very low	54	Low	129 Å²	129	111.7 Å²	111.7	84%	0.838	69%	0.693	S	S	*	*			trans	-53.7	126.1	-178.4	23.3	-32.3	0	0	0	108.5	S339	P337-S339 PolarHBondContact O-N 2.93Å
338	A	46.4	Very low	51.2	Low	89 Å²	89	119 Å²	119	74%	0.736	74%	0.739	S	S	*	*			trans	-49.8	113.6	174.8	0	0	0	0	0	107.6	G336 V340	G336-A338 PolarHBondContact O-N 3.1Å; G336-A338 VanDerWaalsContact O-N 3.1Å; A338-V340 VanDerWaalsContact C-N 3.28Å; A338-V340 PolarHBondContact O-N 2.98Å
339	S	42.5	Very low	48.5	Very low	103 Å²	103	124.3 Å²	124.3	72%	0.72	77%	0.77	S	S	*	*			trans	-64	97.9	170.9	54.1	0	0	0	0	106.5	P337 T341	P337-S339 PolarHBondContact O-N 2.93Å; S339-T341 VanDerWaalsContact C-N 3.27Å; S339-T341 PolarHBondContact O-N 2.85Å
340	V	48.4	Very low	46.4	Very low	136 Å²	136	128.1 Å²	128.1	82%	0.824	79%	0.794	S	S	*	*			trans	-66.9	95.8	164.4	-174.8	0	0	0	0	105.2	A338	A338-V340 VanDerWaalsContact C-N 3.28Å; A338-V340 PolarHBondContact O-N 2.98Å
341	T	51.3	Low	45	Very low	123 Å²	123	125.8 Å²	125.8	76%	0.755	80%	0.8	S	S	*	*			trans	-76.2	127.2	162.2	45.9	0	0	0	0	107.8	S339	S339-T341 VanDerWaalsContact C-N 3.27Å; S339-T341 PolarHBondContact O-N 2.85Å
342	E	46.8	Very low	44.8	Very low	269 Å²	269	126.5 Å²	126.5	100%	1.257	80%	0.803	S	S	*	*			trans	-46.9	0	178.3	-64.8	178.3	142.3	0	0	114.8

Retrieved 342 of 342 residues in 1252 ms (Link to these results)

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