A0A087Y7J9_POEFO Loading...

WD repeat and FYVE domain containing 1

AlphaFold DB , UniProt , Accession A0A087Y7J9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 411 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	37.5	Very low	247 Å²	247	141.5 Å²	141.5	100%	1.217	78%	0.778	S	S	*	*				0	109.9	0	-65.4	-172.4	-151.1	0	0	106.6	A3	M1-A3 PolarHBondContact O-N 3.41Å
2	A	29.2	Very low	40.4	Very low	101 Å²	101	131.8 Å²	131.8	84%	0.835	73%	0.73	S	S	*	*			trans	-68.6	121.3	178.6	0	0	0	0	0	108.2	E4	A2-E4 PolarHBondContact O-N 3.22Å
3	A	29.9	Very low	43.7	Very low	94 Å²	94	135.9 Å²	135.9	78%	0.777	73%	0.728	S	S	*	*			trans	-70.2	111.8	171.2	0	0	0	0	0	107.6	M1 I5	M1-A3 PolarHBondContact O-N 3.41Å; A3-I5 PolarHBondContact O-N 2.84Å; A3-I5 VanDerWaalsContact O-N 3.15Å
4	E	29.4	Very low	46.7	Very low	164 Å²	164	127.8 Å²	127.8	77%	0.766	69%	0.686	S	S	*	*			trans	-59.7	113.2	172	-74.1	174.6	155.6	0	0	109.2	A2 H6	A2-E4 PolarHBondContact O-N 3.22Å; E4-H6 VanDerWaalsContact C-N 3.29Å; E4-H6 PolarHBondContact O-N 3.08Å; E4-H6 PolarHBondContact O-ND1 3.21Å
5	I	34.9	Very low	49.6	Very low	165 Å²	165	124 Å²	124	85%	0.846	67%	0.669	S	S	*	*			trans	-68.5	91.4	173.2	-58.8	169.7	0	0	0	106.7	A3 S7	A3-I5 PolarHBondContact O-N 2.84Å; A3-I5 VanDerWaalsContact O-N 3.15Å; I5-S7 PolarHBondContact O-N 3.09Å; I5-S7 VanDerWaalsContact O-N 3.12Å
6	H	33.8	Very low	52.1	Low	147 Å²	147	120.1 Å²	120.1	68%	0.681	65%	0.647	S	S	*	*			trans	-62.5	114.2	163.3	-79.8	62.5	0	0	0	107.1	E4 R8	E4-H6 VanDerWaalsContact C-N 3.29Å; E4-H6 PolarHBondContact O-N 3.08Å; E4-H6 PolarHBondContact O-ND1 3.21Å; H6-R8 PolarHBondContact O-N 2.88Å
7	S	36.6	Very low	54.3	Low	111 Å²	111	117.8 Å²	117.8	78%	0.776	63%	0.634	S	S	*	*			trans	-52.5	104.7	167.1	52.3	0	0	0	0	108.3	I5	I5-S7 PolarHBondContact O-N 3.09Å; I5-S7 VanDerWaalsContact O-N 3.12Å
8	R	48.8	Very low	56.3	Low	149 Å²	149	113.8 Å²	113.8	56%	0.562	61%	0.613	S	S	*	*			trans	-59.1	132	178	-71.7	-178.9	179.6	179.2	0.2	108.3	H6 Q10 V400	H6-R8 PolarHBondContact O-N 2.88Å; R8-Q10 PolarHBondContact O-N 2.86Å; R8-V400 PolarHBondContact NH1-O 2.85Å
9	P	36.9	Very low	58.2	Low	93 Å²	93	113.8 Å²	113.8	60%	0.604	61%	0.607	S	S	*	*			trans	-62.2	132.8	-175.5	21.9	-30.5	0	0	0	110.6	T11 A12	P9-T11 PolarHBondContact O-N 3.08Å; P9-A12 PolarHBondContact O-N 2.81Å
10	Q	46.8	Very low	60	Low	178 Å²	178	108.5 Å²	108.5	83%	0.832	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	12.7	177.2	-74.4	176.4	-25.1	0	0	114.5	R8	R8-Q10 PolarHBondContact O-N 2.86Å
11	T	53.8	Low	61.4	Low	108 Å²	108	109.6 Å²	109.6	66%	0.663	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-2.3	-175.2	57.7	0	0	0	0	114	P9 R13	P9-T11 PolarHBondContact O-N 3.08Å; T11-R13 PolarHBondContact O-N 3.28Å
12	A	72.4	Confident	64	Low	25 Å²	25	99.9 Å²	99.9	21%	0.207	54%	0.543	C	S	.	.			trans	-64.4	123.5	174.5	0	0	0	0	0	110	P9 H364 Q398 V399	P9-A12 PolarHBondContact O-N 2.81Å; A12-H364 PolarHBondContact O-CE1 2.81Å; A12-Q398 HydrophobicContact CB-CB 4.01Å; A12-Q398 WeakPolarHBondContact CB-O 3.48Å; A12-V399 HydrophobicContact CB-CG2 4.38Å
13	R	82.4	Confident	66.9	Low	185 Å²	185	95.8 Å²	95.8	70%	0.698	51%	0.506	S	S	*	.			trans	-124.3	145.6	-179.6	-70	-179	179.5	-175	-0.6	109.8	T11 V15	T11-R13 PolarHBondContact O-N 3.28Å; R13-V15 PolarHBondContact O-N 3.02Å
14	P	86.8	Confident	69.9	Low	22 Å²	22	95.1 Å²	95.1	14%	0.143	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-64.4	136.2	172	28.8	-34.7	0	0	0	109.8	H364 W394 D395 M396 V399	P14-H364 VanDerWaalsContact CD-CG 3.43Å; P14-H364 VanDerWaalsContact CD-ND1 3.31Å; P14-H364 WeakPolarHBondContact CD-ND1 3.3Å; P14-H364 HydrophobicContact CG-CB 3.69Å; P14-W394 HydrophobicContact CB-CE3 4.2Å; P14-D395 WeakPolarHBondContact CA-O 3.27Å; P14-M396 HydrophobicContact CB-SD 3.53Å; P14-M396 VanDerWaalsContact CB-SD 3.53Å; P14-V399 HydrophobicContact CB-CG2 4.49Å
15	V	89.1	Confident	72.9	Confident	71 Å²	71	90.4 Å²	90.4	43%	0.43	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122.6	177.9	-178.8	0	0	0	0	108.6	R13 L17 W394 D395	R13-V15 PolarHBondContact O-N 3.02Å; V15-L17 HydrophobicContact CG1-CD2 4.5Å; V15-L17 PolarHBondContact O-N 2.96Å; V15-W394 CarbonylContact O-C 3.6Å; V15-W394 WeakPolarHBondContact O-CA 3.47Å; V15-D395 HydrophobicContact CB-CB 4.24Å; V15-D395 PolarHBondContact N-O 2.85Å; V15-D395 PolarHBondContact O-N 3.48Å
16	L	90.7	Very high	75.7	Confident	61 Å²	61	83.1 Å²	83.1	32%	0.319	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	116.1	172.2	-178.2	67.2	0	0	0	108.9	K19 K392 W394	L16-K19 HydrophobicContact CD2-CD 4.33Å; L16-K19 VanDerWaalsContact CD2-CE 3.42Å; L16-K19 HydrophobicContact CD2-CG 4.01Å; L16-K392 HydrophobicContact CD1-CB 3.72Å; L16-K392 HydrophobicContact CD1-CD 4.13Å; L16-K392 HydrophobicContact CD1-CG 4.01Å; L16-W394 HydrophobicContact CB-CE3 3.8Å; L16-W394 HydrophobicContact CB-CH2 4.26Å; L16-W394 HydrophobicContact CB-CZ3 3.67Å; L16-W394 HydrophobicContact CD1-CD2 3.91Å; L16-W394 HydrophobicContact CD1-CE3 4.04Å; L16-W394 HydrophobicContact CD1-CH2 4.09Å; L16-W394 HydrophobicContact CD1-CZ2 3.95Å; L16-W394 HydrophobicContact CD1-CZ3 4.14Å; L16-W394 HydrophobicContact CG-CZ3 4.41Å
17	L	89.5	Confident	78.6	Confident	82 Å²	82	76.1 Å²	76.1	43%	0.429	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-50.8	179.7	-65.7	-179.7	0	0	0	111.6	V15 L381 I393 D395	V15-L17 HydrophobicContact CG1-CD2 4.5Å; V15-L17 PolarHBondContact O-N 2.96Å; L17-L381 HydrophobicContact CD1-CD2 3.48Å; L17-L381 VanDerWaalsContact CD1-CD2 3.48Å; L17-I393 HydrophobicContact CD1-CG2 4.48Å; L17-I393 PolarHBondContact N-O 2.7Å; L17-D395 HydrophobicContact CD1-CB 4.01Å; L17-D395 HydrophobicContact CD2-CB 4.09Å; L17-D395 HydrophobicContact CG-CB 3.97Å
18	N	90.6	Very high	81.3	Confident	45 Å²	45	72.1 Å²	72.1	24%	0.241	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	152.2	-172.1	-92.9	-41.8	0	0	0	111.9	G57 Y59 I393	N18-G57 PolarHBondContact ND2-O 3.2Å; N18-Y59 HydrophobicContact CB-CD2 4.17Å; N18-Y59 HydrophobicContact CB-CE2 3.91Å; N18-Y59 WeakPolarHBondContact ND2-CE2 3.47Å; N18-I393 PolarHBondContact N-O 3.41Å; N18-I393 PolarHBondContact O-N 2.96Å
19	K	92.6	Very high	83.5	Confident	115 Å²	115	65.1 Å²	65.1	50%	0.5	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	128	170.3	-62.8	-175.7	-178.3	179.2	0	108.5	L16 I390 V391 K392	L16-K19 HydrophobicContact CD2-CD 4.33Å; L16-K19 VanDerWaalsContact CD2-CE 3.42Å; L16-K19 HydrophobicContact CD2-CG 4.01Å; K19-I390 HydrophobicContact CB-CG2 4.2Å; K19-V391 WeakPolarHBondContact CA-O 3.27Å; K19-K392 HydrophobicContact CG-CG 4.39Å
20	I	92.5	Very high	86.3	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.036	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.9	175.6	-52.3	179.9	0	0	0	107.3	V39 W51 Y59 V391 I393	I20-V39 HydrophobicContact CD1-CB 4.29Å; I20-V39 HydrophobicContact CD1-CG2 4.14Å; I20-W51 HydrophobicContact CD1-CB 4.22Å; I20-W51 HydrophobicContact CD1-CG 4.27Å; I20-W51 HydrophobicContact CG2-CD2 3.53Å; I20-W51 HydrophobicContact CG2-CE3 3.57Å; I20-W51 HydrophobicContact CG2-CG 4.15Å; I20-W51 HydrophobicContact CG2-CH2 3.81Å; I20-W51 HydrophobicContact CG2-CZ2 3.78Å; I20-W51 HydrophobicContact CG2-CZ3 3.7Å; I20-Y59 HydrophobicContact CD1-CD1 3.84Å; I20-Y59 HydrophobicContact CD1-CD2 4.06Å; I20-Y59 HydrophobicContact CD1-CE1 4.45Å; I20-Y59 HydrophobicContact CD1-CG 3.62Å; I20-Y59 HydrophobicContact CG1-CD2 4.07Å; I20-Y59 HydrophobicContact CG1-CG 3.95Å; I20-V391 HydrophobicContact CB-CB 4.19Å; I20-V391 PolarHBondContact N-O 3.34Å; I20-V391 PolarHBondContact O-N 3.44Å; I20-I393 HydrophobicContact CD1-CD1 4.13Å
21	E	90.7	Very high	88.6	Confident	132 Å²	132	53.2 Å²	53.2	62%	0.617	29%	0.29	S	S	*	.			trans	-117.6	139.5	177.6	-58.3	-174.3	177.3	0	0	108.6	I390	E21-I390 HydrophobicContact CG-CD1 4.47Å; E21-I390 HydrophobicContact CG-CG1 4.16Å; E21-I390 HydrophobicContact CG-CG2 4.38Å
22	G	86.3	Confident	90.5	Very high	42 Å²	42	48.4 Å²	48.4	43%	0.433	26%	0.26	S	S	.	.			trans	159.6	-14.6	176.7	0	0	0	0	0	115.3	R49	G22-R49 VanDerWaalsContact O-CZ 3.24Å; G22-R49 PolarHBondContact O-NH1 3.12Å; G22-R49 PolarHBondContact O-NH2 2.55Å
23	H	91.5	Very high	91.4	Very high	15 Å²	15	47.2 Å²	47.2	7%	0.069	25%	0.25	C	S	.	.			trans	-73.9	143.5	172.5	-76.5	-74.6	0	0	0	111.2	V27 T41 S43 D45 T47 R49 R389	H23-V27 HydrophobicContact CB-CG2 3.96Å; H23-T41 PolarHBondContact NE2-OG1 2.87Å; H23-S43 WeakPolarHBondContact ND1-CB 3.27Å; H23-D45 IonicContact CG-OD2 3.83Å; H23-D45 IonicContact ND1-OD1 2.57Å; H23-D45 IonicContact ND1-OD2 3.46Å; H23-D45 PolarHBondContact ND1-OD2 2.87Å; H23-T47 PolarHBondContact CE1-OG1 2.93Å; H23-T47 PolarHBondContact ND1-OG1 2.97Å; H23-R49 VanDerWaalsContact CE1-CD 3.47Å; H23-R49 WeakPolarHBondContact CE1-CD 3.03Å; H23-R49 PolarHBondContact CE1-NE 3.32Å; H23-R389 HydrophobicContact CB-CB 4.49Å
24	S	91.8	Very high	91.5	Very high	80 Å²	80	40.5 Å²	40.5	56%	0.559	23%	0.23	S	C	*	.	S	Bend	trans	-87.2	-15.3	176.9	57.4	0	0	0	0	113	D45 R389	S24-D45 PolarHBondContact N-OD2 3.05Å; S24-D45 WeakPolarHBondContact OG-CB 3.36Å; S24-R389 WeakPolarHBondContact O-CD 3.28Å; S24-R389 PolarHBondContact O-NE 3.11Å; S24-R389 PolarHBondContact O-NH1 2.68Å
25	D	93.5	Very high	91.2	Very high	65 Å²	65	47.4 Å²	47.4	35%	0.348	26%	0.258	S	S	.	.	S	Bend	trans	-139.7	-178.6	-179.8	-144.3	-23.1	0	0	0	112	S43 E44 D45 R389	D25-S43 PolarHBondContact O-OG 2.96Å; D25-E44 HydrophobicContact CB-CB 4.21Å; D25-D45 HydrophobicContact CB-CB 3.94Å; D25-R389 WeakPolarHBondContact O-CB 3.42Å; D25-R389 WeakPolarHBondContact O-CG 3.27Å
26	A	93.1	Very high	90.9	Very high	12 Å²	12	48.5 Å²	48.5	10%	0.099	26%	0.259	C	S	.	.			trans	-52.9	141.4	-178.5	0	0	0	0	0	112.4	S43 E44	A26-S43 WeakPolarHBondContact O-CA 3.46Å; A26-S43 WeakPolarHBondContact O-CB 3.46Å; A26-S43 PolarHBondContact O-OG 3.03Å; A26-E44 PolarHBondContact O-N 3.25Å
27	V	95	Very high	90.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	111.9	175.4	-177.1	0	0	0	0	107.9	H23 V42 C385 G386 V391	H23-V27 HydrophobicContact CB-CG2 3.96Å; V27-V42 WeakPolarHBondContact CG1-O 3.5Å; V27-C385 HydrophobicContact CB-CB 3.95Å; V27-C385 HydrophobicContact CG1-CB 3.73Å; V27-C385 PolarHBondContact O-SG 2.74Å; V27-C385 VanDerWaalsContact O-SG 3.37Å; V27-G386 PolarHBondContact N-O 3.44Å; V27-G386 VanDerWaalsContact N-O 3.09Å; V27-V391 HydrophobicContact CB-CG2 4.3Å; V27-V391 HydrophobicContact CG1-CG2 3.87Å; V27-V391 HydrophobicContact CG2-CG2 4.12Å
28	N	93.7	Very high	90.8	Very high	27 Å²	27	44.7 Å²	44.7	14%	0.144	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-31.7	-171.5	-75.3	-33.1	0	0	0	112.8	V42 C71 S72 H372	N28-V42 PolarHBondContact N-O 2.75Å; N28-C71 PolarHBondContact ND2-O 3.04Å; N28-S72 WeakPolarHBondContact CB-O 3.31Å; N28-H372 WeakPolarHBondContact O-CB 3.4Å
29	A	93.8	Very high	91	Very high	3 Å²	3	42.5 Å²	42.5	3%	0.025	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	148.4	171.6	0	0	0	0	0	111.8	V42 M74	A29-V42 HydrophobicContact CB-CG2 3.65Å; A29-V42 PolarHBondContact N-O 3.36Å; A29-V42 PolarHBondContact O-N 3.4Å; A29-M74 HydrophobicContact CB-CB 4.12Å; A29-M74 HydrophobicContact CB-CE 4.44Å
30	A	95.4	Very high	91.1	Very high	1 Å²	1	37 Å²	37	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	133.7	175.9	0	0	0	0	0	109.2	V39 I40 T41 H372 D374 V383 C385 V391	A30-V39 HydrophobicContact CB-CG1 4.33Å; A30-I40 CarbonylContact C-O 3.54Å; A30-I40 VanDerWaalsContact CA-O 3.28Å; A30-I40 WeakPolarHBondContact CA-O 3.13Å; A30-T41 HydrophobicContact CB-CG2 4.17Å; A30-H372 PolarHBondContact O-CD2 3.37Å; A30-D374 WeakPolarHBondContact O-CB 3.12Å; A30-V383 HydrophobicContact CB-CG1 4.34Å; A30-V383 HydrophobicContact CB-CG2 3.94Å; A30-C385 HydrophobicContact CB-CB 3.96Å; A30-V391 HydrophobicContact CB-CG1 4.02Å
31	V	94.8	Very high	91.3	Very high	20 Å²	20	36.7 Å²	36.7	12%	0.121	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	138	-179.1	167.1	0	0	0	0	109.4	V39 I40 M74 Y76 D374	V31-V39 WeakPolarHBondContact O-CA 3.47Å; V31-I40 PolarHBondContact N-O 3.36Å; V31-I40 PolarHBondContact O-N 2.8Å; V31-M74 HydrophobicContact CB-CE 3.67Å; V31-M74 HydrophobicContact CG2-CE 3.52Å; V31-Y76 HydrophobicContact CG1-CD1 3.99Å; V31-D374 HydrophobicContact CG2-CB 4.38Å
32	L	93.9	Very high	91.5	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	139.1	173.9	-74	160.9	0	0	0	109.6	P34 V39 D374 D376 L381 V383	L32-P34 VanDerWaalsContact O-CD 3.29Å; L32-P34 WeakPolarHBondContact O-CD 3.35Å; L32-V39 HydrophobicContact CD2-CG2 3.96Å; L32-D374 PolarHBondContact N-OD2 3.26Å; L32-D374 VanDerWaalsContact N-OD2 3.12Å; L32-D376 HydrophobicContact CD1-CB 4.16Å; L32-L381 HydrophobicContact CD1-CB 4.01Å; L32-L381 WeakPolarHBondContact CD1-O 3.45Å; L32-V383 HydrophobicContact CD1-CB 4.27Å; L32-V383 HydrophobicContact CD1-CG1 4.23Å; L32-V383 HydrophobicContact CD2-CB 4.32Å; L32-V383 HydrophobicContact CG-CB 3.99Å; L32-V383 HydrophobicContact CG-CG1 3.85Å
33	I	91.5	Very high	92	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	118.2	171.3	-59.4	172	0	0	0	107.1	E36 G38 I40 V50 L52 F101	I33-E36 HydrophobicContact CB-CB 4.28Å; I33-E36 HydrophobicContact CG2-CB 3.83Å; I33-E36 HydrophobicContact CG2-CG 4.18Å; I33-G38 PolarHBondContact N-O 3.23Å; I33-I40 HydrophobicContact CD1-CD1 4.29Å; I33-I40 HydrophobicContact CD1-CG1 3.86Å; I33-I40 HydrophobicContact CG1-CD1 4.07Å; I33-I40 HydrophobicContact CG1-CG1 3.8Å; I33-V50 HydrophobicContact CD1-CG1 3.84Å; I33-L52 HydrophobicContact CD1-CD2 4.4Å; I33-F101 HydrophobicContact CD1-CD1 3.88Å; I33-F101 HydrophobicContact CD1-CE1 3.73Å; I33-F101 HydrophobicContact CD1-CZ 4.42Å; I33-F101 HydrophobicContact CG1-CE1 4.43Å; I33-F101 HydrophobicContact CG2-CE1 3.91Å; I33-F101 HydrophobicContact CG2-CZ 3.69Å
34	P	84.3	Confident	92.1	Very high	44 Å²	44	31.2 Å²	31.2	29%	0.286	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	145.9	176.5	-24.9	35.6	0	0	0	111.3	L32 E36 H78	L32-P34 VanDerWaalsContact O-CD 3.29Å; L32-P34 WeakPolarHBondContact O-CD 3.35Å; P34-E36 PolarHBondContact O-N 2.57Å; P34-H78 HydrophobicContact CB-CB 4.43Å; P34-H78 HydrophobicContact CG-CB 3.8Å; P34-H78 PolarHBondContact O-CE1 3.34Å
35	K	80.9	Confident	92.2	Very high	167 Å²	167	28.4 Å²	28.4	73%	0.726	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.6	-20.3	178.7	-54.6	171.5	-177.4	164.6	0	116.5
36	E	83.6	Confident	92.2	Very high	95 Å²	95	31.8 Å²	31.8	44%	0.444	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	149.9	178.8	-65.3	-63.1	154.6	0	0	111.5	I33 P34 G38 F101 R379	I33-E36 HydrophobicContact CB-CB 4.28Å; I33-E36 HydrophobicContact CG2-CB 3.83Å; I33-E36 HydrophobicContact CG2-CG 4.18Å; P34-E36 PolarHBondContact O-N 2.57Å; E36-G38 PolarHBondContact O-N 3.39Å; E36-F101 HydrophobicContact CG-CE2 4.13Å; E36-R379 PolarHBondContact O-NH1 2.98Å
37	D	85.4	Confident	92.3	Very high	61 Å²	61	31.3 Å²	31.3	33%	0.326	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	64.7	171.3	-81.3	12.5	0	0	0	110	K53 Y59 R379	D37-K53 HydrophobicContact CB-CB 3.67Å; D37-K53 HydrophobicContact CB-CD 3.88Å; D37-K53 HydrophobicContact CB-CG 4.49Å; D37-K53 VanDerWaalsContact O-CB 3.27Å; D37-K53 WeakPolarHBondContact O-CB 3.44Å; D37-K53 PolarHBondContact O-N 3.31Å; D37-K53 VanDerWaalsContact OD2-CD 3.27Å; D37-K53 WeakPolarHBondContact OD2-CD 3.49Å; D37-K53 IonicContact OD2-NZ 3.08Å; D37-K53 PolarHBondContact OD2-NZ 2.97Å; D37-K53 VanDerWaalsContact OD2-NZ 3.08Å; D37-Y59 WeakPolarHBondContact O-CE1 3.35Å; D37-R379 IonicContact OD1-CZ 2.78Å; D37-R379 IonicContact OD1-NH1 3.6Å; D37-R379 IonicContact OD1-NH2 3.51Å; D37-R379 PolarHBondContact OD1-NH2 2.84Å
38	G	91.5	Very high	92.3	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.01	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	157.3	-175.7	0	0	0	0	0	115	I33 E36 W51	I33-G38 PolarHBondContact N-O 3.23Å; E36-G38 PolarHBondContact O-N 3.39Å; G38-W51 CarbonylContact C-O 3.56Å; G38-W51 WeakPolarHBondContact CA-O 3.3Å
39	V	94.7	Very high	92.4	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.8	178.2	-174.7	0	0	0	0	109.3	I20 A30 V31 L32 T41 W51 Y59 V383 V391 I393	I20-V39 HydrophobicContact CD1-CB 4.29Å; I20-V39 HydrophobicContact CD1-CG2 4.14Å; A30-V39 HydrophobicContact CB-CG1 4.33Å; V31-V39 WeakPolarHBondContact O-CA 3.47Å; L32-V39 HydrophobicContact CD2-CG2 3.96Å; V39-T41 HydrophobicContact CG1-CG2 3.86Å; V39-W51 PolarHBondContact N-O 2.96Å; V39-W51 PolarHBondContact O-N 2.88Å; V39-Y59 HydrophobicContact CG2-CE1 4.11Å; V39-V383 HydrophobicContact CG1-CG2 4.1Å; V39-V391 HydrophobicContact CG1-CG1 4.34Å; V39-I393 HydrophobicContact CG2-CD1 3.63Å; V39-I393 HydrophobicContact CG2-CG1 4.28Å
40	I	95.8	Very high	92.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.3	169.6	-50.9	174.9	0	0	0	108.4	A30 V31 I33 I48 R49 V50 M74 Y76 I83 I97	A30-I40 CarbonylContact C-O 3.54Å; A30-I40 VanDerWaalsContact CA-O 3.28Å; A30-I40 WeakPolarHBondContact CA-O 3.13Å; V31-I40 PolarHBondContact N-O 3.36Å; V31-I40 PolarHBondContact O-N 2.8Å; I33-I40 HydrophobicContact CD1-CD1 4.29Å; I33-I40 HydrophobicContact CD1-CG1 3.86Å; I33-I40 HydrophobicContact CG1-CD1 4.07Å; I33-I40 HydrophobicContact CG1-CG1 3.8Å; I40-I48 HydrophobicContact CG2-CG2 4.47Å; I40-R49 WeakPolarHBondContact CA-O 3.48Å; I40-V50 HydrophobicContact CG1-CG1 4.3Å; I40-V50 HydrophobicContact CG1-CG2 4.18Å; I40-V50 HydrophobicContact CG2-CG2 4.24Å; I40-M74 HydrophobicContact CB-CE 4.37Å; I40-M74 HydrophobicContact CB-SD 4.27Å; I40-M74 HydrophobicContact CG2-CE 4.37Å; I40-M74 HydrophobicContact CG2-SD 3.69Å; I40-Y76 HydrophobicContact CD1-CD1 4.07Å; I40-Y76 HydrophobicContact CD1-CD2 3.7Å; I40-Y76 HydrophobicContact CD1-CE1 4.17Å; I40-Y76 HydrophobicContact CD1-CE2 3.82Å; I40-Y76 HydrophobicContact CD1-CG 3.83Å; I40-I83 HydrophobicContact CG2-CD1 3.74Å; I40-I97 HydrophobicContact CD1-CD1 3.79Å
41	T	96.2	Very high	92.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142	-178.6	63.9	0	0	0	0	110.8	H23 A30 V39 I48 R49 W51 V391	H23-T41 PolarHBondContact NE2-OG1 2.87Å; A30-T41 HydrophobicContact CB-CG2 4.17Å; V39-T41 HydrophobicContact CG1-CG2 3.86Å; T41-I48 WeakPolarHBondContact O-CA 3.42Å; T41-R49 PolarHBondContact N-O 3.23Å; T41-R49 PolarHBondContact O-N 3.4Å; T41-W51 PolarHBondContact OG1-NE1 2.95Å; T41-V391 HydrophobicContact CG2-CG1 4.49Å; T41-V391 HydrophobicContact CG2-CG2 3.8Å
42	V	95.2	Very high	92.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.4	170.5	-64.4	0	0	0	0	109.7	V27 N28 A29 I48 C71 M74 I85	V27-V42 WeakPolarHBondContact CG1-O 3.5Å; N28-V42 PolarHBondContact N-O 2.75Å; A29-V42 HydrophobicContact CB-CG2 3.65Å; A29-V42 PolarHBondContact N-O 3.36Å; A29-V42 PolarHBondContact O-N 3.4Å; V42-I48 HydrophobicContact CG1-CG1 4.22Å; V42-I48 HydrophobicContact CG1-CG2 4.13Å; V42-C71 HydrophobicContact CB-CB 3.72Å; V42-C71 HydrophobicContact CG1-CB 4.43Å; V42-C71 HydrophobicContact CG2-CB 4.35Å; V42-M74 HydrophobicContact CG1-CB 4.15Å; V42-M74 HydrophobicContact CG1-CG 4.28Å; V42-M74 HydrophobicContact CG1-SD 3.68Å; V42-M74 HydrophobicContact CG2-CB 3.84Å; V42-M74 HydrophobicContact CG2-SD 4.5Å; V42-I85 HydrophobicContact CG1-CD1 4.24Å; V42-I85 HydrophobicContact CG1-CG1 4.49Å; V42-I85 HydrophobicContact CG1-CG2 4.42Å
43	S	95.7	Very high	92.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	157.9	-172.5	172.7	0	0	0	0	112.4	H23 D25 A26 D45 R46 T47 C71	H23-S43 WeakPolarHBondContact ND1-CB 3.27Å; D25-S43 PolarHBondContact O-OG 2.96Å; A26-S43 WeakPolarHBondContact O-CA 3.46Å; A26-S43 WeakPolarHBondContact O-CB 3.46Å; A26-S43 PolarHBondContact O-OG 3.03Å; S43-D45 WeakPolarHBondContact CB-OD1 3.07Å; S43-D45 PolarHBondContact O-N 2.98Å; S43-D45 PolarHBondContact OG-N 2.5Å; S43-D45 PolarHBondContact OG-OD1 2.96Å; S43-R46 PolarHBondContact O-N 2.78Å; S43-T47 PolarHBondContact N-O 2.87Å; S43-C71 PolarHBondContact O-N 3.02Å
44	E	94.1	Very high	92.1	Very high	73 Å²	73	41.1 Å²	41.1	34%	0.341	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-17.7	172.2	-159.6	161.2	171.6	0	0	112.2	D25 A26 R46 P70	D25-E44 HydrophobicContact CB-CB 4.21Å; A26-E44 PolarHBondContact O-N 3.25Å; E44-R46 PolarHBondContact O-N 2.93Å; E44-P70 HydrophobicContact CG-CB 4.03Å
45	D	93.7	Very high	92.2	Very high	22 Å²	22	47.7 Å²	47.7	12%	0.118	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	3.7	172.5	71.9	5.9	0	0	0	114.7	H23 S24 D25 S43 T47 R49	H23-D45 IonicContact CG-OD2 3.83Å; H23-D45 IonicContact ND1-OD1 2.57Å; H23-D45 IonicContact ND1-OD2 3.46Å; H23-D45 PolarHBondContact ND1-OD2 2.87Å; S24-D45 PolarHBondContact N-OD2 3.05Å; S24-D45 WeakPolarHBondContact OG-CB 3.36Å; D25-D45 HydrophobicContact CB-CB 3.94Å; S43-D45 WeakPolarHBondContact CB-OD1 3.07Å; S43-D45 PolarHBondContact O-N 2.98Å; S43-D45 PolarHBondContact OG-N 2.5Å; S43-D45 PolarHBondContact OG-OD1 2.96Å; D45-T47 VanDerWaalsContact C-N 3.25Å; D45-T47 PolarHBondContact O-N 3.13Å; D45-T47 WeakPolarHBondContact OD1-CA 3.33Å; D45-T47 WeakPolarHBondContact OD1-CB 3.16Å; D45-T47 VanDerWaalsContact OD1-CG2 3.31Å; D45-T47 WeakPolarHBondContact OD1-CG2 3.38Å; D45-T47 PolarHBondContact OD1-N 3.1Å; D45-T47 PolarHBondContact OD1-OG1 3.36Å; D45-T47 PolarHBondContact OD2-OG1 3.17Å; D45-T47 VanDerWaalsContact OD2-OG1 3.12Å; D45-R49 IonicContact OD2-NH2 3.25Å; D45-R49 PolarHBondContact OD2-NH2 2.95Å
46	R	94.8	Very high	92.3	Very high	135 Å²	135	44 Å²	44	51%	0.509	21%	0.212	S	C	.	.	S	Bend	trans	66.8	23.7	-176.5	-53.1	177.7	-76.5	-176.9	-5	113.2	S43 E44 T66 V67 P70	S43-R46 PolarHBondContact O-N 2.78Å; E44-R46 PolarHBondContact O-N 2.93Å; R46-T66 WeakPolarHBondContact O-CA 3.48Å; R46-V67 HydrophobicContact CB-CG2 4.17Å; R46-V67 VanDerWaalsContact O-CG2 3.3Å; R46-V67 WeakPolarHBondContact O-CG2 3.22Å; R46-V67 PolarHBondContact O-N 2.76Å; R46-P70 HydrophobicContact CG-CB 4.45Å; R46-P70 HydrophobicContact CG-CG 4.03Å
47	T	95	Very high	92.3	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	144.9	176.8	76.1	0	0	0	0	112.4	H23 S43 D45 R49 Y64 H65 T66	H23-T47 PolarHBondContact CE1-OG1 2.93Å; H23-T47 PolarHBondContact ND1-OG1 2.97Å; S43-T47 PolarHBondContact N-O 2.87Å; D45-T47 VanDerWaalsContact C-N 3.25Å; D45-T47 PolarHBondContact O-N 3.13Å; D45-T47 WeakPolarHBondContact OD1-CA 3.33Å; D45-T47 WeakPolarHBondContact OD1-CB 3.16Å; D45-T47 VanDerWaalsContact OD1-CG2 3.31Å; D45-T47 WeakPolarHBondContact OD1-CG2 3.38Å; D45-T47 PolarHBondContact OD1-N 3.1Å; D45-T47 PolarHBondContact OD1-OG1 3.36Å; D45-T47 PolarHBondContact OD2-OG1 3.17Å; D45-T47 VanDerWaalsContact OD2-OG1 3.12Å; T47-R49 PolarHBondContact OG1-NE 3.3Å; T47-Y64 HydrophobicContact CG2-CE1 4.47Å; T47-Y64 HydrophobicContact CG2-CE2 3.99Å; T47-Y64 WeakPolarHBondContact CG2-OH 3.4Å; T47-H65 CarbonylContact C-O 3.54Å; T47-H65 WeakPolarHBondContact CA-O 3.31Å; T47-T66 HydrophobicContact CG2-CG2 4.36Å
48	I	95.4	Very high	92.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.1	168.5	-51.2	154.6	0	0	0	105.8	I40 T41 V42 H65 V67 I83 I85 F95 M104	I40-I48 HydrophobicContact CG2-CG2 4.47Å; T41-I48 WeakPolarHBondContact O-CA 3.42Å; V42-I48 HydrophobicContact CG1-CG1 4.22Å; V42-I48 HydrophobicContact CG1-CG2 4.13Å; I48-H65 HydrophobicContact CB-CB 4.46Å; I48-H65 PolarHBondContact N-O 2.62Å; I48-H65 PolarHBondContact O-N 3.4Å; I48-V67 HydrophobicContact CD1-CG1 3.55Å; I48-V67 HydrophobicContact CG1-CG1 4.41Å; I48-I83 HydrophobicContact CG2-CD1 4.5Å; I48-I85 HydrophobicContact CB-CD1 4.37Å; I48-I85 HydrophobicContact CD1-CD1 3.09Å; I48-I85 HydrophobicContact CG1-CD1 3.56Å; I48-I85 HydrophobicContact CG2-CD1 3.97Å; I48-F95 HydrophobicContact CD1-CE2 4Å; I48-F95 HydrophobicContact CD1-CZ 4.26Å; I48-M104 HydrophobicContact CD1-CE 4.05Å; I48-M104 HydrophobicContact CG2-CE 4Å; I48-M104 HydrophobicContact CG2-SD 4.23Å
49	R	95.3	Very high	92.4	Very high	21 Å²	21	45.7 Å²	45.7	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	136	-176.7	-56.4	-177.5	-166.4	-166.7	10.1	110.3	G22 H23 I40 T41 D45 T47 W51 I63 Y64	G22-R49 VanDerWaalsContact O-CZ 3.24Å; G22-R49 PolarHBondContact O-NH1 3.12Å; G22-R49 PolarHBondContact O-NH2 2.55Å; H23-R49 VanDerWaalsContact CE1-CD 3.47Å; H23-R49 WeakPolarHBondContact CE1-CD 3.03Å; H23-R49 PolarHBondContact CE1-NE 3.32Å; I40-R49 WeakPolarHBondContact CA-O 3.48Å; T41-R49 PolarHBondContact N-O 3.23Å; T41-R49 PolarHBondContact O-N 3.4Å; D45-R49 IonicContact OD2-NH2 3.25Å; D45-R49 PolarHBondContact OD2-NH2 2.95Å; T47-R49 PolarHBondContact OG1-NE 3.3Å; R49-W51 HydrophobicContact CB-CZ2 4.18Å; R49-W51 VanDerWaalsContact CD-CZ2 3.47Å; R49-W51 HydrophobicContact CG-CZ2 4.49Å; R49-I63 VanDerWaalsContact CA-O 3.3Å; R49-I63 WeakPolarHBondContact CA-O 3.4Å; R49-Y64 HydrophobicContact CG-CD2 4.12Å
50	V	95.3	Very high	92.2	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	114.8	170.8	-176.1	0	0	0	0	107.3	I33 I40 P61 S62 I63 I97 F101	I33-V50 HydrophobicContact CD1-CG1 3.84Å; I40-V50 HydrophobicContact CG1-CG1 4.3Å; I40-V50 HydrophobicContact CG1-CG2 4.18Å; I40-V50 HydrophobicContact CG2-CG2 4.24Å; V50-P61 CarbonylContact O-C 3.46Å; V50-P61 WeakPolarHBondContact O-CA 3.45Å; V50-S62 PolarHBondContact O-N 2.88Å; V50-I63 HydrophobicContact CB-CB 3.89Å; V50-I63 HydrophobicContact CB-CD1 4.01Å; V50-I63 HydrophobicContact CB-CG1 4.32Å; V50-I63 HydrophobicContact CG2-CB 3.91Å; V50-I63 HydrophobicContact CG2-CD1 3.75Å; V50-I63 HydrophobicContact CG2-CG1 4.37Å; V50-I63 HydrophobicContact CG2-CG2 4.4Å; V50-I63 PolarHBondContact N-O 3.45Å; V50-I63 VanDerWaalsContact N-O 3.11Å; V50-I63 PolarHBondContact O-N 2.84Å; V50-I97 HydrophobicContact CG2-CD1 4.36Å; V50-F101 HydrophobicContact CG1-CB 4.35Å; V50-F101 HydrophobicContact CG1-CD1 4.16Å
51	W	94.3	Very high	91.9	Very high	9 Å²	9	55 Å²	55	3%	0.034	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.4	-178	-55.7	88.2	0	0	0	109.1	I20 G38 V39 T41 R49 Y59 W60 P61	I20-W51 HydrophobicContact CD1-CB 4.22Å; I20-W51 HydrophobicContact CD1-CG 4.27Å; I20-W51 HydrophobicContact CG2-CD2 3.53Å; I20-W51 HydrophobicContact CG2-CE3 3.57Å; I20-W51 HydrophobicContact CG2-CG 4.15Å; I20-W51 HydrophobicContact CG2-CH2 3.81Å; I20-W51 HydrophobicContact CG2-CZ2 3.78Å; I20-W51 HydrophobicContact CG2-CZ3 3.7Å; G38-W51 CarbonylContact C-O 3.56Å; G38-W51 WeakPolarHBondContact CA-O 3.3Å; V39-W51 PolarHBondContact N-O 2.96Å; V39-W51 PolarHBondContact O-N 2.88Å; T41-W51 PolarHBondContact OG1-NE1 2.95Å; R49-W51 HydrophobicContact CB-CZ2 4.18Å; R49-W51 VanDerWaalsContact CD-CZ2 3.47Å; R49-W51 HydrophobicContact CG-CZ2 4.49Å; W51-Y59 HydrophobicContact CB-CD1 3.95Å; W51-W60 VanDerWaalsContact CA-O 3.31Å; W51-W60 WeakPolarHBondContact CA-O 3.37Å; W51-P61 HydrophobicContact CD2-CB 4.24Å; W51-P61 HydrophobicContact CE3-CB 3.85Å; W51-P61 HydrophobicContact CE3-CG 4.21Å; W51-P61 HydrophobicContact CH2-CB 4.18Å; W51-P61 HydrophobicContact CH2-CG 4.3Å; W51-P61 HydrophobicContact CZ3-CB 3.83Å; W51-P61 HydrophobicContact CZ3-CG 3.81Å
52	L	93.2	Very high	91.6	Very high	29 Å²	29	56 Å²	56	15%	0.152	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.4	171.1	-61	178.9	0	0	0	109.3	I33 W60 S62 F101	I33-L52 HydrophobicContact CD1-CD2 4.4Å; L52-W60 PolarHBondContact N-O 2.72Å; L52-W60 PolarHBondContact O-N 3.18Å; L52-S62 WeakPolarHBondContact CD1-OG 3.2Å; L52-F101 HydrophobicContact CD1-CB 3.92Å; L52-F101 HydrophobicContact CD2-CB 4.21Å; L52-F101 HydrophobicContact CD2-CG 4.41Å; L52-F101 HydrophobicContact CG-CB 4.42Å
53	K	91.5	Very high	91.4	Very high	81 Å²	81	56.4 Å²	56.4	35%	0.352	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.7	174	-165.8	-176.6	172.3	-169.5	0	109.8	D37 Q58 Y59	D37-K53 HydrophobicContact CB-CB 3.67Å; D37-K53 HydrophobicContact CB-CD 3.88Å; D37-K53 HydrophobicContact CB-CG 4.49Å; D37-K53 VanDerWaalsContact O-CB 3.27Å; D37-K53 WeakPolarHBondContact O-CB 3.44Å; D37-K53 PolarHBondContact O-N 3.31Å; D37-K53 VanDerWaalsContact OD2-CD 3.27Å; D37-K53 WeakPolarHBondContact OD2-CD 3.49Å; D37-K53 IonicContact OD2-NZ 3.08Å; D37-K53 PolarHBondContact OD2-NZ 2.97Å; D37-K53 VanDerWaalsContact OD2-NZ 3.08Å; K53-Q58 WeakPolarHBondContact CA-O 3.18Å; K53-Y59 HydrophobicContact CB-CD1 4.2Å; K53-Y59 HydrophobicContact CB-CE1 3.88Å; K53-Y59 HydrophobicContact CB-CE2 4.3Å; K53-Y59 HydrophobicContact CD-CE2 4.29Å; K53-Y59 HydrophobicContact CG-CE2 4.18Å
54	R	88.8	Confident	91.2	Very high	123 Å²	123	63 Å²	63	46%	0.464	30%	0.298	S	S	.	.			trans	-89.3	169.4	174.6	-61	-65.8	-176.3	176.6	-4.7	110.5	S56 G57 Q58 W60	R54-S56 PolarHBondContact O-N 3.28Å; R54-S56 VanDerWaalsContact O-N 3.09Å; R54-G57 WeakPolarHBondContact O-CA 3.23Å; R54-G57 PolarHBondContact O-N 2.84Å; R54-Q58 PolarHBondContact N-O 3.28Å; R54-W60 HydrophobicContact CG-CB 3.94Å
55	D	85.4	Confident	91.2	Very high	182 Å²	182	62.2 Å²	62.2	97%	0.973	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.1	175.9	-57.2	-33.2	0	0	0	113.1	G57	D55-G57 PolarHBondContact O-N 3.47Å
56	S	84.5	Confident	91.1	Very high	89 Å²	89	65.3 Å²	65.3	62%	0.622	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-7.7	172.4	62.6	0	0	0	0	114	R54 Q58	R54-S56 PolarHBondContact O-N 3.28Å; R54-S56 VanDerWaalsContact O-N 3.09Å; S56-Q58 PolarHBondContact O-N 3.21Å
57	G	83.4	Confident	91	Very high	24 Å²	24	59.8 Å²	59.8	25%	0.247	30%	0.295	C	S	.	.	S	Bend	trans	82.3	-7.2	-174.8	0	0	0	0	0	114.6	N18 R54 D55	N18-G57 PolarHBondContact ND2-O 3.2Å; R54-G57 WeakPolarHBondContact O-CA 3.23Å; R54-G57 PolarHBondContact O-N 2.84Å; D55-G57 PolarHBondContact O-N 3.47Å
58	Q	87.4	Confident	90.7	Very high	140 Å²	140	64.3 Å²	64.3	65%	0.654	33%	0.327	S	S	*	.			trans	-86.7	146.6	178.2	-66.7	-175.5	-5.4	0	0	111.9	K53 R54 S56	K53-Q58 WeakPolarHBondContact CA-O 3.18Å; R54-Q58 PolarHBondContact N-O 3.28Å; S56-Q58 PolarHBondContact O-N 3.21Å
59	Y	91.5	Very high	90.6	Very high	29 Å²	29	65 Å²	65	11%	0.114	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.6	173.3	-79	-91.9	0	0	0	110.6	N18 I20 D37 V39 W51 K53 I393	N18-Y59 HydrophobicContact CB-CD2 4.17Å; N18-Y59 HydrophobicContact CB-CE2 3.91Å; N18-Y59 WeakPolarHBondContact ND2-CE2 3.47Å; I20-Y59 HydrophobicContact CD1-CD1 3.84Å; I20-Y59 HydrophobicContact CD1-CD2 4.06Å; I20-Y59 HydrophobicContact CD1-CE1 4.45Å; I20-Y59 HydrophobicContact CD1-CG 3.62Å; I20-Y59 HydrophobicContact CG1-CD2 4.07Å; I20-Y59 HydrophobicContact CG1-CG 3.95Å; D37-Y59 WeakPolarHBondContact O-CE1 3.35Å; V39-Y59 HydrophobicContact CG2-CE1 4.11Å; W51-Y59 HydrophobicContact CB-CD1 3.95Å; K53-Y59 HydrophobicContact CB-CD1 4.2Å; K53-Y59 HydrophobicContact CB-CE1 3.88Å; K53-Y59 HydrophobicContact CB-CE2 4.3Å; K53-Y59 HydrophobicContact CD-CE2 4.29Å; K53-Y59 HydrophobicContact CG-CE2 4.18Å; Y59-I393 HydrophobicContact CD2-CD1 4.22Å; Y59-I393 HydrophobicContact CE1-CD1 3.95Å; Y59-I393 HydrophobicContact CE2-CD1 3.43Å; Y59-I393 VanDerWaalsContact CE2-CD1 3.43Å; Y59-I393 VanDerWaalsContact OH-CD1 3.27Å; Y59-I393 WeakPolarHBondContact OH-CD1 3.45Å
60	W	89.4	Confident	90.6	Very high	156 Å²	156	65.6 Å²	65.6	59%	0.591	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	136.4	178.9	-172.4	-91.8	0	0	0	110.8	W51 L52 R54 S62	W51-W60 VanDerWaalsContact CA-O 3.31Å; W51-W60 WeakPolarHBondContact CA-O 3.37Å; L52-W60 PolarHBondContact N-O 2.72Å; L52-W60 PolarHBondContact O-N 3.18Å; R54-W60 HydrophobicContact CG-CB 3.94Å; W60-S62 PolarHBondContact O-N 3.29Å
61	P	90.2	Very high	90.6	Very high	38 Å²	38	65.6 Å²	65.6	25%	0.247	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	96.1	177.3	30.6	-30.9	0	0	0	109.5	V50 W51	V50-P61 CarbonylContact O-C 3.46Å; V50-P61 WeakPolarHBondContact O-CA 3.45Å; W51-P61 HydrophobicContact CD2-CB 4.24Å; W51-P61 HydrophobicContact CE3-CB 3.85Å; W51-P61 HydrophobicContact CE3-CG 4.21Å; W51-P61 HydrophobicContact CH2-CB 4.18Å; W51-P61 HydrophobicContact CH2-CG 4.3Å; W51-P61 HydrophobicContact CZ3-CB 3.83Å; W51-P61 HydrophobicContact CZ3-CG 3.81Å
62	S	89.6	Confident	90.6	Very high	23 Å²	23	65.7 Å²	65.7	16%	0.161	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-37	176.4	-63.5	0	0	0	0	111.7	V50 L52 W60 F101	V50-S62 PolarHBondContact O-N 2.88Å; L52-S62 WeakPolarHBondContact CD1-OG 3.2Å; W60-S62 PolarHBondContact O-N 3.29Å; S62-F101 WeakPolarHBondContact CB-O 3.16Å
63	I	91	Very high	90.6	Very high	8 Å²	8	65 Å²	65	4%	0.041	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.1	171.9	-66.1	159.4	0	0	0	108.5	R49 V50 H65 I97 F101 M104	R49-I63 VanDerWaalsContact CA-O 3.3Å; R49-I63 WeakPolarHBondContact CA-O 3.4Å; V50-I63 HydrophobicContact CB-CB 3.89Å; V50-I63 HydrophobicContact CB-CD1 4.01Å; V50-I63 HydrophobicContact CB-CG1 4.32Å; V50-I63 HydrophobicContact CG2-CB 3.91Å; V50-I63 HydrophobicContact CG2-CD1 3.75Å; V50-I63 HydrophobicContact CG2-CG1 4.37Å; V50-I63 HydrophobicContact CG2-CG2 4.4Å; V50-I63 PolarHBondContact N-O 3.45Å; V50-I63 VanDerWaalsContact N-O 3.11Å; V50-I63 PolarHBondContact O-N 2.84Å; I63-H65 HydrophobicContact CG2-CB 4.37Å; I63-I97 HydrophobicContact CD1-CG2 4.03Å; I63-F101 VanDerWaalsContact CD1-O 3.22Å; I63-F101 WeakPolarHBondContact CD1-O 3.08Å; I63-F101 WeakPolarHBondContact CG1-O 3.07Å; I63-M104 HydrophobicContact CD1-CB 4.31Å; I63-M104 HydrophobicContact CG2-CB 3.9Å; I63-M104 HydrophobicContact CG2-SD 4.19Å
64	Y	92.1	Very high	90.8	Very high	138 Å²	138	61.9 Å²	61.9	54%	0.541	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	108.2	168.2	-177.4	-84.6	0	0	0	107.9	T47 R49 T66	T47-Y64 HydrophobicContact CG2-CE1 4.47Å; T47-Y64 HydrophobicContact CG2-CE2 3.99Å; T47-Y64 WeakPolarHBondContact CG2-OH 3.4Å; R49-Y64 HydrophobicContact CG-CD2 4.12Å; Y64-T66 HydrophobicContact CD1-CG2 4.33Å; Y64-T66 HydrophobicContact CE1-CG2 3.56Å
65	H	92.6	Very high	91	Very high	57 Å²	57	57.1 Å²	57.1	26%	0.264	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.3	-179.4	-167	79.3	0	0	0	110.6	T47 I48 I63 F95 M104	T47-H65 CarbonylContact C-O 3.54Å; T47-H65 WeakPolarHBondContact CA-O 3.31Å; I48-H65 HydrophobicContact CB-CB 4.46Å; I48-H65 PolarHBondContact N-O 2.62Å; I48-H65 PolarHBondContact O-N 3.4Å; I63-H65 HydrophobicContact CG2-CB 4.37Å; H65-F95 AromaticContact CD2-CE1 3.8Å; H65-F95 AromaticContact CD2-CZ 3.95Å; H65-F95 AromaticContact NE2-CE1 3.4Å; H65-F95 WeakPolarHBondContact NE2-CE1 3.3Å; H65-F95 AromaticContact NE2-CZ 3.79Å; H65-M104 HydrophobicContact CB-SD 4.09Å
66	T	92.8	Very high	91.5	Very high	87 Å²	87	49.9 Å²	49.9	53%	0.534	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.5	178.9	54.6	0	0	0	0	110.3	R46 T47 Y64	R46-T66 WeakPolarHBondContact O-CA 3.48Å; T47-T66 HydrophobicContact CG2-CG2 4.36Å; Y64-T66 HydrophobicContact CD1-CG2 4.33Å; Y64-T66 HydrophobicContact CE1-CG2 3.56Å
67	V	91.9	Very high	91.9	Very high	19 Å²	19	47.9 Å²	47.9	12%	0.115	25%	0.25	C	S	.	.			trans	-107.2	167	176.4	-69.6	0	0	0	0	111.9	R46 I48 S69 C71 F95	R46-V67 HydrophobicContact CB-CG2 4.17Å; R46-V67 VanDerWaalsContact O-CG2 3.3Å; R46-V67 WeakPolarHBondContact O-CG2 3.22Å; R46-V67 PolarHBondContact O-N 2.76Å; I48-V67 HydrophobicContact CD1-CG1 3.55Å; I48-V67 HydrophobicContact CG1-CG1 4.41Å; V67-S69 WeakPolarHBondContact CG2-O 3.38Å; V67-C71 WeakPolarHBondContact CG2-SG 3.4Å; V67-F95 HydrophobicContact CG1-CZ 4.09Å
68	S	89.4	Confident	92.1	Very high	98 Å²	98	48.8 Å²	48.8	69%	0.685	25%	0.248	S	C	*	.	S	Bend	trans	-71.4	-28.6	-177.4	53.4	0	0	0	0	114
69	S	93.8	Very high	92.1	Very high	15 Å²	15	48 Å²	48	11%	0.105	25%	0.248	C	C	.	.	S	Bend	trans	-136.3	151.8	-173.7	-177.7	0	0	0	0	110.7	V67 N89	V67-S69 WeakPolarHBondContact CG2-O 3.38Å; S69-N89 WeakPolarHBondContact CB-ND2 3.43Å; S69-N89 PolarHBondContact OG-N 3.39Å
70	P	94.8	Very high	92.1	Very high	32 Å²	32	47.7 Å²	47.7	21%	0.208	25%	0.25	C	S	.	.			trans	-54.4	142.8	180	-28.3	36.1	0	0	0	112.8	E44 R46 Q87 D88	E44-P70 HydrophobicContact CG-CB 4.03Å; R46-P70 HydrophobicContact CG-CB 4.45Å; R46-P70 HydrophobicContact CG-CG 4.03Å; P70-Q87 WeakPolarHBondContact O-CA 3.4Å; P70-D88 HydrophobicContact CB-CB 4.33Å; P70-D88 PolarHBondContact O-N 3.49Å
71	C	94.6	Very high	92.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	127.7	179.2	-59.1	0	0	0	0	110.3	N28 V42 S43 V67 I85	N28-C71 PolarHBondContact ND2-O 3.04Å; V42-C71 HydrophobicContact CB-CB 3.72Å; V42-C71 HydrophobicContact CG1-CB 4.43Å; V42-C71 HydrophobicContact CG2-CB 4.35Å; S43-C71 PolarHBondContact O-N 3.02Å; V67-C71 WeakPolarHBondContact CG2-SG 3.4Å; C71-I85 HydrophobicContact CB-CG2 4Å
72	S	93.8	Very high	92.4	Very high	12 Å²	12	45.5 Å²	45.5	8%	0.084	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-40.2	-176.6	56.6	0	0	0	0	113.5	N28 G86 D88 V117	N28-S72 WeakPolarHBondContact CB-O 3.31Å; S72-G86 PolarHBondContact N-O 2.8Å; S72-G86 PolarHBondContact OG-O 2.87Å; S72-G86 VanDerWaalsContact OG-O 3.11Å; S72-D88 WeakPolarHBondContact CB-OD1 3.32Å; S72-V117 WeakPolarHBondContact CB-O 3.4Å; S72-V117 PolarHBondContact OG-O 2.79Å
73	C	93.6	Very high	92.7	Very high	13 Å²	13	44.4 Å²	44.4	9%	0.088	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	161.4	-178.8	64.8	0	0	0	0	111.3	G86	C73-G86 PolarHBondContact O-N 2.87Å
74	M	95.4	Very high	93	Very high	17 Å²	17	44 Å²	44	8%	0.084	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	147	-177.3	179.1	177.8	61.9	0	0	110.9	A29 V31 I40 V42 I83 F84	A29-M74 HydrophobicContact CB-CB 4.12Å; A29-M74 HydrophobicContact CB-CE 4.44Å; V31-M74 HydrophobicContact CB-CE 3.67Å; V31-M74 HydrophobicContact CG2-CE 3.52Å; I40-M74 HydrophobicContact CB-CE 4.37Å; I40-M74 HydrophobicContact CB-SD 4.27Å; I40-M74 HydrophobicContact CG2-CE 4.37Å; I40-M74 HydrophobicContact CG2-SD 3.69Å; V42-M74 HydrophobicContact CG1-CB 4.15Å; V42-M74 HydrophobicContact CG1-CG 4.28Å; V42-M74 HydrophobicContact CG1-SD 3.68Å; V42-M74 HydrophobicContact CG2-CB 3.84Å; V42-M74 HydrophobicContact CG2-SD 4.5Å; M74-I83 HydrophobicContact CG-CD1 3.85Å; M74-I83 HydrophobicContact CG-CG1 3.92Å; M74-I83 HydrophobicContact SD-CD1 3.4Å; M74-I83 WeakPolarHBondContact SD-CD1 3.36Å; M74-I83 HydrophobicContact SD-CG1 4.14Å; M74-F84 WeakPolarHBondContact CA-O 3.42Å
75	S	94.9	Very high	93.2	Very high	22 Å²	22	37.4 Å²	37.4	15%	0.154	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	123.5	166.1	179	0	0	0	0	108.6	I83 F84 F122	S75-I83 WeakPolarHBondContact O-CA 3.27Å; S75-F84 PolarHBondContact N-O 3.28Å; S75-F84 PolarHBondContact O-N 2.76Å; S75-F122 PolarHBondContact OG-N 2.9Å
76	Y	94.3	Very high	93.3	Very high	30 Å²	30	34.7 Å²	34.7	12%	0.118	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.8	179.8	170.9	-114.3	0	0	0	109.9	V31 I40 H78 I83 I97	V31-Y76 HydrophobicContact CG1-CD1 3.99Å; I40-Y76 HydrophobicContact CD1-CD1 4.07Å; I40-Y76 HydrophobicContact CD1-CD2 3.7Å; I40-Y76 HydrophobicContact CD1-CE1 4.17Å; I40-Y76 HydrophobicContact CD1-CE2 3.82Å; I40-Y76 HydrophobicContact CD1-CG 3.83Å; Y76-H78 HydrophobicContact CE1-CB 4.07Å; Y76-H78 PolarHBondContact OH-ND1 2.93Å; Y76-I83 HydrophobicContact CD2-CB 4.24Å; Y76-I97 HydrophobicContact CE2-CD1 4.19Å
77	H	92.9	Very high	93.5	Very high	47 Å²	47	30.9 Å²	30.9	22%	0.218	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	116.5	175.1	-172.2	-85.7	0	0	0	110	S80 R81 R82 F122	H77-S80 PolarHBondContact ND1-N 2.75Å; H77-S80 PolarHBondContact ND1-OG 3.05Å; H77-R81 WeakPolarHBondContact O-CA 3.43Å; H77-R81 PolarHBondContact O-N 2.86Å; H77-R82 PolarHBondContact N-O 2.89Å; H77-R82 PolarHBondContact O-N 2.8Å; H77-F122 HydrophobicContact CB-CD1 3.72Å; H77-F122 HydrophobicContact CB-CE1 3.77Å; H77-F122 AromaticContact CG-CE1 3.85Å
78	H	87.8	Confident	93.6	Very high	44 Å²	44	32.1 Å²	32.1	20%	0.204	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-53.2	-169.3	179.3	64.6	0	0	0	113.3	P34 Y76 S80 R81	P34-H78 HydrophobicContact CB-CB 4.43Å; P34-H78 HydrophobicContact CG-CB 3.8Å; P34-H78 PolarHBondContact O-CE1 3.34Å; Y76-H78 HydrophobicContact CE1-CB 4.07Å; Y76-H78 PolarHBondContact OH-ND1 2.93Å; H78-S80 VanDerWaalsContact C-N 3.28Å; H78-S80 PolarHBondContact O-N 2.89Å; H78-R81 WeakPolarHBondContact O-CG 3.41Å; H78-R81 PolarHBondContact O-N 2.77Å
79	D	88.9	Confident	93.8	Very high	122 Å²	122	31 Å²	31	65%	0.652	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-31.7	-171.5	-60.3	-30.3	0	0	0	112.9
80	S	90.6	Very high	93.8	Very high	24 Å²	24	30.3 Å²	30.3	17%	0.168	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-10.4	177.2	66.1	0	0	0	0	113.1	H77 H78 R82 L96	H77-S80 PolarHBondContact ND1-N 2.75Å; H77-S80 PolarHBondContact ND1-OG 3.05Å; H78-S80 VanDerWaalsContact C-N 3.28Å; H78-S80 PolarHBondContact O-N 2.89Å; S80-R82 PolarHBondContact O-N 2.92Å; S80-L96 WeakPolarHBondContact O-CD1 3.43Å
81	R	92.6	Very high	93.8	Very high	69 Å²	69	29.4 Å²	29.4	26%	0.26	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	24.5	-174.1	-64	169.1	-77.1	150.4	-23.1	114	H77 H78 L96 I97 E99	H77-R81 WeakPolarHBondContact O-CA 3.43Å; H77-R81 PolarHBondContact O-N 2.86Å; H78-R81 WeakPolarHBondContact O-CG 3.41Å; H78-R81 PolarHBondContact O-N 2.77Å; R81-L96 HydrophobicContact CB-CD1 4.36Å; R81-I97 WeakPolarHBondContact CB-O 3.4Å; R81-I97 PolarHBondContact NH1-O 2.77Å; R81-I97 PolarHBondContact O-N 3.41Å; R81-E99 IonicContact CZ-OE1 3.3Å; R81-E99 IonicContact NH1-OE1 2.95Å; R81-E99 IonicContact NH2-OE1 2.78Å; R81-E99 PolarHBondContact NH2-OE1 3.17Å
82	R	94.3	Very high	93.9	Very high	78 Å²	78	29.4 Å²	29.4	29%	0.294	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	138	176.4	-66.2	-178.7	-175.2	-159	16.9	109.4	H77 S80 F84 E94 F95 L96	H77-R82 PolarHBondContact N-O 2.89Å; H77-R82 PolarHBondContact O-N 2.8Å; S80-R82 PolarHBondContact O-N 2.92Å; R82-F84 HydrophobicContact CB-CE2 4.06Å; R82-E94 WeakPolarHBondContact CD-OE1 3.49Å; R82-E94 IonicContact CZ-OE1 3.95Å; R82-E94 IonicContact NE-OE1 3.19Å; R82-E94 IonicContact NH1-OE1 3.92Å; R82-E94 PolarHBondContact NH1-OE1 3.44Å; R82-F95 WeakPolarHBondContact CA-O 3.34Å; R82-L96 HydrophobicContact CG-CD1 4.14Å
83	I	95.5	Very high	94	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.9	174.4	-179.3	174.1	0	0	0	108.6	I40 I48 M74 S75 Y76 I85 E94 F95 I97 M104	I40-I83 HydrophobicContact CG2-CD1 3.74Å; I48-I83 HydrophobicContact CG2-CD1 4.5Å; M74-I83 HydrophobicContact CG-CD1 3.85Å; M74-I83 HydrophobicContact CG-CG1 3.92Å; M74-I83 HydrophobicContact SD-CD1 3.4Å; M74-I83 WeakPolarHBondContact SD-CD1 3.36Å; M74-I83 HydrophobicContact SD-CG1 4.14Å; S75-I83 WeakPolarHBondContact O-CA 3.27Å; Y76-I83 HydrophobicContact CD2-CB 4.24Å; I83-I85 HydrophobicContact CD1-CD1 3.99Å; I83-I85 HydrophobicContact CD1-CG1 4.15Å; I83-I85 HydrophobicContact CG1-CD1 4.17Å; I83-I85 HydrophobicContact CG1-CG1 3.91Å; I83-E94 WeakPolarHBondContact O-CA 3.44Å; I83-F95 HydrophobicContact CG2-CB 3.65Å; I83-F95 PolarHBondContact N-O 2.85Å; I83-F95 PolarHBondContact O-N 3.47Å; I83-I97 HydrophobicContact CB-CD1 4.45Å; I83-I97 HydrophobicContact CG2-CD1 4.07Å; I83-I97 HydrophobicContact CG2-CG1 4.16Å; I83-M104 HydrophobicContact CD1-CE 4.49Å; I83-M104 HydrophobicContact CG2-CE 3.49Å; I83-M104 VanDerWaalsContact CG2-CE 3.49Å
84	F	96.1	Very high	94.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.6	174.2	-62.9	-89.2	0	0	0	108.7	M74 S75 R82 V92 V93 E94 Y110 M120 F122 V129 T143	M74-F84 WeakPolarHBondContact CA-O 3.42Å; S75-F84 PolarHBondContact N-O 3.28Å; S75-F84 PolarHBondContact O-N 2.76Å; R82-F84 HydrophobicContact CB-CE2 4.06Å; F84-V92 HydrophobicContact CB-CG1 4.44Å; F84-V92 HydrophobicContact CD1-CG1 4.43Å; F84-V93 CarbonylContact C-O 3.59Å; F84-V93 WeakPolarHBondContact CA-O 3.21Å; F84-E94 HydrophobicContact CD1-CB 3.81Å; F84-E94 HydrophobicContact CD1-CG 4.1Å; F84-E94 HydrophobicContact CE1-CB 3.58Å; F84-E94 HydrophobicContact CE1-CG 3.51Å; F84-E94 HydrophobicContact CZ-CB 4.4Å; F84-E94 HydrophobicContact CZ-CG 3.84Å; F84-Y110 HydrophobicContact CE1-CE2 4.29Å; F84-M120 HydrophobicContact CB-CE 3.51Å; F84-M120 HydrophobicContact CB-SD 3.66Å; F84-M120 WeakPolarHBondContact O-CE 3.43Å; F84-F122 HydrophobicContact CD2-CB 3.69Å; F84-F122 HydrophobicContact CD2-CD1 4.28Å; F84-F122 HydrophobicContact CD2-CD2 4.03Å; F84-F122 AromaticContact CD2-CG 3.72Å; F84-F122 HydrophobicContact CD2-CG 3.72Å; F84-F122 HydrophobicContact CE2-CB 3.85Å; F84-F122 AromaticContact CE2-CD1 3.78Å; F84-F122 HydrophobicContact CE2-CD1 3.78Å; F84-F122 AromaticContact CE2-CD2 3.29Å; F84-F122 HydrophobicContact CE2-CD2 3.29Å; F84-F122 HydrophobicContact CE2-CE1 4.14Å; F84-F122 AromaticContact CE2-CE2 3.7Å; F84-F122 HydrophobicContact CE2-CE2 3.7Å; F84-F122 AromaticContact CE2-CG 3.32Å; F84-F122 HydrophobicContact CE2-CG 3.32Å; F84-F122 HydrophobicContact CE2-CZ 4.09Å; F84-F122 AromaticContact CZ-CD2 3.64Å; F84-F122 HydrophobicContact CZ-CD2 3.64Å; F84-F122 AromaticContact CZ-CE2 3.81Å; F84-F122 HydrophobicContact CZ-CE2 3.81Å; F84-F122 HydrophobicContact CZ-CG 4.15Å; F84-F122 HydrophobicContact CZ-CZ 4.45Å; F84-V129 HydrophobicContact CD1-CG2 3.52Å; F84-V129 HydrophobicContact CD2-CG2 4.31Å; F84-V129 HydrophobicContact CE1-CG2 3.37Å; F84-V129 HydrophobicContact CE2-CG2 4.19Å; F84-V129 HydrophobicContact CG-CG2 4Å; F84-V129 HydrophobicContact CZ-CG2 3.73Å; F84-T143 HydrophobicContact CE1-CG2 3.98Å; F84-T143 HydrophobicContact CZ-CG2 3.83Å
85	I	96.6	Very high	94.1	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	122	-174.5	-56.7	178.4	0	0	0	108.9	V42 I48 C71 I83 V92 V93 F95 M104	V42-I85 HydrophobicContact CG1-CD1 4.24Å; V42-I85 HydrophobicContact CG1-CG1 4.49Å; V42-I85 HydrophobicContact CG1-CG2 4.42Å; I48-I85 HydrophobicContact CB-CD1 4.37Å; I48-I85 HydrophobicContact CD1-CD1 3.09Å; I48-I85 HydrophobicContact CG1-CD1 3.56Å; I48-I85 HydrophobicContact CG2-CD1 3.97Å; C71-I85 HydrophobicContact CB-CG2 4Å; I83-I85 HydrophobicContact CD1-CD1 3.99Å; I83-I85 HydrophobicContact CD1-CG1 4.15Å; I83-I85 HydrophobicContact CG1-CD1 4.17Å; I83-I85 HydrophobicContact CG1-CG1 3.91Å; I85-V92 CarbonylContact O-C 3.58Å; I85-V92 WeakPolarHBondContact O-CA 3.48Å; I85-V93 PolarHBondContact N-O 3.09Å; I85-V93 PolarHBondContact O-N 2.83Å; I85-F95 HydrophobicContact CD1-CD2 3.95Å; I85-F95 HydrophobicContact CD1-CE2 3.96Å; I85-M104 HydrophobicContact CD1-CE 4.07Å
86	G	96	Very high	94.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	137.8	171.2	0	0	0	0	0	110.3	S72 C73	S72-G86 PolarHBondContact N-O 2.8Å; S72-G86 PolarHBondContact OG-O 2.87Å; S72-G86 VanDerWaalsContact OG-O 3.11Å; C73-G86 PolarHBondContact O-N 2.87Å
87	Q	95.6	Very high	94.1	Very high	6 Å²	6	28.7 Å²	28.7	3%	0.028	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	159.7	179.8	-67.9	-178.4	-5.8	0	0	111.8	P70 N89 G90 A91 V117	P70-Q87 WeakPolarHBondContact O-CA 3.4Å; Q87-N89 WeakPolarHBondContact CB-OD1 2.91Å; Q87-N89 PolarHBondContact O-N 2.8Å; Q87-N89 PolarHBondContact OE1-ND2 3.09Å; Q87-N89 PolarHBondContact OE1-OD1 3.23Å; Q87-G90 PolarHBondContact O-N 3.12Å; Q87-A91 WeakPolarHBondContact CB-O 3.45Å; Q87-A91 PolarHBondContact N-O 2.88Å; Q87-V117 PolarHBondContact O-N 2.93Å
88	D	94.3	Very high	94.1	Very high	46 Å²	46	27.6 Å²	27.6	25%	0.246	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-24	177.3	-83	13.2	0	0	0	113.6	P70 S72 G90 R116	P70-D88 HydrophobicContact CB-CB 4.33Å; P70-D88 PolarHBondContact O-N 3.49Å; S72-D88 WeakPolarHBondContact CB-OD1 3.32Å; D88-G90 PolarHBondContact O-N 3.39Å; D88-R116 HydrophobicContact CB-CB 4.5Å; D88-R116 VanDerWaalsContact O-CA 3.23Å; D88-R116 WeakPolarHBondContact O-CA 3.43Å; D88-R116 PolarHBondContact O-N 3.19Å; D88-R116 WeakPolarHBondContact OD1-CD 3.29Å; D88-R116 VanDerWaalsContact OD1-CG 3.27Å; D88-R116 WeakPolarHBondContact OD1-CG 3.28Å; D88-R116 IonicContact OD1-CZ 3.7Å; D88-R116 IonicContact OD1-NE 2.75Å; D88-R116 PolarHBondContact OD1-NE 3.4Å; D88-R116 IonicContact OD2-NE 3.5Å
89	N	93.9	Very high	94.1	Very high	74 Å²	74	32.5 Å²	32.5	40%	0.396	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-1.1	173.1	66.1	8.6	0	0	0	114	S69 Q87 A91	S69-N89 WeakPolarHBondContact CB-ND2 3.43Å; S69-N89 PolarHBondContact OG-N 3.39Å; Q87-N89 WeakPolarHBondContact CB-OD1 2.91Å; Q87-N89 PolarHBondContact O-N 2.8Å; Q87-N89 PolarHBondContact OE1-ND2 3.09Å; Q87-N89 PolarHBondContact OE1-OD1 3.23Å; N89-A91 VanDerWaalsContact OD1-CB 3.23Å; N89-A91 WeakPolarHBondContact OD1-CB 3.4Å; N89-A91 PolarHBondContact OD1-N 3.37Å
90	G	93.6	Very high	93.9	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.01	16%	0.155	C	C	.	.	S	Bend	trans	86	0.6	-178.7	0	0	0	0	0	115.7	Q87 D88 H113 N115	Q87-G90 PolarHBondContact O-N 3.12Å; D88-G90 PolarHBondContact O-N 3.39Å; G90-H113 CarbonylContact C-O 3.59Å; G90-H113 WeakPolarHBondContact CA-O 3.43Å; G90-H113 PolarHBondContact O-N 2.97Å; G90-N115 WeakPolarHBondContact CA-O 3.43Å
91	A	95.2	Very high	93.8	Very high	12 Å²	12	30.5 Å²	30.5	10%	0.099	15%	0.15	C	C	.	.			trans	-77	140.8	172.6	0	0	0	0	0	111.1	Q87 N89 T109 Y110	Q87-A91 WeakPolarHBondContact CB-O 3.45Å; Q87-A91 PolarHBondContact N-O 2.88Å; N89-A91 VanDerWaalsContact OD1-CB 3.23Å; N89-A91 WeakPolarHBondContact OD1-CB 3.4Å; N89-A91 PolarHBondContact OD1-N 3.37Å; A91-T109 HydrophobicContact CB-CG2 4.11Å; A91-Y110 WeakPolarHBondContact CA-O 3.47Å
92	V	96.1	Very high	93.6	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.1	163.3	172.6	0	0	0	0	107.5	F84 I85 Y110 A112 V117 M120 V129	F84-V92 HydrophobicContact CB-CG1 4.44Å; F84-V92 HydrophobicContact CD1-CG1 4.43Å; I85-V92 CarbonylContact O-C 3.58Å; I85-V92 WeakPolarHBondContact O-CA 3.48Å; V92-Y110 HydrophobicContact CG1-CD2 4.39Å; V92-Y110 PolarHBondContact N-O 3.3Å; V92-Y110 WeakPolarHBondContact O-CB 3.34Å; V92-Y110 WeakPolarHBondContact O-CD2 3.46Å; V92-Y110 PolarHBondContact O-N 2.91Å; V92-A112 HydrophobicContact CB-CB 4.38Å; V92-A112 HydrophobicContact CG2-CB 3.86Å; V92-V117 HydrophobicContact CG2-CG1 4.3Å; V92-V117 HydrophobicContact CG2-CG2 4.09Å; V92-M120 HydrophobicContact CB-SD 4.39Å; V92-M120 HydrophobicContact CG1-CE 4.45Å; V92-M120 HydrophobicContact CG1-SD 3.42Å; V92-M120 WeakPolarHBondContact CG1-SD 3.49Å; V92-M120 HydrophobicContact CG2-SD 4.05Å; V92-V129 HydrophobicContact CG1-CG1 4.14Å
93	V	95.6	Very high	93.5	Very high	6 Å²	6	33.6 Å²	33.6	4%	0.036	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.3	-176.9	-169	0	0	0	0	109.9	F84 I85 F95 H106 T109	F84-V93 CarbonylContact C-O 3.59Å; F84-V93 WeakPolarHBondContact CA-O 3.21Å; I85-V93 PolarHBondContact N-O 3.09Å; I85-V93 PolarHBondContact O-N 2.83Å; V93-F95 HydrophobicContact CB-CD2 4.41Å; V93-F95 HydrophobicContact CB-CE2 3.75Å; V93-F95 HydrophobicContact CB-CZ 4.37Å; V93-F95 HydrophobicContact CG1-CD2 3.95Å; V93-F95 HydrophobicContact CG1-CE1 4.37Å; V93-F95 HydrophobicContact CG1-CE2 3.31Å; V93-F95 HydrophobicContact CG1-CZ 3.55Å; V93-H106 VanDerWaalsContact CG1-CD2 3.43Å; V93-H106 WeakPolarHBondContact CG1-CD2 3.46Å; V93-T109 HydrophobicContact CG2-CG2 4.2Å
94	E	95.8	Very high	93.4	Very high	3 Å²	3	34.4 Å²	34.4	1%	0.014	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.3	174.6	-179.7	-177	-163.5	0	0	110.3	R82 I83 F84 V107 K108 Y110	R82-E94 WeakPolarHBondContact CD-OE1 3.49Å; R82-E94 IonicContact CZ-OE1 3.95Å; R82-E94 IonicContact NE-OE1 3.19Å; R82-E94 IonicContact NH1-OE1 3.92Å; R82-E94 PolarHBondContact NH1-OE1 3.44Å; I83-E94 WeakPolarHBondContact O-CA 3.44Å; F84-E94 HydrophobicContact CD1-CB 3.81Å; F84-E94 HydrophobicContact CD1-CG 4.1Å; F84-E94 HydrophobicContact CE1-CB 3.58Å; F84-E94 HydrophobicContact CE1-CG 3.51Å; F84-E94 HydrophobicContact CZ-CB 4.4Å; F84-E94 HydrophobicContact CZ-CG 3.84Å; E94-V107 HydrophobicContact CB-CB 4.32Å; E94-V107 HydrophobicContact CG-CB 3.95Å; E94-V107 HydrophobicContact CG-CG1 4.38Å; E94-V107 HydrophobicContact CG-CG2 4.35Å; E94-V107 PolarHBondContact O-N 2.88Å; E94-K108 PolarHBondContact N-O 3Å; E94-K108 PolarHBondContact O-N 3.22Å; E94-Y110 HydrophobicContact CB-CE2 3.86Å; E94-Y110 PolarHBondContact OE2-OH 2.6Å; E94-Y110 VanDerWaalsContact OE2-OH 3.06Å
95	F	95.6	Very high	93.2	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.018	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	155.5	170.9	-60	-97.1	0	0	0	110.8	I48 H65 V67 R82 I83 I85 V93 M104 N105 H106	I48-F95 HydrophobicContact CD1-CE2 4Å; I48-F95 HydrophobicContact CD1-CZ 4.26Å; H65-F95 AromaticContact CD2-CE1 3.8Å; H65-F95 AromaticContact CD2-CZ 3.95Å; H65-F95 AromaticContact NE2-CE1 3.4Å; H65-F95 WeakPolarHBondContact NE2-CE1 3.3Å; H65-F95 AromaticContact NE2-CZ 3.79Å; V67-F95 HydrophobicContact CG1-CZ 4.09Å; R82-F95 WeakPolarHBondContact CA-O 3.34Å; I83-F95 HydrophobicContact CG2-CB 3.65Å; I83-F95 PolarHBondContact N-O 2.85Å; I83-F95 PolarHBondContact O-N 3.47Å; I85-F95 HydrophobicContact CD1-CD2 3.95Å; I85-F95 HydrophobicContact CD1-CE2 3.96Å; V93-F95 HydrophobicContact CB-CD2 4.41Å; V93-F95 HydrophobicContact CB-CE2 3.75Å; V93-F95 HydrophobicContact CB-CZ 4.37Å; V93-F95 HydrophobicContact CG1-CD2 3.95Å; V93-F95 HydrophobicContact CG1-CE1 4.37Å; V93-F95 HydrophobicContact CG1-CE2 3.31Å; V93-F95 HydrophobicContact CG1-CZ 3.55Å; F95-M104 HydrophobicContact CB-CE 3.29Å; F95-M104 HydrophobicContact CB-CG 3.84Å; F95-M104 HydrophobicContact CB-SD 4.41Å; F95-M104 HydrophobicContact CD1-CE 3.83Å; F95-M104 HydrophobicContact CD1-CG 3.97Å; F95-M104 HydrophobicContact CD1-SD 4.42Å; F95-M104 HydrophobicContact CD2-CE 3.52Å; F95-M104 HydrophobicContact CE1-CE 4.5Å; F95-M104 HydrophobicContact CE2-CE 4.21Å; F95-M104 HydrophobicContact CG-CE 3.3Å; F95-M104 HydrophobicContact CG-CG 4.16Å; F95-M104 HydrophobicContact CG-SD 4.41Å; F95-N105 CarbonylContact C-O 3.45Å; F95-N105 WeakPolarHBondContact CA-O 3.47Å; F95-N105 WeakPolarHBondContact CB-O 3.14Å; F95-H106 HydrophobicContact CD1-CB 4.01Å; F95-H106 HydrophobicContact CE1-CB 3.89Å
96	L	95.4	Very high	93.1	Very high	65 Å²	65	42.6 Å²	42.6	34%	0.34	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.3	173.5	-177.5	68	0	0	0	109.5	S80 R81 R82 N105 V107	S80-L96 WeakPolarHBondContact O-CD1 3.43Å; R81-L96 HydrophobicContact CB-CD1 4.36Å; R82-L96 HydrophobicContact CG-CD1 4.14Å; L96-N105 PolarHBondContact N-O 2.93Å; L96-N105 PolarHBondContact O-N 3.33Å; L96-V107 HydrophobicContact CB-CG2 3.84Å
97	I	94	Very high	93	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	135	177.4	-58.3	173	0	0	0	109.4	I40 V50 I63 Y76 R81 I83 F101	I40-I97 HydrophobicContact CD1-CD1 3.79Å; V50-I97 HydrophobicContact CG2-CD1 4.36Å; I63-I97 HydrophobicContact CD1-CG2 4.03Å; Y76-I97 HydrophobicContact CE2-CD1 4.19Å; R81-I97 WeakPolarHBondContact CB-O 3.4Å; R81-I97 PolarHBondContact NH1-O 2.77Å; R81-I97 PolarHBondContact O-N 3.41Å; I83-I97 HydrophobicContact CB-CD1 4.45Å; I83-I97 HydrophobicContact CG2-CD1 4.07Å; I83-I97 HydrophobicContact CG2-CG1 4.16Å; I97-F101 HydrophobicContact CG2-CD1 3.62Å; I97-F101 HydrophobicContact CG2-CE1 4.14Å; I97-F101 HydrophobicContact CG2-CG 4.32Å
98	S	92.1	Very high	92.9	Very high	25 Å²	25	48.4 Å²	48.4	18%	0.175	25%	0.246	C	C	.	.			trans	-66.8	157.7	174.9	58.9	0	0	0	0	112	D100 F101 N102 K103	S98-D100 WeakPolarHBondContact CB-OD1 3.18Å; S98-D100 PolarHBondContact O-N 3.35Å; S98-D100 PolarHBondContact OG-OD1 2.79Å; S98-F101 PolarHBondContact O-N 3.44Å; S98-N102 PolarHBondContact OG-N 3.02Å; S98-K103 PolarHBondContact N-O 2.79Å; S98-K103 PolarHBondContact OG-N 2.91Å; S98-K103 PolarHBondContact OG-O 2.97Å; S98-K103 VanDerWaalsContact OG-O 3.13Å
99	E	87.7	Confident	92.9	Very high	147 Å²	147	49.7 Å²	49.7	69%	0.687	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-31.6	-177.6	-64.8	-176.2	177.4	0	0	113	R81 F101	R81-E99 IonicContact CZ-OE1 3.3Å; R81-E99 IonicContact NH1-OE1 2.95Å; R81-E99 IonicContact NH2-OE1 2.78Å; R81-E99 PolarHBondContact NH2-OE1 3.17Å; E99-F101 VanDerWaalsContact C-N 3.29Å; E99-F101 WeakPolarHBondContact O-CD2 3.2Å
100	D	86.4	Confident	92.9	Very high	88 Å²	88	46.2 Å²	46.2	47%	0.471	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	2	179.6	68.8	-19.9	0	0	0	113.4	S98 N102	S98-D100 WeakPolarHBondContact CB-OD1 3.18Å; S98-D100 PolarHBondContact O-N 3.35Å; S98-D100 PolarHBondContact OG-OD1 2.79Å; D100-N102 VanDerWaalsContact CG-ND2 3.3Å; D100-N102 PolarHBondContact O-N 3.28Å; D100-N102 VanDerWaalsContact O-N 3.08Å; D100-N102 PolarHBondContact O-ND2 3.48Å; D100-N102 PolarHBondContact OD1-N 3.21Å; D100-N102 WeakPolarHBondContact OD2-CB 3.36Å; D100-N102 PolarHBondContact OD2-ND2 3.23Å
101	F	87.8	Confident	92.9	Very high	15 Å²	15	50.9 Å²	50.9	7%	0.066	27%	0.268	C	S	.	.	S	Bend	trans	52.7	29.2	-178.6	-63	-89.1	0	0	0	114.3	I33 E36 V50 L52 S62 I63 I97 S98 E99	I33-F101 HydrophobicContact CD1-CD1 3.88Å; I33-F101 HydrophobicContact CD1-CE1 3.73Å; I33-F101 HydrophobicContact CD1-CZ 4.42Å; I33-F101 HydrophobicContact CG1-CE1 4.43Å; I33-F101 HydrophobicContact CG2-CE1 3.91Å; I33-F101 HydrophobicContact CG2-CZ 3.69Å; E36-F101 HydrophobicContact CG-CE2 4.13Å; V50-F101 HydrophobicContact CG1-CB 4.35Å; V50-F101 HydrophobicContact CG1-CD1 4.16Å; L52-F101 HydrophobicContact CD1-CB 3.92Å; L52-F101 HydrophobicContact CD2-CB 4.21Å; L52-F101 HydrophobicContact CD2-CG 4.41Å; L52-F101 HydrophobicContact CG-CB 4.42Å; S62-F101 WeakPolarHBondContact CB-O 3.16Å; I63-F101 VanDerWaalsContact CD1-O 3.22Å; I63-F101 WeakPolarHBondContact CD1-O 3.08Å; I63-F101 WeakPolarHBondContact CG1-O 3.07Å; I97-F101 HydrophobicContact CG2-CD1 3.62Å; I97-F101 HydrophobicContact CG2-CE1 4.14Å; I97-F101 HydrophobicContact CG2-CG 4.32Å; S98-F101 PolarHBondContact O-N 3.44Å; E99-F101 VanDerWaalsContact C-N 3.29Å; E99-F101 WeakPolarHBondContact O-CD2 3.2Å
102	N	88.7	Confident	92.7	Very high	85 Å²	85	50.3 Å²	50.3	46%	0.455	26%	0.263	S	S	.	.	S	Bend	trans	-107.1	-12.8	178.2	-64.4	-43.7	0	0	0	113.3	S98 D100	S98-N102 PolarHBondContact OG-N 3.02Å; D100-N102 VanDerWaalsContact CG-ND2 3.3Å; D100-N102 PolarHBondContact O-N 3.28Å; D100-N102 VanDerWaalsContact O-N 3.08Å; D100-N102 PolarHBondContact O-ND2 3.48Å; D100-N102 PolarHBondContact OD1-N 3.21Å; D100-N102 WeakPolarHBondContact OD2-CB 3.36Å; D100-N102 PolarHBondContact OD2-ND2 3.23Å
103	K	90.9	Very high	92.7	Very high	127 Å²	127	50.9 Å²	50.9	55%	0.552	27%	0.265	S	S	*	.			trans	-136	143.2	-179.1	-167.6	174.7	-176.5	-175.2	0	111.5	S98 N105	S98-K103 PolarHBondContact N-O 2.79Å; S98-K103 PolarHBondContact OG-N 2.91Å; S98-K103 PolarHBondContact OG-O 2.97Å; S98-K103 VanDerWaalsContact OG-O 3.13Å; K103-N105 WeakPolarHBondContact CE-OD1 3.45Å
104	M	93.4	Very high	92.6	Very high	18 Å²	18	57.7 Å²	57.7	9%	0.089	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.1	176	-174	173.9	-171.5	0	0	108.7	I48 I63 H65 I83 I85 F95	I48-M104 HydrophobicContact CD1-CE 4.05Å; I48-M104 HydrophobicContact CG2-CE 4Å; I48-M104 HydrophobicContact CG2-SD 4.23Å; I63-M104 HydrophobicContact CD1-CB 4.31Å; I63-M104 HydrophobicContact CG2-CB 3.9Å; I63-M104 HydrophobicContact CG2-SD 4.19Å; H65-M104 HydrophobicContact CB-SD 4.09Å; I83-M104 HydrophobicContact CD1-CE 4.49Å; I83-M104 HydrophobicContact CG2-CE 3.49Å; I83-M104 VanDerWaalsContact CG2-CE 3.49Å; I85-M104 HydrophobicContact CD1-CE 4.07Å; F95-M104 HydrophobicContact CB-CE 3.29Å; F95-M104 HydrophobicContact CB-CG 3.84Å; F95-M104 HydrophobicContact CB-SD 4.41Å; F95-M104 HydrophobicContact CD1-CE 3.83Å; F95-M104 HydrophobicContact CD1-CG 3.97Å; F95-M104 HydrophobicContact CD1-SD 4.42Å; F95-M104 HydrophobicContact CD2-CE 3.52Å; F95-M104 HydrophobicContact CE1-CE 4.5Å; F95-M104 HydrophobicContact CE2-CE 4.21Å; F95-M104 HydrophobicContact CG-CE 3.3Å; F95-M104 HydrophobicContact CG-CG 4.16Å; F95-M104 HydrophobicContact CG-SD 4.41Å
105	N	93.3	Very high	92.5	Very high	68 Å²	68	61.6 Å²	61.6	36%	0.364	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.7	-179.9	-62.1	-47.4	0	0	0	109.7	F95 L96 K103	F95-N105 CarbonylContact C-O 3.45Å; F95-N105 WeakPolarHBondContact CA-O 3.47Å; F95-N105 WeakPolarHBondContact CB-O 3.14Å; L96-N105 PolarHBondContact N-O 2.93Å; L96-N105 PolarHBondContact O-N 3.33Å; K103-N105 WeakPolarHBondContact CE-OD1 3.45Å
106	H	94.6	Very high	92.4	Very high	103 Å²	103	65 Å²	65	48%	0.477	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	135.4	168.2	174.4	-94.7	0	0	0	109.7	V93 F95 T109	V93-H106 VanDerWaalsContact CG1-CD2 3.43Å; V93-H106 WeakPolarHBondContact CG1-CD2 3.46Å; F95-H106 HydrophobicContact CD1-CB 4.01Å; F95-H106 HydrophobicContact CE1-CB 3.89Å; H106-T109 PolarHBondContact NE2-OG1 3.46Å
107	V	93.6	Very high	92.5	Very high	69 Å²	69	61.9 Å²	61.9	42%	0.418	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-57.5	178.4	-179.2	0	0	0	0	110	E94 L96	E94-V107 HydrophobicContact CB-CB 4.32Å; E94-V107 HydrophobicContact CG-CB 3.95Å; E94-V107 HydrophobicContact CG-CG1 4.38Å; E94-V107 HydrophobicContact CG-CG2 4.35Å; E94-V107 PolarHBondContact O-N 2.88Å; L96-V107 HydrophobicContact CB-CG2 3.84Å
108	K	93.1	Very high	92.5	Very high	59 Å²	59	63 Å²	63	26%	0.257	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	150.5	-173.8	-159.6	173.7	-67	171.6	0	111.6	E94 Y110 T143 Q144	E94-K108 PolarHBondContact N-O 3Å; E94-K108 PolarHBondContact O-N 3.22Å; K108-Y110 HydrophobicContact CB-CE2 3.92Å; K108-Y110 HydrophobicContact CD-CE1 3.91Å; K108-Y110 HydrophobicContact CD-CE2 4.34Å; K108-Y110 HydrophobicContact CG-CE2 4.23Å; K108-T143 PolarHBondContact NZ-O 2.84Å; K108-Q144 PolarHBondContact NZ-O 2.96Å
109	T	94.7	Very high	92.5	Very high	73 Å²	73	62.2 Å²	62.2	45%	0.448	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.8	171.4	-59.8	0	0	0	0	109.3	A91 V93 H106	A91-T109 HydrophobicContact CB-CG2 4.11Å; V93-T109 HydrophobicContact CG2-CG2 4.2Å; H106-T109 PolarHBondContact NE2-OG1 3.46Å
110	Y	93.8	Very high	92.9	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.008	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.8	-175.6	-63.6	-89.6	0	0	0	109.4	F84 A91 V92 E94 K108 A112 M141 T143	F84-Y110 HydrophobicContact CE1-CE2 4.29Å; A91-Y110 WeakPolarHBondContact CA-O 3.47Å; V92-Y110 HydrophobicContact CG1-CD2 4.39Å; V92-Y110 PolarHBondContact N-O 3.3Å; V92-Y110 WeakPolarHBondContact O-CB 3.34Å; V92-Y110 WeakPolarHBondContact O-CD2 3.46Å; V92-Y110 PolarHBondContact O-N 2.91Å; E94-Y110 HydrophobicContact CB-CE2 3.86Å; E94-Y110 PolarHBondContact OE2-OH 2.6Å; E94-Y110 VanDerWaalsContact OE2-OH 3.06Å; K108-Y110 HydrophobicContact CB-CE2 3.92Å; K108-Y110 HydrophobicContact CD-CE1 3.91Å; K108-Y110 HydrophobicContact CD-CE2 4.34Å; K108-Y110 HydrophobicContact CG-CE2 4.23Å; Y110-A112 PolarHBondContact O-N 3.45Å; Y110-M141 VanDerWaalsContact CB-SD 3.58Å; Y110-M141 HydrophobicContact CD1-CB 4.13Å; Y110-M141 HydrophobicContact CD1-SD 3.79Å; Y110-M141 HydrophobicContact CE1-CB 4.48Å; Y110-M141 HydrophobicContact CG-SD 4.1Å; Y110-T143 WeakPolarHBondContact OH-CA 3.31Å; Y110-T143 PolarHBondContact OH-O 2.95Å
111	P	92.9	Very high	93.3	Very high	99 Å²	99	53.1 Å²	53.1	64%	0.643	28%	0.275	S	S	*	.			trans	-78.1	68.4	175.5	32.5	-34.3	0	0	0	110.2
112	A	92.3	Very high	93.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.275	C	S	.	.			trans	-75.9	-34.6	-170.3	0	0	0	0	0	113.1	V92 Y110 S139 M141 R151	V92-A112 HydrophobicContact CB-CB 4.38Å; V92-A112 HydrophobicContact CG2-CB 3.86Å; Y110-A112 PolarHBondContact O-N 3.45Å; A112-S139 PolarHBondContact O-OG 2.83Å; A112-M141 HydrophobicContact CB-SD 3.92Å; A112-R151 PolarHBondContact O-NH2 3.44Å
113	H	95	Very high	93.8	Very high	12 Å²	12	49.7 Å²	49.7	6%	0.056	26%	0.257	C	S	.	.			trans	-140.7	162.2	-173.9	-65	-77.4	0	0	0	112.3	G90 N115 S131 D135 S137 S139	G90-H113 CarbonylContact C-O 3.59Å; G90-H113 WeakPolarHBondContact CA-O 3.43Å; G90-H113 PolarHBondContact O-N 2.97Å; H113-N115 WeakPolarHBondContact CB-O 3.27Å; H113-S131 PolarHBondContact CD2-OG 2.89Å; H113-S131 VanDerWaalsContact NE2-C 3.34Å; H113-S131 PolarHBondContact NE2-O 3.01Å; H113-S131 PolarHBondContact NE2-OG 3.44Å; H113-D135 WeakPolarHBondContact CA-OD2 3.42Å; H113-D135 VanDerWaalsContact CB-OD2 3.29Å; H113-D135 WeakPolarHBondContact CB-OD2 3.1Å; H113-D135 IonicContact CE1-OD1 3.23Å; H113-D135 IonicContact CG-OD1 3.54Å; H113-D135 IonicContact CG-OD2 3.92Å; H113-D135 IonicContact ND1-OD1 3.62Å; H113-D135 PolarHBondContact ND1-OD1 2.92Å; H113-D135 IonicContact ND1-OD2 3.01Å; H113-D135 PolarHBondContact ND1-OD2 3.38Å; H113-S137 PolarHBondContact CE1-O 2.85Å; H113-S137 VanDerWaalsContact CE1-O 3.31Å; H113-S137 PolarHBondContact CE1-OG 3.39Å; H113-S137 PolarHBondContact ND1-OG 2.8Å; H113-S137 VanDerWaalsContact ND1-OG 3.11Å; H113-S139 PolarHBondContact NE2-OG 3.04Å; H113-S139 VanDerWaalsContact NE2-OG 3.15Å
114	Q	92.8	Very high	93.7	Very high	150 Å²	150	47 Å²	47	70%	0.701	25%	0.248	S	C	*	.	S	Bend	trans	-91.9	-18.6	174.1	-66.8	180	3.1	0	0	113.4	D135	Q114-D135 HydrophobicContact CB-CB 4.29Å; Q114-D135 PolarHBondContact N-OD2 2.89Å
115	N	93.6	Very high	93.5	Very high	85 Å²	85	53.5 Å²	53.5	46%	0.455	28%	0.279	S	S	.	.	S	Bend	trans	-130.6	175.5	178.7	-71.5	-35.1	0	0	0	109.3	G90 H113 V117 H134 D135	G90-N115 WeakPolarHBondContact CA-O 3.43Å; H113-N115 WeakPolarHBondContact CB-O 3.27Å; N115-V117 PolarHBondContact O-N 2.81Å; N115-H134 HydrophobicContact CB-CB 3.78Å; N115-D135 HydrophobicContact CB-CB 4.3Å
116	R	94.8	Very high	93.2	Very high	74 Å²	74	51.3 Å²	51.3	28%	0.279	27%	0.269	S	S	.	.			trans	-38.8	127.2	178.2	178.4	173.5	-156.3	-132.1	8.8	114	D88 G133 H134	D88-R116 HydrophobicContact CB-CB 4.5Å; D88-R116 VanDerWaalsContact O-CA 3.23Å; D88-R116 WeakPolarHBondContact O-CA 3.43Å; D88-R116 PolarHBondContact O-N 3.19Å; D88-R116 WeakPolarHBondContact OD1-CD 3.29Å; D88-R116 VanDerWaalsContact OD1-CG 3.27Å; D88-R116 WeakPolarHBondContact OD1-CG 3.28Å; D88-R116 IonicContact OD1-CZ 3.7Å; D88-R116 IonicContact OD1-NE 2.75Å; D88-R116 PolarHBondContact OD1-NE 3.4Å; D88-R116 IonicContact OD2-NE 3.5Å; R116-G133 WeakPolarHBondContact O-CA 3.42Å; R116-H134 HydrophobicContact CB-CB 4.37Å; R116-H134 PolarHBondContact O-N 3.26Å
117	V	96.4	Very high	93	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	127.3	170.6	-171.9	0	0	0	0	108.3	S72 Q87 V92 N115 T132	S72-V117 WeakPolarHBondContact CB-O 3.4Å; S72-V117 PolarHBondContact OG-O 2.79Å; Q87-V117 PolarHBondContact O-N 2.93Å; V92-V117 HydrophobicContact CG2-CG1 4.3Å; V92-V117 HydrophobicContact CG2-CG2 4.09Å; N115-V117 PolarHBondContact O-N 2.81Å; V117-T132 CarbonylContact C-O 3.56Å; V117-T132 WeakPolarHBondContact CA-O 3.45Å; V117-T132 WeakPolarHBondContact CG1-O 3.45Å
118	S	94	Very high	93	Very high	24 Å²	24	46.7 Å²	46.7	17%	0.168	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-41.9	-175.2	49.1	0	0	0	0	112.7	T132 A158 S159	S118-T132 PolarHBondContact N-O 2.95Å; S118-T132 PolarHBondContact OG-O 2.57Å; S118-T132 VanDerWaalsContact OG-O 3.13Å; S118-T132 PolarHBondContact OG-OG1 3.11Å; S118-A158 VanDerWaalsContact CB-O 3.32Å; S118-A158 WeakPolarHBondContact CB-O 3.36Å; S118-A158 PolarHBondContact OG-O 2.86Å; S118-S159 WeakPolarHBondContact CB-O 3.35Å
119	G	93.2	Very high	93.1	Very high	9 Å²	9	44 Å²	44	9%	0.093	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	152.3	179.4	0	0	0	0	0	111.6	S131 T132	G119-S131 CarbonylContact O-C 3.5Å; G119-S131 WeakPolarHBondContact O-CA 3.31Å; G119-T132 WeakPolarHBondContact CA-OG1 3.38Å; G119-T132 PolarHBondContact N-OG1 2.91Å; G119-T132 VanDerWaalsContact N-OG1 3.16Å; G119-T132 PolarHBondContact O-N 3.37Å; G119-T132 PolarHBondContact O-OG1 3.08Å
120	M	94.9	Very high	93.2	Very high	18 Å²	18	40.5 Å²	40.5	9%	0.089	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	145.1	-176.9	177.7	172.1	55.1	0	0	111	F84 V92 V129 V130	F84-M120 HydrophobicContact CB-CE 3.51Å; F84-M120 HydrophobicContact CB-SD 3.66Å; F84-M120 WeakPolarHBondContact O-CE 3.43Å; V92-M120 HydrophobicContact CB-SD 4.39Å; V92-M120 HydrophobicContact CG1-CE 4.45Å; V92-M120 HydrophobicContact CG1-SD 3.42Å; V92-M120 WeakPolarHBondContact CG1-SD 3.49Å; V92-M120 HydrophobicContact CG2-SD 4.05Å; M120-V129 HydrophobicContact CG-CG1 3.82Å; M120-V129 HydrophobicContact SD-CG1 3.65Å; M120-V130 CarbonylContact C-O 3.54Å; M120-V130 VanDerWaalsContact CA-O 3.3Å; M120-V130 WeakPolarHBondContact CA-O 3.47Å
121	V	95.4	Very high	93.3	Very high	26 Å²	26	40.5 Å²	40.5	16%	0.158	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	136.2	173.2	-178.9	0	0	0	0	108.6	V130 L161	V121-V130 PolarHBondContact N-O 3.39Å; V121-V130 PolarHBondContact O-N 3.01Å; V121-L161 HydrophobicContact CB-CD2 4.34Å; V121-L161 HydrophobicContact CG2-CD2 4.12Å; V121-L161 HydrophobicContact CG2-CG 4.09Å
122	F	94.8	Very high	93.5	Very high	16 Å²	16	35.8 Å²	35.8	7%	0.07	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.6	172.4	166.6	-108.3	0	0	0	109	S75 H77 F84 L124 V129 T143	S75-F122 PolarHBondContact OG-N 2.9Å; H77-F122 HydrophobicContact CB-CD1 3.72Å; H77-F122 HydrophobicContact CB-CE1 3.77Å; H77-F122 AromaticContact CG-CE1 3.85Å; F84-F122 HydrophobicContact CD2-CB 3.69Å; F84-F122 HydrophobicContact CD2-CD1 4.28Å; F84-F122 HydrophobicContact CD2-CD2 4.03Å; F84-F122 AromaticContact CD2-CG 3.72Å; F84-F122 HydrophobicContact CD2-CG 3.72Å; F84-F122 HydrophobicContact CE2-CB 3.85Å; F84-F122 AromaticContact CE2-CD1 3.78Å; F84-F122 HydrophobicContact CE2-CD1 3.78Å; F84-F122 AromaticContact CE2-CD2 3.29Å; F84-F122 HydrophobicContact CE2-CD2 3.29Å; F84-F122 HydrophobicContact CE2-CE1 4.14Å; F84-F122 AromaticContact CE2-CE2 3.7Å; F84-F122 HydrophobicContact CE2-CE2 3.7Å; F84-F122 AromaticContact CE2-CG 3.32Å; F84-F122 HydrophobicContact CE2-CG 3.32Å; F84-F122 HydrophobicContact CE2-CZ 4.09Å; F84-F122 AromaticContact CZ-CD2 3.64Å; F84-F122 HydrophobicContact CZ-CD2 3.64Å; F84-F122 AromaticContact CZ-CE2 3.81Å; F84-F122 HydrophobicContact CZ-CE2 3.81Å; F84-F122 HydrophobicContact CZ-CG 4.15Å; F84-F122 HydrophobicContact CZ-CZ 4.45Å; F122-L124 HydrophobicContact CE1-CB 4.05Å; F122-L124 HydrophobicContact CE1-CD1 4.24Å; F122-L124 HydrophobicContact CZ-CB 4.13Å; F122-L124 HydrophobicContact CZ-CD1 3.85Å; F122-V129 HydrophobicContact CB-CG2 4.42Å; F122-V129 HydrophobicContact CD2-CG2 3.76Å; F122-T143 HydrophobicContact CD2-CG2 4.23Å; F122-T143 HydrophobicContact CE2-CG2 3.94Å
123	S	92.8	Very high	93.6	Very high	12 Å²	12	35.8 Å²	35.8	8%	0.084	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.3	174.2	164.1	0	0	0	0	108.9	S126 E127 W128 H165	S123-S126 WeakPolarHBondContact CB-OG 3.43Å; S123-S126 PolarHBondContact OG-N 3.03Å; S123-S126 PolarHBondContact OG-OG 2.99Å; S123-E127 VanDerWaalsContact O-CA 3.23Å; S123-E127 WeakPolarHBondContact O-CA 3.48Å; S123-E127 PolarHBondContact O-N 3.46Å; S123-W128 PolarHBondContact N-O 2.86Å; S123-W128 PolarHBondContact O-N 3.06Å; S123-H165 WeakPolarHBondContact OG-CB 3.36Å
124	L	89.3	Confident	93.6	Very high	69 Å²	69	37.4 Å²	37.4	36%	0.361	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-41.7	178.4	-175.1	67.2	0	0	0	111.5	F122 S126 E127	F122-L124 HydrophobicContact CE1-CB 4.05Å; F122-L124 HydrophobicContact CE1-CD1 4.24Å; F122-L124 HydrophobicContact CZ-CB 4.13Å; F122-L124 HydrophobicContact CZ-CD1 3.85Å; L124-S126 PolarHBondContact O-N 2.77Å; L124-E127 WeakPolarHBondContact O-CG 3.14Å; L124-E127 PolarHBondContact O-N 3.4Å; L124-E127 VanDerWaalsContact O-N 3.14Å
125	E	88.7	Confident	93.6	Very high	156 Å²	156	31.1 Å²	31.1	73%	0.729	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-40.3	-176.5	-67.2	-65.8	166	0	0	112.9
126	S	87.1	Confident	93.6	Very high	22 Å²	22	31.8 Å²	31.8	15%	0.154	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-12.4	174.4	61.2	0	0	0	0	112.9	S123 L124 W128	S123-S126 WeakPolarHBondContact CB-OG 3.43Å; S123-S126 PolarHBondContact OG-N 3.03Å; S123-S126 PolarHBondContact OG-OG 2.99Å; L124-S126 PolarHBondContact O-N 2.77Å; S126-W128 PolarHBondContact O-N 3.29Å; S126-W128 PolarHBondContact O-NE1 2.94Å; S126-W128 VanDerWaalsContact O-NE1 3.12Å
127	E	90.8	Very high	93.6	Very high	60 Å²	60	28.2 Å²	28.2	28%	0.28	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	30.4	-171.1	-62.9	-179.2	128.3	0	0	113.4	S123 L124 T143 Q144	S123-E127 VanDerWaalsContact O-CA 3.23Å; S123-E127 WeakPolarHBondContact O-CA 3.48Å; S123-E127 PolarHBondContact O-N 3.46Å; L124-E127 WeakPolarHBondContact O-CG 3.14Å; L124-E127 PolarHBondContact O-N 3.4Å; L124-E127 VanDerWaalsContact O-N 3.14Å; E127-T143 WeakPolarHBondContact CB-OG1 3.23Å; E127-T143 WeakPolarHBondContact O-CB 3.27Å; E127-T143 WeakPolarHBondContact O-CG2 3.23Å; E127-T143 PolarHBondContact O-N 2.99Å; E127-T143 PolarHBondContact O-OG1 2.91Å; E127-Q144 VanDerWaalsContact CD-CG 3.49Å; E127-Q144 WeakPolarHBondContact OE1-CG 3.49Å; E127-Q144 PolarHBondContact OE1-NE2 3.14Å; E127-Q144 WeakPolarHBondContact OE2-CG 3.31Å; E127-Q144 PolarHBondContact OE2-NE2 2.79Å
128	W	93.4	Very high	93.6	Very high	15 Å²	15	28.2 Å²	28.2	6%	0.057	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	141.9	179.5	-64.9	0.5	0	0	0	110.8	S123 S126 W140 M141 L149 L184 K186	S123-W128 PolarHBondContact N-O 2.86Å; S123-W128 PolarHBondContact O-N 3.06Å; S126-W128 PolarHBondContact O-N 3.29Å; S126-W128 PolarHBondContact O-NE1 2.94Å; S126-W128 VanDerWaalsContact O-NE1 3.12Å; W128-W140 AromaticContact CE3-CD1 3.95Å; W128-M141 WeakPolarHBondContact CA-O 3.31Å; W128-L149 HydrophobicContact CD2-CD1 3.85Å; W128-L149 VanDerWaalsContact CE2-CD1 3.44Å; W128-L149 HydrophobicContact CG-CD1 3.98Å; W128-L149 HydrophobicContact CZ2-CD1 4Å; W128-L149 VanDerWaalsContact NE1-CD1 3.28Å; W128-L184 HydrophobicContact CZ3-CB 3.9Å; W128-K186 HydrophobicContact CZ2-CG 3.88Å
129	V	94.9	Very high	93.6	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.012	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121	160	175.9	0	0	0	0	106.8	F84 V92 M120 F122 W140 M141 T143	F84-V129 HydrophobicContact CD1-CG2 3.52Å; F84-V129 HydrophobicContact CD2-CG2 4.31Å; F84-V129 HydrophobicContact CE1-CG2 3.37Å; F84-V129 HydrophobicContact CE2-CG2 4.19Å; F84-V129 HydrophobicContact CG-CG2 4Å; F84-V129 HydrophobicContact CZ-CG2 3.73Å; V92-V129 HydrophobicContact CG1-CG1 4.14Å; M120-V129 HydrophobicContact CG-CG1 3.82Å; M120-V129 HydrophobicContact SD-CG1 3.65Å; F122-V129 HydrophobicContact CB-CG2 4.42Å; F122-V129 HydrophobicContact CD2-CG2 3.76Å; V129-W140 CarbonylContact O-C 3.6Å; V129-W140 VanDerWaalsContact O-CA 3.31Å; V129-W140 WeakPolarHBondContact O-CA 3.43Å; V129-M141 PolarHBondContact N-O 2.88Å; V129-M141 PolarHBondContact O-N 2.95Å; V129-T143 HydrophobicContact CB-CG2 4.48Å; V129-T143 HydrophobicContact CG2-CG2 3.49Å; V129-T143 VanDerWaalsContact CG2-CG2 3.49Å
130	V	96.1	Very high	93.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.1	174	-171.1	0	0	0	0	106.9	M120 V121 V138 S139 W140 L161 Y163 L184	M120-V130 CarbonylContact C-O 3.54Å; M120-V130 VanDerWaalsContact CA-O 3.3Å; M120-V130 WeakPolarHBondContact CA-O 3.47Å; V121-V130 PolarHBondContact N-O 3.39Å; V121-V130 PolarHBondContact O-N 3.01Å; V130-V138 HydrophobicContact CG1-CG2 3.77Å; V130-S139 WeakPolarHBondContact CA-O 3.5Å; V130-W140 HydrophobicContact CB-CB 4.46Å; V130-W140 HydrophobicContact CG1-CB 4.4Å; V130-W140 HydrophobicContact CG2-CB 3.93Å; V130-L161 HydrophobicContact CB-CD2 3.84Å; V130-L161 HydrophobicContact CG1-CD1 4Å; V130-L161 HydrophobicContact CG1-CD2 3.64Å; V130-L161 HydrophobicContact CG1-CG 4.44Å; V130-L161 WeakPolarHBondContact O-CD2 3.42Å; V130-Y163 HydrophobicContact CG2-CD2 4.28Å; V130-Y163 HydrophobicContact CG2-CG 4.22Å; V130-L184 HydrophobicContact CG1-CD1 4.05Å; V130-L184 HydrophobicContact CG2-CD1 4.06Å
131	S	96.3	Very high	93.6	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.007	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	150.9	-179.1	61.7	0	0	0	0	111.4	H113 G119 V138 S139	H113-S131 PolarHBondContact CD2-OG 2.89Å; H113-S131 VanDerWaalsContact NE2-C 3.34Å; H113-S131 PolarHBondContact NE2-O 3.01Å; H113-S131 PolarHBondContact NE2-OG 3.44Å; G119-S131 CarbonylContact O-C 3.5Å; G119-S131 WeakPolarHBondContact O-CA 3.31Å; S131-V138 CarbonylContact O-C 3.54Å; S131-V138 VanDerWaalsContact O-CA 3.32Å; S131-V138 WeakPolarHBondContact O-CA 3.47Å; S131-V138 WeakPolarHBondContact O-CG2 3.33Å; S131-S139 PolarHBondContact N-O 3.08Å; S131-S139 PolarHBondContact O-N 2.9Å; S131-S139 PolarHBondContact OG-OG 2.85Å
132	T	96	Very high	93.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	147.1	178.2	47.2	0	0	0	0	109.2	V117 S118 G119 V138 A158 L161 I172	V117-T132 CarbonylContact C-O 3.56Å; V117-T132 WeakPolarHBondContact CA-O 3.45Å; V117-T132 WeakPolarHBondContact CG1-O 3.45Å; S118-T132 PolarHBondContact N-O 2.95Å; S118-T132 PolarHBondContact OG-O 2.57Å; S118-T132 VanDerWaalsContact OG-O 3.13Å; S118-T132 PolarHBondContact OG-OG1 3.11Å; G119-T132 WeakPolarHBondContact CA-OG1 3.38Å; G119-T132 PolarHBondContact N-OG1 2.91Å; G119-T132 VanDerWaalsContact N-OG1 3.16Å; G119-T132 PolarHBondContact O-N 3.37Å; G119-T132 PolarHBondContact O-OG1 3.08Å; T132-V138 HydrophobicContact CG2-CB 3.96Å; T132-V138 HydrophobicContact CG2-CG2 3.8Å; T132-A158 HydrophobicContact CG2-CB 3.89Å; T132-L161 HydrophobicContact CG2-CB 3.92Å; T132-L161 HydrophobicContact CG2-CD1 4.18Å; T132-L161 HydrophobicContact CG2-CD2 4.3Å; T132-L161 HydrophobicContact CG2-CG 4.36Å; T132-I172 HydrophobicContact CG2-CG1 4.3Å; T132-I172 HydrophobicContact CG2-CG2 4.03Å
133	G	94.9	Very high	93.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162.8	-174.4	0	0	0	0	0	114.7	R116 D135 K136 S137	R116-G133 WeakPolarHBondContact O-CA 3.42Å; G133-D135 PolarHBondContact O-N 2.99Å; G133-K136 PolarHBondContact O-N 2.84Å; G133-S137 PolarHBondContact N-O 2.92Å
134	H	94.6	Very high	93.1	Very high	46 Å²	46	31 Å²	31	21%	0.213	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-7.9	173.5	-71.5	-164.5	0	0	0	113.2	N115 R116 K136 W157	N115-H134 HydrophobicContact CB-CB 3.78Å; R116-H134 HydrophobicContact CB-CB 4.37Å; R116-H134 PolarHBondContact O-N 3.26Å; H134-K136 PolarHBondContact O-N 3.32Å; H134-W157 HydrophobicContact CB-CE3 3.68Å; H134-W157 HydrophobicContact CB-CZ3 4.35Å; H134-W157 AromaticContact CD2-CE3 3.29Å; H134-W157 AromaticContact CD2-CZ3 3.7Å; H134-W157 AromaticContact CE1-CE3 3.49Å; H134-W157 VanDerWaalsContact CE1-CE3 3.49Å; H134-W157 AromaticContact CE1-CH2 3.9Å; H134-W157 AromaticContact CE1-CZ3 3Å; H134-W157 WeakPolarHBondContact CE1-CZ3 3.3Å; H134-W157 AromaticContact CG-CE3 3.17Å; H134-W157 AromaticContact CG-CZ3 3.53Å; H134-W157 AromaticContact ND1-CE3 3.31Å; H134-W157 VanDerWaalsContact ND1-CE3 3.31Å; H134-W157 AromaticContact ND1-CZ3 3.09Å; H134-W157 WeakPolarHBondContact ND1-CZ3 3.38Å; H134-W157 AromaticContact NE2-CE3 3.51Å; H134-W157 AromaticContact NE2-CZ3 3.41Å; H134-W157 WeakPolarHBondContact NE2-CZ3 3.39Å
135	D	93.5	Very high	93	Very high	19 Å²	19	31.2 Å²	31.2	10%	0.102	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	11.5	170.1	66.8	0.1	0	0	0	113.2	H113 Q114 N115 G133 S137	H113-D135 WeakPolarHBondContact CA-OD2 3.42Å; H113-D135 VanDerWaalsContact CB-OD2 3.29Å; H113-D135 WeakPolarHBondContact CB-OD2 3.1Å; H113-D135 IonicContact CE1-OD1 3.23Å; H113-D135 IonicContact CG-OD1 3.54Å; H113-D135 IonicContact CG-OD2 3.92Å; H113-D135 IonicContact ND1-OD1 3.62Å; H113-D135 PolarHBondContact ND1-OD1 2.92Å; H113-D135 IonicContact ND1-OD2 3.01Å; H113-D135 PolarHBondContact ND1-OD2 3.38Å; Q114-D135 HydrophobicContact CB-CB 4.29Å; Q114-D135 PolarHBondContact N-OD2 2.89Å; N115-D135 HydrophobicContact CB-CB 4.3Å; G133-D135 PolarHBondContact O-N 2.99Å; D135-S137 PolarHBondContact O-N 3.07Å; D135-S137 WeakPolarHBondContact OD1-CB 3.44Å; D135-S137 PolarHBondContact OD1-N 2.78Å; D135-S137 VanDerWaalsContact OD1-N 3.09Å; D135-S137 PolarHBondContact OD1-OG 2.98Å; D135-S137 PolarHBondContact OD2-OG 3.29Å
136	K	94.3	Very high	92.8	Very high	98 Å²	98	24.9 Å²	24.9	43%	0.426	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	30	-179.7	-42	-178.7	174.5	-169.6	0	112.8	G133 H134 Y153 F154 T155 W157	G133-K136 PolarHBondContact O-N 2.84Å; H134-K136 PolarHBondContact O-N 3.32Å; K136-Y153 CarbonylContact O-C 3.55Å; K136-Y153 WeakPolarHBondContact O-CA 3.11Å; K136-F154 WeakPolarHBondContact CB-O 3.39Å; K136-F154 PolarHBondContact O-N 3.07Å; K136-T155 WeakPolarHBondContact CD-O 3.49Å; K136-T155 PolarHBondContact NZ-O 3.19Å; K136-W157 HydrophobicContact CG-CB 4.35Å
137	S	94.5	Very high	92.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	153	178.2	76.4	0	0	0	0	113	H113 G133 D135 H152	H113-S137 PolarHBondContact CE1-O 2.85Å; H113-S137 VanDerWaalsContact CE1-O 3.31Å; H113-S137 PolarHBondContact CE1-OG 3.39Å; H113-S137 PolarHBondContact ND1-OG 2.8Å; H113-S137 VanDerWaalsContact ND1-OG 3.11Å; G133-S137 PolarHBondContact N-O 2.92Å; D135-S137 PolarHBondContact O-N 3.07Å; D135-S137 WeakPolarHBondContact OD1-CB 3.44Å; D135-S137 PolarHBondContact OD1-N 2.78Å; D135-S137 VanDerWaalsContact OD1-N 3.09Å; D135-S137 PolarHBondContact OD1-OG 2.98Å; D135-S137 PolarHBondContact OD2-OG 3.29Å; S137-H152 CarbonylContact C-O 3.53Å; S137-H152 WeakPolarHBondContact CA-O 3.5Å; S137-H152 WeakPolarHBondContact CB-O 3.15Å
138	V	95.3	Very high	93	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	132.4	158.9	61.7	0	0	0	0	107.3	V130 S131 T132 R151 H152 F154 L161 I172 L182	V130-V138 HydrophobicContact CG1-CG2 3.77Å; S131-V138 CarbonylContact O-C 3.54Å; S131-V138 VanDerWaalsContact O-CA 3.32Å; S131-V138 WeakPolarHBondContact O-CA 3.47Å; S131-V138 WeakPolarHBondContact O-CG2 3.33Å; T132-V138 HydrophobicContact CG2-CB 3.96Å; T132-V138 HydrophobicContact CG2-CG2 3.8Å; V138-R151 CarbonylContact O-C 3.58Å; V138-R151 VanDerWaalsContact O-CA 3.28Å; V138-R151 WeakPolarHBondContact O-CA 3.33Å; V138-R151 WeakPolarHBondContact O-CG 3.34Å; V138-H152 HydrophobicContact CG1-CB 3.8Å; V138-H152 PolarHBondContact N-O 2.92Å; V138-H152 PolarHBondContact O-N 3.36Å; V138-F154 HydrophobicContact CB-CE2 3.87Å; V138-F154 HydrophobicContact CB-CZ 4.47Å; V138-F154 HydrophobicContact CG1-CE2 3.56Å; V138-F154 HydrophobicContact CG1-CZ 3.85Å; V138-L161 HydrophobicContact CG2-CD1 4.5Å; V138-I172 HydrophobicContact CB-CG1 4.4Å; V138-I172 HydrophobicContact CG2-CG1 4.27Å; V138-L182 HydrophobicContact CG1-CD1 3.83Å
139	S	94.8	Very high	92.9	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	146.5	175.6	67.3	0	0	0	0	109.8	A112 H113 V130 S131 G150	A112-S139 PolarHBondContact O-OG 2.83Å; H113-S139 PolarHBondContact NE2-OG 3.04Å; H113-S139 VanDerWaalsContact NE2-OG 3.15Å; V130-S139 WeakPolarHBondContact CA-O 3.5Å; S131-S139 PolarHBondContact N-O 3.08Å; S131-S139 PolarHBondContact O-N 2.9Å; S131-S139 PolarHBondContact OG-OG 2.85Å; S139-G150 WeakPolarHBondContact CA-O 3.25Å
140	W	94.9	Very high	92.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.8	171	58.9	107.5	0	0	0	109.7	W128 V129 V130 L149 G150 L184 E185 Y189	W128-W140 AromaticContact CE3-CD1 3.95Å; V129-W140 CarbonylContact O-C 3.6Å; V129-W140 VanDerWaalsContact O-CA 3.31Å; V129-W140 WeakPolarHBondContact O-CA 3.43Å; V130-W140 HydrophobicContact CB-CB 4.46Å; V130-W140 HydrophobicContact CG1-CB 4.4Å; V130-W140 HydrophobicContact CG2-CB 3.93Å; W140-L149 HydrophobicContact CG-CB 4.22Å; W140-L149 WeakPolarHBondContact O-CB 3.5Å; W140-L149 PolarHBondContact O-N 3.47Å; W140-G150 PolarHBondContact N-O 3.34Å; W140-G150 VanDerWaalsContact N-O 3.12Å; W140-G150 PolarHBondContact O-N 3.28Å; W140-L184 HydrophobicContact CB-CD1 4.5Å; W140-L184 HydrophobicContact CD2-CD1 4.34Å; W140-L184 HydrophobicContact CD2-CD2 4.27Å; W140-L184 HydrophobicContact CE3-CD1 4.34Å; W140-L184 HydrophobicContact CE3-CD2 3.91Å; W140-L184 HydrophobicContact CG-CD1 4.41Å; W140-L184 HydrophobicContact CH2-CD2 4.09Å; W140-L184 HydrophobicContact CZ2-CD2 4.4Å; W140-L184 HydrophobicContact CZ3-CD2 3.82Å; W140-E185 PolarHBondContact NE1-O 2.88Å; W140-Y189 AromaticContact CH2-CD1 3.9Å; W140-Y189 HydrophobicContact CH2-CD1 3.9Å; W140-Y189 HydrophobicContact CH2-CG 4.19Å
141	M	93.6	Very high	92.6	Very high	7 Å²	7	32.1 Å²	32.1	3%	0.034	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.8	-171.9	-55.8	-169.3	122.4	0	0	110	Y110 A112 W128 V129 M148	Y110-M141 VanDerWaalsContact CB-SD 3.58Å; Y110-M141 HydrophobicContact CD1-CB 4.13Å; Y110-M141 HydrophobicContact CD1-SD 3.79Å; Y110-M141 HydrophobicContact CE1-CB 4.48Å; Y110-M141 HydrophobicContact CG-SD 4.1Å; A112-M141 HydrophobicContact CB-SD 3.92Å; W128-M141 WeakPolarHBondContact CA-O 3.31Å; V129-M141 PolarHBondContact N-O 2.88Å; V129-M141 PolarHBondContact O-N 2.95Å; M141-M148 HydrophobicContact CE-CB 3.57Å; M141-M148 HydrophobicContact CE-CG 3.89Å; M141-M148 HydrophobicContact CE-SD 4.17Å; M141-M148 HydrophobicContact CG-CG 4.45Å
142	C	92.6	Very high	92.4	Very high	19 Å²	19	33.2 Å²	33.2	13%	0.128	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	126.1	175.4	177.7	0	0	0	0	109.7	S145 G146 S147 L149	C142-S145 VanDerWaalsContact CB-OG 3.3Å; C142-S145 WeakPolarHBondContact CB-OG 3.4Å; C142-S145 PolarHBondContact SG-OG 2.92Å; C142-G146 VanDerWaalsContact O-CA 3.23Å; C142-G146 WeakPolarHBondContact O-CA 3.21Å; C142-G146 PolarHBondContact O-N 2.9Å; C142-S147 PolarHBondContact N-O 2.96Å; C142-L149 HydrophobicContact CB-CD1 3.99Å; C142-L149 HydrophobicContact CB-CD2 4.03Å; C142-L149 HydrophobicContact CB-CG 3.99Å
143	T	90.6	Very high	92.3	Very high	4 Å²	4	39.9 Å²	39.9	3%	0.025	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-39.4	-178	55.3	0	0	0	0	112.4	F84 K108 Y110 F122 E127 V129	F84-T143 HydrophobicContact CE1-CG2 3.98Å; F84-T143 HydrophobicContact CZ-CG2 3.83Å; K108-T143 PolarHBondContact NZ-O 2.84Å; Y110-T143 WeakPolarHBondContact OH-CA 3.31Å; Y110-T143 PolarHBondContact OH-O 2.95Å; F122-T143 HydrophobicContact CD2-CG2 4.23Å; F122-T143 HydrophobicContact CE2-CG2 3.94Å; E127-T143 WeakPolarHBondContact CB-OG1 3.23Å; E127-T143 WeakPolarHBondContact O-CB 3.27Å; E127-T143 WeakPolarHBondContact O-CG2 3.23Å; E127-T143 PolarHBondContact O-N 2.99Å; E127-T143 PolarHBondContact O-OG1 2.91Å; V129-T143 HydrophobicContact CB-CG2 4.48Å; V129-T143 HydrophobicContact CG2-CG2 3.49Å; V129-T143 VanDerWaalsContact CG2-CG2 3.49Å
144	Q	88.3	Confident	92.1	Very high	132 Å²	132	41.1 Å²	41.1	62%	0.617	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-61.6	176.2	-66.7	-169.5	-9.8	0	0	112	K108 E127	K108-Q144 PolarHBondContact NZ-O 2.96Å; E127-Q144 VanDerWaalsContact CD-CG 3.49Å; E127-Q144 WeakPolarHBondContact OE1-CG 3.49Å; E127-Q144 PolarHBondContact OE1-NE2 3.14Å; E127-Q144 WeakPolarHBondContact OE2-CG 3.31Å; E127-Q144 PolarHBondContact OE2-NE2 2.79Å
145	S	87.4	Confident	91.8	Very high	74 Å²	74	44.4 Å²	44.4	52%	0.517	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-28.3	-176.3	62.1	0	0	0	0	112.6	C142 S147	C142-S145 VanDerWaalsContact CB-OG 3.3Å; C142-S145 WeakPolarHBondContact CB-OG 3.4Å; C142-S145 PolarHBondContact SG-OG 2.92Å; S145-S147 PolarHBondContact OG-N 3.3Å; S145-S147 PolarHBondContact OG-OG 3.01Å
146	G	85.1	Confident	91.8	Very high	23 Å²	23	44.5 Å²	44.5	24%	0.237	24%	0.237	C	C	.	.			trans	78.8	2.9	-168.6	0	0	0	0	0	114.1	C142	C142-G146 VanDerWaalsContact O-CA 3.23Å; C142-G146 WeakPolarHBondContact O-CA 3.21Å; C142-G146 PolarHBondContact O-N 2.9Å
147	S	89.6	Confident	91.7	Very high	54 Å²	54	44 Å²	44	38%	0.378	23%	0.233	S	C	.	.			trans	-84.8	143	-175.7	62.8	0	0	0	0	112	C142 S145 L149	C142-S147 PolarHBondContact N-O 2.96Å; S145-S147 PolarHBondContact OG-N 3.3Å; S145-S147 PolarHBondContact OG-OG 3.01Å; S147-L149 PolarHBondContact O-N 3.15Å
148	M	91.7	Very high	91.6	Very high	96 Å²	96	44 Å²	44	47%	0.473	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	124.4	166.4	-169	165.2	57.9	0	0	109.5	M141	M141-M148 HydrophobicContact CE-CB 3.57Å; M141-M148 HydrophobicContact CE-CG 3.89Å; M141-M148 HydrophobicContact CE-SD 4.17Å; M141-M148 HydrophobicContact CG-CG 4.45Å
149	L	92.1	Very high	91.5	Very high	34 Å²	34	45.3 Å²	45.3	18%	0.178	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-43.8	-179.7	-70.9	179.2	0	0	0	110.8	W128 W140 C142 S147 K186	W128-L149 HydrophobicContact CD2-CD1 3.85Å; W128-L149 VanDerWaalsContact CE2-CD1 3.44Å; W128-L149 HydrophobicContact CG-CD1 3.98Å; W128-L149 HydrophobicContact CZ2-CD1 4Å; W128-L149 VanDerWaalsContact NE1-CD1 3.28Å; W140-L149 HydrophobicContact CG-CB 4.22Å; W140-L149 WeakPolarHBondContact O-CB 3.5Å; W140-L149 PolarHBondContact O-N 3.47Å; C142-L149 HydrophobicContact CB-CD1 3.99Å; C142-L149 HydrophobicContact CB-CD2 4.03Å; C142-L149 HydrophobicContact CB-CG 3.99Å; S147-L149 PolarHBondContact O-N 3.15Å; L149-K186 VanDerWaalsContact CB-O 3.27Å; L149-K186 WeakPolarHBondContact CB-O 3.5Å
150	G	91.1	Very high	91.4	Very high	13 Å²	13	45.9 Å²	45.9	13%	0.134	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.7	171.4	175.2	0	0	0	0	0	113	S139 W140	S139-G150 WeakPolarHBondContact CA-O 3.25Å; W140-G150 PolarHBondContact N-O 3.34Å; W140-G150 VanDerWaalsContact N-O 3.12Å; W140-G150 PolarHBondContact O-N 3.28Å
151	R	93.4	Very high	91.4	Very high	54 Å²	54	46.4 Å²	46.4	20%	0.204	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	139.2	177.5	-174.4	179.7	-73.9	176.2	-0.2	109.9	A112 V138 Y153	A112-R151 PolarHBondContact O-NH2 3.44Å; V138-R151 CarbonylContact O-C 3.58Å; V138-R151 VanDerWaalsContact O-CA 3.28Å; V138-R151 WeakPolarHBondContact O-CA 3.33Å; V138-R151 WeakPolarHBondContact O-CG 3.34Å; R151-Y153 VanDerWaalsContact CD-CZ 3.45Å; R151-Y153 VanDerWaalsContact CD-OH 3.27Å; R151-Y153 WeakPolarHBondContact CD-OH 3.14Å; R151-Y153 HydrophobicContact CG-CE2 4.24Å; R151-Y153 PolarHBondContact NH1-OH 2.92Å
152	H	92.9	Very high	91.5	Very high	25 Å²	25	47.9 Å²	47.9	12%	0.116	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141.9	171.4	173.3	-103.5	0	0	0	109.9	S137 V138 F154 L182 Y189	S137-H152 CarbonylContact C-O 3.53Å; S137-H152 WeakPolarHBondContact CA-O 3.5Å; S137-H152 WeakPolarHBondContact CB-O 3.15Å; V138-H152 HydrophobicContact CG1-CB 3.8Å; V138-H152 PolarHBondContact N-O 2.92Å; V138-H152 PolarHBondContact O-N 3.36Å; H152-F154 AromaticContact CE1-CD1 3.55Å; H152-F154 AromaticContact CE1-CE1 3.36Å; H152-F154 WeakPolarHBondContact CE1-CE1 3.03Å; H152-F154 AromaticContact CE1-CZ 3.85Å; H152-F154 AromaticContact ND1-CD1 3.74Å; H152-F154 AromaticContact ND1-CE1 3.3Å; H152-F154 VanDerWaalsContact ND1-CE1 3.3Å; H152-F154 WeakPolarHBondContact ND1-CE1 3.11Å; H152-F154 AromaticContact ND1-CE2 3.65Å; H152-F154 AromaticContact ND1-CZ 3.26Å; H152-F154 VanDerWaalsContact ND1-CZ 3.26Å; H152-F154 WeakPolarHBondContact ND1-CZ 3.07Å; H152-L182 HydrophobicContact CB-CD1 4.21Å; H152-Y189 HydrophobicContact CB-CD1 4.42Å; H152-Y189 HydrophobicContact CB-CD2 4.41Å; H152-Y189 HydrophobicContact CB-CE1 4.32Å; H152-Y189 HydrophobicContact CB-CE2 4.34Å; H152-Y189 HydrophobicContact CB-CG 4.47Å; H152-Y189 AromaticContact CD2-CD2 3.89Å; H152-Y189 AromaticContact CD2-CE2 3.17Å; H152-Y189 WeakPolarHBondContact CD2-CE2 3.42Å; H152-Y189 AromaticContact CD2-CZ 3.37Å; H152-Y189 PolarHBondContact CD2-OH 3.44Å; H152-Y189 AromaticContact CG-CE2 3.95Å; H152-Y189 AromaticContact NE2-CE2 3.88Å
153	Y	93.1	Very high	91.6	Very high	140 Å²	140	47.8 Å²	47.8	55%	0.549	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.4	179.7	-67.2	-83.8	0	0	0	111.1	K136 R151	K136-Y153 CarbonylContact O-C 3.55Å; K136-Y153 WeakPolarHBondContact O-CA 3.11Å; R151-Y153 VanDerWaalsContact CD-CZ 3.45Å; R151-Y153 VanDerWaalsContact CD-OH 3.27Å; R151-Y153 WeakPolarHBondContact CD-OH 3.14Å; R151-Y153 HydrophobicContact CG-CE2 4.24Å; R151-Y153 PolarHBondContact NH1-OH 2.92Å
154	F	91.3	Very high	91.7	Very high	26 Å²	26	47.9 Å²	47.9	11%	0.114	25%	0.253	C	S	.	.			trans	-110.3	166.8	177.3	-59	-82.1	0	0	0	110.6	K136 V138 H152 S156 A158 I172 T180 L182	K136-F154 WeakPolarHBondContact CB-O 3.39Å; K136-F154 PolarHBondContact O-N 3.07Å; V138-F154 HydrophobicContact CB-CE2 3.87Å; V138-F154 HydrophobicContact CB-CZ 4.47Å; V138-F154 HydrophobicContact CG1-CE2 3.56Å; V138-F154 HydrophobicContact CG1-CZ 3.85Å; H152-F154 AromaticContact CE1-CD1 3.55Å; H152-F154 AromaticContact CE1-CE1 3.36Å; H152-F154 WeakPolarHBondContact CE1-CE1 3.03Å; H152-F154 AromaticContact CE1-CZ 3.85Å; H152-F154 AromaticContact ND1-CD1 3.74Å; H152-F154 AromaticContact ND1-CE1 3.3Å; H152-F154 VanDerWaalsContact ND1-CE1 3.3Å; H152-F154 WeakPolarHBondContact ND1-CE1 3.11Å; H152-F154 AromaticContact ND1-CE2 3.65Å; H152-F154 AromaticContact ND1-CZ 3.26Å; H152-F154 VanDerWaalsContact ND1-CZ 3.26Å; H152-F154 WeakPolarHBondContact ND1-CZ 3.07Å; F154-S156 VanDerWaalsContact C-N 3.34Å; F154-S156 WeakPolarHBondContact CB-O 3.41Å; F154-A158 HydrophobicContact CD2-CB 4.47Å; F154-I172 HydrophobicContact CE2-CG2 3.94Å; F154-I172 HydrophobicContact CZ-CB 3.98Å; F154-I172 HydrophobicContact CZ-CD1 4.27Å; F154-I172 HydrophobicContact CZ-CG1 4.08Å; F154-I172 HydrophobicContact CZ-CG2 3.87Å; F154-T180 HydrophobicContact CE1-CG2 3.95Å; F154-L182 HydrophobicContact CE1-CD1 4.42Å; F154-L182 HydrophobicContact CZ-CD1 3.87Å
155	T	88.3	Confident	91.8	Very high	115 Å²	115	45.6 Å²	45.6	71%	0.706	24%	0.241	S	C	*	.	S	Bend	trans	-71.6	-33.2	176.1	53	0	0	0	0	112.1	K136	K136-T155 WeakPolarHBondContact CD-O 3.49Å; K136-T155 PolarHBondContact NZ-O 3.19Å
156	S	92	Very high	91.8	Very high	21 Å²	21	49.3 Å²	49.3	15%	0.147	25%	0.251	C	S	.	.	S	Bend	trans	-119.3	159.2	178.1	-159.7	0	0	0	0	110.7	F154	F154-S156 VanDerWaalsContact C-N 3.34Å; F154-S156 WeakPolarHBondContact CB-O 3.41Å
157	W	93.1	Very high	92	Very high	88 Å²	88	50.6 Å²	50.6	33%	0.333	25%	0.254	S	S	.	.			trans	-60.6	139.1	171.4	54.5	-17.7	0	0	0	112.3	H134 K136 Y175	H134-W157 HydrophobicContact CB-CE3 3.68Å; H134-W157 HydrophobicContact CB-CZ3 4.35Å; H134-W157 AromaticContact CD2-CE3 3.29Å; H134-W157 AromaticContact CD2-CZ3 3.7Å; H134-W157 AromaticContact CE1-CE3 3.49Å; H134-W157 VanDerWaalsContact CE1-CE3 3.49Å; H134-W157 AromaticContact CE1-CH2 3.9Å; H134-W157 AromaticContact CE1-CZ3 3Å; H134-W157 WeakPolarHBondContact CE1-CZ3 3.3Å; H134-W157 AromaticContact CG-CE3 3.17Å; H134-W157 AromaticContact CG-CZ3 3.53Å; H134-W157 AromaticContact ND1-CE3 3.31Å; H134-W157 VanDerWaalsContact ND1-CE3 3.31Å; H134-W157 AromaticContact ND1-CZ3 3.09Å; H134-W157 WeakPolarHBondContact ND1-CZ3 3.38Å; H134-W157 AromaticContact NE2-CE3 3.51Å; H134-W157 AromaticContact NE2-CZ3 3.41Å; H134-W157 WeakPolarHBondContact NE2-CZ3 3.39Å; K136-W157 HydrophobicContact CG-CB 4.35Å; W157-Y175 AromaticContact CD1-CG 3.62Å; W157-Y175 AromaticContact CE2-CD2 3.58Å; W157-Y175 AromaticContact CE2-CG 3.67Å; W157-Y175 AromaticContact CZ2-CD2 3.49Å; W157-Y175 HydrophobicContact CZ2-CD2 3.49Å; W157-Y175 VanDerWaalsContact CZ2-CD2 3.49Å; W157-Y175 AromaticContact CZ2-CE2 3.61Å; W157-Y175 HydrophobicContact CZ2-CE2 3.61Å; W157-Y175 HydrophobicContact CZ2-CG 4.04Å; W157-Y175 AromaticContact NE1-CD1 3.24Å; W157-Y175 AromaticContact NE1-CD2 3.28Å; W157-Y175 VanDerWaalsContact NE1-CD2 3.28Å; W157-Y175 AromaticContact NE1-CE1 3.96Å; W157-Y175 AromaticContact NE1-CG 2.86Å; W157-Y175 PolarHBondContact O-N 2.95Å
158	A	93.3	Very high	92.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	132	177	0	0	0	0	0	108.9	S118 T132 F154 I172	S118-A158 VanDerWaalsContact CB-O 3.32Å; S118-A158 WeakPolarHBondContact CB-O 3.36Å; S118-A158 PolarHBondContact OG-O 2.86Å; T132-A158 HydrophobicContact CG2-CB 3.89Å; F154-A158 HydrophobicContact CD2-CB 4.47Å; A158-I172 HydrophobicContact CB-CG2 3.62Å
159	S	92.4	Very high	92.2	Very high	27 Å²	27	48.8 Å²	48.8	19%	0.189	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-32.1	-173.6	51	0	0	0	0	113	S118 G173 I202	S118-S159 WeakPolarHBondContact CB-O 3.35Å; S159-G173 PolarHBondContact N-O 3.29Å; S159-G173 PolarHBondContact OG-O 3.22Å; S159-G173 VanDerWaalsContact OG-O 3.09Å; S159-I202 WeakPolarHBondContact CB-O 3.36Å; S159-I202 PolarHBondContact OG-O 2.94Å
160	C	92.7	Very high	92.3	Very high	11 Å²	11	47.2 Å²	47.2	7%	0.074	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	161	-175.5	57.3	0	0	0	0	111.6	G173 I202	C160-G173 PolarHBondContact N-O 3.37Å; C160-G173 PolarHBondContact O-N 3.12Å; C160-I202 WeakPolarHBondContact SG-CG2 3.24Å
161	L	95.2	Very high	92.5	Very high	11 Å²	11	46.7 Å²	46.7	6%	0.058	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	140.2	-170.3	173.9	71.1	0	0	0	110.7	V121 V130 T132 V138 A170 F171 I172	V121-L161 HydrophobicContact CB-CD2 4.34Å; V121-L161 HydrophobicContact CG2-CD2 4.12Å; V121-L161 HydrophobicContact CG2-CG 4.09Å; V130-L161 HydrophobicContact CB-CD2 3.84Å; V130-L161 HydrophobicContact CG1-CD1 4Å; V130-L161 HydrophobicContact CG1-CD2 3.64Å; V130-L161 HydrophobicContact CG1-CG 4.44Å; V130-L161 WeakPolarHBondContact O-CD2 3.42Å; T132-L161 HydrophobicContact CG2-CB 3.92Å; T132-L161 HydrophobicContact CG2-CD1 4.18Å; T132-L161 HydrophobicContact CG2-CD2 4.3Å; T132-L161 HydrophobicContact CG2-CG 4.36Å; V138-L161 HydrophobicContact CG2-CD1 4.5Å; L161-A170 HydrophobicContact CD1-CB 4.25Å; L161-F171 CarbonylContact C-O 3.5Å; L161-F171 WeakPolarHBondContact CA-O 3.37Å; L161-I172 HydrophobicContact CD1-CD1 4.34Å; L161-I172 HydrophobicContact CD1-CG1 3.8Å
162	Q	95.4	Very high	92.6	Very high	38 Å²	38	44.2 Å²	44.2	18%	0.178	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	145	161.2	-73.4	-65.7	-13.7	0	0	109.6	A170 F171 L205 W207	Q162-A170 CarbonylContact O-C 3.53Å; Q162-A170 WeakPolarHBondContact O-CA 3.39Å; Q162-F171 HydrophobicContact CB-CB 4.38Å; Q162-F171 HydrophobicContact CB-CD2 4.35Å; Q162-F171 PolarHBondContact N-O 3.11Å; Q162-F171 PolarHBondContact O-N 3.06Å; Q162-L205 HydrophobicContact CG-CB 3.86Å; Q162-L205 VanDerWaalsContact CG-O 3.29Å; Q162-L205 WeakPolarHBondContact CG-O 3.23Å; Q162-L205 PolarHBondContact NE2-O 3.27Å; Q162-W207 HydrophobicContact CB-CB 4.17Å
163	Y	94.8	Very high	92.7	Very high	18 Å²	18	43 Å²	43	7%	0.071	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	131.1	179.9	176.8	-107.8	0	0	0	111	V130 H165 H169 A170 L184	V130-Y163 HydrophobicContact CG2-CD2 4.28Å; V130-Y163 HydrophobicContact CG2-CG 4.22Å; Y163-H165 HydrophobicContact CE1-CB 3.94Å; Y163-H169 WeakPolarHBondContact CA-O 3.39Å; Y163-H169 WeakPolarHBondContact CD2-O 3.32Å; Y163-A170 HydrophobicContact CD2-CB 4.12Å; Y163-L184 HydrophobicContact CD2-CD1 4.15Å; Y163-L184 HydrophobicContact CE2-CD1 4.03Å
164	D	93.7	Very high	92.7	Very high	6 Å²	6	36.5 Å²	36.5	3%	0.032	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.5	172.6	-176.3	2.8	0	0	0	109.5	E166 T167 Q168 H169 W207	D164-E166 PolarHBondContact OD1-N 2.83Å; D164-E166 VanDerWaalsContact OD1-N 3.17Å; D164-T167 WeakPolarHBondContact OD2-CG2 3.41Å; D164-T167 PolarHBondContact OD2-OG1 2.75Å; D164-Q168 CarbonylContact O-C 3.53Å; D164-Q168 WeakPolarHBondContact O-CA 3.46Å; D164-Q168 PolarHBondContact O-N 3.03Å; D164-H169 PolarHBondContact N-O 3.29Å; D164-H169 PolarHBondContact O-N 3.07Å; D164-W207 PolarHBondContact OD2-NE1 3.02Å
165	H	88.7	Confident	92.8	Very high	83 Å²	83	41.3 Å²	41.3	38%	0.384	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-32.7	-176.6	65.7	-70.7	0	0	0	112.9	S123 Y163	S123-H165 WeakPolarHBondContact OG-CB 3.36Å; Y163-H165 HydrophobicContact CE1-CB 3.94Å
166	E	88.5	Confident	92.9	Very high	152 Å²	152	38.3 Å²	38.3	71%	0.71	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-42	-178.9	-66.2	-171	169.4	0	0	110.9	D164	D164-E166 PolarHBondContact OD1-N 2.83Å; D164-E166 VanDerWaalsContact OD1-N 3.17Å
167	T	88.7	Confident	92.8	Very high	51 Å²	51	37.3 Å²	37.3	31%	0.313	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-7.1	-175.8	69.2	0	0	0	0	113	D164 H169	D164-T167 WeakPolarHBondContact OD2-CG2 3.41Å; D164-T167 PolarHBondContact OD2-OG1 2.75Å; T167-H169 WeakPolarHBondContact CB-ND1 3.09Å; T167-H169 PolarHBondContact O-CE1 2.87Å; T167-H169 PolarHBondContact O-N 2.91Å; T167-H169 PolarHBondContact O-ND1 2.93Å; T167-H169 PolarHBondContact OG1-ND1 3.37Å
168	Q	91.3	Very high	92.8	Very high	71 Å²	71	35.7 Å²	35.7	33%	0.332	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	31.2	-175.7	-56.3	-175.4	-36	0	0	114	D164 K183 L184	D164-Q168 CarbonylContact O-C 3.53Å; D164-Q168 WeakPolarHBondContact O-CA 3.46Å; D164-Q168 PolarHBondContact O-N 3.03Å; Q168-K183 WeakPolarHBondContact O-CA 3.41Å; Q168-L184 WeakPolarHBondContact CB-O 3.27Å; Q168-L184 PolarHBondContact O-N 2.87Å
169	H	93.4	Very high	92.9	Very high	41 Å²	41	35.8 Å²	35.8	19%	0.19	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	134.5	177.7	-68.2	91.8	0	0	0	111.2	Y163 D164 T167 F171 L181 L182 I192	Y163-H169 WeakPolarHBondContact CA-O 3.39Å; Y163-H169 WeakPolarHBondContact CD2-O 3.32Å; D164-H169 PolarHBondContact N-O 3.29Å; D164-H169 PolarHBondContact O-N 3.07Å; T167-H169 WeakPolarHBondContact CB-ND1 3.09Å; T167-H169 PolarHBondContact O-CE1 2.87Å; T167-H169 PolarHBondContact O-N 2.91Å; T167-H169 PolarHBondContact O-ND1 2.93Å; T167-H169 PolarHBondContact OG1-ND1 3.37Å; H169-F171 HydrophobicContact CB-CE2 4.44Å; H169-F171 HydrophobicContact CB-CZ 4.43Å; H169-L181 HydrophobicContact CB-CD1 3.79Å; H169-L182 CarbonylContact C-O 3.51Å; H169-L182 WeakPolarHBondContact CA-O 3Å; H169-I192 WeakPolarHBondContact CD2-CD1 3.35Å; H169-I192 WeakPolarHBondContact NE2-CD1 3.29Å
170	A	94.6	Very high	92.9	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.9	169.2	0	0	0	0	0	109.8	L161 Q162 Y163 I172 L182 L184	L161-A170 HydrophobicContact CD1-CB 4.25Å; Q162-A170 CarbonylContact O-C 3.53Å; Q162-A170 WeakPolarHBondContact O-CA 3.39Å; Y163-A170 HydrophobicContact CD2-CB 4.12Å; A170-I172 HydrophobicContact CB-CD1 3.74Å; A170-L182 PolarHBondContact N-O 3.43Å; A170-L182 PolarHBondContact O-N 3Å; A170-L184 HydrophobicContact CB-CD1 3.74Å; A170-L184 HydrophobicContact CB-CD2 4.5Å; A170-L184 HydrophobicContact CB-CG 3.97Å
171	F	95.6	Very high	93	Very high	2 Å²	2	35 Å²	35	1%	0.009	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.2	171.7	-55	-83.7	0	0	0	108.1	L161 Q162 H169 L181 L205 W207 L214 I228	L161-F171 CarbonylContact C-O 3.5Å; L161-F171 WeakPolarHBondContact CA-O 3.37Å; Q162-F171 HydrophobicContact CB-CB 4.38Å; Q162-F171 HydrophobicContact CB-CD2 4.35Å; Q162-F171 PolarHBondContact N-O 3.11Å; Q162-F171 PolarHBondContact O-N 3.06Å; H169-F171 HydrophobicContact CB-CE2 4.44Å; H169-F171 HydrophobicContact CB-CZ 4.43Å; F171-L181 HydrophobicContact CD1-CD1 3.62Å; F171-L181 HydrophobicContact CE1-CD1 3.31Å; F171-L181 HydrophobicContact CE1-CD2 4.21Å; F171-L181 HydrophobicContact CE1-CG 4.22Å; F171-L181 HydrophobicContact CG-CD1 4.35Å; F171-L181 HydrophobicContact CZ-CD1 3.84Å; F171-L205 HydrophobicContact CB-CD1 4.26Å; F171-W207 HydrophobicContact CD2-CB 4.2Å; F171-W207 HydrophobicContact CD2-CD2 4.2Å; F171-W207 HydrophobicContact CD2-CE3 4.44Å; F171-W207 HydrophobicContact CD2-CG 4.11Å; F171-W207 HydrophobicContact CE1-CE3 4.29Å; F171-W207 HydrophobicContact CE1-CZ3 4.25Å; F171-W207 HydrophobicContact CE2-CB 4.19Å; F171-W207 AromaticContact CE2-CD1 3.97Å; F171-W207 AromaticContact CE2-CD2 3.36Å; F171-W207 HydrophobicContact CE2-CD2 3.36Å; F171-W207 AromaticContact CE2-CE2 3.65Å; F171-W207 AromaticContact CE2-CE3 3.7Å; F171-W207 HydrophobicContact CE2-CE3 3.7Å; F171-W207 AromaticContact CE2-CG 3.6Å; F171-W207 HydrophobicContact CE2-CG 3.6Å; F171-W207 HydrophobicContact CE2-CH2 4.45Å; F171-W207 HydrophobicContact CE2-CZ2 4.19Å; F171-W207 HydrophobicContact CE2-CZ3 4.25Å; F171-W207 AromaticContact CE2-NE1 3.98Å; F171-W207 AromaticContact CZ-CD2 3.68Å; F171-W207 HydrophobicContact CZ-CD2 3.68Å; F171-W207 AromaticContact CZ-CE2 3.82Å; F171-W207 AromaticContact CZ-CE3 3.6Å; F171-W207 HydrophobicContact CZ-CE3 3.6Å; F171-W207 HydrophobicContact CZ-CG 4.39Å; F171-W207 AromaticContact CZ-CH2 3.8Å; F171-W207 HydrophobicContact CZ-CH2 3.8Å; F171-W207 AromaticContact CZ-CZ2 3.88Å; F171-W207 HydrophobicContact CZ-CZ2 3.88Å; F171-W207 AromaticContact CZ-CZ3 3.69Å; F171-W207 HydrophobicContact CZ-CZ3 3.69Å; F171-L214 HydrophobicContact CB-CD1 4.04Å; F171-L214 HydrophobicContact CB-CD2 4.34Å; F171-L214 HydrophobicContact CD1-CD1 4.12Å; F171-L214 HydrophobicContact CD1-CD2 3.76Å; F171-L214 HydrophobicContact CD1-CG 4.49Å; F171-L214 HydrophobicContact CD2-CD1 4.21Å; F171-L214 HydrophobicContact CE1-CD2 4.41Å; F171-L214 HydrophobicContact CG-CD1 3.85Å; F171-L214 HydrophobicContact CG-CD2 4.21Å; F171-I228 HydrophobicContact CD1-CD1 4.12Å; F171-I228 HydrophobicContact CE1-CD1 3.36Å; F171-I228 HydrophobicContact CZ-CD1 4.06Å
172	I	95.6	Very high	93	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.8	-178.4	-59.9	88.7	0	0	0	108.6	T132 V138 F154 A158 L161 A170 I179 T180 L182	T132-I172 HydrophobicContact CG2-CG1 4.3Å; T132-I172 HydrophobicContact CG2-CG2 4.03Å; V138-I172 HydrophobicContact CB-CG1 4.4Å; V138-I172 HydrophobicContact CG2-CG1 4.27Å; F154-I172 HydrophobicContact CE2-CG2 3.94Å; F154-I172 HydrophobicContact CZ-CB 3.98Å; F154-I172 HydrophobicContact CZ-CD1 4.27Å; F154-I172 HydrophobicContact CZ-CG1 4.08Å; F154-I172 HydrophobicContact CZ-CG2 3.87Å; A158-I172 HydrophobicContact CB-CG2 3.62Å; L161-I172 HydrophobicContact CD1-CD1 4.34Å; L161-I172 HydrophobicContact CD1-CG1 3.8Å; A170-I172 HydrophobicContact CB-CD1 3.74Å; I172-I179 CarbonylContact O-C 3.54Å; I172-I179 VanDerWaalsContact O-CA 3.27Å; I172-I179 WeakPolarHBondContact O-CA 3.3Å; I172-T180 PolarHBondContact N-O 2.89Å; I172-T180 PolarHBondContact O-N 3.13Å; I172-L182 HydrophobicContact CD1-CB 4.23Å; I172-L182 HydrophobicContact CD1-CD1 3.71Å; I172-L182 HydrophobicContact CD1-CG 3.89Å
173	G	94.8	Very high	92.9	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134.9	170.4	0	0	0	0	0	110.1	S159 C160	S159-G173 PolarHBondContact N-O 3.29Å; S159-G173 PolarHBondContact OG-O 3.22Å; S159-G173 VanDerWaalsContact OG-O 3.09Å; C160-G173 PolarHBondContact N-O 3.37Å; C160-G173 PolarHBondContact O-N 3.12Å
174	D	93.3	Very high	92.8	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	170.5	175.6	80.6	7.2	0	0	0	112.3	S176 G177 Q178 I202	D174-S176 VanDerWaalsContact CG-OG 3.24Å; D174-S176 PolarHBondContact O-N 3.44Å; D174-S176 VanDerWaalsContact OD1-C 3.29Å; D174-S176 VanDerWaalsContact OD1-CA 3.29Å; D174-S176 WeakPolarHBondContact OD1-CA 3.04Å; D174-S176 PolarHBondContact OD1-N 3.46Å; D174-S176 PolarHBondContact OD1-OG 3.36Å; D174-S176 VanDerWaalsContact OD1-OG 3.1Å; D174-S176 PolarHBondContact OD2-OG 3.31Å; D174-G177 PolarHBondContact OD1-N 3.33Å; D174-Q178 VanDerWaalsContact CG-O 3.31Å; D174-Q178 PolarHBondContact N-O 3.33Å; D174-Q178 PolarHBondContact OD1-N 2.99Å; D174-Q178 WeakPolarHBondContact OD2-CB 3.38Å; D174-I202 PolarHBondContact O-N 2.86Å; D174-I202 VanDerWaalsContact O-N 3.14Å
175	Y	92.8	Very high	92.6	Very high	126 Å²	126	38.4 Å²	38.4	49%	0.494	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-14.7	173.6	-175.3	-98.7	0	0	0	114.2	W157 G177 S201	W157-Y175 AromaticContact CD1-CG 3.62Å; W157-Y175 AromaticContact CE2-CD2 3.58Å; W157-Y175 AromaticContact CE2-CG 3.67Å; W157-Y175 AromaticContact CZ2-CD2 3.49Å; W157-Y175 HydrophobicContact CZ2-CD2 3.49Å; W157-Y175 VanDerWaalsContact CZ2-CD2 3.49Å; W157-Y175 AromaticContact CZ2-CE2 3.61Å; W157-Y175 HydrophobicContact CZ2-CE2 3.61Å; W157-Y175 HydrophobicContact CZ2-CG 4.04Å; W157-Y175 AromaticContact NE1-CD1 3.24Å; W157-Y175 AromaticContact NE1-CD2 3.28Å; W157-Y175 VanDerWaalsContact NE1-CD2 3.28Å; W157-Y175 AromaticContact NE1-CE1 3.96Å; W157-Y175 AromaticContact NE1-CG 2.86Å; W157-Y175 PolarHBondContact O-N 2.95Å; Y175-G177 VanDerWaalsContact C-N 3.31Å; Y175-S201 VanDerWaalsContact CD2-OG 3.27Å; Y175-S201 WeakPolarHBondContact CD2-OG 3.2Å; Y175-S201 VanDerWaalsContact O-CA 3.24Å; Y175-S201 WeakPolarHBondContact O-CA 3.38Å; Y175-S201 WeakPolarHBondContact O-CB 3.18Å
176	S	91.1	Very high	92.2	Very high	52 Å²	52	42 Å²	42	36%	0.364	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.1	178.4	85	0	0	0	0	113.7	D174 Q178	D174-S176 VanDerWaalsContact CG-OG 3.24Å; D174-S176 PolarHBondContact O-N 3.44Å; D174-S176 VanDerWaalsContact OD1-C 3.29Å; D174-S176 VanDerWaalsContact OD1-CA 3.29Å; D174-S176 WeakPolarHBondContact OD1-CA 3.04Å; D174-S176 PolarHBondContact OD1-N 3.46Å; D174-S176 PolarHBondContact OD1-OG 3.36Å; D174-S176 VanDerWaalsContact OD1-OG 3.1Å; D174-S176 PolarHBondContact OD2-OG 3.31Å; S176-Q178 WeakPolarHBondContact OG-CG 3.48Å; S176-Q178 PolarHBondContact OG-NE2 2.84Å
177	G	90.5	Very high	92	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.01	20%	0.202	C	C	.	.	S	Bend	trans	92.9	11.4	-178.5	0	0	0	0	0	114.2	D174 Y175 G200	D174-G177 PolarHBondContact OD1-N 3.33Å; Y175-G177 VanDerWaalsContact C-N 3.31Å; G177-G200 WeakPolarHBondContact CA-O 3.21Å
178	Q	92.5	Very high	91.9	Very high	54 Å²	54	43.7 Å²	43.7	25%	0.252	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137	178	-53.4	-178.2	37.8	0	0	111	D174 S176 T194 K196 I202	D174-Q178 VanDerWaalsContact CG-O 3.31Å; D174-Q178 PolarHBondContact N-O 3.33Å; D174-Q178 PolarHBondContact OD1-N 2.99Å; D174-Q178 WeakPolarHBondContact OD2-CB 3.38Å; S176-Q178 WeakPolarHBondContact OG-CG 3.48Å; S176-Q178 PolarHBondContact OG-NE2 2.84Å; Q178-T194 HydrophobicContact CB-CG2 3.96Å; Q178-K196 HydrophobicContact CG-CG 4.23Å; Q178-I202 WeakPolarHBondContact O-CD1 3.29Å
179	I	94.6	Very high	92	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	120.6	171.3	-53.2	164.3	0	0	0	107.6	I172 T194 L195 I202 L205 L214 S216 W226	I172-I179 CarbonylContact O-C 3.54Å; I172-I179 VanDerWaalsContact O-CA 3.27Å; I172-I179 WeakPolarHBondContact O-CA 3.3Å; I179-T194 CarbonylContact O-C 3.58Å; I179-T194 WeakPolarHBondContact O-CA 3.4Å; I179-L195 HydrophobicContact CB-CB 4.17Å; I179-L195 HydrophobicContact CB-CD1 4.48Å; I179-L195 PolarHBondContact N-O 2.77Å; I179-L195 PolarHBondContact O-N 3.29Å; I179-I202 HydrophobicContact CB-CD1 4.47Å; I179-I202 HydrophobicContact CD1-CD1 4.44Å; I179-I202 HydrophobicContact CG1-CD1 3.43Å; I179-I202 VanDerWaalsContact CG1-CD1 3.43Å; I179-I202 HydrophobicContact CG1-CG1 4.35Å; I179-L205 HydrophobicContact CD1-CD2 3.94Å; I179-L205 HydrophobicContact CG1-CD2 4.24Å; I179-L205 HydrophobicContact CG2-CD1 4.31Å; I179-L205 HydrophobicContact CG2-CD2 4.46Å; I179-L214 HydrophobicContact CD1-CD2 4.29Å; I179-L214 HydrophobicContact CG2-CD2 3.92Å; I179-S216 VanDerWaalsContact CD1-CB 3.47Å; I179-W226 HydrophobicContact CD1-CZ2 4.12Å
180	T	94.3	Very high	91.9	Very high	11 Å²	11	45.7 Å²	45.7	7%	0.067	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.9	175.9	-55.4	0	0	0	0	110.2	F154 I172 L182 T191	F154-T180 HydrophobicContact CE1-CG2 3.95Å; I172-T180 PolarHBondContact N-O 2.89Å; I172-T180 PolarHBondContact O-N 3.13Å; T180-L182 HydrophobicContact CG2-CD2 3.72Å; T180-L182 HydrophobicContact CG2-CG 4.09Å; T180-T191 HydrophobicContact CG2-CG2 3.88Å
181	L	94.6	Very high	91.8	Very high	9 Å²	9	49.1 Å²	49.1	5%	0.047	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	114.4	171.2	177.3	54.7	0	0	0	109.5	H169 F171 I192 T193	H169-L181 HydrophobicContact CB-CD1 3.79Å; F171-L181 HydrophobicContact CD1-CD1 3.62Å; F171-L181 HydrophobicContact CE1-CD1 3.31Å; F171-L181 HydrophobicContact CE1-CD2 4.21Å; F171-L181 HydrophobicContact CE1-CG 4.22Å; F171-L181 HydrophobicContact CG-CD1 4.35Å; F171-L181 HydrophobicContact CZ-CD1 3.84Å; L181-I192 HydrophobicContact CD2-CB 4.13Å; L181-I192 HydrophobicContact CD2-CD1 4.25Å; L181-I192 HydrophobicContact CD2-CG2 4.01Å; L181-I192 HydrophobicContact CG-CB 4.09Å; L181-I192 HydrophobicContact CG-CD1 4.14Å; L181-I192 PolarHBondContact O-N 2.93Å; L181-T193 HydrophobicContact CB-CG2 3.98Å; L181-T193 HydrophobicContact CD2-CG2 4.16Å; L181-T193 PolarHBondContact N-O 3.14Å
182	L	94.4	Very high	91.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.8	175.2	-60.4	-177.7	0	0	0	109.6	V138 H152 F154 H169 A170 I172 T180 L184 S190 T191	V138-L182 HydrophobicContact CG1-CD1 3.83Å; H152-L182 HydrophobicContact CB-CD1 4.21Å; F154-L182 HydrophobicContact CE1-CD1 4.42Å; F154-L182 HydrophobicContact CZ-CD1 3.87Å; H169-L182 CarbonylContact C-O 3.51Å; H169-L182 WeakPolarHBondContact CA-O 3Å; A170-L182 PolarHBondContact N-O 3.43Å; A170-L182 PolarHBondContact O-N 3Å; I172-L182 HydrophobicContact CD1-CB 4.23Å; I172-L182 HydrophobicContact CD1-CD1 3.71Å; I172-L182 HydrophobicContact CD1-CG 3.89Å; T180-L182 HydrophobicContact CG2-CD2 3.72Å; T180-L182 HydrophobicContact CG2-CG 4.09Å; L182-L184 HydrophobicContact CB-CD2 4.03Å; L182-L184 HydrophobicContact CD1-CD2 4.49Å; L182-S190 WeakPolarHBondContact CA-O 3.45Å; L182-T191 HydrophobicContact CD2-CG2 4.03Å; L182-T191 VanDerWaalsContact CD2-OG1 3.25Å; L182-T191 WeakPolarHBondContact CD2-OG1 3.15Å
183	K	93.8	Very high	91.3	Very high	71 Å²	71	56 Å²	56	31%	0.309	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.8	161.7	178.4	-178.7	-178.4	-169.4	0	108.4	Q168 Y189 S190 I192	Q168-K183 WeakPolarHBondContact O-CA 3.41Å; K183-Y189 WeakPolarHBondContact O-CA 3.27Å; K183-S190 PolarHBondContact N-O 2.8Å; K183-S190 PolarHBondContact O-N 3.07Å; K183-I192 HydrophobicContact CB-CD1 3.72Å; K183-I192 HydrophobicContact CB-CG1 4.43Å
184	L	92.4	Very high	91.2	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.2	-175.4	-57.2	-175	0	0	0	110	W128 V130 W140 Y163 Q168 A170 L182	W128-L184 HydrophobicContact CZ3-CB 3.9Å; V130-L184 HydrophobicContact CG1-CD1 4.05Å; V130-L184 HydrophobicContact CG2-CD1 4.06Å; W140-L184 HydrophobicContact CB-CD1 4.5Å; W140-L184 HydrophobicContact CD2-CD1 4.34Å; W140-L184 HydrophobicContact CD2-CD2 4.27Å; W140-L184 HydrophobicContact CE3-CD1 4.34Å; W140-L184 HydrophobicContact CE3-CD2 3.91Å; W140-L184 HydrophobicContact CG-CD1 4.41Å; W140-L184 HydrophobicContact CH2-CD2 4.09Å; W140-L184 HydrophobicContact CZ2-CD2 4.4Å; W140-L184 HydrophobicContact CZ3-CD2 3.82Å; Y163-L184 HydrophobicContact CD2-CD1 4.15Å; Y163-L184 HydrophobicContact CE2-CD1 4.03Å; Q168-L184 WeakPolarHBondContact CB-O 3.27Å; Q168-L184 PolarHBondContact O-N 2.87Å; A170-L184 HydrophobicContact CB-CD1 3.74Å; A170-L184 HydrophobicContact CB-CD2 4.5Å; A170-L184 HydrophobicContact CB-CG 3.97Å; L182-L184 HydrophobicContact CB-CD2 4.03Å; L182-L184 HydrophobicContact CD1-CD2 4.49Å
185	E	88.6	Confident	91	Very high	75 Å²	75	59.9 Å²	59.9	35%	0.35	30%	0.302	S	S	.	.			trans	-117.8	172.8	172.1	-68	173.4	177.5	0	0	109.2	W140 Q187 T188	W140-E185 PolarHBondContact NE1-O 2.88Å; E185-Q187 PolarHBondContact O-N 2.81Å; E185-Q187 VanDerWaalsContact O-N 3.11Å; E185-T188 CarbonylContact C-O 3.59Å; E185-T188 WeakPolarHBondContact CA-O 3.29Å; E185-T188 WeakPolarHBondContact CB-O 3.46Å; E185-T188 VanDerWaalsContact CB-OG1 3.27Å; E185-T188 WeakPolarHBondContact CB-OG1 3.45Å; E185-T188 PolarHBondContact N-O 2.8Å; E185-T188 PolarHBondContact OE2-OG1 2.81Å
186	K	81.8	Confident	90.8	Very high	157 Å²	157	61 Å²	61	68%	0.683	31%	0.309	S	S	*	.	S	Bend	trans	-56.3	-33.5	-172.5	-79.5	-176.1	178	-177.8	0	114.2	W128 L149	W128-K186 HydrophobicContact CZ2-CG 3.88Å; L149-K186 VanDerWaalsContact CB-O 3.27Å; L149-K186 WeakPolarHBondContact CB-O 3.5Å
187	Q	83.4	Confident	90.3	Very high	166 Å²	166	60.6 Å²	60.6	78%	0.776	31%	0.313	S	S	*	.	S	Bend	trans	-137.4	-3.7	-180	-67.8	-177.7	-9.4	0	0	112.9	E185	E185-Q187 PolarHBondContact O-N 2.81Å; E185-Q187 VanDerWaalsContact O-N 3.11Å
188	T	87.8	Confident	90.3	Very high	73 Å²	73	61.2 Å²	61.2	45%	0.448	32%	0.316	S	S	.	.			trans	-126.9	160.9	-172.7	38.9	0	0	0	0	109	E185	E185-T188 CarbonylContact C-O 3.59Å; E185-T188 WeakPolarHBondContact CA-O 3.29Å; E185-T188 WeakPolarHBondContact CB-O 3.46Å; E185-T188 VanDerWaalsContact CB-OG1 3.27Å; E185-T188 WeakPolarHBondContact CB-OG1 3.45Å; E185-T188 PolarHBondContact N-O 2.8Å; E185-T188 PolarHBondContact OE2-OG1 2.81Å
189	Y	91.5	Very high	90.1	Very high	104 Å²	104	66.2 Å²	66.2	41%	0.408	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	153.6	169.7	64.4	-85.7	0	0	0	108.2	W140 H152 K183	W140-Y189 AromaticContact CH2-CD1 3.9Å; W140-Y189 HydrophobicContact CH2-CD1 3.9Å; W140-Y189 HydrophobicContact CH2-CG 4.19Å; H152-Y189 HydrophobicContact CB-CD1 4.42Å; H152-Y189 HydrophobicContact CB-CD2 4.41Å; H152-Y189 HydrophobicContact CB-CE1 4.32Å; H152-Y189 HydrophobicContact CB-CE2 4.34Å; H152-Y189 HydrophobicContact CB-CG 4.47Å; H152-Y189 AromaticContact CD2-CD2 3.89Å; H152-Y189 AromaticContact CD2-CE2 3.17Å; H152-Y189 WeakPolarHBondContact CD2-CE2 3.42Å; H152-Y189 AromaticContact CD2-CZ 3.37Å; H152-Y189 PolarHBondContact CD2-OH 3.44Å; H152-Y189 AromaticContact CG-CE2 3.95Å; H152-Y189 AromaticContact NE2-CE2 3.88Å; K183-Y189 WeakPolarHBondContact O-CA 3.27Å
190	S	92.4	Very high	89.8	Confident	50 Å²	50	66.9 Å²	66.9	35%	0.35	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.2	168.6	52.9	0	0	0	0	109.7	L182 K183 I192	L182-S190 WeakPolarHBondContact CA-O 3.45Å; K183-S190 PolarHBondContact N-O 2.8Å; K183-S190 PolarHBondContact O-N 3.07Å; S190-I192 PolarHBondContact O-N 3.49Å
191	T	92.7	Very high	89.8	Confident	73 Å²	73	67.2 Å²	67.2	45%	0.448	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	115.2	173	-55	0	0	0	0	108.2	T180 L182	T180-T191 HydrophobicContact CG2-CG2 3.88Å; L182-T191 HydrophobicContact CD2-CG2 4.03Å; L182-T191 VanDerWaalsContact CD2-OG1 3.25Å; L182-T191 WeakPolarHBondContact CD2-OG1 3.15Å
192	I	90.6	Very high	89.8	Confident	85 Å²	85	66.8 Å²	66.8	44%	0.436	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-51.4	-178	-68.9	160.6	0	0	0	110.1	H169 L181 K183 S190	H169-I192 WeakPolarHBondContact CD2-CD1 3.35Å; H169-I192 WeakPolarHBondContact NE2-CD1 3.29Å; L181-I192 HydrophobicContact CD2-CB 4.13Å; L181-I192 HydrophobicContact CD2-CD1 4.25Å; L181-I192 HydrophobicContact CD2-CG2 4.01Å; L181-I192 HydrophobicContact CG-CB 4.09Å; L181-I192 HydrophobicContact CG-CD1 4.14Å; L181-I192 PolarHBondContact O-N 2.93Å; K183-I192 HydrophobicContact CB-CD1 3.72Å; K183-I192 HydrophobicContact CB-CG1 4.43Å; S190-I192 PolarHBondContact O-N 3.49Å
193	T	90.4	Very high	89.7	Confident	62 Å²	62	67.9 Å²	67.9	38%	0.38	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	164.7	-178.6	-167	0	0	0	0	111.7	L181 L195	L181-T193 HydrophobicContact CB-CG2 3.98Å; L181-T193 HydrophobicContact CD2-CG2 4.16Å; L181-T193 PolarHBondContact N-O 3.14Å; T193-L195 HydrophobicContact CG2-CD2 4.15Å
194	T	90.9	Very high	89.7	Confident	54 Å²	54	65.4 Å²	65.4	33%	0.331	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	117.5	172.6	-52.3	0	0	0	0	108.4	Q178 I179 K196	Q178-T194 HydrophobicContact CB-CG2 3.96Å; I179-T194 CarbonylContact O-C 3.58Å; I179-T194 WeakPolarHBondContact O-CA 3.4Å; T194-K196 HydrophobicContact CG2-CG 4.5Å
195	L	90.2	Very high	89.9	Confident	33 Å²	33	65.6 Å²	65.6	17%	0.173	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.6	177.2	-49.3	173.2	0	0	0	108.4	I179 T193 L214 W226 I228	I179-L195 HydrophobicContact CB-CB 4.17Å; I179-L195 HydrophobicContact CB-CD1 4.48Å; I179-L195 PolarHBondContact N-O 2.77Å; I179-L195 PolarHBondContact O-N 3.29Å; T193-L195 HydrophobicContact CG2-CD2 4.15Å; L195-L214 HydrophobicContact CD1-CD2 4.21Å; L195-W226 HydrophobicContact CB-CD2 4.31Å; L195-W226 HydrophobicContact CB-CE3 4.01Å; L195-W226 HydrophobicContact CB-CH2 4.02Å; L195-W226 HydrophobicContact CB-CZ2 4.32Å; L195-W226 HydrophobicContact CB-CZ3 3.86Å; L195-W226 HydrophobicContact CD1-CB 4.19Å; L195-W226 HydrophobicContact CD1-CD2 3.8Å; L195-W226 HydrophobicContact CD1-CE3 3.95Å; L195-W226 HydrophobicContact CD1-CG 3.9Å; L195-W226 HydrophobicContact CD2-CE3 4.22Å; L195-W226 HydrophobicContact CG-CE3 4.28Å; L195-I228 HydrophobicContact CD1-CD1 4.48Å
196	K	88.4	Confident	90.2	Very high	148 Å²	148	64.7 Å²	64.7	64%	0.643	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.9	177	-62.1	-173.7	178	-179.4	0	108.4	Q178 T194	Q178-K196 HydrophobicContact CG-CG 4.23Å; T194-K196 HydrophobicContact CG2-CG 4.5Å
197	G	81.3	Confident	90.8	Very high	44 Å²	44	58.5 Å²	58.5	45%	0.454	32%	0.316	S	S	.	.			trans	-174.2	-26.2	178.9	0	0	0	0	0	114.2
198	H	89.1	Confident	91.1	Very high	14 Å²	14	50.7 Å²	50.7	7%	0.065	28%	0.279	C	S	.	.			trans	-81.6	142.1	172.8	-73.9	-64.8	0	0	0	111.7	S216 A218 D220 S222	H198-S216 PolarHBondContact CD2-OG 2.82Å; H198-S216 WeakPolarHBondContact NE2-CB 3.21Å; H198-S216 PolarHBondContact NE2-OG 3.39Å; H198-A218 HydrophobicContact CB-CB 3.99Å; H198-A218 VanDerWaalsContact ND1-CB 3.25Å; H198-A218 WeakPolarHBondContact ND1-CB 3.41Å; H198-D220 WeakPolarHBondContact CA-OD2 3.3Å; H198-D220 WeakPolarHBondContact CB-OD2 3.42Å; H198-D220 IonicContact CG-OD2 2.89Å; H198-D220 IonicContact ND1-OD1 3.17Å; H198-D220 PolarHBondContact ND1-OD1 2.97Å; H198-D220 IonicContact ND1-OD2 3.45Å; H198-D220 PolarHBondContact ND1-OD2 2.87Å; H198-S222 PolarHBondContact CE1-OG 2.58Å; H198-S222 PolarHBondContact ND1-OG 2.88Å
199	E	88.1	Confident	91.1	Very high	160 Å²	160	49.6 Å²	49.6	75%	0.748	27%	0.274	S	S	*	.	S	Bend	trans	-92.7	-12.3	174.8	-67	-176.7	173.4	0	0	112.1	D220	E199-D220 HydrophobicContact CB-CB 4.42Å; E199-D220 PolarHBondContact N-OD2 2.99Å
200	G	89.8	Confident	90.8	Very high	16 Å²	16	50.2 Å²	50.2	17%	0.165	29%	0.288	C	S	.	.	S	Bend	trans	-125.6	170.9	179.8	0	0	0	0	0	113.1	G177 I202	G177-G200 WeakPolarHBondContact CA-O 3.21Å; G200-I202 PolarHBondContact O-N 2.97Å
201	S	92.9	Very high	90.5	Very high	18 Å²	18	51.2 Å²	51.2	13%	0.126	29%	0.287	C	S	.	.			trans	-53.4	131.9	175	166.3	0	0	0	0	111.6	Y175 G203 A218 S219	Y175-S201 VanDerWaalsContact CD2-OG 3.27Å; Y175-S201 WeakPolarHBondContact CD2-OG 3.2Å; Y175-S201 VanDerWaalsContact O-CA 3.24Å; Y175-S201 WeakPolarHBondContact O-CA 3.38Å; Y175-S201 WeakPolarHBondContact O-CB 3.18Å; S201-G203 PolarHBondContact O-N 2.89Å; S201-A218 CarbonylContact O-C 3.59Å; S201-A218 WeakPolarHBondContact O-CA 3.49Å; S201-A218 WeakPolarHBondContact O-CB 3.39Å; S201-S219 PolarHBondContact O-N 2.81Å; S201-S219 PolarHBondContact O-OG 2.86Å; S201-S219 VanDerWaalsContact O-OG 3.05Å
202	I	94.9	Very high	90.3	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	123	173.6	-60.4	147.2	0	0	0	107.3	S159 C160 D174 Q178 I179 G200 L205	S159-I202 WeakPolarHBondContact CB-O 3.36Å; S159-I202 PolarHBondContact OG-O 2.94Å; C160-I202 WeakPolarHBondContact SG-CG2 3.24Å; D174-I202 PolarHBondContact O-N 2.86Å; D174-I202 VanDerWaalsContact O-N 3.14Å; Q178-I202 WeakPolarHBondContact O-CD1 3.29Å; I179-I202 HydrophobicContact CB-CD1 4.47Å; I179-I202 HydrophobicContact CD1-CD1 4.44Å; I179-I202 HydrophobicContact CG1-CD1 3.43Å; I179-I202 VanDerWaalsContact CG1-CD1 3.43Å; I179-I202 HydrophobicContact CG1-CG1 4.35Å; G200-I202 PolarHBondContact O-N 2.97Å; I202-L205 HydrophobicContact CG2-CD2 4.09Å; I202-L205 HydrophobicContact CG2-CG 4.13Å
203	G	92	Very high	90.3	Very high	22 Å²	22	51 Å²	51	23%	0.227	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-31.8	178.2	0	0	0	0	0	112.3	S201 G217	S201-G203 PolarHBondContact O-N 2.89Å; G203-G217 PolarHBondContact N-O 3.48Å
204	T	94.3	Very high	90.5	Very high	19 Å²	19	48.1 Å²	48.1	12%	0.117	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	151.3	-169.7	-177.5	0	0	0	0	112	G217 V245 Q246 L248	T204-G217 PolarHBondContact N-O 2.95Å; T204-G217 PolarHBondContact O-N 3Å; T204-V245 HydrophobicContact CG2-CG1 4.25Å; T204-Q246 WeakPolarHBondContact CB-O 3.06Å; T204-L248 HydrophobicContact CG2-CB 4.05Å; T204-L248 HydrophobicContact CG2-CD1 3.82Å; T204-L248 HydrophobicContact CG2-CG 3.56Å; T204-L248 PolarHBondContact OG1-N 3.18Å
205	L	95.8	Very high	90.7	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	145.6	177.4	-71.4	173.3	0	0	0	109.7	Q162 F171 I179 I202 L214 F215 S216	Q162-L205 HydrophobicContact CG-CB 3.86Å; Q162-L205 VanDerWaalsContact CG-O 3.29Å; Q162-L205 WeakPolarHBondContact CG-O 3.23Å; Q162-L205 PolarHBondContact NE2-O 3.27Å; F171-L205 HydrophobicContact CB-CD1 4.26Å; I179-L205 HydrophobicContact CD1-CD2 3.94Å; I179-L205 HydrophobicContact CG1-CD2 4.24Å; I179-L205 HydrophobicContact CG2-CD1 4.31Å; I179-L205 HydrophobicContact CG2-CD2 4.46Å; I202-L205 HydrophobicContact CG2-CD2 4.09Å; I202-L205 HydrophobicContact CG2-CG 4.13Å; L205-L214 HydrophobicContact CD2-CD1 4.38Å; L205-L214 HydrophobicContact CD2-CD2 4.36Å; L205-L214 HydrophobicContact CD2-CG 4.41Å; L205-F215 CarbonylContact C-O 3.56Å; L205-F215 WeakPolarHBondContact CA-O 3.33Å; L205-S216 VanDerWaalsContact CD2-CB 3.45Å
206	W	95.1	Very high	90.9	Very high	57 Å²	57	44 Å²	44	22%	0.216	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	124.7	171	-164.1	-86.9	0	0	0	110.7	F215 L248	W206-F215 HydrophobicContact CB-CB 4.42Å; W206-F215 PolarHBondContact N-O 3.22Å; W206-F215 PolarHBondContact O-N 2.8Å; W206-L248 HydrophobicContact CB-CB 4.27Å; W206-L248 VanDerWaalsContact CE3-O 3.28Å
207	W	94.1	Very high	91.2	Very high	26 Å²	26	36.9 Å²	36.9	10%	0.098	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.9	179.9	175.2	-118.6	0	0	0	111	Q162 D164 F171 R212 L213 L214 I228	Q162-W207 HydrophobicContact CB-CB 4.17Å; D164-W207 PolarHBondContact OD2-NE1 3.02Å; F171-W207 HydrophobicContact CD2-CB 4.2Å; F171-W207 HydrophobicContact CD2-CD2 4.2Å; F171-W207 HydrophobicContact CD2-CE3 4.44Å; F171-W207 HydrophobicContact CD2-CG 4.11Å; F171-W207 HydrophobicContact CE1-CE3 4.29Å; F171-W207 HydrophobicContact CE1-CZ3 4.25Å; F171-W207 HydrophobicContact CE2-CB 4.19Å; F171-W207 AromaticContact CE2-CD1 3.97Å; F171-W207 AromaticContact CE2-CD2 3.36Å; F171-W207 HydrophobicContact CE2-CD2 3.36Å; F171-W207 AromaticContact CE2-CE2 3.65Å; F171-W207 AromaticContact CE2-CE3 3.7Å; F171-W207 HydrophobicContact CE2-CE3 3.7Å; F171-W207 AromaticContact CE2-CG 3.6Å; F171-W207 HydrophobicContact CE2-CG 3.6Å; F171-W207 HydrophobicContact CE2-CH2 4.45Å; F171-W207 HydrophobicContact CE2-CZ2 4.19Å; F171-W207 HydrophobicContact CE2-CZ3 4.25Å; F171-W207 AromaticContact CE2-NE1 3.98Å; F171-W207 AromaticContact CZ-CD2 3.68Å; F171-W207 HydrophobicContact CZ-CD2 3.68Å; F171-W207 AromaticContact CZ-CE2 3.82Å; F171-W207 AromaticContact CZ-CE3 3.6Å; F171-W207 HydrophobicContact CZ-CE3 3.6Å; F171-W207 HydrophobicContact CZ-CG 4.39Å; F171-W207 AromaticContact CZ-CH2 3.8Å; F171-W207 HydrophobicContact CZ-CH2 3.8Å; F171-W207 AromaticContact CZ-CZ2 3.88Å; F171-W207 HydrophobicContact CZ-CZ2 3.88Å; F171-W207 AromaticContact CZ-CZ3 3.69Å; F171-W207 HydrophobicContact CZ-CZ3 3.69Å; W207-R212 VanDerWaalsContact CH2-C 3.49Å; W207-R212 HydrophobicContact CH2-CB 3.75Å; W207-R212 HydrophobicContact CH2-CG 4.31Å; W207-R212 HydrophobicContact CZ2-CB 4.26Å; W207-R212 HydrophobicContact CZ2-CG 4.36Å; W207-R212 VanDerWaalsContact CZ3-C 3.44Å; W207-L213 VanDerWaalsContact CE3-O 3.23Å; W207-L214 HydrophobicContact CB-CD1 4.2Å; W207-L214 HydrophobicContact CE3-CB 3.82Å; W207-L214 HydrophobicContact CE3-CD1 4.12Å; W207-L214 HydrophobicContact CZ3-CB 4.06Å; W207-I228 HydrophobicContact CE3-CD1 4.43Å; W207-I228 HydrophobicContact CH2-CB 4.02Å; W207-I228 HydrophobicContact CH2-CD1 4.27Å; W207-I228 HydrophobicContact CH2-CG1 4.47Å; W207-I228 HydrophobicContact CH2-CG2 4.38Å; W207-I228 HydrophobicContact CZ3-CB 4.05Å; W207-I228 HydrophobicContact CZ3-CD1 3.65Å; W207-I228 HydrophobicContact CZ3-CG1 4Å
208	D	91.3	Very high	91.9	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.011	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	109	166.4	179.1	10.1	0	0	0	110.1	V210 Q211 R212 L213 Y250 Q252	D208-V210 VanDerWaalsContact C-N 3.31Å; D208-V210 PolarHBondContact O-N 2.87Å; D208-V210 PolarHBondContact OD1-N 3.2Å; D208-Q211 VanDerWaalsContact OD2-CB 3.3Å; D208-Q211 WeakPolarHBondContact OD2-CB 3.47Å; D208-Q211 VanDerWaalsContact OD2-CG 3.31Å; D208-Q211 WeakPolarHBondContact OD2-CG 3.44Å; D208-Q211 PolarHBondContact OD2-N 2.68Å; D208-R212 WeakPolarHBondContact O-CA 3.46Å; D208-R212 PolarHBondContact O-N 3.4Å; D208-L213 PolarHBondContact N-O 2.81Å; D208-L213 PolarHBondContact O-N 3.05Å; D208-Y250 HydrophobicContact CB-CD1 4.02Å; D208-Y250 HydrophobicContact CB-CE1 4.3Å; D208-Y250 WeakPolarHBondContact OD2-CE1 3.35Å; D208-Q252 PolarHBondContact OD1-NE2 3.15Å
209	P	86.9	Confident	92.1	Very high	51 Å²	51	36 Å²	36	33%	0.331	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-26.3	179.6	28.1	-34.4	0	0	0	113.3
210	V	86.1	Confident	92.1	Very high	117 Å²	117	30.1 Å²	30.1	71%	0.709	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-51	-175.1	-179.8	0	0	0	0	110.5	D208	D208-V210 VanDerWaalsContact C-N 3.31Å; D208-V210 PolarHBondContact O-N 2.87Å; D208-V210 PolarHBondContact OD1-N 3.2Å
211	Q	84.6	Confident	92.2	Very high	70 Å²	70	32.4 Å²	32.4	33%	0.327	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-8.5	178.8	-58	-173.1	-28.3	0	0	112.8	D208 L213 Y250	D208-Q211 VanDerWaalsContact OD2-CB 3.3Å; D208-Q211 WeakPolarHBondContact OD2-CB 3.47Å; D208-Q211 VanDerWaalsContact OD2-CG 3.31Å; D208-Q211 WeakPolarHBondContact OD2-CG 3.44Å; D208-Q211 PolarHBondContact OD2-N 2.68Å; Q211-L213 VanDerWaalsContact C-N 3.27Å; Q211-L213 HydrophobicContact CB-CD1 3.91Å; Q211-L213 HydrophobicContact CB-CG 3.81Å; Q211-L213 PolarHBondContact O-N 3.4Å; Q211-Y250 PolarHBondContact OE1-OH 3.22Å
212	R	89.1	Confident	92.2	Very high	135 Å²	135	32 Å²	32	51%	0.509	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	41.9	-175.6	-60.6	179.6	177.6	-170.5	-0.6	112.6	W207 D208 I228	W207-R212 VanDerWaalsContact CH2-C 3.49Å; W207-R212 HydrophobicContact CH2-CB 3.75Å; W207-R212 HydrophobicContact CH2-CG 4.31Å; W207-R212 HydrophobicContact CZ2-CB 4.26Å; W207-R212 HydrophobicContact CZ2-CG 4.36Å; W207-R212 VanDerWaalsContact CZ3-C 3.44Å; D208-R212 WeakPolarHBondContact O-CA 3.46Å; D208-R212 PolarHBondContact O-N 3.4Å; R212-I228 PolarHBondContact O-N 3.49Å
213	L	91.1	Very high	92.2	Very high	20 Å²	20	32 Å²	32	11%	0.105	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.4	177.9	-61.4	179.1	0	0	0	109.4	W207 D208 Q211 F215 M225 W226 D227	W207-L213 VanDerWaalsContact CE3-O 3.23Å; D208-L213 PolarHBondContact N-O 2.81Å; D208-L213 PolarHBondContact O-N 3.05Å; Q211-L213 VanDerWaalsContact C-N 3.27Å; Q211-L213 HydrophobicContact CB-CD1 3.91Å; Q211-L213 HydrophobicContact CB-CG 3.81Å; Q211-L213 PolarHBondContact O-N 3.4Å; L213-F215 HydrophobicContact CB-CE2 4.02Å; L213-F215 HydrophobicContact CB-CZ 4.24Å; L213-F215 HydrophobicContact CD1-CZ 4.24Å; L213-M225 HydrophobicContact CB-CG 4.46Å; L213-M225 HydrophobicContact CD1-CE 4.32Å; L213-M225 HydrophobicContact CD1-SD 4.09Å; L213-M225 HydrophobicContact CD2-CG 4.3Å; L213-M225 HydrophobicContact CD2-SD 3.82Å; L213-M225 HydrophobicContact CG-SD 4.45Å; L213-W226 WeakPolarHBondContact CA-O 3.33Å; L213-D227 HydrophobicContact CD2-CB 4.09Å
214	L	93.6	Very high	92.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.3	169.5	-177.1	72.4	0	0	0	108.9	F171 I179 L195 L205 W207 M225 W226 I228	F171-L214 HydrophobicContact CB-CD1 4.04Å; F171-L214 HydrophobicContact CB-CD2 4.34Å; F171-L214 HydrophobicContact CD1-CD1 4.12Å; F171-L214 HydrophobicContact CD1-CD2 3.76Å; F171-L214 HydrophobicContact CD1-CG 4.49Å; F171-L214 HydrophobicContact CD2-CD1 4.21Å; F171-L214 HydrophobicContact CE1-CD2 4.41Å; F171-L214 HydrophobicContact CG-CD1 3.85Å; F171-L214 HydrophobicContact CG-CD2 4.21Å; I179-L214 HydrophobicContact CD1-CD2 4.29Å; I179-L214 HydrophobicContact CG2-CD2 3.92Å; L195-L214 HydrophobicContact CD1-CD2 4.21Å; L205-L214 HydrophobicContact CD2-CD1 4.38Å; L205-L214 HydrophobicContact CD2-CD2 4.36Å; L205-L214 HydrophobicContact CD2-CG 4.41Å; W207-L214 HydrophobicContact CB-CD1 4.2Å; W207-L214 HydrophobicContact CE3-CB 3.82Å; W207-L214 HydrophobicContact CE3-CD1 4.12Å; W207-L214 HydrophobicContact CZ3-CB 4.06Å; L214-M225 CarbonylContact O-C 3.51Å; L214-M225 WeakPolarHBondContact O-CA 3.38Å; L214-W226 HydrophobicContact CB-CB 4.2Å; L214-W226 PolarHBondContact N-O 3.16Å; L214-W226 PolarHBondContact O-N 3.41Å; L214-I228 HydrophobicContact CB-CD1 3.72Å; L214-I228 HydrophobicContact CB-CG1 4.38Å; L214-I228 HydrophobicContact CD2-CD1 4.12Å
215	F	94.9	Very high	92.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131.9	171.1	-59.5	-85	0	0	0	109.2	L205 W206 L213 I224 M225 L248 Y250 L257 M271	L205-F215 CarbonylContact C-O 3.56Å; L205-F215 WeakPolarHBondContact CA-O 3.33Å; W206-F215 HydrophobicContact CB-CB 4.42Å; W206-F215 PolarHBondContact N-O 3.22Å; W206-F215 PolarHBondContact O-N 2.8Å; L213-F215 HydrophobicContact CB-CE2 4.02Å; L213-F215 HydrophobicContact CB-CZ 4.24Å; L213-F215 HydrophobicContact CD1-CZ 4.24Å; F215-I224 WeakPolarHBondContact CA-O 3.17Å; F215-M225 HydrophobicContact CD1-CB 3.83Å; F215-M225 HydrophobicContact CD1-CG 3.95Å; F215-M225 HydrophobicContact CE1-CB 3.77Å; F215-M225 HydrophobicContact CE1-CE 3.77Å; F215-M225 HydrophobicContact CE1-CG 3.54Å; F215-M225 HydrophobicContact CE1-SD 4.48Å; F215-M225 HydrophobicContact CZ-CE 4.14Å; F215-M225 HydrophobicContact CZ-CG 4.08Å; F215-L248 HydrophobicContact CB-CD1 4.19Å; F215-Y250 HydrophobicContact CD2-CG 4.3Å; F215-Y250 HydrophobicContact CE2-CD1 4.02Å; F215-Y250 AromaticContact CE2-CD2 3.67Å; F215-Y250 HydrophobicContact CE2-CD2 3.67Å; F215-Y250 HydrophobicContact CE2-CE1 4.43Å; F215-Y250 HydrophobicContact CE2-CE2 4.15Å; F215-Y250 AromaticContact CE2-CG 3.59Å; F215-Y250 HydrophobicContact CE2-CG 3.59Å; F215-Y250 AromaticContact CZ-CD2 3.76Å; F215-Y250 HydrophobicContact CZ-CD2 3.76Å; F215-Y250 AromaticContact CZ-CE2 3.9Å; F215-Y250 HydrophobicContact CZ-CE2 3.9Å; F215-Y250 HydrophobicContact CZ-CG 4.16Å; F215-L257 HydrophobicContact CB-CD1 4.16Å; F215-L257 HydrophobicContact CD1-CD1 4.05Å; F215-L257 HydrophobicContact CD1-CD2 3.67Å; F215-L257 HydrophobicContact CD1-CG 4.44Å; F215-L257 HydrophobicContact CD2-CD1 4.14Å; F215-L257 HydrophobicContact CE1-CD1 4.48Å; F215-L257 HydrophobicContact CE1-CD2 4.12Å; F215-L257 HydrophobicContact CG-CD1 3.85Å; F215-L257 HydrophobicContact CG-CD2 4.23Å; F215-M271 HydrophobicContact CE1-CE 4.17Å
216	S	95.6	Very high	92	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	133.5	176	59.1	0	0	0	0	111.1	I179 H198 L205 I223 I224 W226	I179-S216 VanDerWaalsContact CD1-CB 3.47Å; H198-S216 PolarHBondContact CD2-OG 2.82Å; H198-S216 WeakPolarHBondContact NE2-CB 3.21Å; H198-S216 PolarHBondContact NE2-OG 3.39Å; L205-S216 VanDerWaalsContact CD2-CB 3.45Å; S216-I223 CarbonylContact O-C 3.49Å; S216-I223 WeakPolarHBondContact O-CA 3.3Å; S216-I223 WeakPolarHBondContact O-CG2 3.27Å; S216-I224 PolarHBondContact N-O 3.13Å; S216-I224 PolarHBondContact O-N 3.27Å; S216-I224 PolarHBondContact OG-O 2.84Å; S216-W226 PolarHBondContact OG-NE1 2.54Å
217	G	94.9	Very high	91.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.8	175.6	0	0	0	0	0	109.1	G203 T204 L248	G203-G217 PolarHBondContact N-O 3.48Å; T204-G217 PolarHBondContact N-O 2.95Å; T204-G217 PolarHBondContact O-N 3Å; G217-L248 VanDerWaalsContact N-CD1 3.28Å
218	A	94.7	Very high	91.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	174.7	-174.2	0	0	0	0	0	113.5	H198 S201 D220 H221 S222 V245	H198-A218 HydrophobicContact CB-CB 3.99Å; H198-A218 VanDerWaalsContact ND1-CB 3.25Å; H198-A218 WeakPolarHBondContact ND1-CB 3.41Å; S201-A218 CarbonylContact O-C 3.59Å; S201-A218 WeakPolarHBondContact O-CA 3.49Å; S201-A218 WeakPolarHBondContact O-CB 3.39Å; A218-D220 WeakPolarHBondContact CB-OD1 3.12Å; A218-D220 PolarHBondContact O-N 2.89Å; A218-H221 PolarHBondContact O-N 3.43Å; A218-S222 PolarHBondContact N-O 3.09Å; A218-S222 VanDerWaalsContact N-O 3.16Å; A218-V245 PolarHBondContact O-N 2.65Å
219	S	93.5	Very high	90.4	Very high	40 Å²	40	35 Å²	35	28%	0.28	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-6	176.9	-55.8	0	0	0	0	113.3	S201 H221	S201-S219 PolarHBondContact O-N 2.81Å; S201-S219 PolarHBondContact O-OG 2.86Å; S201-S219 VanDerWaalsContact O-OG 3.05Å; S219-H221 PolarHBondContact O-N 2.72Å
220	D	89.4	Confident	89	Confident	36 Å²	36	34.1 Å²	34.1	19%	0.193	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	12.3	172.3	63.6	13.7	0	0	0	113.2	H198 E199 A218 S222	H198-D220 WeakPolarHBondContact CA-OD2 3.3Å; H198-D220 WeakPolarHBondContact CB-OD2 3.42Å; H198-D220 IonicContact CG-OD2 2.89Å; H198-D220 IonicContact ND1-OD1 3.17Å; H198-D220 PolarHBondContact ND1-OD1 2.97Å; H198-D220 IonicContact ND1-OD2 3.45Å; H198-D220 PolarHBondContact ND1-OD2 2.87Å; E199-D220 HydrophobicContact CB-CB 4.42Å; E199-D220 PolarHBondContact N-OD2 2.99Å; A218-D220 WeakPolarHBondContact CB-OD1 3.12Å; A218-D220 PolarHBondContact O-N 2.89Å; D220-S222 PolarHBondContact O-N 3.18Å; D220-S222 VanDerWaalsContact O-N 3.14Å; D220-S222 WeakPolarHBondContact OD1-CA 3.31Å; D220-S222 VanDerWaalsContact OD1-CB 3.3Å; D220-S222 WeakPolarHBondContact OD1-CB 3.23Å; D220-S222 PolarHBondContact OD1-N 3.05Å; D220-S222 PolarHBondContact OD1-OG 3.02Å; D220-S222 PolarHBondContact OD2-OG 3.16Å
221	H	92	Very high	87.3	Confident	63 Å²	63	41 Å²	41	29%	0.292	20%	0.202	S	C	.	.	S	Bend	trans	67.1	5.6	-178.9	-39.8	-65.6	0	0	0	114.8	A218 S219 H242 E243 R244	A218-H221 PolarHBondContact O-N 3.43Å; S219-H221 PolarHBondContact O-N 2.72Å; H221-H242 PolarHBondContact CE1-O 2.63Å; H221-H242 VanDerWaalsContact CE1-O 3.29Å; H221-H242 PolarHBondContact ND1-O 3.01Å; H221-E243 IonicContact CE1-OE2 3.63Å; H221-E243 WeakPolarHBondContact ND1-CA 3.31Å; H221-E243 PolarHBondContact ND1-O 3.09Å; H221-E243 VanDerWaalsContact ND1-O 3.11Å; H221-R244 PolarHBondContact ND1-N 3.11Å
222	S	92.2	Very high	85.9	Confident	10 Å²	10	46.7 Å²	46.7	7%	0.07	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	153.9	-178.4	79.5	0	0	0	0	112	H198 A218 D220	H198-S222 PolarHBondContact CE1-OG 2.58Å; H198-S222 PolarHBondContact ND1-OG 2.88Å; A218-S222 PolarHBondContact N-O 3.09Å; A218-S222 VanDerWaalsContact N-O 3.16Å; D220-S222 PolarHBondContact O-N 3.18Å; D220-S222 VanDerWaalsContact O-N 3.14Å; D220-S222 WeakPolarHBondContact OD1-CA 3.31Å; D220-S222 VanDerWaalsContact OD1-CB 3.3Å; D220-S222 WeakPolarHBondContact OD1-CB 3.23Å; D220-S222 PolarHBondContact OD1-N 3.05Å; D220-S222 PolarHBondContact OD1-OG 3.02Å; D220-S222 PolarHBondContact OD2-OG 3.16Å
223	I	95	Very high	84.8	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.6	168.2	-61.6	158.6	0	0	0	106.8	S216 L238 V245 L248 L257 S259 W269	S216-I223 CarbonylContact O-C 3.49Å; S216-I223 WeakPolarHBondContact O-CA 3.3Å; S216-I223 WeakPolarHBondContact O-CG2 3.27Å; I223-L238 HydrophobicContact CB-CB 4.06Å; I223-L238 HydrophobicContact CG2-CD1 4.23Å; I223-L238 PolarHBondContact N-O 3.19Å; I223-L238 PolarHBondContact O-N 3.17Å; I223-V245 HydrophobicContact CD1-CG1 4.23Å; I223-V245 HydrophobicContact CD1-CG2 4.3Å; I223-V245 HydrophobicContact CG1-CB 4.46Å; I223-V245 HydrophobicContact CG1-CG1 4.08Å; I223-V245 HydrophobicContact CG1-CG2 3.96Å; I223-L248 HydrophobicContact CD1-CD2 3.9Å; I223-L248 HydrophobicContact CG1-CD2 4.18Å; I223-L248 HydrophobicContact CG2-CD1 4.27Å; I223-L248 HydrophobicContact CG2-CD2 4.28Å; I223-L257 HydrophobicContact CG2-CD2 3.88Å; I223-S259 WeakPolarHBondContact CD1-OG 3.22Å; I223-W269 HydrophobicContact CD1-CZ2 4.34Å
224	I	93.6	Very high	84.3	Confident	12 Å²	12	46 Å²	46	6%	0.062	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.2	175.6	-59.2	172.6	0	0	0	108.6	F215 S216 W226 L236 L237	F215-I224 WeakPolarHBondContact CA-O 3.17Å; S216-I224 PolarHBondContact N-O 3.13Å; S216-I224 PolarHBondContact O-N 3.27Å; S216-I224 PolarHBondContact OG-O 2.84Å; I224-W226 HydrophobicContact CB-CZ2 4Å; I224-W226 HydrophobicContact CD1-CH2 4.39Å; I224-W226 HydrophobicContact CD1-CZ2 3.89Å; I224-W226 HydrophobicContact CG2-CD2 3.84Å; I224-W226 HydrophobicContact CG2-CE3 4.39Å; I224-W226 HydrophobicContact CG2-CG 4.3Å; I224-W226 HydrophobicContact CG2-CH2 4.17Å; I224-W226 HydrophobicContact CG2-CZ2 3.6Å; I224-L236 CarbonylContact C-O 3.59Å; I224-L236 WeakPolarHBondContact CA-O 3.32Å; I224-L237 HydrophobicContact CD1-CD1 4.34Å; I224-L237 HydrophobicContact CG1-CD1 3.75Å
225	M	93.3	Very high	84	Confident	19 Å²	19	48.7 Å²	48.7	9%	0.094	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130.6	162.9	-178.3	-145.5	-70.4	0	0	108.7	L213 L214 F215 T235 L236 M271	L213-M225 HydrophobicContact CB-CG 4.46Å; L213-M225 HydrophobicContact CD1-CE 4.32Å; L213-M225 HydrophobicContact CD1-SD 4.09Å; L213-M225 HydrophobicContact CD2-CG 4.3Å; L213-M225 HydrophobicContact CD2-SD 3.82Å; L213-M225 HydrophobicContact CG-SD 4.45Å; L214-M225 CarbonylContact O-C 3.51Å; L214-M225 WeakPolarHBondContact O-CA 3.38Å; F215-M225 HydrophobicContact CD1-CB 3.83Å; F215-M225 HydrophobicContact CD1-CG 3.95Å; F215-M225 HydrophobicContact CE1-CB 3.77Å; F215-M225 HydrophobicContact CE1-CE 3.77Å; F215-M225 HydrophobicContact CE1-CG 3.54Å; F215-M225 HydrophobicContact CE1-SD 4.48Å; F215-M225 HydrophobicContact CZ-CE 4.14Å; F215-M225 HydrophobicContact CZ-CG 4.08Å; M225-T235 VanDerWaalsContact O-CA 3.29Å; M225-T235 WeakPolarHBondContact O-CA 3.49Å; M225-L236 HydrophobicContact CB-CB 4.18Å; M225-L236 HydrophobicContact CE-CD1 3.65Å; M225-L236 PolarHBondContact N-O 3.18Å; M225-L236 PolarHBondContact O-N 3.39Å; M225-L236 HydrophobicContact SD-CD1 3.87Å; M225-L236 HydrophobicContact SD-CG 4.42Å; M225-M271 HydrophobicContact CE-CE 3.03Å
226	W	91.7	Very high	83.6	Confident	21 Å²	21	49.2 Å²	49.2	8%	0.08	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.8	174.6	-47.5	84.5	0	0	0	109.4	I179 L195 L213 L214 S216 I224 I228 T235	I179-W226 HydrophobicContact CD1-CZ2 4.12Å; L195-W226 HydrophobicContact CB-CD2 4.31Å; L195-W226 HydrophobicContact CB-CE3 4.01Å; L195-W226 HydrophobicContact CB-CH2 4.02Å; L195-W226 HydrophobicContact CB-CZ2 4.32Å; L195-W226 HydrophobicContact CB-CZ3 3.86Å; L195-W226 HydrophobicContact CD1-CB 4.19Å; L195-W226 HydrophobicContact CD1-CD2 3.8Å; L195-W226 HydrophobicContact CD1-CE3 3.95Å; L195-W226 HydrophobicContact CD1-CG 3.9Å; L195-W226 HydrophobicContact CD2-CE3 4.22Å; L195-W226 HydrophobicContact CG-CE3 4.28Å; L213-W226 WeakPolarHBondContact CA-O 3.33Å; L214-W226 HydrophobicContact CB-CB 4.2Å; L214-W226 PolarHBondContact N-O 3.16Å; L214-W226 PolarHBondContact O-N 3.41Å; S216-W226 PolarHBondContact OG-NE1 2.54Å; I224-W226 HydrophobicContact CB-CZ2 4Å; I224-W226 HydrophobicContact CD1-CH2 4.39Å; I224-W226 HydrophobicContact CD1-CZ2 3.89Å; I224-W226 HydrophobicContact CG2-CD2 3.84Å; I224-W226 HydrophobicContact CG2-CE3 4.39Å; I224-W226 HydrophobicContact CG2-CG 4.3Å; I224-W226 HydrophobicContact CG2-CH2 4.17Å; I224-W226 HydrophobicContact CG2-CZ2 3.6Å; W226-I228 HydrophobicContact CB-CG1 4.33Å; W226-I228 PolarHBondContact O-N 3.23Å; W226-T235 HydrophobicContact CD2-CG2 4.29Å; W226-T235 HydrophobicContact CE3-CG2 3.44Å; W226-T235 VanDerWaalsContact CE3-CG2 3.44Å; W226-T235 HydrophobicContact CZ3-CG2 3.67Å
227	D	89.3	Confident	83.4	Confident	40 Å²	40	50.6 Å²	50.6	21%	0.214	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	106.7	169	-178	-2.1	0	0	0	110	L213 G229 G230 R234	L213-D227 HydrophobicContact CD2-CB 4.09Å; D227-G229 PolarHBondContact OD1-N 2.86Å; D227-G229 VanDerWaalsContact OD1-N 3.11Å; D227-G230 WeakPolarHBondContact OD1-CA 3.32Å; D227-G230 PolarHBondContact OD1-N 3.15Å; D227-R234 HydrophobicContact CB-CB 4.1Å; D227-R234 PolarHBondContact N-O 3.27Å
228	I	84.9	Confident	83.2	Confident	64 Å²	64	50.6 Å²	50.6	33%	0.328	27%	0.265	S	S	.	.	S	Bend	trans	-95.2	-21	-177.9	-52.4	-168.8	0	0	0	110.8	F171 L195 W207 R212 L214 W226	F171-I228 HydrophobicContact CD1-CD1 4.12Å; F171-I228 HydrophobicContact CE1-CD1 3.36Å; F171-I228 HydrophobicContact CZ-CD1 4.06Å; L195-I228 HydrophobicContact CD1-CD1 4.48Å; W207-I228 HydrophobicContact CE3-CD1 4.43Å; W207-I228 HydrophobicContact CH2-CB 4.02Å; W207-I228 HydrophobicContact CH2-CD1 4.27Å; W207-I228 HydrophobicContact CH2-CG1 4.47Å; W207-I228 HydrophobicContact CH2-CG2 4.38Å; W207-I228 HydrophobicContact CZ3-CB 4.05Å; W207-I228 HydrophobicContact CZ3-CD1 3.65Å; W207-I228 HydrophobicContact CZ3-CG1 4Å; R212-I228 PolarHBondContact O-N 3.49Å; L214-I228 HydrophobicContact CB-CD1 3.72Å; L214-I228 HydrophobicContact CB-CG1 4.38Å; L214-I228 HydrophobicContact CD2-CD1 4.12Å; W226-I228 HydrophobicContact CB-CG1 4.33Å; W226-I228 PolarHBondContact O-N 3.23Å
229	G	72.1	Confident	83	Confident	36 Å²	36	53.2 Å²	53.2	37%	0.371	28%	0.277	S	S	.	.	S	Bend	trans	-103.9	-18.2	-171.4	0	0	0	0	0	116.9	D227	D227-G229 PolarHBondContact OD1-N 2.86Å; D227-G229 VanDerWaalsContact OD1-N 3.11Å
230	G	58	Low	82.5	Confident	32 Å²	32	51.4 Å²	51.4	33%	0.33	27%	0.265	S	S	.	.	S	Bend	trans	-126.9	87.2	-159.5	0	0	0	0	0	116.7	D227 K232	D227-G230 WeakPolarHBondContact OD1-CA 3.32Å; D227-G230 PolarHBondContact OD1-N 3.15Å; G230-K232 PolarHBondContact O-N 3.31Å
231	R	48.9	Very low	82.4	Confident	261 Å²	261	50 Å²	50	99%	0.985	26%	0.257	S	S	*	.	S	Bend	trans	52.7	-13.4	154.5	-64	-173	-175.2	-165.4	1.4	121.1
232	K	56.5	Low	82.2	Confident	190 Å²	190	53.2 Å²	53.2	83%	0.826	27%	0.272	S	S	*	.	S	Bend	trans	-137.8	-6.6	-177.1	-67.6	-174	179.4	-178.5	0	115.7	G230 R234	G230-K232 PolarHBondContact O-N 3.31Å; K232-R234 VanDerWaalsContact C-N 3.27Å; K232-R234 PolarHBondContact O-N 3.41Å
233	G	66.4	Low	82.2	Confident	54 Å²	54	57.3 Å²	57.3	56%	0.557	29%	0.29	S	S	*	.			trans	60.5	39.9	-179.6	0	0	0	0	0	112.1
234	R	79.9	Confident	82	Confident	88 Å²	88	62.6 Å²	62.6	33%	0.332	31%	0.31	S	S	.	.			trans	-68.9	138.5	-169.6	-159.2	-173.3	-173.7	175.2	5.7	111.1	D227 K232 R275 E277	D227-R234 HydrophobicContact CB-CB 4.1Å; D227-R234 PolarHBondContact N-O 3.27Å; K232-R234 VanDerWaalsContact C-N 3.27Å; K232-R234 PolarHBondContact O-N 3.41Å; R234-R275 PolarHBondContact NH1-O 2.93Å; R234-R275 PolarHBondContact NH2-O 2.85Å; R234-E277 WeakPolarHBondContact CA-OE1 3.38Å; R234-E277 VanDerWaalsContact CG-CD 3.45Å; R234-E277 HydrophobicContact CG-CG 3.58Å; R234-E277 WeakPolarHBondContact CG-OE1 3.4Å
235	T	86.2	Confident	82.1	Confident	55 Å²	55	62 Å²	62	34%	0.337	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.3	172	58.8	0	0	0	0	111.4	M225 W226 E277	M225-T235 VanDerWaalsContact O-CA 3.29Å; M225-T235 WeakPolarHBondContact O-CA 3.49Å; W226-T235 HydrophobicContact CD2-CG2 4.29Å; W226-T235 HydrophobicContact CE3-CG2 3.44Å; W226-T235 VanDerWaalsContact CE3-CG2 3.44Å; W226-T235 HydrophobicContact CZ3-CG2 3.67Å; T235-E277 PolarHBondContact N-OE1 3.16Å; T235-E277 WeakPolarHBondContact O-CG 3.36Å
236	L	88	Confident	82	Confident	12 Å²	12	63.2 Å²	63.2	6%	0.063	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.8	175.7	-60.7	176.1	0	0	0	109.2	I224 M225 R275 E276 E277	I224-L236 CarbonylContact C-O 3.59Å; I224-L236 WeakPolarHBondContact CA-O 3.32Å; M225-L236 HydrophobicContact CB-CB 4.18Å; M225-L236 HydrophobicContact CE-CD1 3.65Å; M225-L236 PolarHBondContact N-O 3.18Å; M225-L236 PolarHBondContact O-N 3.39Å; M225-L236 HydrophobicContact SD-CD1 3.87Å; M225-L236 HydrophobicContact SD-CG 4.42Å; L236-R275 HydrophobicContact CD1-CB 3.81Å; L236-R275 HydrophobicContact CD2-CB 3.93Å; L236-R275 HydrophobicContact CG-CB 4.47Å; L236-E276 WeakPolarHBondContact CD2-O 3.29Å; L236-E277 HydrophobicContact CD2-CG 4.33Å
237	L	90.4	Very high	82	Confident	28 Å²	28	62.5 Å²	62.5	15%	0.147	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	132.1	173.3	-173.8	68.4	0	0	0	108.9	I224 A278 G337 F338	I224-L237 HydrophobicContact CD1-CD1 4.34Å; I224-L237 HydrophobicContact CG1-CD1 3.75Å; L237-A278 HydrophobicContact CB-CB 4.35Å; L237-G337 VanDerWaalsContact O-CA 3.27Å; L237-G337 WeakPolarHBondContact O-CA 3.42Å; L237-F338 HydrophobicContact CD2-CE1 3.72Å; L237-F338 HydrophobicContact CD2-CZ 3.82Å
238	L	91.2	Very high	82.3	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	113	176.4	-58.1	175.8	0	0	0	108	I223 L257 W269 M271	I223-L238 HydrophobicContact CB-CB 4.06Å; I223-L238 HydrophobicContact CG2-CD1 4.23Å; I223-L238 PolarHBondContact N-O 3.19Å; I223-L238 PolarHBondContact O-N 3.17Å; L238-L257 HydrophobicContact CD1-CD2 4.02Å; L238-W269 HydrophobicContact CB-CD2 4.38Å; L238-W269 HydrophobicContact CB-CE3 4Å; L238-W269 HydrophobicContact CB-CH2 3.99Å; L238-W269 HydrophobicContact CB-CZ2 4.37Å; L238-W269 HydrophobicContact CB-CZ3 3.79Å; L238-W269 HydrophobicContact CD1-CD2 4.17Å; L238-W269 HydrophobicContact CD1-CE3 4.17Å; L238-W269 HydrophobicContact CD1-CG 4.37Å; L238-W269 HydrophobicContact CD2-CE3 3.9Å; L238-W269 HydrophobicContact CD2-CZ3 4.12Å; L238-W269 HydrophobicContact CG-CE3 4.25Å; L238-W269 HydrophobicContact CG-CZ3 4.44Å; L238-M271 HydrophobicContact CD1-CE 4.19Å; L238-M271 HydrophobicContact CD1-SD 4.2Å
239	Q	89.8	Confident	82.7	Confident	55 Å²	55	60.4 Å²	60.4	26%	0.257	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	109	-177.6	-171	176.1	1.1	0	0	109.7	G337 F338 E339	Q239-G337 PolarHBondContact N-O 3.42Å; Q239-F338 HydrophobicContact CB-CD1 4.04Å; Q239-F338 HydrophobicContact CB-CE1 4.41Å; Q239-E339 PolarHBondContact O-N 3.23Å; Q239-E339 VanDerWaalsContact O-N 3.07Å
240	G	84	Confident	83.7	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.01	28%	0.28	C	S	.	.			trans	-157.7	9.1	-176.6	0	0	0	0	0	114	F340 F363	G240-F340 VanDerWaalsContact CA-CE2 3.48Å; G240-F340 WeakPolarHBondContact O-CE2 3.2Å; G240-F340 WeakPolarHBondContact O-CZ 3.18Å; G240-F363 WeakPolarHBondContact O-CE1 3.3Å
241	H	88.1	Confident	85.2	Confident	8 Å²	8	57.9 Å²	57.9	4%	0.037	27%	0.266	C	S	.	.			trans	-109.9	150.8	174	-73.5	-64.2	0	0	0	111	V245 S259 S261	H241-V245 HydrophobicContact CB-CG2 4.24Å; H241-S259 PolarHBondContact NE2-OG 2.98Å; H241-S261 VanDerWaalsContact ND1-CB 3.3Å; H241-S261 WeakPolarHBondContact ND1-CB 3.43Å
242	H	87.4	Confident	86.9	Confident	130 Å²	130	49.4 Å²	49.4	60%	0.602	24%	0.237	S	C	*	.	S	Bend	trans	-93.1	-28.6	174.5	-62.3	93.5	0	0	0	111.7	H221 F340	H221-H242 PolarHBondContact CE1-O 2.63Å; H221-H242 VanDerWaalsContact CE1-O 3.29Å; H221-H242 PolarHBondContact ND1-O 3.01Å; H242-F340 AromaticContact CE1-CE1 3.61Å; H242-F340 AromaticContact CE1-CE2 3.71Å; H242-F340 AromaticContact CE1-CZ 3.14Å; H242-F340 WeakPolarHBondContact CE1-CZ 3.39Å; H242-F340 AromaticContact ND1-CE2 3.98Å; H242-F340 AromaticContact ND1-CZ 3.67Å; H242-F340 AromaticContact NE2-CE1 3.93Å; H242-F340 AromaticContact NE2-CE2 3.89Å; H242-F340 AromaticContact NE2-CZ 3.65Å
243	E	90.6	Very high	88.2	Confident	95 Å²	95	49.3 Å²	49.3	44%	0.444	24%	0.237	S	C	.	.	S	Bend	trans	-116.9	175.5	175.8	-83.3	-64.9	166.3	0	0	113.4	H221 S261 A262 D263	H221-E243 IonicContact CE1-OE2 3.63Å; H221-E243 WeakPolarHBondContact ND1-CA 3.31Å; H221-E243 PolarHBondContact ND1-O 3.09Å; H221-E243 VanDerWaalsContact ND1-O 3.11Å; E243-S261 WeakPolarHBondContact CB-OG 3.44Å; E243-S261 PolarHBondContact O-OG 2.86Å; E243-A262 HydrophobicContact CB-CB 4.49Å; E243-D263 HydrophobicContact CB-CB 3.8Å; E243-D263 HydrophobicContact CG-CB 3.95Å; E243-D263 PolarHBondContact N-OD2 2.79Å
244	R	92.2	Very high	89	Confident	112 Å²	112	48.3 Å²	48.3	42%	0.423	22%	0.22	S	C	.	.			trans	-54.9	136.9	-178.3	58.7	-175.6	-171.3	-179.6	1.5	112.6	H221 Q246 S261 A262	H221-R244 PolarHBondContact ND1-N 3.11Å; R244-Q246 VanDerWaalsContact CD-NE2 3.26Å; R244-Q246 HydrophobicContact CG-CG 4.37Å; R244-S261 WeakPolarHBondContact O-CA 3.36Å; R244-S261 PolarHBondContact O-OG 2.72Å; R244-A262 HydrophobicContact CG-CB 3.58Å; R244-A262 PolarHBondContact O-N 2.88Å
245	V	94.2	Very high	89.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	123	177	-174.4	0	0	0	0	109.6	T204 A218 I223 H241 L248	T204-V245 HydrophobicContact CG2-CG1 4.25Å; A218-V245 PolarHBondContact O-N 2.65Å; I223-V245 HydrophobicContact CD1-CG1 4.23Å; I223-V245 HydrophobicContact CD1-CG2 4.3Å; I223-V245 HydrophobicContact CG1-CB 4.46Å; I223-V245 HydrophobicContact CG1-CG1 4.08Å; I223-V245 HydrophobicContact CG1-CG2 3.96Å; H241-V245 HydrophobicContact CB-CG2 4.24Å; V245-L248 HydrophobicContact CG1-CD2 4.17Å; V245-L248 HydrophobicContact CG1-CG 4.3Å
246	Q	92.3	Very high	89.5	Confident	45 Å²	45	48 Å²	48	21%	0.21	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-29.5	-173.1	-69.5	-64.8	-55.5	0	0	113.2	T204 R244 C260 A262 I370	T204-Q246 WeakPolarHBondContact CB-O 3.06Å; R244-Q246 VanDerWaalsContact CD-NE2 3.26Å; R244-Q246 HydrophobicContact CG-CG 4.37Å; Q246-C260 PolarHBondContact N-O 3.01Å; Q246-A262 HydrophobicContact CG-CB 4.06Å; Q246-I370 VanDerWaalsContact CB-O 3.31Å; Q246-I370 WeakPolarHBondContact CB-O 3.47Å
247	A	92.4	Very high	89.7	Confident	5 Å²	5	47.4 Å²	47.4	4%	0.041	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	142.2	179.4	0	0	0	0	0	112.2	S259 C260 M373	A247-S259 WeakPolarHBondContact O-CA 3.25Å; A247-C260 HydrophobicContact CB-CB 4.23Å; A247-C260 PolarHBondContact N-O 2.99Å; A247-C260 PolarHBondContact O-N 3.39Å; A247-M373 HydrophobicContact CB-CB 3.69Å; A247-M373 HydrophobicContact CB-CE 4.47Å
248	L	95.2	Very high	89.9	Confident	6 Å²	6	46 Å²	46	3%	0.031	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	142.6	177.1	-73.9	177.3	0	0	0	110.4	T204 W206 F215 G217 I223 V245 L257 L258	T204-L248 HydrophobicContact CG2-CB 4.05Å; T204-L248 HydrophobicContact CG2-CD1 3.82Å; T204-L248 HydrophobicContact CG2-CG 3.56Å; T204-L248 PolarHBondContact OG1-N 3.18Å; W206-L248 HydrophobicContact CB-CB 4.27Å; W206-L248 VanDerWaalsContact CE3-O 3.28Å; F215-L248 HydrophobicContact CB-CD1 4.19Å; G217-L248 VanDerWaalsContact N-CD1 3.28Å; I223-L248 HydrophobicContact CD1-CD2 3.9Å; I223-L248 HydrophobicContact CG1-CD2 4.18Å; I223-L248 HydrophobicContact CG2-CD1 4.27Å; I223-L248 HydrophobicContact CG2-CD2 4.28Å; V245-L248 HydrophobicContact CG1-CD2 4.17Å; V245-L248 HydrophobicContact CG1-CG 4.3Å; L248-L257 HydrophobicContact CD2-CD1 4.33Å; L248-L257 HydrophobicContact CD2-CD2 4.29Å; L248-L257 HydrophobicContact CD2-CG 4.36Å; L248-L258 WeakPolarHBondContact CA-O 3.25Å
249	R	93.3	Very high	90	Very high	55 Å²	55	46 Å²	46	21%	0.208	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	122.1	169.9	-177.5	67.7	-177.1	-135.4	3.9	110.4	L251 L258 M373 D374 M375	R249-L251 HydrophobicContact CG-CD2 4.28Å; R249-L258 HydrophobicContact CB-CB 4.4Å; R249-L258 PolarHBondContact N-O 3.37Å; R249-L258 PolarHBondContact O-N 3.49Å; R249-M373 HydrophobicContact CB-CE 3.5Å; R249-M373 VanDerWaalsContact CB-CE 3.5Å; R249-D374 IonicContact NH1-OD1 3.7Å; R249-M375 HydrophobicContact CG-CB 4.36Å
250	Y	92.6	Very high	90.2	Very high	8 Å²	8	43.4 Å²	43.4	3%	0.031	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.3	171.6	-173.6	-117.9	0	0	0	111.1	D208 Q211 F215 Q252 Q256 L257 M271	D208-Y250 HydrophobicContact CB-CD1 4.02Å; D208-Y250 HydrophobicContact CB-CE1 4.3Å; D208-Y250 WeakPolarHBondContact OD2-CE1 3.35Å; Q211-Y250 PolarHBondContact OE1-OH 3.22Å; F215-Y250 HydrophobicContact CD2-CG 4.3Å; F215-Y250 HydrophobicContact CE2-CD1 4.02Å; F215-Y250 AromaticContact CE2-CD2 3.67Å; F215-Y250 HydrophobicContact CE2-CD2 3.67Å; F215-Y250 HydrophobicContact CE2-CE1 4.43Å; F215-Y250 HydrophobicContact CE2-CE2 4.15Å; F215-Y250 AromaticContact CE2-CG 3.59Å; F215-Y250 HydrophobicContact CE2-CG 3.59Å; F215-Y250 AromaticContact CZ-CD2 3.76Å; F215-Y250 HydrophobicContact CZ-CD2 3.76Å; F215-Y250 AromaticContact CZ-CE2 3.9Å; F215-Y250 HydrophobicContact CZ-CE2 3.9Å; F215-Y250 HydrophobicContact CZ-CG 4.16Å; Y250-Q252 HydrophobicContact CD1-CG 4.02Å; Y250-Q252 HydrophobicContact CE1-CG 4.16Å; Y250-Q256 WeakPolarHBondContact CD2-O 3.49Å; Y250-L257 HydrophobicContact CD2-CB 4.21Å; Y250-L257 HydrophobicContact CD2-CD1 4.34Å; Y250-M271 HydrophobicContact CE2-CB 4.26Å; Y250-M271 HydrophobicContact CE2-CG 4.04Å
251	L	90.3	Very high	90.5	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.037	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	98.7	177.9	-59.2	178.5	0	0	0	108.8	R249 F253 T254 R255 Q256 L258 M375 P377 V400	R249-L251 HydrophobicContact CG-CD2 4.28Å; L251-F253 VanDerWaalsContact C-N 3.31Å; L251-F253 PolarHBondContact O-N 3.39Å; L251-T254 VanDerWaalsContact CB-OG1 3.27Å; L251-T254 WeakPolarHBondContact CB-OG1 3.34Å; L251-T254 PolarHBondContact O-N 2.74Å; L251-R255 VanDerWaalsContact O-CA 3.29Å; L251-R255 WeakPolarHBondContact O-CA 3.46Å; L251-R255 PolarHBondContact O-N 3.21Å; L251-Q256 WeakPolarHBondContact CB-O 3.5Å; L251-Q256 PolarHBondContact N-O 2.95Å; L251-Q256 PolarHBondContact O-N 3.04Å; L251-L258 HydrophobicContact CD1-CD1 4.18Å; L251-L258 HydrophobicContact CD1-CG 4.34Å; L251-M375 HydrophobicContact CD1-CE 4.14Å; L251-M375 HydrophobicContact CD1-SD 3.83Å; L251-M375 HydrophobicContact CD2-SD 3.72Å; L251-M375 HydrophobicContact CG-SD 4.31Å; L251-P377 HydrophobicContact CD2-CB 4.07Å; L251-P377 HydrophobicContact CD2-CG 3.72Å; L251-V400 HydrophobicContact CD1-CB 4.27Å; L251-V400 HydrophobicContact CD1-CG1 3.22Å; L251-V400 HydrophobicContact CD1-CG2 4.03Å
252	Q	84.8	Confident	90.6	Very high	82 Å²	82	43.8 Å²	43.8	38%	0.383	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-38.3	-173.2	-67.1	167.8	-40.2	0	0	113.2	D208 Y250	D208-Q252 PolarHBondContact OD1-NE2 3.15Å; Y250-Q252 HydrophobicContact CD1-CG 4.02Å; Y250-Q252 HydrophobicContact CE1-CG 4.16Å
253	F	82.4	Confident	90.6	Very high	188 Å²	188	40.9 Å²	40.9	83%	0.825	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-42.6	-176.8	-66.9	-74	0	0	0	113.1	L251	L251-F253 VanDerWaalsContact C-N 3.31Å; L251-F253 PolarHBondContact O-N 3.39Å
254	T	83.3	Confident	90.4	Very high	33 Å²	33	36.5 Å²	36.5	20%	0.202	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-6.2	-179.8	59	0	0	0	0	112.6	L251 Q256 V400	L251-T254 VanDerWaalsContact CB-OG1 3.27Å; L251-T254 WeakPolarHBondContact CB-OG1 3.34Å; L251-T254 PolarHBondContact O-N 2.74Å; T254-Q256 PolarHBondContact O-N 3.3Å; T254-V400 HydrophobicContact CG2-CG1 4.12Å
255	R	87.2	Confident	90.3	Very high	114 Å²	114	32.1 Å²	32.1	43%	0.43	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	44.5	-174.8	-50.2	-135	-166	122.2	-9.6	112.4	L251 M271 D272	L251-R255 VanDerWaalsContact O-CA 3.29Å; L251-R255 WeakPolarHBondContact O-CA 3.46Å; L251-R255 PolarHBondContact O-N 3.21Å; R255-M271 WeakPolarHBondContact O-CA 3.48Å; R255-M271 VanDerWaalsContact O-CB 3.25Å; R255-M271 WeakPolarHBondContact O-CB 3.3Å; R255-M271 PolarHBondContact O-N 2.78Å; R255-D272 WeakPolarHBondContact CB-OD1 3.49Å; R255-D272 WeakPolarHBondContact CD-OD1 3.46Å; R255-D272 VanDerWaalsContact CG-OD1 3.31Å; R255-D272 WeakPolarHBondContact CG-OD1 3.13Å; R255-D272 IonicContact CZ-OD1 2.94Å; R255-D272 IonicContact NE-OD1 2.74Å; R255-D272 IonicContact NH1-OD1 3.59Å; R255-D272 PolarHBondContact NH1-OD1 3.28Å
256	Q	90.5	Very high	90.2	Very high	22 Å²	22	32.1 Å²	32.1	10%	0.103	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139.4	178.9	-71.7	175.3	-8.4	0	0	110.7	Y250 L251 T254 V268 W269 V400	Y250-Q256 WeakPolarHBondContact CD2-O 3.49Å; L251-Q256 WeakPolarHBondContact CB-O 3.5Å; L251-Q256 PolarHBondContact N-O 2.95Å; L251-Q256 PolarHBondContact O-N 3.04Å; T254-Q256 PolarHBondContact O-N 3.3Å; Q256-V268 HydrophobicContact CB-CG1 4.27Å; Q256-V268 HydrophobicContact CG-CG1 4.4Å; Q256-W269 VanDerWaalsContact CA-O 3.27Å; Q256-W269 WeakPolarHBondContact CA-O 3.39Å; Q256-V400 VanDerWaalsContact OE1-CA 3.27Å; Q256-V400 PolarHBondContact OE1-O 3.44Å
257	L	92.6	Very high	90.2	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.7	170.1	-178.7	72.1	0	0	0	108.4	F215 I223 L238 L248 Y250 V268 W269 M271	F215-L257 HydrophobicContact CB-CD1 4.16Å; F215-L257 HydrophobicContact CD1-CD1 4.05Å; F215-L257 HydrophobicContact CD1-CD2 3.67Å; F215-L257 HydrophobicContact CD1-CG 4.44Å; F215-L257 HydrophobicContact CD2-CD1 4.14Å; F215-L257 HydrophobicContact CE1-CD1 4.48Å; F215-L257 HydrophobicContact CE1-CD2 4.12Å; F215-L257 HydrophobicContact CG-CD1 3.85Å; F215-L257 HydrophobicContact CG-CD2 4.23Å; I223-L257 HydrophobicContact CG2-CD2 3.88Å; L238-L257 HydrophobicContact CD1-CD2 4.02Å; L248-L257 HydrophobicContact CD2-CD1 4.33Å; L248-L257 HydrophobicContact CD2-CD2 4.29Å; L248-L257 HydrophobicContact CD2-CG 4.36Å; Y250-L257 HydrophobicContact CD2-CB 4.21Å; Y250-L257 HydrophobicContact CD2-CD1 4.34Å; L257-V268 WeakPolarHBondContact O-CA 3.36Å; L257-W269 HydrophobicContact CB-CB 4.12Å; L257-W269 PolarHBondContact N-O 2.74Å; L257-W269 VanDerWaalsContact O-CD1 3.3Å; L257-W269 PolarHBondContact O-N 2.76Å; L257-M271 HydrophobicContact CB-CG 4.21Å; L257-M271 HydrophobicContact CB-SD 4.45Å
258	L	93.4	Very high	90.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	134.5	167.9	-64.2	179.2	0	0	0	108.9	L248 R249 L251 A267 V268 M373 M375 M396 V400	L248-L258 WeakPolarHBondContact CA-O 3.25Å; R249-L258 HydrophobicContact CB-CB 4.4Å; R249-L258 PolarHBondContact N-O 3.37Å; R249-L258 PolarHBondContact O-N 3.49Å; L251-L258 HydrophobicContact CD1-CD1 4.18Å; L251-L258 HydrophobicContact CD1-CG 4.34Å; L258-A267 WeakPolarHBondContact CA-O 3.44Å; L258-V268 HydrophobicContact CD2-CB 3.93Å; L258-V268 HydrophobicContact CD2-CG1 3.78Å; L258-V268 HydrophobicContact CD2-CG2 3.34Å; L258-M373 HydrophobicContact CB-CE 4.02Å; L258-M373 HydrophobicContact CB-SD 4.29Å; L258-M375 HydrophobicContact CD1-CE 4.43Å; L258-M375 HydrophobicContact CD1-SD 3.25Å; L258-M375 WeakPolarHBondContact CD1-SD 3.49Å; L258-M396 HydrophobicContact CD2-CE 4.02Å; L258-V400 HydrophobicContact CD2-CG2 4.2Å
259	S	93.9	Very high	90	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.2	173.5	64.3	0	0	0	0	112.4	I223 H241 A247 I266 A267 W269	I223-S259 WeakPolarHBondContact CD1-OG 3.22Å; H241-S259 PolarHBondContact NE2-OG 2.98Å; A247-S259 WeakPolarHBondContact O-CA 3.25Å; S259-I266 WeakPolarHBondContact O-CA 3.44Å; S259-A267 PolarHBondContact N-O 3.39Å; S259-A267 PolarHBondContact O-N 2.9Å; S259-W269 PolarHBondContact OG-NE1 2.84Å
260	C	92.9	Very high	89.8	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.1	178.8	-63.5	0	0	0	0	110.8	Q246 A247 G265 I370 M373	Q246-C260 PolarHBondContact N-O 3.01Å; A247-C260 HydrophobicContact CB-CB 4.23Å; A247-C260 PolarHBondContact N-O 2.99Å; A247-C260 PolarHBondContact O-N 3.39Å; C260-G265 WeakPolarHBondContact CA-O 3.27Å; C260-I370 HydrophobicContact CB-CB 4.02Å; C260-I370 HydrophobicContact CB-CD1 3.91Å; C260-I370 HydrophobicContact CB-CG2 3.6Å; C260-M373 PolarHBondContact SG-SD 2.85Å
261	S	91.4	Very high	89.5	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	159.3	176.6	177.5	0	0	0	0	112	H241 E243 R244 D263 G264 G265	H241-S261 VanDerWaalsContact ND1-CB 3.3Å; H241-S261 WeakPolarHBondContact ND1-CB 3.43Å; E243-S261 WeakPolarHBondContact CB-OG 3.44Å; E243-S261 PolarHBondContact O-OG 2.86Å; R244-S261 WeakPolarHBondContact O-CA 3.36Å; R244-S261 PolarHBondContact O-OG 2.72Å; S261-D263 WeakPolarHBondContact CB-OD1 3.19Å; S261-D263 PolarHBondContact O-N 3.37Å; S261-D263 PolarHBondContact OG-OD1 3.37Å; S261-G264 PolarHBondContact O-N 2.89Å; S261-G265 PolarHBondContact N-O 2.94Å
262	A	90.2	Very high	89.1	Confident	18 Å²	18	34.7 Å²	34.7	15%	0.149	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-19.1	176.7	0	0	0	0	0	113.4	E243 R244 Q246 G264 N369	E243-A262 HydrophobicContact CB-CB 4.49Å; R244-A262 HydrophobicContact CG-CB 3.58Å; R244-A262 PolarHBondContact O-N 2.88Å; Q246-A262 HydrophobicContact CG-CB 4.06Å; A262-G264 PolarHBondContact O-N 2.98Å; A262-N369 WeakPolarHBondContact CA-OD1 3.47Å; A262-N369 WeakPolarHBondContact O-CA 2.93Å; A262-N369 PolarHBondContact O-OD1 3.46Å; A262-N369 VanDerWaalsContact O-OD1 3.08Å
263	D	85.9	Confident	88.9	Confident	69 Å²	69	33 Å²	33	37%	0.369	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9	170.7	58.6	16	0	0	0	113	E243 S261 G265	E243-D263 HydrophobicContact CB-CB 3.8Å; E243-D263 HydrophobicContact CG-CB 3.95Å; E243-D263 PolarHBondContact N-OD2 2.79Å; S261-D263 WeakPolarHBondContact CB-OD1 3.19Å; S261-D263 PolarHBondContact O-N 3.37Å; S261-D263 PolarHBondContact OG-OD1 3.37Å; D263-G265 WeakPolarHBondContact OD1-CA 3.3Å; D263-G265 PolarHBondContact OD1-N 2.97Å
264	G	87	Confident	88.7	Confident	3 Å²	3	32.9 Å²	32.9	3%	0.031	17%	0.171	C	C	.	.	S	Bend	trans	87.8	7.6	-175.2	0	0	0	0	0	114.6	S261 A262 G366 H368	S261-G264 PolarHBondContact O-N 2.89Å; A262-G264 PolarHBondContact O-N 2.98Å; G264-G366 WeakPolarHBondContact O-CA 3.44Å; G264-G366 PolarHBondContact O-N 3.11Å; G264-H368 WeakPolarHBondContact CA-O 3.43Å
265	G	90.9	Very high	88.7	Confident	19 Å²	19	31.7 Å²	31.7	20%	0.196	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	130.3	171.3	0	0	0	0	0	111.4	C260 S261 D263	C260-G265 WeakPolarHBondContact CA-O 3.27Å; S261-G265 PolarHBondContact N-O 2.94Å; D263-G265 WeakPolarHBondContact OD1-CA 3.3Å; D263-G265 PolarHBondContact OD1-N 2.97Å
266	I	92.3	Very high	88.5	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	116.6	172.9	-52.2	-178.6	0	0	0	107.1	S259 H364 I370 M382	S259-I266 WeakPolarHBondContact O-CA 3.44Å; I266-H364 HydrophobicContact CB-CB 4.4Å; I266-H364 PolarHBondContact N-O 2.97Å; I266-H364 PolarHBondContact O-N 2.62Å; I266-I370 HydrophobicContact CD1-CD1 3.94Å; I266-I370 HydrophobicContact CG1-CD1 3.63Å; I266-M382 HydrophobicContact CD1-CE 3.63Å
267	A	91.9	Very high	88.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133.9	178.4	0	0	0	0	0	110.3	L258 S259 W269 T362 F363	L258-A267 WeakPolarHBondContact CA-O 3.44Å; S259-A267 PolarHBondContact N-O 3.39Å; S259-A267 PolarHBondContact O-N 2.9Å; A267-W269 HydrophobicContact CB-CZ2 4.16Å; A267-T362 WeakPolarHBondContact CA-O 3.33Å; A267-F363 HydrophobicContact CB-CD1 3.66Å; A267-F363 HydrophobicContact CB-CE1 3.6Å
268	V	92.3	Very high	87.6	Confident	7 Å²	7	35.1 Å²	35.1	4%	0.042	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	112	174.6	-173	0	0	0	0	108.3	Q256 L257 L258 A361 T362 M396 V399	Q256-V268 HydrophobicContact CB-CG1 4.27Å; Q256-V268 HydrophobicContact CG-CG1 4.4Å; L257-V268 WeakPolarHBondContact O-CA 3.36Å; L258-V268 HydrophobicContact CD2-CB 3.93Å; L258-V268 HydrophobicContact CD2-CG1 3.78Å; L258-V268 HydrophobicContact CD2-CG2 3.34Å; V268-A361 CarbonylContact O-C 3.51Å; V268-A361 WeakPolarHBondContact O-CA 3.03Å; V268-T362 PolarHBondContact N-O 2.81Å; V268-T362 PolarHBondContact O-N 2.66Å; V268-M396 HydrophobicContact CG2-CE 4.13Å; V268-V399 HydrophobicContact CB-CG1 4.36Å; V268-V399 HydrophobicContact CG2-CG1 3.64Å
269	W	91.1	Very high	87	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	128.8	-176.6	-52.2	78.2	0	0	0	110	I223 L238 Q256 L257 S259 A267 M271 E339 A361	I223-W269 HydrophobicContact CD1-CZ2 4.34Å; L238-W269 HydrophobicContact CB-CD2 4.38Å; L238-W269 HydrophobicContact CB-CE3 4Å; L238-W269 HydrophobicContact CB-CH2 3.99Å; L238-W269 HydrophobicContact CB-CZ2 4.37Å; L238-W269 HydrophobicContact CB-CZ3 3.79Å; L238-W269 HydrophobicContact CD1-CD2 4.17Å; L238-W269 HydrophobicContact CD1-CE3 4.17Å; L238-W269 HydrophobicContact CD1-CG 4.37Å; L238-W269 HydrophobicContact CD2-CE3 3.9Å; L238-W269 HydrophobicContact CD2-CZ3 4.12Å; L238-W269 HydrophobicContact CG-CE3 4.25Å; L238-W269 HydrophobicContact CG-CZ3 4.44Å; Q256-W269 VanDerWaalsContact CA-O 3.27Å; Q256-W269 WeakPolarHBondContact CA-O 3.39Å; L257-W269 HydrophobicContact CB-CB 4.12Å; L257-W269 PolarHBondContact N-O 2.74Å; L257-W269 VanDerWaalsContact O-CD1 3.3Å; L257-W269 PolarHBondContact O-N 2.76Å; S259-W269 PolarHBondContact OG-NE1 2.84Å; A267-W269 HydrophobicContact CB-CZ2 4.16Å; W269-M271 HydrophobicContact CB-SD 3.87Å; W269-E339 HydrophobicContact CE3-CG 4.45Å; W269-E339 HydrophobicContact CH2-CG 3.87Å; W269-E339 HydrophobicContact CZ3-CG 3.52Å; W269-A361 HydrophobicContact CD2-CB 3.9Å; W269-A361 HydrophobicContact CE3-CB 3.68Å; W269-A361 HydrophobicContact CG-CB 4.41Å; W269-A361 HydrophobicContact CH2-CB 4.46Å; W269-A361 HydrophobicContact CZ3-CB 3.99Å
270	N	88.8	Confident	86.4	Confident	60 Å²	60	45.5 Å²	45.5	32%	0.321	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	122.4	169.2	-171.5	-8.6	0	0	0	109.8	D272 R275 L360	N270-D272 PolarHBondContact OD1-N 3.33Å; N270-R275 PolarHBondContact O-NE 2.87Å; N270-R275 PolarHBondContact O-NH2 2.8Å; N270-L360 PolarHBondContact N-O 3.2Å
271	M	86	Confident	85.9	Confident	23 Å²	23	51.1 Å²	51.1	11%	0.113	26%	0.262	C	S	.	.			trans	-106.4	-1.9	-179.7	-51.6	-51.3	-63	0	0	113.4	F215 M225 L238 Y250 R255 L257 W269 T273	F215-M271 HydrophobicContact CE1-CE 4.17Å; M225-M271 HydrophobicContact CE-CE 3.03Å; L238-M271 HydrophobicContact CD1-CE 4.19Å; L238-M271 HydrophobicContact CD1-SD 4.2Å; Y250-M271 HydrophobicContact CE2-CB 4.26Å; Y250-M271 HydrophobicContact CE2-CG 4.04Å; R255-M271 WeakPolarHBondContact O-CA 3.48Å; R255-M271 VanDerWaalsContact O-CB 3.25Å; R255-M271 WeakPolarHBondContact O-CB 3.3Å; R255-M271 PolarHBondContact O-N 2.78Å; L257-M271 HydrophobicContact CB-CG 4.21Å; L257-M271 HydrophobicContact CB-SD 4.45Å; W269-M271 HydrophobicContact CB-SD 3.87Å; M271-T273 PolarHBondContact O-N 2.86Å
272	D	82.6	Confident	85.4	Confident	89 Å²	89	55 Å²	55	48%	0.476	28%	0.282	S	S	.	.	S	Bend	trans	-74	-12.7	174.9	-85.9	-33.3	0	0	0	113.5	R255 N270	R255-D272 WeakPolarHBondContact CB-OD1 3.49Å; R255-D272 WeakPolarHBondContact CD-OD1 3.46Å; R255-D272 VanDerWaalsContact CG-OD1 3.31Å; R255-D272 WeakPolarHBondContact CG-OD1 3.13Å; R255-D272 IonicContact CZ-OD1 2.94Å; R255-D272 IonicContact NE-OD1 2.74Å; R255-D272 IonicContact NH1-OD1 3.59Å; R255-D272 PolarHBondContact NH1-OD1 3.28Å; N270-D272 PolarHBondContact OD1-N 3.33Å
273	T	79.7	Confident	84.7	Confident	46 Å²	46	60.7 Å²	60.7	28%	0.282	31%	0.31	S	S	.	.	S	Bend	trans	-84.2	143.8	-179.5	55	0	0	0	0	112.2	M271 R275 L360	M271-T273 PolarHBondContact O-N 2.86Å; T273-R275 PolarHBondContact O-N 3.14Å; T273-L360 HydrophobicContact CG2-CD2 3.9Å
274	Q	78.9	Confident	84.5	Confident	187 Å²	187	58.8 Å²	58.8	87%	0.874	30%	0.302	S	S	*	.			trans	-68.4	95.3	170.8	-71.8	-170.4	-9.2	0	0	110.4
275	R	83	Confident	84.1	Confident	7 Å²	7	63.8 Å²	63.8	3%	0.026	33%	0.328	C	S	.	.			trans	-78.7	158.9	171.5	-69.2	-178.1	-175.7	-96.2	4.5	110.7	R234 L236 N270 T273 P334 I335 L360	R234-R275 PolarHBondContact NH1-O 2.93Å; R234-R275 PolarHBondContact NH2-O 2.85Å; L236-R275 HydrophobicContact CD1-CB 3.81Å; L236-R275 HydrophobicContact CD2-CB 3.93Å; L236-R275 HydrophobicContact CG-CB 4.47Å; N270-R275 PolarHBondContact O-NE 2.87Å; N270-R275 PolarHBondContact O-NH2 2.8Å; T273-R275 PolarHBondContact O-N 3.14Å; R275-P334 PolarHBondContact NH1-O 3.07Å; R275-I335 CarbonylContact C-O 3.57Å; R275-I335 WeakPolarHBondContact CA-O 3.3Å; R275-I335 WeakPolarHBondContact CB-O 3.41Å; R275-L360 VanDerWaalsContact NH2-CB 3.28Å; R275-L360 PolarHBondContact NH2-O 3.42Å
276	E	83.8	Confident	83.7	Confident	96 Å²	96	64.8 Å²	64.8	45%	0.449	33%	0.332	S	S	.	.			trans	-105.9	150	173.9	-73.6	-171.4	170	0	0	111	L236 I335 M336	L236-E276 WeakPolarHBondContact CD2-O 3.29Å; E276-I335 HydrophobicContact CB-CG2 4.02Å; E276-I335 HydrophobicContact CG-CG2 3.82Å; E276-I335 PolarHBondContact N-O 3.26Å; E276-M336 HydrophobicContact CB-CE 4.25Å; E276-M336 HydrophobicContact CB-CG 3.81Å; E276-M336 WeakPolarHBondContact OE2-CE 3.34Å
277	E	83	Confident	83.1	Confident	85 Å²	85	64.8 Å²	64.8	40%	0.397	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-74.9	142.7	173.7	-58.9	-168.8	123.7	0	0	109.8	R234 T235 L236	R234-E277 WeakPolarHBondContact CA-OE1 3.38Å; R234-E277 VanDerWaalsContact CG-CD 3.45Å; R234-E277 HydrophobicContact CG-CG 3.58Å; R234-E277 WeakPolarHBondContact CG-OE1 3.4Å; T235-E277 PolarHBondContact N-OE1 3.16Å; T235-E277 WeakPolarHBondContact O-CG 3.36Å; L236-E277 HydrophobicContact CD2-CG 4.33Å
278	A	80.3	Confident	82.8	Confident	28 Å²	28	67.9 Å²	67.9	23%	0.231	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-69.1	135.5	171.5	0	0	0	0	0	109.4	L237 F338	L237-A278 HydrophobicContact CB-CB 4.35Å; A278-F338 HydrophobicContact CB-CE2 4.38Å; A278-F338 HydrophobicContact CB-CZ 4.15Å
279	P	81.6	Confident	82.5	Confident	40 Å²	40	71.9 Å²	71.9	26%	0.26	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-66.8	144.7	178.2	28.9	-36.3	0	0	0	110.9	R316 G319	P279-R316 WeakPolarHBondContact CD-O 3.27Å; P279-G319 VanDerWaalsContact CG-N 3.34Å
280	Q	81.1	Confident	82.2	Confident	178 Å²	178	74.2 Å²	74.2	83%	0.832	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-63.3	145.3	169.4	-68.8	-176.8	-2	0	0	110.5	L282	Q280-L282 PolarHBondContact O-N 3.3Å
281	W	82.6	Confident	81.9	Confident	117 Å²	117	79.1 Å²	79.1	44%	0.443	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-71.3	132.2	177.6	-66.1	-6.8	0	0	0	110.2	H314	W281-H314 HydrophobicContact CD2-CB 4.25Å; W281-H314 AromaticContact CD2-CG 3.93Å; W281-H314 AromaticContact CD2-ND1 3.78Å; W281-H314 AromaticContact CE3-ND1 3.79Å; W281-H314 HydrophobicContact CG-CB 4.11Å; W281-H314 AromaticContact CG-CG 3.82Å
282	L	81.1	Confident	81.6	Confident	82 Å²	82	83.5 Å²	83.5	43%	0.429	42%	0.42	S	S	.	.			trans	-93.2	115.5	173.3	-69.6	163	0	0	0	108.2	Q280 G319 K320 A321	Q280-L282 PolarHBondContact O-N 3.3Å; L282-G319 PolarHBondContact N-O 2.9Å; L282-K320 HydrophobicContact CD1-CG 4.06Å; L282-A321 WeakPolarHBondContact O-CB 3.18Å
283	D	75.5	Confident	81.3	Confident	138 Å²	138	82.2 Å²	82.2	74%	0.738	42%	0.417	S	S	*	.			trans	-75.6	130.8	172	-76.4	-37.1	0	0	0	110.7	Q312	D283-Q312 PolarHBondContact OD1-NE2 2.76Å
284	S	80.3	Confident	81	Confident	29 Å²	29	80.9 Å²	80.9	20%	0.203	41%	0.407	C	S	.	.			trans	-152.1	141.2	175.3	-168	0	0	0	0	109.6	S286 F294	S284-S286 WeakPolarHBondContact CB-O 3.49Å; S284-S286 PolarHBondContact O-N 2.83Å; S284-S286 PolarHBondContact OG-N 2.71Å; S284-S286 PolarHBondContact OG-O 3.47Å; S284-S286 VanDerWaalsContact OG-O 3.1Å; S284-F294 VanDerWaalsContact O-CD2 3.22Å; S284-F294 WeakPolarHBondContact O-CD2 3.43Å; S284-F294 WeakPolarHBondContact O-CE2 3.48Å
285	D	79.5	Confident	80.3	Confident	107 Å²	107	79 Å²	79	57%	0.572	40%	0.396	S	S	*	.	S	Bend	trans	-79	-6	174.6	-64.6	-37.8	0	0	0	112.4	F294 R310	D285-F294 VanDerWaalsContact C-CD2 3.48Å; D285-F294 WeakPolarHBondContact O-CD2 3.25Å; D285-F294 PolarHBondContact O-N 3.35Å; D285-R310 IonicContact OD1-CZ 3.85Å; D285-R310 IonicContact OD1-NH1 3.91Å; D285-R310 PolarHBondContact OD1-NH1 2.87Å; D285-R310 IonicContact OD1-NH2 3.4Å; D285-R310 PolarHBondContact OD1-NH2 2.86Å
286	S	81.6	Confident	79.1	Confident	41 Å²	41	84.9 Å²	84.9	29%	0.287	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-131.2	157.1	175.4	63.5	0	0	0	0	112.6	S284 Q288 Q292 F294	S284-S286 WeakPolarHBondContact CB-O 3.49Å; S284-S286 PolarHBondContact O-N 2.83Å; S284-S286 PolarHBondContact OG-N 2.71Å; S284-S286 PolarHBondContact OG-O 3.47Å; S284-S286 VanDerWaalsContact OG-O 3.1Å; S286-Q288 PolarHBondContact O-N 2.81Å; S286-Q292 CarbonylContact C-O 3.59Å; S286-Q292 WeakPolarHBondContact CA-O 3.33Å; S286-F294 VanDerWaalsContact O-CE2 3.24Å; S286-F294 WeakPolarHBondContact O-CE2 3.14Å
287	C	81.6	Confident	77.9	Confident	0 Å²	0	82.9 Å²	82.9	0%	0	41%	0.411	C	S	.	.			trans	-66.4	119.4	176.1	178.3	0	0	0	0	109.8	K289 C290 E291 Q292 F294 C323	C287-K289 PolarHBondContact O-N 2.91Å; C287-C290 PolarHBondContact O-N 3.12Å; C287-E291 WeakPolarHBondContact O-CA 3.47Å; C287-E291 PolarHBondContact O-N 2.89Å; C287-Q292 PolarHBondContact N-O 2.59Å; C287-F294 HydrophobicContact CB-CE1 4.36Å; C287-F294 HydrophobicContact CB-CZ 4.22Å; C287-C323 HydrophobicContact CB-CB 4.13Å; C287-C323 PolarHBondContact SG-N 2.96Å; C287-C323 VanDerWaalsContact SG-N 3.39Å
288	Q	85.6	Confident	76.8	Confident	65 Å²	65	83.6 Å²	83.6	30%	0.304	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	13.2	-179.8	-62.6	-175.3	-23.2	0	0	114.5	S286 K320 A321	S286-Q288 PolarHBondContact O-N 2.81Å; Q288-K320 HydrophobicContact CB-CB 4.35Å; Q288-K320 HydrophobicContact CB-CD 4.32Å; Q288-A321 PolarHBondContact N-O 3Å
289	K	84.6	Confident	75.8	Confident	92 Å²	92	89.8 Å²	89.8	40%	0.4	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-45.3	178.3	-70.5	-68.2	-171.7	171.3	0	112.4	C287 V322 C326	C287-K289 PolarHBondContact O-N 2.91Å; K289-V322 HydrophobicContact CG-CG1 3.79Å; K289-C326 HydrophobicContact CB-CB 4.18Å
290	C	85.6	Confident	74.5	Confident	49 Å²	49	91.8 Å²	91.8	33%	0.331	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	4	-179.9	65.4	0	0	0	0	113.8	C287 Q292 C326	C287-C290 PolarHBondContact O-N 3.12Å; C290-Q292 HydrophobicContact CB-CG 4.37Å; C290-Q292 PolarHBondContact O-N 3.27Å; C290-C326 VanDerWaalsContact SG-SG 3.65Å
291	E	83.2	Confident	73.5	Confident	163 Å²	163	84 Å²	84	76%	0.762	41%	0.408	S	S	*	.			trans	59.5	3.5	178.5	-59.4	178.4	179.3	0	0	115.2	C287	C287-E291 WeakPolarHBondContact O-CA 3.47Å; C287-E291 PolarHBondContact O-N 2.89Å
292	Q	78.7	Confident	72.4	Confident	114 Å²	114	87.9 Å²	87.9	53%	0.533	42%	0.423	S	S	.	.			trans	-64.8	130.6	175.9	-67	-65	-42.9	0	0	110.1	S286 C287 C290	S286-Q292 CarbonylContact C-O 3.59Å; S286-Q292 WeakPolarHBondContact CA-O 3.33Å; C287-Q292 PolarHBondContact N-O 2.59Å; C290-Q292 HydrophobicContact CB-CG 4.37Å; C290-Q292 PolarHBondContact O-N 3.27Å
293	P	77.2	Confident	71.6	Confident	62 Å²	62	90 Å²	90	40%	0.403	43%	0.434	S	S	.	.	B	Isolated β-bridge	trans	-64.6	146.5	177.6	27.3	-33.1	0	0	0	110.6	F295	P293-F295 HydrophobicContact CG-CD2 4.13Å; P293-F295 HydrophobicContact CG-CE1 4.34Å; P293-F295 HydrophobicContact CG-CE2 3.54Å; P293-F295 HydrophobicContact CG-CZ 3.65Å; P293-F295 WeakPolarHBondContact O-CD2 3.38Å; P293-F295 PolarHBondContact O-N 3.23Å
294	F	73.6	Confident	70.8	Confident	19 Å²	19	87.1 Å²	87.1	8%	0.083	42%	0.422	C	S	.	.			trans	-71.9	93.9	170.7	-66	-63	0	0	0	108.6	S284 D285 S286 C287 Q311 Q312 A321 C323	S284-F294 VanDerWaalsContact O-CD2 3.22Å; S284-F294 WeakPolarHBondContact O-CD2 3.43Å; S284-F294 WeakPolarHBondContact O-CE2 3.48Å; D285-F294 VanDerWaalsContact C-CD2 3.48Å; D285-F294 WeakPolarHBondContact O-CD2 3.25Å; D285-F294 PolarHBondContact O-N 3.35Å; S286-F294 VanDerWaalsContact O-CE2 3.24Å; S286-F294 WeakPolarHBondContact O-CE2 3.14Å; C287-F294 HydrophobicContact CB-CE1 4.36Å; C287-F294 HydrophobicContact CB-CZ 4.22Å; F294-Q311 VanDerWaalsContact CD1-O 3.28Å; F294-Q311 WeakPolarHBondContact CD1-O 3.46Å; F294-Q312 HydrophobicContact CD1-CB 4.28Å; F294-Q312 HydrophobicContact CD2-CB 4.22Å; F294-Q312 HydrophobicContact CD2-CG 4.22Å; F294-Q312 HydrophobicContact CE1-CB 4.31Å; F294-Q312 HydrophobicContact CE1-CG 4.47Å; F294-Q312 HydrophobicContact CE2-CB 4.27Å; F294-Q312 HydrophobicContact CE2-CG 3.86Å; F294-Q312 HydrophobicContact CG-CB 4.24Å; F294-Q312 HydrophobicContact CZ-CB 4.32Å; F294-Q312 HydrophobicContact CZ-CG 4Å; F294-A321 HydrophobicContact CE2-CB 3.81Å; F294-A321 HydrophobicContact CZ-CB 3.9Å; F294-C323 HydrophobicContact CE1-CB 4.11Å
295	F	63	Low	69.9	Low	146 Å²	146	95.1 Å²	95.1	64%	0.64	45%	0.453	S	S	*	.			trans	-68.7	143.6	176.5	-75.6	-76.8	0	0	0	111.6	P293 N297	P293-F295 HydrophobicContact CG-CD2 4.13Å; P293-F295 HydrophobicContact CG-CE1 4.34Å; P293-F295 HydrophobicContact CG-CE2 3.54Å; P293-F295 HydrophobicContact CG-CZ 3.65Å; P293-F295 WeakPolarHBondContact O-CD2 3.38Å; P293-F295 PolarHBondContact O-N 3.23Å; F295-N297 PolarHBondContact O-N 2.94Å
296	W	58.1	Low	68.4	Low	132 Å²	132	93 Å²	93	50%	0.5	44%	0.444	S	S	.	.	B	Isolated β-bridge	trans	-66	119.8	167.5	-60.9	81.1	0	0	0	108.4	I298 M301	W296-I298 HydrophobicContact CB-CG1 3.99Å; W296-I298 PolarHBondContact O-N 3.45Å; W296-M301 HydrophobicContact CB-CE 3.72Å; W296-M301 HydrophobicContact CB-SD 4.13Å; W296-M301 HydrophobicContact CD2-CE 3.86Å; W296-M301 HydrophobicContact CE3-CE 3.17Å; W296-M301 HydrophobicContact CE3-SD 3.66Å; W296-M301 HydrophobicContact CG-CE 4.16Å; W296-M301 HydrophobicContact CZ3-CE 4Å
297	N	58	Low	66.5	Low	54 Å²	54	99.3 Å²	99.3	29%	0.289	47%	0.474	S	S	.	.			trans	-78.4	77.2	166.9	-169	-8.1	0	0	0	108.7	F295 K299 Q300 M301	F295-N297 PolarHBondContact O-N 2.94Å; N297-K299 PolarHBondContact O-N 3.05Å; N297-K299 VanDerWaalsContact O-N 3.16Å; N297-Q300 HydrophobicContact CB-CB 3.92Å; N297-Q300 VanDerWaalsContact ND2-CB 3.28Å; N297-Q300 WeakPolarHBondContact ND2-CB 3.39Å; N297-Q300 PolarHBondContact ND2-OE1 2.73Å; N297-Q300 PolarHBondContact O-N 2.97Å; N297-Q300 VanDerWaalsContact O-N 3.07Å; N297-Q300 PolarHBondContact OD1-N 3.38Å; N297-M301 WeakPolarHBondContact O-CG 3.27Å; N297-M301 PolarHBondContact O-N 3.1Å
298	I	59.7	Low	65.1	Low	100 Å²	100	101.1 Å²	101.1	51%	0.513	49%	0.493	S	S	.	.	H	α-helix	trans	-53.3	-38.2	-175.8	-63.8	174.4	0	0	0	110.9	W296 M301 W302	W296-I298 HydrophobicContact CB-CG1 3.99Å; W296-I298 PolarHBondContact O-N 3.45Å; I298-M301 PolarHBondContact O-N 2.8Å; I298-W302 HydrophobicContact CG2-CE3 3.41Å; I298-W302 VanDerWaalsContact CG2-CE3 3.41Å; I298-W302 HydrophobicContact CG2-CZ3 3.42Å; I298-W302 VanDerWaalsContact CG2-CZ3 3.42Å; I298-W302 WeakPolarHBondContact O-CB 3.29Å; I298-W302 PolarHBondContact O-N 2.96Å
299	K	59	Low	63.5	Low	157 Å²	157	101.2 Å²	101.2	68%	0.683	50%	0.495	S	S	*	.	H	α-helix	trans	-64.1	-49.6	177.9	-169.6	174.7	-177.7	177.7	0	112	N297 M301 W302 D303	N297-K299 PolarHBondContact O-N 3.05Å; N297-K299 VanDerWaalsContact O-N 3.16Å; K299-M301 VanDerWaalsContact C-N 3.32Å; K299-M301 PolarHBondContact O-N 3.45Å; K299-W302 PolarHBondContact O-N 3.01Å; K299-D303 VanDerWaalsContact O-CG 3.27Å; K299-D303 PolarHBondContact O-N 2.92Å
300	Q	55.8	Low	62.2	Low	83 Å²	83	102.1 Å²	102.1	39%	0.388	50%	0.496	S	S	.	.	H	α-helix	trans	-65.4	-34.4	176.1	-172.3	175.9	6.7	0	0	112	N297 W302 D303 T304 L309	N297-Q300 HydrophobicContact CB-CB 3.92Å; N297-Q300 VanDerWaalsContact ND2-CB 3.28Å; N297-Q300 WeakPolarHBondContact ND2-CB 3.39Å; N297-Q300 PolarHBondContact ND2-OE1 2.73Å; N297-Q300 PolarHBondContact O-N 2.97Å; N297-Q300 VanDerWaalsContact O-N 3.07Å; N297-Q300 PolarHBondContact OD1-N 3.38Å; Q300-W302 VanDerWaalsContact C-N 3.35Å; Q300-D303 PolarHBondContact O-N 3.14Å; Q300-T304 WeakPolarHBondContact O-CB 3.43Å; Q300-T304 PolarHBondContact O-N 2.79Å; Q300-T304 PolarHBondContact O-OG1 3.12Å; Q300-L309 HydrophobicContact CG-CD1 4.44Å
301	M	58.8	Low	61.1	Low	14 Å²	14	104.1 Å²	104.1	7%	0.069	50%	0.5	C	S	.	.	H	α-helix	trans	-63.4	-41.1	173.1	-67.7	167.5	-175.8	0	0	112.1	W296 N297 I298 K299 K305 T306 L309	W296-M301 HydrophobicContact CB-CE 3.72Å; W296-M301 HydrophobicContact CB-SD 4.13Å; W296-M301 HydrophobicContact CD2-CE 3.86Å; W296-M301 HydrophobicContact CE3-CE 3.17Å; W296-M301 HydrophobicContact CE3-SD 3.66Å; W296-M301 HydrophobicContact CG-CE 4.16Å; W296-M301 HydrophobicContact CZ3-CE 4Å; N297-M301 WeakPolarHBondContact O-CG 3.27Å; N297-M301 PolarHBondContact O-N 3.1Å; I298-M301 PolarHBondContact O-N 2.8Å; K299-M301 VanDerWaalsContact C-N 3.32Å; K299-M301 PolarHBondContact O-N 3.45Å; M301-K305 VanDerWaalsContact O-CA 3.27Å; M301-K305 WeakPolarHBondContact O-CA 3.28Å; M301-K305 PolarHBondContact O-N 3.42Å; M301-T306 WeakPolarHBondContact CA-O 3.15Å; M301-T306 VanDerWaalsContact CB-O 3.3Å; M301-T306 WeakPolarHBondContact CB-O 3.48Å; M301-T306 VanDerWaalsContact CG-O 3.3Å; M301-T306 WeakPolarHBondContact CG-O 3.24Å; M301-T306 PolarHBondContact O-N 3.01Å; M301-L309 VanDerWaalsContact CE-C 3.46Å; M301-L309 HydrophobicContact CE-CB 3.79Å; M301-L309 WeakPolarHBondContact CE-O 3.32Å; M301-L309 HydrophobicContact CG-CB 4.13Å; M301-L309 HydrophobicContact CG-CD1 4.46Å
302	W	60.5	Low	60.6	Low	199 Å²	199	98 Å²	98	75%	0.754	47%	0.471	S	S	*	.	H	α-helix	trans	-66.7	-43.3	175.8	-117	-84.5	0	0	0	112	I298 K299 Q300	I298-W302 HydrophobicContact CG2-CE3 3.41Å; I298-W302 VanDerWaalsContact CG2-CE3 3.41Å; I298-W302 HydrophobicContact CG2-CZ3 3.42Å; I298-W302 VanDerWaalsContact CG2-CZ3 3.42Å; I298-W302 WeakPolarHBondContact O-CB 3.29Å; I298-W302 PolarHBondContact O-N 2.96Å; K299-W302 PolarHBondContact O-N 3.01Å; Q300-W302 VanDerWaalsContact C-N 3.35Å
303	D	64.8	Low	60.8	Low	125 Å²	125	95.2 Å²	95.2	67%	0.668	46%	0.458	S	S	*	.	H	α-helix	trans	-68.6	-36.2	179.9	-68.1	-24.5	0	0	0	112.1	K299 Q300	K299-D303 VanDerWaalsContact O-CG 3.27Å; K299-D303 PolarHBondContact O-N 2.92Å; Q300-D303 PolarHBondContact O-N 3.14Å
304	T	57.8	Low	61.2	Low	79 Å²	79	93.9 Å²	93.9	49%	0.485	45%	0.447	S	S	.	.	H	α-helix	trans	-95.6	-3.3	-177.6	-23.5	0	0	0	0	113.1	Q300 T306	Q300-T304 WeakPolarHBondContact O-CB 3.43Å; Q300-T304 PolarHBondContact O-N 2.79Å; Q300-T304 PolarHBondContact O-OG1 3.12Å; T304-T306 PolarHBondContact O-N 2.93Å
305	K	60.6	Low	61.9	Low	196 Å²	196	93 Å²	93	85%	0.852	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	30.2	-173.4	-62.1	-176.8	-179.9	177.8	0	114.7	M301	M301-K305 VanDerWaalsContact O-CA 3.27Å; M301-K305 WeakPolarHBondContact O-CA 3.28Å; M301-K305 PolarHBondContact O-N 3.42Å
306	T	48.4	Very low	63	Low	62 Å²	62	88.5 Å²	88.5	38%	0.38	42%	0.422	S	S	.	.			trans	-115	110.5	178.8	50.2	0	0	0	0	109.8	M301 T304 L309	M301-T306 WeakPolarHBondContact CA-O 3.15Å; M301-T306 VanDerWaalsContact CB-O 3.3Å; M301-T306 WeakPolarHBondContact CB-O 3.48Å; M301-T306 VanDerWaalsContact CG-O 3.3Å; M301-T306 WeakPolarHBondContact CG-O 3.24Å; M301-T306 PolarHBondContact O-N 3.01Å; T304-T306 PolarHBondContact O-N 2.93Å; T306-L309 WeakPolarHBondContact OG1-CD1 3.32Å
307	L	42.3	Very low	64.4	Low	175 Å²	175	84.6 Å²	84.6	92%	0.916	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	135.3	167.6	-67	162.6	0	0	0	108.3
308	G	51.4	Low	65.8	Low	38 Å²	38	83.7 Å²	83.7	39%	0.392	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	115.1	-8.7	171.8	0	0	0	0	0	118	R310	G308-R310 VanDerWaalsContact C-N 3.29Å; G308-R310 PolarHBondContact O-N 2.91Å
309	L	52.2	Low	67	Low	66 Å²	66	79 Å²	79	35%	0.346	38%	0.381	S	S	.	.			trans	-62.8	81.5	-179.8	-75.6	165.9	0	0	0	113.4	Q300 M301 T306	Q300-L309 HydrophobicContact CG-CD1 4.44Å; M301-L309 VanDerWaalsContact CE-C 3.46Å; M301-L309 HydrophobicContact CE-CB 3.79Å; M301-L309 WeakPolarHBondContact CE-O 3.32Å; M301-L309 HydrophobicContact CG-CB 4.13Å; M301-L309 HydrophobicContact CG-CD1 4.46Å; T306-L309 WeakPolarHBondContact OG1-CD1 3.32Å
310	R	58.3	Low	68.4	Low	112 Å²	112	75.1 Å²	75.1	42%	0.423	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-68.1	125.5	160.7	-63.6	178.7	177.6	-148.7	-6.9	106.9	D285 G308 Q312	D285-R310 IonicContact OD1-CZ 3.85Å; D285-R310 IonicContact OD1-NH1 3.91Å; D285-R310 PolarHBondContact OD1-NH1 2.87Å; D285-R310 IonicContact OD1-NH2 3.4Å; D285-R310 PolarHBondContact OD1-NH2 2.86Å; G308-R310 VanDerWaalsContact C-N 3.29Å; G308-R310 PolarHBondContact O-N 2.91Å; R310-Q312 HydrophobicContact CB-CB 4.14Å; R310-Q312 PolarHBondContact O-N 3.36Å
311	Q	62.3	Low	69.9	Low	90 Å²	90	71.2 Å²	71.2	42%	0.421	35%	0.346	S	S	.	.			trans	-74.6	48.4	168.3	-69.2	-168	0.6	0	0	111	F294	F294-Q311 VanDerWaalsContact CD1-O 3.28Å; F294-Q311 WeakPolarHBondContact CD1-O 3.46Å
312	Q	72.1	Confident	71.3	Confident	34 Å²	34	70.5 Å²	70.5	16%	0.159	34%	0.343	C	S	.	.			trans	-87.8	122.8	176.1	-176.1	176.8	-10.2	0	0	107.6	D283 F294 R310 H314 A321	D283-Q312 PolarHBondContact OD1-NE2 2.76Å; F294-Q312 HydrophobicContact CD1-CB 4.28Å; F294-Q312 HydrophobicContact CD2-CB 4.22Å; F294-Q312 HydrophobicContact CD2-CG 4.22Å; F294-Q312 HydrophobicContact CE1-CB 4.31Å; F294-Q312 HydrophobicContact CE1-CG 4.47Å; F294-Q312 HydrophobicContact CE2-CB 4.27Å; F294-Q312 HydrophobicContact CE2-CG 3.86Å; F294-Q312 HydrophobicContact CG-CB 4.24Å; F294-Q312 HydrophobicContact CZ-CB 4.32Å; F294-Q312 HydrophobicContact CZ-CG 4Å; R310-Q312 HydrophobicContact CB-CB 4.14Å; R310-Q312 PolarHBondContact O-N 3.36Å; Q312-H314 PolarHBondContact NE2-CE1 3.29Å; Q312-H314 VanDerWaalsContact NE2-CE1 3.33Å; Q312-H314 PolarHBondContact NE2-NE2 3.26Å; Q312-A321 HydrophobicContact CG-CB 3.99Å
313	H	82.8	Confident	72.4	Confident	56 Å²	56	62.1 Å²	62.1	26%	0.259	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	148.3	169.4	-56.6	-62	0	0	0	108.8	A321 V322 R343	H313-A321 CarbonylContact O-C 3.58Å; H313-A321 WeakPolarHBondContact O-CA 3.16Å; H313-V322 HydrophobicContact CB-CG2 4.44Å; H313-V322 WeakPolarHBondContact CB-O 3.38Å; H313-V322 PolarHBondContact N-O 2.91Å; H313-V322 VanDerWaalsContact N-O 3.08Å; H313-V322 WeakPolarHBondContact O-CG2 3.33Å; H313-V322 PolarHBondContact O-N 2.91Å; H313-V322 VanDerWaalsContact O-O 3.13Å; H313-R343 PolarHBondContact CD2-NH1 2.76Å; H313-R343 PolarHBondContact NE2-NH1 3.06Å
314	H	86.1	Confident	73.2	Confident	35 Å²	35	57.6 Å²	57.6	16%	0.162	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.3	174.6	-64.4	101.3	0	0	0	109.9	W281 Q312 R316	W281-H314 HydrophobicContact CD2-CB 4.25Å; W281-H314 AromaticContact CD2-CG 3.93Å; W281-H314 AromaticContact CD2-ND1 3.78Å; W281-H314 AromaticContact CE3-ND1 3.79Å; W281-H314 HydrophobicContact CG-CB 4.11Å; W281-H314 AromaticContact CG-CG 3.82Å; Q312-H314 PolarHBondContact NE2-CE1 3.29Å; Q312-H314 VanDerWaalsContact NE2-CE1 3.33Å; Q312-H314 PolarHBondContact NE2-NE2 3.26Å; H314-R316 PolarHBondContact O-N 2.57Å
315	C	87.8	Confident	74.5	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.313	C	S	.	.			trans	-71	121.8	171	176.7	0	0	0	0	109.2	K317 C318 G319 K320 V322 C345	C315-K317 VanDerWaalsContact C-N 3.27Å; C315-K317 PolarHBondContact O-N 2.87Å; C315-C318 VanDerWaalsContact CB-SG 3.53Å; C315-C318 PolarHBondContact O-N 3.37Å; C315-C318 PolarHBondContact SG-SG 3.07Å; C315-G319 WeakPolarHBondContact O-CA 3.28Å; C315-G319 PolarHBondContact O-N 3.43Å; C315-K320 PolarHBondContact N-O 3.27Å; C315-V322 HydrophobicContact CB-CG2 4.34Å; C315-C345 HydrophobicContact CB-CB 4.14Å; C315-C345 PolarHBondContact SG-N 2.8Å
316	R	87.3	Confident	75.7	Confident	52 Å²	52	54.6 Å²	54.6	20%	0.196	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-22	-175.4	-140	72.6	168.6	120.1	-14.7	114.6	P279 H314 F338 V342 R343	P279-R316 WeakPolarHBondContact CD-O 3.27Å; H314-R316 PolarHBondContact O-N 2.57Å; R316-F338 HydrophobicContact CB-CE2 4.23Å; R316-F338 HydrophobicContact CB-CZ 4.48Å; R316-F338 HydrophobicContact CG-CD1 4.03Å; R316-F338 HydrophobicContact CG-CD2 3.82Å; R316-F338 HydrophobicContact CG-CE1 3.55Å; R316-F338 HydrophobicContact CG-CE2 3.31Å; R316-F338 HydrophobicContact CG-CG 4.16Å; R316-F338 HydrophobicContact CG-CZ 3.17Å; R316-V342 HydrophobicContact CB-CB 4.01Å; R316-V342 HydrophobicContact CB-CG2 3.75Å; R316-V342 HydrophobicContact CG-CB 4.14Å; R316-V342 HydrophobicContact CG-CG1 4.36Å; R316-V342 HydrophobicContact CG-CG2 4.09Å; R316-R343 PolarHBondContact N-O 2.93Å
317	K	86.3	Confident	77.5	Confident	49 Å²	49	51.8 Å²	51.8	21%	0.213	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-33.7	177.1	-173	174.9	-176.4	179.7	0	113.9	C315 V344 C348 T351 I352	C315-K317 VanDerWaalsContact C-N 3.27Å; C315-K317 PolarHBondContact O-N 2.87Å; K317-V344 HydrophobicContact CB-CG1 4.2Å; K317-C348 HydrophobicContact CB-CB 4.19Å; K317-C348 HydrophobicContact CD-CB 4Å; K317-C348 HydrophobicContact CG-CB 4.49Å; K317-T351 PolarHBondContact NZ-OG1 3.08Å; K317-I352 HydrophobicContact CD-CD1 4.15Å; K317-I352 HydrophobicContact CD-CG1 3.9Å
318	C	87.2	Confident	79.6	Confident	36 Å²	36	47.6 Å²	47.6	24%	0.243	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-0.7	-173.2	68.9	0	0	0	0	115.3	C315 K320	C315-C318 VanDerWaalsContact CB-SG 3.53Å; C315-C318 PolarHBondContact O-N 3.37Å; C315-C318 PolarHBondContact SG-SG 3.07Å; C318-K320 HydrophobicContact CB-CG 4.46Å; C318-K320 PolarHBondContact O-N 3.43Å
319	G	86.1	Confident	81.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.245	C	C	.	.			trans	72.9	-8.6	177	0	0	0	0	0	115.3	P279 L282 C315	P279-G319 VanDerWaalsContact CG-N 3.34Å; L282-G319 PolarHBondContact N-O 2.9Å; C315-G319 WeakPolarHBondContact O-CA 3.28Å; C315-G319 PolarHBondContact O-N 3.43Å
320	K	88.3	Confident	83.1	Confident	77 Å²	77	53.6 Å²	53.6	34%	0.335	26%	0.257	S	S	.	.			trans	-66.3	138.4	-176.2	-63.7	-166.7	174.1	-171	0	112.9	L282 Q288 C315 C318 V322	L282-K320 HydrophobicContact CD1-CG 4.06Å; Q288-K320 HydrophobicContact CB-CB 4.35Å; Q288-K320 HydrophobicContact CB-CD 4.32Å; C315-K320 PolarHBondContact N-O 3.27Å; C318-K320 HydrophobicContact CB-CG 4.46Å; C318-K320 PolarHBondContact O-N 3.43Å; K320-V322 HydrophobicContact CB-CG1 4.44Å; K320-V322 PolarHBondContact O-N 3.2Å
321	A	86.9	Confident	84.6	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	120.4	167.7	0	0	0	0	0	110.7	L282 Q288 F294 Q312 H313	L282-A321 WeakPolarHBondContact O-CB 3.18Å; Q288-A321 PolarHBondContact N-O 3Å; F294-A321 HydrophobicContact CE2-CB 3.81Å; F294-A321 HydrophobicContact CZ-CB 3.9Å; Q312-A321 HydrophobicContact CG-CB 3.99Å; H313-A321 CarbonylContact O-C 3.58Å; H313-A321 WeakPolarHBondContact O-CA 3.16Å
322	V	87.3	Confident	85.8	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	144.8	-175.1	-68.5	0	0	0	0	111.7	K289 H313 C315 K320 C345	K289-V322 HydrophobicContact CG-CG1 3.79Å; H313-V322 HydrophobicContact CB-CG2 4.44Å; H313-V322 WeakPolarHBondContact CB-O 3.38Å; H313-V322 PolarHBondContact N-O 2.91Å; H313-V322 VanDerWaalsContact N-O 3.08Å; H313-V322 WeakPolarHBondContact O-CG2 3.33Å; H313-V322 PolarHBondContact O-N 2.91Å; H313-V322 VanDerWaalsContact O-O 3.13Å; C315-V322 HydrophobicContact CB-CG2 4.34Å; K320-V322 HydrophobicContact CB-CG1 4.44Å; K320-V322 PolarHBondContact O-N 3.2Å; V322-C345 HydrophobicContact CG1-CB 4.07Å
323	C	84.9	Confident	86.4	Confident	22 Å²	22	44.8 Å²	44.8	15%	0.149	22%	0.223	C	C	.	.			trans	-79.2	167.6	175.2	71.4	0	0	0	0	111.3	C287 F294 K325 C326 S327	C287-C323 HydrophobicContact CB-CB 4.13Å; C287-C323 PolarHBondContact SG-N 2.96Å; C287-C323 VanDerWaalsContact SG-N 3.39Å; F294-C323 HydrophobicContact CE1-CB 4.11Å; C323-K325 PolarHBondContact O-N 3.17Å; C323-C326 PolarHBondContact O-N 2.89Å; C323-C326 VanDerWaalsContact SG-SG 3.69Å; C323-S327 PolarHBondContact O-N 3.26Å; C323-S327 PolarHBondContact O-OG 2.91Å
324	G	82.1	Confident	86.5	Confident	30 Å²	30	42.1 Å²	42.1	31%	0.309	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-57.1	-34.7	178.4	0	0	0	0	0	114.1	S327	G324-S327 CarbonylContact O-C 3.49Å; G324-S327 PolarHBondContact O-N 3.07Å
325	K	84.7	Confident	86.5	Confident	189 Å²	189	42.4 Å²	42.4	82%	0.822	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-67.4	-35.5	178.8	-67.2	-177.6	179.7	178.6	0	113.2	C323 S327	C323-K325 PolarHBondContact O-N 3.17Å; K325-S327 VanDerWaalsContact C-N 3.33Å
326	C	85.3	Confident	86.2	Confident	24 Å²	24	43.1 Å²	43.1	16%	0.162	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-91	4.4	-179.9	-62.2	0	0	0	0	113.5	K289 C290 C323 C345 D346	K289-C326 HydrophobicContact CB-CB 4.18Å; C290-C326 VanDerWaalsContact SG-SG 3.65Å; C323-C326 PolarHBondContact O-N 2.89Å; C323-C326 VanDerWaalsContact SG-SG 3.69Å; C326-C345 VanDerWaalsContact O-CA 3.26Å; C326-C345 WeakPolarHBondContact O-CA 3.45Å; C326-C345 WeakPolarHBondContact O-CB 3.5Å; C326-D346 VanDerWaalsContact C-OD2 3.24Å; C326-D346 WeakPolarHBondContact CA-OD2 3.39Å; C326-D346 PolarHBondContact O-N 3.17Å; C326-D346 VanDerWaalsContact O-N 3.14Å
327	S	86.6	Confident	86	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.014	21%	0.207	C	C	.	.			trans	-139.6	47.7	-177.4	61.1	0	0	0	0	110.8	C323 G324 K325 K329 R343	C323-S327 PolarHBondContact O-N 3.26Å; C323-S327 PolarHBondContact O-OG 2.91Å; G324-S327 CarbonylContact O-C 3.49Å; G324-S327 PolarHBondContact O-N 3.07Å; K325-S327 VanDerWaalsContact C-N 3.33Å; S327-K329 VanDerWaalsContact C-N 3.32Å; S327-R343 PolarHBondContact O-NH1 3.18Å; S327-R343 PolarHBondContact OG-NH1 3.28Å; S327-R343 VanDerWaalsContact OG-NH1 3.08Å
328	S	85.1	Confident	86.1	Confident	87 Å²	87	38.3 Å²	38.3	61%	0.608	20%	0.197	S	C	*	.			trans	-72.7	-27.9	-175.6	67.7	0	0	0	0	112.6	D346	S328-D346 PolarHBondContact N-OD1 2.82Å; S328-D346 PolarHBondContact OG-OD1 3.47Å
329	K	88.7	Confident	86.1	Confident	75 Å²	75	37.4 Å²	37.4	33%	0.326	19%	0.189	S	C	.	.			trans	-98.8	155.3	-173.6	-55.7	-179.2	-171.8	172.7	0	112.8	S327 V344 F349 D350	S327-K329 VanDerWaalsContact C-N 3.32Å; K329-V344 PolarHBondContact O-N 2.68Å; K329-F349 HydrophobicContact CB-CB 4.34Å; K329-F349 HydrophobicContact CB-CD1 4.49Å; K329-F349 HydrophobicContact CB-CD2 3.58Å; K329-F349 HydrophobicContact CB-CE2 3.94Å; K329-F349 HydrophobicContact CB-CG 3.88Å; K329-F349 HydrophobicContact CD-CB 4.08Å; K329-F349 HydrophobicContact CD-CD1 3.29Å; K329-F349 HydrophobicContact CD-CD2 3.95Å; K329-F349 HydrophobicContact CD-CE1 3.58Å; K329-F349 HydrophobicContact CD-CE2 4.2Å; K329-F349 HydrophobicContact CD-CG 3.48Å; K329-F349 VanDerWaalsContact CD-CG 3.48Å; K329-F349 HydrophobicContact CD-CZ 4.02Å; K329-F349 HydrophobicContact CG-CD2 4.42Å; K329-F349 HydrophobicContact CG-CG 4.34Å; K329-D350 IonicContact NZ-OD1 2.69Å; K329-D350 PolarHBondContact NZ-OD1 2.87Å
330	R	89.4	Confident	86.1	Confident	156 Å²	156	40 Å²	40	59%	0.589	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	143.1	170.6	-67.2	-178.3	176.2	-126.5	7.9	109.9	P341 V342 F349	R330-P341 HydrophobicContact CB-CB 4.01Å; R330-P341 PolarHBondContact NH1-O 3.17Å; R330-V342 CarbonylContact C-O 3.51Å; R330-V342 WeakPolarHBondContact CA-O 3.27Å; R330-V342 WeakPolarHBondContact CB-O 3.48Å; R330-F349 WeakPolarHBondContact O-CE2 3.39Å
331	S	88.7	Confident	86.1	Confident	7 Å²	7	39.8 Å²	39.8	5%	0.049	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	152.4	177.2	-175.4	0	0	0	0	109.5	V342	S331-V342 PolarHBondContact N-O 3.15Å; S331-V342 VanDerWaalsContact O-CG2 3.3Å; S331-V342 WeakPolarHBondContact O-CG2 3.12Å; S331-V342 PolarHBondContact O-N 3.39Å
332	T	87.7	Confident	86.1	Confident	34 Å²	34	40.5 Å²	40.5	21%	0.209	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	150.1	160.1	55.2	0	0	0	0	108.9	E339 P341	T332-E339 VanDerWaalsContact CG2-O 3.29Å; T332-E339 WeakPolarHBondContact CG2-O 3.49Å; T332-P341 HydrophobicContact CG2-CG 4.26Å
333	F	86.2	Confident	86.1	Confident	9 Å²	9	43.7 Å²	43.7	4%	0.039	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	71.8	171.8	-158.7	-120.3	0	0	0	110.1	I335 M336 G337 F338 I352 D356	F333-I335 PolarHBondContact O-N 3.45Å; F333-I335 VanDerWaalsContact O-N 3.15Å; F333-M336 HydrophobicContact CD1-CB 3.72Å; F333-M336 HydrophobicContact CD1-CE 4.42Å; F333-M336 HydrophobicContact CD1-CG 3.52Å; F333-M336 HydrophobicContact CD1-SD 3.49Å; F333-M336 WeakPolarHBondContact CD1-SD 2.96Å; F333-M336 HydrophobicContact CE1-CB 4.16Å; F333-M336 HydrophobicContact CE1-CE 3.74Å; F333-M336 HydrophobicContact CE1-CG 3.45Å; F333-M336 VanDerWaalsContact CE1-CG 3.45Å; F333-M336 HydrophobicContact CE1-SD 3.42Å; F333-M336 WeakPolarHBondContact CE1-SD 3.49Å; F333-M336 PolarHBondContact O-N 2.88Å; F333-M336 VanDerWaalsContact O-N 3.12Å; F333-G337 PolarHBondContact O-N 3.12Å; F333-F338 CarbonylContact C-O 3.53Å; F333-F338 HydrophobicContact CB-CB 4.49Å; F333-F338 HydrophobicContact CB-CD2 4.48Å; F333-F338 PolarHBondContact N-O 3.24Å; F333-F338 PolarHBondContact O-N 3.15Å; F333-I352 HydrophobicContact CD2-CD1 4.19Å; F333-I352 HydrophobicContact CD2-CG1 4.09Å; F333-I352 HydrophobicContact CD2-CG2 4.01Å; F333-I352 HydrophobicContact CE2-CG1 4.15Å; F333-I352 HydrophobicContact CE2-CG2 4.32Å; F333-D356 HydrophobicContact CD2-CB 4.06Å; F333-D356 HydrophobicContact CE2-CB 3.68Å
334	P	84.4	Confident	86.4	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.006	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-55.9	-28	-176.7	-33.9	43.3	0	0	0	115.1	R275 M336 G337 E339 D356 T358 L360	R275-P334 PolarHBondContact NH1-O 3.07Å; P334-M336 VanDerWaalsContact C-N 3.3Å; P334-M336 PolarHBondContact O-N 3.46Å; P334-G337 WeakPolarHBondContact O-CA 3.31Å; P334-G337 PolarHBondContact O-N 2.88Å; P334-E339 WeakPolarHBondContact CB-OE1 3.49Å; P334-E339 WeakPolarHBondContact CG-OE2 3.19Å; P334-D356 VanDerWaalsContact CD-O 3.25Å; P334-D356 WeakPolarHBondContact CD-O 3.46Å; P334-T358 WeakPolarHBondContact CB-O 3.35Å; P334-T358 WeakPolarHBondContact CG-O 3.27Å; P334-L360 HydrophobicContact CB-CB 4.09Å; P334-L360 HydrophobicContact CB-CD1 4.14Å; P334-L360 HydrophobicContact CB-CG 3.79Å
335	I	84.8	Confident	86.8	Confident	41 Å²	41	41.3 Å²	41.3	21%	0.21	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-60.9	-37.5	177.3	-63.9	171.8	0	0	0	111.6	R275 E276 F333 G337 D356 L360	R275-I335 CarbonylContact C-O 3.57Å; R275-I335 WeakPolarHBondContact CA-O 3.3Å; R275-I335 WeakPolarHBondContact CB-O 3.41Å; E276-I335 HydrophobicContact CB-CG2 4.02Å; E276-I335 HydrophobicContact CG-CG2 3.82Å; E276-I335 PolarHBondContact N-O 3.26Å; F333-I335 PolarHBondContact O-N 3.45Å; F333-I335 VanDerWaalsContact O-N 3.15Å; I335-G337 VanDerWaalsContact C-N 3.25Å; I335-D356 HydrophobicContact CD1-CB 4.29Å; I335-L360 HydrophobicContact CG1-CD1 4.42Å
336	M	82.9	Confident	87	Confident	14 Å²	14	34.3 Å²	34.3	7%	0.069	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-90.6	14.3	169.5	-67.9	173.9	175.4	0	0	112.8	E276 F333 P334 F338	E276-M336 HydrophobicContact CB-CE 4.25Å; E276-M336 HydrophobicContact CB-CG 3.81Å; E276-M336 WeakPolarHBondContact OE2-CE 3.34Å; F333-M336 HydrophobicContact CD1-CB 3.72Å; F333-M336 HydrophobicContact CD1-CE 4.42Å; F333-M336 HydrophobicContact CD1-CG 3.52Å; F333-M336 HydrophobicContact CD1-SD 3.49Å; F333-M336 WeakPolarHBondContact CD1-SD 2.96Å; F333-M336 HydrophobicContact CE1-CB 4.16Å; F333-M336 HydrophobicContact CE1-CE 3.74Å; F333-M336 HydrophobicContact CE1-CG 3.45Å; F333-M336 VanDerWaalsContact CE1-CG 3.45Å; F333-M336 HydrophobicContact CE1-SD 3.42Å; F333-M336 WeakPolarHBondContact CE1-SD 3.49Å; F333-M336 PolarHBondContact O-N 2.88Å; F333-M336 VanDerWaalsContact O-N 3.12Å; P334-M336 VanDerWaalsContact C-N 3.3Å; P334-M336 PolarHBondContact O-N 3.46Å; M336-F338 HydrophobicContact CB-CD2 3.8Å; M336-F338 HydrophobicContact CB-CE2 3.69Å
337	G	82.5	Confident	87.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	14.6	178.6	0	0	0	0	0	116	L237 Q239 F333 P334 I335 E339	L237-G337 VanDerWaalsContact O-CA 3.27Å; L237-G337 WeakPolarHBondContact O-CA 3.42Å; Q239-G337 PolarHBondContact N-O 3.42Å; F333-G337 PolarHBondContact O-N 3.12Å; P334-G337 WeakPolarHBondContact O-CA 3.31Å; P334-G337 PolarHBondContact O-N 2.88Å; I335-G337 VanDerWaalsContact C-N 3.25Å; G337-E339 PolarHBondContact O-N 2.87Å
338	F	88.1	Confident	87.2	Confident	1 Å²	1	36.4 Å²	36.4	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	93.9	174.4	-57.2	-66.1	0	0	0	111.1	L237 Q239 A278 R316 F333 M336 V342	L237-F338 HydrophobicContact CD2-CE1 3.72Å; L237-F338 HydrophobicContact CD2-CZ 3.82Å; Q239-F338 HydrophobicContact CB-CD1 4.04Å; Q239-F338 HydrophobicContact CB-CE1 4.41Å; A278-F338 HydrophobicContact CB-CE2 4.38Å; A278-F338 HydrophobicContact CB-CZ 4.15Å; R316-F338 HydrophobicContact CB-CE2 4.23Å; R316-F338 HydrophobicContact CB-CZ 4.48Å; R316-F338 HydrophobicContact CG-CD1 4.03Å; R316-F338 HydrophobicContact CG-CD2 3.82Å; R316-F338 HydrophobicContact CG-CE1 3.55Å; R316-F338 HydrophobicContact CG-CE2 3.31Å; R316-F338 HydrophobicContact CG-CG 4.16Å; R316-F338 HydrophobicContact CG-CZ 3.17Å; F333-F338 CarbonylContact C-O 3.53Å; F333-F338 HydrophobicContact CB-CB 4.49Å; F333-F338 HydrophobicContact CB-CD2 4.48Å; F333-F338 PolarHBondContact N-O 3.24Å; F333-F338 PolarHBondContact O-N 3.15Å; M336-F338 HydrophobicContact CB-CD2 3.8Å; M336-F338 HydrophobicContact CB-CE2 3.69Å; F338-V342 HydrophobicContact CB-CG1 3.92Å; F338-V342 HydrophobicContact CB-CG2 3.84Å; F338-V342 HydrophobicContact CD1-CG1 3.67Å; F338-V342 HydrophobicContact CD2-CG2 4.29Å; F338-V342 HydrophobicContact CE1-CG1 4.48Å; F338-V342 HydrophobicContact CG-CG1 3.89Å; F338-V342 HydrophobicContact CG-CG2 3.95Å
339	E	87.2	Confident	87.4	Confident	16 Å²	16	34.3 Å²	34.3	8%	0.075	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-23.1	178.2	-61.9	-69.3	168.6	0	0	112	Q239 W269 T332 P334 G337 P359 L360 A361 F363	Q239-E339 PolarHBondContact O-N 3.23Å; Q239-E339 VanDerWaalsContact O-N 3.07Å; W269-E339 HydrophobicContact CE3-CG 4.45Å; W269-E339 HydrophobicContact CH2-CG 3.87Å; W269-E339 HydrophobicContact CZ3-CG 3.52Å; T332-E339 VanDerWaalsContact CG2-O 3.29Å; T332-E339 WeakPolarHBondContact CG2-O 3.49Å; P334-E339 WeakPolarHBondContact CB-OE1 3.49Å; P334-E339 WeakPolarHBondContact CG-OE2 3.19Å; G337-E339 PolarHBondContact O-N 2.87Å; E339-P359 VanDerWaalsContact OE2-CA 3.3Å; E339-P359 WeakPolarHBondContact OE2-CA 3.5Å; E339-P359 WeakPolarHBondContact OE2-CB 3.26Å; E339-L360 WeakPolarHBondContact OE1-CA 3.36Å; E339-L360 WeakPolarHBondContact OE1-CB 3.3Å; E339-L360 PolarHBondContact OE1-N 3.47Å; E339-L360 PolarHBondContact OE2-N 2.91Å; E339-A361 HydrophobicContact CG-CB 3.96Å; E339-A361 PolarHBondContact OE1-N 3.01Å; E339-A361 VanDerWaalsContact OE1-N 3.13Å; E339-F363 HydrophobicContact CB-CE2 3.9Å; E339-F363 HydrophobicContact CB-CZ 3.62Å; E339-F363 HydrophobicContact CG-CE2 4.28Å; E339-F363 HydrophobicContact CG-CZ 3.88Å
340	F	86.9	Confident	87.3	Confident	54 Å²	54	36.2 Å²	36.2	24%	0.237	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	157.1	173.7	-64.2	-47.7	0	0	0	113.5	G240 H242 V342	G240-F340 VanDerWaalsContact CA-CE2 3.48Å; G240-F340 WeakPolarHBondContact O-CE2 3.2Å; G240-F340 WeakPolarHBondContact O-CZ 3.18Å; H242-F340 AromaticContact CE1-CE1 3.61Å; H242-F340 AromaticContact CE1-CE2 3.71Å; H242-F340 AromaticContact CE1-CZ 3.14Å; H242-F340 WeakPolarHBondContact CE1-CZ 3.39Å; H242-F340 AromaticContact ND1-CE2 3.98Å; H242-F340 AromaticContact ND1-CZ 3.67Å; H242-F340 AromaticContact NE2-CE1 3.93Å; H242-F340 AromaticContact NE2-CE2 3.89Å; H242-F340 AromaticContact NE2-CZ 3.65Å; F340-V342 PolarHBondContact O-N 3.48Å
341	P	86.7	Confident	87.3	Confident	73 Å²	73	32.7 Å²	32.7	47%	0.474	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	103.2	178.8	-24.1	34.6	0	0	0	113.1	R330 T332	R330-P341 HydrophobicContact CB-CB 4.01Å; R330-P341 PolarHBondContact NH1-O 3.17Å; T332-P341 HydrophobicContact CG2-CG 4.26Å
342	V	87.6	Confident	87.1	Confident	16 Å²	16	32.7 Å²	32.7	10%	0.097	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	156.3	175.6	-68.4	0	0	0	0	111.2	R316 R330 S331 F338 F340 V344	R316-V342 HydrophobicContact CB-CB 4.01Å; R316-V342 HydrophobicContact CB-CG2 3.75Å; R316-V342 HydrophobicContact CG-CB 4.14Å; R316-V342 HydrophobicContact CG-CG1 4.36Å; R316-V342 HydrophobicContact CG-CG2 4.09Å; R330-V342 CarbonylContact C-O 3.51Å; R330-V342 WeakPolarHBondContact CA-O 3.27Å; R330-V342 WeakPolarHBondContact CB-O 3.48Å; S331-V342 PolarHBondContact N-O 3.15Å; S331-V342 VanDerWaalsContact O-CG2 3.3Å; S331-V342 WeakPolarHBondContact O-CG2 3.12Å; S331-V342 PolarHBondContact O-N 3.39Å; F338-V342 HydrophobicContact CB-CG1 3.92Å; F338-V342 HydrophobicContact CB-CG2 3.84Å; F338-V342 HydrophobicContact CD1-CG1 3.67Å; F338-V342 HydrophobicContact CD2-CG2 4.29Å; F338-V342 HydrophobicContact CE1-CG1 4.48Å; F338-V342 HydrophobicContact CG-CG1 3.89Å; F338-V342 HydrophobicContact CG-CG2 3.95Å; F340-V342 PolarHBondContact O-N 3.48Å; V342-V344 HydrophobicContact CG2-CG2 4.3Å
343	R	88.6	Confident	87.1	Confident	66 Å²	66	37.1 Å²	37.1	25%	0.249	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129.5	178.1	-175	177.4	-74.7	-132.5	12.8	110.4	H313 R316 S327	H313-R343 PolarHBondContact CD2-NH1 2.76Å; H313-R343 PolarHBondContact NE2-NH1 3.06Å; R316-R343 PolarHBondContact N-O 2.93Å; S327-R343 PolarHBondContact O-NH1 3.18Å; S327-R343 PolarHBondContact OG-NH1 3.28Å; S327-R343 VanDerWaalsContact OG-NH1 3.08Å
344	V	90.4	Very high	86.8	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.006	23%	0.231	C	C	.	.			trans	-132.2	141.6	-179.8	-176.7	0	0	0	0	107.7	K317 K329 V342 C348 I352	K317-V344 HydrophobicContact CB-CG1 4.2Å; K329-V344 PolarHBondContact O-N 2.68Å; V342-V344 HydrophobicContact CG2-CG2 4.3Å; V344-C348 HydrophobicContact CG1-CB 3.26Å; V344-I352 HydrophobicContact CG1-CD1 4.09Å; V344-I352 HydrophobicContact CG2-CD1 4.31Å
345	C	90	Very high	86.7	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.007	26%	0.257	C	S	.	.			trans	-65.5	150.3	175	76.2	0	0	0	0	110.5	C315 V322 C326 A347 C348 F349	C315-C345 HydrophobicContact CB-CB 4.14Å; C315-C345 PolarHBondContact SG-N 2.8Å; V322-C345 HydrophobicContact CG1-CB 4.07Å; C326-C345 VanDerWaalsContact O-CA 3.26Å; C326-C345 WeakPolarHBondContact O-CA 3.45Å; C326-C345 WeakPolarHBondContact O-CB 3.5Å; C345-A347 PolarHBondContact O-N 3.3Å; C345-A347 VanDerWaalsContact O-N 3.17Å; C345-C348 WeakPolarHBondContact O-CA 3.35Å; C345-C348 PolarHBondContact O-N 3.48Å; C345-C348 VanDerWaalsContact SG-CB 3.58Å; C345-C348 PolarHBondContact SG-N 3.28Å; C345-C348 PolarHBondContact SG-SG 3.37Å; C345-F349 PolarHBondContact O-N 3.41Å
346	D	88.6	Confident	86.5	Confident	42 Å²	42	49.3 Å²	49.3	23%	0.225	26%	0.255	C	S	.	.	H	α-helix	trans	-57.6	-40.2	-171.1	-54.4	-46.7	0	0	0	111.7	C326 S328 C348 F349 D350	C326-D346 VanDerWaalsContact C-OD2 3.24Å; C326-D346 WeakPolarHBondContact CA-OD2 3.39Å; C326-D346 PolarHBondContact O-N 3.17Å; C326-D346 VanDerWaalsContact O-N 3.14Å; S328-D346 PolarHBondContact N-OD1 2.82Å; S328-D346 PolarHBondContact OG-OD1 3.47Å; D346-C348 VanDerWaalsContact C-N 3.32Å; D346-C348 PolarHBondContact O-N 3.17Å; D346-F349 WeakPolarHBondContact O-CB 3.29Å; D346-F349 PolarHBondContact O-N 2.91Å; D346-F349 VanDerWaalsContact O-N 3.15Å; D346-D350 PolarHBondContact O-N 3.4Å
347	A	88.4	Confident	86.5	Confident	54 Å²	54	52.8 Å²	52.8	45%	0.446	27%	0.267	S	S	.	.	H	α-helix	trans	-61.1	-35.9	174.8	0	0	0	0	0	113.8	C345 T351	C345-A347 PolarHBondContact O-N 3.3Å; C345-A347 VanDerWaalsContact O-N 3.17Å; A347-T351 WeakPolarHBondContact O-CG2 3.46Å
348	C	88.1	Confident	86.6	Confident	17 Å²	17	56.5 Å²	56.5	12%	0.115	29%	0.29	C	S	.	.	H	α-helix	trans	-78	-32.9	176.4	-78.2	0	0	0	0	111.2	K317 V344 C345 D346 D350 T351 I352	K317-C348 HydrophobicContact CB-CB 4.19Å; K317-C348 HydrophobicContact CD-CB 4Å; K317-C348 HydrophobicContact CG-CB 4.49Å; V344-C348 HydrophobicContact CG1-CB 3.26Å; C345-C348 WeakPolarHBondContact O-CA 3.35Å; C345-C348 PolarHBondContact O-N 3.48Å; C345-C348 VanDerWaalsContact SG-CB 3.58Å; C345-C348 PolarHBondContact SG-N 3.28Å; C345-C348 PolarHBondContact SG-SG 3.37Å; D346-C348 VanDerWaalsContact C-N 3.32Å; D346-C348 PolarHBondContact O-N 3.17Å; C348-D350 VanDerWaalsContact C-N 3.29Å; C348-D350 PolarHBondContact O-N 2.75Å; C348-T351 PolarHBondContact O-N 3.25Å; C348-T351 VanDerWaalsContact O-N 3.15Å; C348-T351 PolarHBondContact O-OG1 3.24Å; C348-I352 WeakPolarHBondContact O-CG1 3.11Å; C348-I352 PolarHBondContact O-N 3.05Å
349	F	88.4	Confident	86.4	Confident	43 Å²	43	60.1 Å²	60.1	19%	0.189	31%	0.313	C	S	.	.	H	α-helix	trans	-58.6	-43.8	176.8	-178.9	-85.8	0	0	0	111.4	K329 R330 C345 D346 T351 I352	K329-F349 HydrophobicContact CB-CB 4.34Å; K329-F349 HydrophobicContact CB-CD1 4.49Å; K329-F349 HydrophobicContact CB-CD2 3.58Å; K329-F349 HydrophobicContact CB-CE2 3.94Å; K329-F349 HydrophobicContact CB-CG 3.88Å; K329-F349 HydrophobicContact CD-CB 4.08Å; K329-F349 HydrophobicContact CD-CD1 3.29Å; K329-F349 HydrophobicContact CD-CD2 3.95Å; K329-F349 HydrophobicContact CD-CE1 3.58Å; K329-F349 HydrophobicContact CD-CE2 4.2Å; K329-F349 HydrophobicContact CD-CG 3.48Å; K329-F349 VanDerWaalsContact CD-CG 3.48Å; K329-F349 HydrophobicContact CD-CZ 4.02Å; K329-F349 HydrophobicContact CG-CD2 4.42Å; K329-F349 HydrophobicContact CG-CG 4.34Å; R330-F349 WeakPolarHBondContact O-CE2 3.39Å; C345-F349 PolarHBondContact O-N 3.41Å; D346-F349 WeakPolarHBondContact O-CB 3.29Å; D346-F349 PolarHBondContact O-N 2.91Å; D346-F349 VanDerWaalsContact O-N 3.15Å; F349-T351 PolarHBondContact O-N 3.05Å; F349-I352 PolarHBondContact O-N 2.71Å; F349-I352 VanDerWaalsContact O-N 3.15Å
350	D	87.4	Confident	86.4	Confident	115 Å²	115	60.7 Å²	60.7	62%	0.615	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.1	-179	-58.3	-26.1	0	0	0	112.7	K329 D346 C348	K329-D350 IonicContact NZ-OD1 2.69Å; K329-D350 PolarHBondContact NZ-OD1 2.87Å; D346-D350 PolarHBondContact O-N 3.4Å; C348-D350 VanDerWaalsContact C-N 3.29Å; C348-D350 PolarHBondContact O-N 2.75Å
351	T	88.9	Confident	86.3	Confident	81 Å²	81	58.4 Å²	58.4	50%	0.497	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-10.2	175.1	64.1	0	0	0	0	114.3	K317 A347 C348 F349	K317-T351 PolarHBondContact NZ-OG1 3.08Å; A347-T351 WeakPolarHBondContact O-CG2 3.46Å; C348-T351 PolarHBondContact O-N 3.25Å; C348-T351 VanDerWaalsContact O-N 3.15Å; C348-T351 PolarHBondContact O-OG1 3.24Å; F349-T351 PolarHBondContact O-N 3.05Å
352	I	86	Confident	86.4	Confident	7 Å²	7	57.8 Å²	57.8	4%	0.036	30%	0.303	C	S	.	.			trans	-86.8	114.7	180	-64.8	167	0	0	0	108	K317 F333 V344 C348 F349 D356 R357	K317-I352 HydrophobicContact CD-CD1 4.15Å; K317-I352 HydrophobicContact CD-CG1 3.9Å; F333-I352 HydrophobicContact CD2-CD1 4.19Å; F333-I352 HydrophobicContact CD2-CG1 4.09Å; F333-I352 HydrophobicContact CD2-CG2 4.01Å; F333-I352 HydrophobicContact CE2-CG1 4.15Å; F333-I352 HydrophobicContact CE2-CG2 4.32Å; V344-I352 HydrophobicContact CG1-CD1 4.09Å; V344-I352 HydrophobicContact CG2-CD1 4.31Å; C348-I352 WeakPolarHBondContact O-CG1 3.11Å; C348-I352 PolarHBondContact O-N 3.05Å; F349-I352 PolarHBondContact O-N 2.71Å; F349-I352 VanDerWaalsContact O-N 3.15Å; I352-D356 HydrophobicContact CG2-CB 3.93Å; I352-R357 HydrophobicContact CG2-CG 3.86Å; I352-R357 PolarHBondContact O-NH2 2.97Å
353	K	86.6	Confident	86.4	Confident	127 Å²	127	61 Å²	61	55%	0.552	32%	0.316	S	S	*	.			trans	-81.5	169.6	178.4	-63.5	173.9	-179.8	179.4	0	111.2	E355 D356 R357	K353-E355 VanDerWaalsContact C-N 3.32Å; K353-E355 HydrophobicContact CB-CG 3.79Å; K353-E355 HydrophobicContact CD-CG 4.1Å; K353-E355 WeakPolarHBondContact CD-OE1 3.48Å; K353-E355 IonicContact NZ-OE1 3.4Å; K353-E355 PolarHBondContact NZ-OE1 3.11Å; K353-E355 PolarHBondContact O-N 2.88Å; K353-D356 PolarHBondContact N-OD2 2.82Å; K353-D356 VanDerWaalsContact N-OD2 3.07Å; K353-D356 PolarHBondContact O-N 2.77Å; K353-R357 WeakPolarHBondContact O-CG 3.37Å
354	E	80.8	Confident	86.4	Confident	160 Å²	160	59.1 Å²	59.1	75%	0.748	31%	0.31	S	S	*	.	S	Bend	trans	-65.6	-34.4	176.5	-67.7	-174.3	167.4	0	0	112.8	D356 R357	E354-D356 VanDerWaalsContact C-N 3.27Å; E354-D356 PolarHBondContact O-N 2.91Å; E354-R357 WeakPolarHBondContact O-CB 3.4Å; E354-R357 PolarHBondContact O-N 2.64Å
355	E	81.6	Confident	86.2	Confident	116 Å²	116	66.1 Å²	66.1	54%	0.542	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-58.1	-38.9	172.9	58.7	-173.8	173.4	0	0	112	K353 R357 T358	K353-E355 VanDerWaalsContact C-N 3.32Å; K353-E355 HydrophobicContact CB-CG 3.79Å; K353-E355 HydrophobicContact CD-CG 4.1Å; K353-E355 WeakPolarHBondContact CD-OE1 3.48Å; K353-E355 IonicContact NZ-OE1 3.4Å; K353-E355 PolarHBondContact NZ-OE1 3.11Å; K353-E355 PolarHBondContact O-N 2.88Å; E355-R357 PolarHBondContact O-N 2.73Å; E355-T358 WeakPolarHBondContact O-CG2 3.46Å; E355-T358 PolarHBondContact O-N 3.29Å; E355-T358 PolarHBondContact O-OG1 2.98Å
356	D	81.4	Confident	85.6	Confident	31 Å²	31	66.1 Å²	66.1	17%	0.166	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-72.7	-10.3	178.7	-58	-36.8	0	0	0	113.3	F333 P334 I335 I352 K353 E354	F333-D356 HydrophobicContact CD2-CB 4.06Å; F333-D356 HydrophobicContact CE2-CB 3.68Å; P334-D356 VanDerWaalsContact CD-O 3.25Å; P334-D356 WeakPolarHBondContact CD-O 3.46Å; I335-D356 HydrophobicContact CD1-CB 4.29Å; I352-D356 HydrophobicContact CG2-CB 3.93Å; K353-D356 PolarHBondContact N-OD2 2.82Å; K353-D356 VanDerWaalsContact N-OD2 3.07Å; K353-D356 PolarHBondContact O-N 2.77Å; E354-D356 VanDerWaalsContact C-N 3.27Å; E354-D356 PolarHBondContact O-N 2.91Å
357	R	82.7	Confident	85.3	Confident	87 Å²	87	72.1 Å²	72.1	33%	0.328	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-98.3	-5.4	179.7	-63.8	175.3	-170.9	166.8	7.6	112.4	I352 K353 E354 E355	I352-R357 HydrophobicContact CG2-CG 3.86Å; I352-R357 PolarHBondContact O-NH2 2.97Å; K353-R357 WeakPolarHBondContact O-CG 3.37Å; E354-R357 WeakPolarHBondContact O-CB 3.4Å; E354-R357 PolarHBondContact O-N 2.64Å; E355-R357 PolarHBondContact O-N 2.73Å
358	T	83.8	Confident	85.2	Confident	79 Å²	79	70.3 Å²	70.3	49%	0.485	35%	0.349	S	S	.	.	S	Bend	trans	-65.4	126.2	179.2	60.7	0	0	0	0	109.7	P334 E355 L360	P334-T358 WeakPolarHBondContact CB-O 3.35Å; P334-T358 WeakPolarHBondContact CG-O 3.27Å; E355-T358 WeakPolarHBondContact O-CG2 3.46Å; E355-T358 PolarHBondContact O-N 3.29Å; E355-T358 PolarHBondContact O-OG1 2.98Å; T358-L360 PolarHBondContact O-N 3.16Å
359	P	83.7	Confident	85.2	Confident	76 Å²	76	71.7 Å²	71.7	49%	0.494	36%	0.355	S	S	.	.			trans	-64	135.5	-176.1	26.2	-33.8	0	0	0	110.7	E339	E339-P359 VanDerWaalsContact OE2-CA 3.3Å; E339-P359 WeakPolarHBondContact OE2-CA 3.5Å; E339-P359 WeakPolarHBondContact OE2-CB 3.26Å
360	L	86.7	Confident	85.3	Confident	28 Å²	28	69.6 Å²	69.6	15%	0.147	35%	0.346	C	S	.	.	S	Bend	trans	-103.3	7.4	175.4	-62.8	-179.8	0	0	0	111.6	N270 T273 R275 P334 I335 E339 T358	N270-L360 PolarHBondContact N-O 3.2Å; T273-L360 HydrophobicContact CG2-CD2 3.9Å; R275-L360 VanDerWaalsContact NH2-CB 3.28Å; R275-L360 PolarHBondContact NH2-O 3.42Å; P334-L360 HydrophobicContact CB-CB 4.09Å; P334-L360 HydrophobicContact CB-CD1 4.14Å; P334-L360 HydrophobicContact CB-CG 3.79Å; I335-L360 HydrophobicContact CG1-CD1 4.42Å; E339-L360 WeakPolarHBondContact OE1-CA 3.36Å; E339-L360 WeakPolarHBondContact OE1-CB 3.3Å; E339-L360 PolarHBondContact OE1-N 3.47Å; E339-L360 PolarHBondContact OE2-N 2.91Å; T358-L360 PolarHBondContact O-N 3.16Å
361	A	86.4	Confident	85.3	Confident	6 Å²	6	65.6 Å²	65.6	5%	0.05	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.8	171.8	0	0	0	0	0	111.2	V268 W269 E339 F363	V268-A361 CarbonylContact O-C 3.51Å; V268-A361 WeakPolarHBondContact O-CA 3.03Å; W269-A361 HydrophobicContact CD2-CB 3.9Å; W269-A361 HydrophobicContact CE3-CB 3.68Å; W269-A361 HydrophobicContact CG-CB 4.41Å; W269-A361 HydrophobicContact CH2-CB 4.46Å; W269-A361 HydrophobicContact CZ3-CB 3.99Å; E339-A361 HydrophobicContact CG-CB 3.96Å; E339-A361 PolarHBondContact OE1-N 3.01Å; E339-A361 VanDerWaalsContact OE1-N 3.13Å; A361-F363 HydrophobicContact CB-CE1 4.48Å; A361-F363 HydrophobicContact CB-CE2 4.13Å; A361-F363 HydrophobicContact CB-CZ 3.9Å
362	T	88.3	Confident	85.5	Confident	61 Å²	61	64.5 Å²	64.5	37%	0.374	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.4	167.6	59	0	0	0	0	109.8	A267 V268 H364	A267-T362 WeakPolarHBondContact CA-O 3.33Å; V268-T362 PolarHBondContact N-O 2.81Å; V268-T362 PolarHBondContact O-N 2.66Å; T362-H364 PolarHBondContact OG1-NE2 3.15Å
363	F	88.2	Confident	85.9	Confident	84 Å²	84	64.7 Å²	64.7	37%	0.368	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.1	-177.3	-60.3	-80.1	0	0	0	110.7	G240 A267 E339 A361	G240-F363 WeakPolarHBondContact O-CE1 3.3Å; A267-F363 HydrophobicContact CB-CD1 3.66Å; A267-F363 HydrophobicContact CB-CE1 3.6Å; E339-F363 HydrophobicContact CB-CE2 3.9Å; E339-F363 HydrophobicContact CB-CZ 3.62Å; E339-F363 HydrophobicContact CG-CE2 4.28Å; E339-F363 HydrophobicContact CG-CZ 3.88Å; A361-F363 HydrophobicContact CB-CE1 4.48Å; A361-F363 HydrophobicContact CB-CE2 4.13Å; A361-F363 HydrophobicContact CB-CZ 3.9Å
364	H	88.8	Confident	86.2	Confident	26 Å²	26	59.9 Å²	59.9	12%	0.12	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	152.3	-179.5	-52.4	-69.4	0	0	0	110.4	A12 P14 I266 T362 V399	A12-H364 PolarHBondContact O-CE1 2.81Å; P14-H364 VanDerWaalsContact CD-CG 3.43Å; P14-H364 VanDerWaalsContact CD-ND1 3.31Å; P14-H364 WeakPolarHBondContact CD-ND1 3.3Å; P14-H364 HydrophobicContact CG-CB 3.69Å; I266-H364 HydrophobicContact CB-CB 4.4Å; I266-H364 PolarHBondContact N-O 2.97Å; I266-H364 PolarHBondContact O-N 2.62Å; T362-H364 PolarHBondContact OG1-NE2 3.15Å; H364-V399 WeakPolarHBondContact NE2-CG1 3.48Å
365	E	85.9	Confident	86.7	Confident	148 Å²	148	52.5 Å²	52.5	69%	0.692	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.7	178.7	-68.9	-177.1	174.3	0	0	111.3	K367	E365-K367 VanDerWaalsContact C-N 3.27Å; E365-K367 HydrophobicContact CB-CG 4.28Å
366	G	77.6	Confident	87.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.243	C	C	.	.			trans	-75.9	-13.7	170	0	0	0	0	0	113.5	G264 H368 K392 W394	G264-G366 WeakPolarHBondContact O-CA 3.44Å; G264-G366 PolarHBondContact O-N 3.11Å; G366-H368 PolarHBondContact O-N 3.17Å; G366-K392 PolarHBondContact O-NZ 3.15Å; G366-W394 WeakPolarHBondContact O-CZ2 3.43Å
367	K	81.6	Confident	87.2	Confident	169 Å²	169	48.9 Å²	48.9	74%	0.735	25%	0.252	S	S	*	.	S	Bend	trans	55	28.6	-180	-54.3	-178.1	179	-177.6	0	114	E365 K392	E365-K367 VanDerWaalsContact C-N 3.27Å; E365-K367 HydrophobicContact CB-CG 4.28Å; K367-K392 PolarHBondContact O-NZ 3.35Å; K367-K392 VanDerWaalsContact O-NZ 3.1Å
368	H	86.7	Confident	87.3	Confident	16 Å²	16	47.5 Å²	47.5	7%	0.074	26%	0.255	C	S	.	.	S	Bend	trans	-160.7	163.5	167.7	67.4	167.6	0	0	0	110.3	G264 G366 I370 T384 D388 K392	G264-H368 WeakPolarHBondContact CA-O 3.43Å; G366-H368 PolarHBondContact O-N 3.17Å; H368-I370 PolarHBondContact O-N 3.34Å; H368-T384 PolarHBondContact CE1-OG1 2.82Å; H368-T384 PolarHBondContact NE2-OG1 2.97Å; H368-D388 HydrophobicContact CB-CB 4.42Å; H368-D388 WeakPolarHBondContact CB-OD2 3.41Å; H368-D388 IonicContact CG-OD2 2.86Å; H368-D388 VanDerWaalsContact CG-OD2 3.3Å; H368-D388 VanDerWaalsContact ND1-CG 3.32Å; H368-D388 IonicContact ND1-OD1 3.66Å; H368-D388 PolarHBondContact ND1-OD1 2.91Å; H368-D388 IonicContact ND1-OD2 3.7Å; H368-D388 PolarHBondContact ND1-OD2 3.47Å; H368-K392 VanDerWaalsContact CB-NZ 3.28Å
369	N	87.1	Confident	87.3	Confident	45 Å²	45	46.9 Å²	46.9	24%	0.241	24%	0.244	C	C	.	.			trans	-63.7	126.5	170	177.4	11.8	0	0	0	110	A262 G386 S387	A262-N369 WeakPolarHBondContact CA-OD1 3.47Å; A262-N369 WeakPolarHBondContact O-CA 2.93Å; A262-N369 PolarHBondContact O-OD1 3.46Å; A262-N369 VanDerWaalsContact O-OD1 3.08Å; N369-G386 WeakPolarHBondContact O-CA 3.48Å; N369-S387 PolarHBondContact ND2-OG 2.91Å
370	I	90.1	Very high	87.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.			trans	-103.4	108.3	178.4	-57.3	168.1	0	0	0	108.2	Q246 C260 I266 H368 H372 T384	Q246-I370 VanDerWaalsContact CB-O 3.31Å; Q246-I370 WeakPolarHBondContact CB-O 3.47Å; C260-I370 HydrophobicContact CB-CB 4.02Å; C260-I370 HydrophobicContact CB-CD1 3.91Å; C260-I370 HydrophobicContact CB-CG2 3.6Å; I266-I370 HydrophobicContact CD1-CD1 3.94Å; I266-I370 HydrophobicContact CG1-CD1 3.63Å; H368-I370 PolarHBondContact O-N 3.34Å; I370-H372 WeakPolarHBondContact CG2-O 3.09Å; I370-T384 HydrophobicContact CD1-CG2 4.28Å; I370-T384 HydrophobicContact CG2-CG2 4.32Å
371	A	89.1	Confident	87.8	Confident	30 Å²	30	42.9 Å²	42.9	25%	0.248	22%	0.219	C	C	.	.	S	Bend	trans	-87.4	-35.1	172.7	0	0	0	0	0	111.8	C385	A371-C385 PolarHBondContact N-O 3.39Å
372	H	92.1	Very high	88.1	Confident	59 Å²	59	42.6 Å²	42.6	27%	0.273	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	150.1	179.3	-170.1	86.4	0	0	0	110.9	N28 A30 I370 C385	N28-H372 WeakPolarHBondContact O-CB 3.4Å; A30-H372 PolarHBondContact O-CD2 3.37Å; I370-H372 WeakPolarHBondContact CG2-O 3.09Å; H372-C385 PolarHBondContact N-O 3.08Å; H372-C385 PolarHBondContact O-N 3.19Å; H372-C385 VanDerWaalsContact O-N 3.09Å
373	M	94.3	Very high	88.4	Confident	11 Å²	11	39.7 Å²	39.7	5%	0.054	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	136.1	176	176.2	-163.4	62	0	0	108.9	A247 R249 L258 C260 M382 V383 T384	A247-M373 HydrophobicContact CB-CB 3.69Å; A247-M373 HydrophobicContact CB-CE 4.47Å; R249-M373 HydrophobicContact CB-CE 3.5Å; R249-M373 VanDerWaalsContact CB-CE 3.5Å; L258-M373 HydrophobicContact CB-CE 4.02Å; L258-M373 HydrophobicContact CB-SD 4.29Å; C260-M373 PolarHBondContact SG-SD 2.85Å; M373-M382 HydrophobicContact CG-CG 3.73Å; M373-M382 HydrophobicContact CG-SD 3.91Å; M373-M382 HydrophobicContact SD-CG 4.04Å; M373-M382 HydrophobicContact SD-SD 3.47Å; M373-V383 VanDerWaalsContact CA-O 3.31Å; M373-V383 WeakPolarHBondContact CA-O 3.33Å; M373-T384 HydrophobicContact CB-CG2 4.45Å; M373-T384 HydrophobicContact CG-CG2 4.25Å
374	D	93.6	Very high	88.7	Confident	26 Å²	26	35.7 Å²	35.7	14%	0.139	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	151.7	165.4	-178.7	42.7	0	0	0	109.8	A30 V31 L32 R249 M382 V383	A30-D374 WeakPolarHBondContact O-CB 3.12Å; V31-D374 HydrophobicContact CG2-CB 4.38Å; L32-D374 PolarHBondContact N-OD2 3.26Å; L32-D374 VanDerWaalsContact N-OD2 3.12Å; R249-D374 IonicContact NH1-OD1 3.7Å; D374-M382 CarbonylContact O-C 3.56Å; D374-M382 WeakPolarHBondContact O-CA 3.49Å; D374-V383 HydrophobicContact CB-CG1 3.78Å; D374-V383 PolarHBondContact N-O 3.41Å; D374-V383 VanDerWaalsContact N-O 3.08Å; D374-V383 PolarHBondContact O-N 3.22Å
375	M	91.1	Very high	88.9	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.02	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	134.4	-178.1	-173.2	-175.8	-178.3	0	0	110.2	R249 L251 L258 P377 L381 M382 M396 V400	R249-M375 HydrophobicContact CG-CB 4.36Å; L251-M375 HydrophobicContact CD1-CE 4.14Å; L251-M375 HydrophobicContact CD1-SD 3.83Å; L251-M375 HydrophobicContact CD2-SD 3.72Å; L251-M375 HydrophobicContact CG-SD 4.31Å; L258-M375 HydrophobicContact CD1-CE 4.43Å; L258-M375 HydrophobicContact CD1-SD 3.25Å; L258-M375 WeakPolarHBondContact CD1-SD 3.49Å; M375-P377 VanDerWaalsContact O-CD 3.31Å; M375-P377 WeakPolarHBondContact O-CD 3.46Å; M375-L381 WeakPolarHBondContact CA-O 3.47Å; M375-L381 VanDerWaalsContact CG-O 3.27Å; M375-L381 WeakPolarHBondContact CG-O 3.41Å; M375-M382 HydrophobicContact CB-CB 4.49Å; M375-M382 HydrophobicContact CG-CB 4.27Å; M375-M396 HydrophobicContact CE-CB 3.99Å; M375-V400 HydrophobicContact CE-CB 4.32Å; M375-V400 HydrophobicContact CE-CG1 4.17Å; M375-V400 HydrophobicContact CE-CG2 4.1Å
376	D	89.7	Confident	89	Confident	19 Å²	19	27.5 Å²	27.5	10%	0.102	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	102.8	164.4	-175.2	-14.9	0	0	0	109.2	L32 S378 R379 G380 L381	L32-D376 HydrophobicContact CD1-CB 4.16Å; D376-S378 PolarHBondContact O-N 2.87Å; D376-S378 WeakPolarHBondContact OD1-CB 3.45Å; D376-S378 PolarHBondContact OD1-N 3.41Å; D376-S378 PolarHBondContact OD1-OG 3.27Å; D376-S378 PolarHBondContact OD2-OG 2.74Å; D376-R379 PolarHBondContact O-N 3.5Å; D376-R379 VanDerWaalsContact OD2-CD 3.27Å; D376-R379 WeakPolarHBondContact OD2-CD 3.36Å; D376-G380 WeakPolarHBondContact O-CA 3.13Å; D376-G380 PolarHBondContact O-N 3.19Å; D376-L381 PolarHBondContact N-O 3.14Å; D376-L381 PolarHBondContact O-N 3.37Å
377	P	83.8	Confident	89.5	Confident	53 Å²	53	30.8 Å²	30.8	34%	0.344	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-25.3	-178.6	-19.2	34.2	0	0	0	113.1	L251 M375	L251-P377 HydrophobicContact CD2-CB 4.07Å; L251-P377 HydrophobicContact CD2-CG 3.72Å; M375-P377 VanDerWaalsContact O-CD 3.31Å; M375-P377 WeakPolarHBondContact O-CD 3.46Å
378	S	84.1	Confident	89.8	Confident	57 Å²	57	25 Å²	25	40%	0.399	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-38.5	-176.8	71.9	0	0	0	0	111.5	D376	D376-S378 PolarHBondContact O-N 2.87Å; D376-S378 WeakPolarHBondContact OD1-CB 3.45Å; D376-S378 PolarHBondContact OD1-N 3.41Å; D376-S378 PolarHBondContact OD1-OG 3.27Å; D376-S378 PolarHBondContact OD2-OG 2.74Å
379	R	85.4	Confident	90	Very high	67 Å²	67	30.4 Å²	30.4	25%	0.253	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-12.1	179.1	-63.9	169.3	60.2	-174.1	3.4	112.9	E36 D37 D376 L381 T397	E36-R379 PolarHBondContact O-NH1 2.98Å; D37-R379 IonicContact OD1-CZ 2.78Å; D37-R379 IonicContact OD1-NH1 3.6Å; D37-R379 IonicContact OD1-NH2 3.51Å; D37-R379 PolarHBondContact OD1-NH2 2.84Å; D376-R379 PolarHBondContact O-N 3.5Å; D376-R379 VanDerWaalsContact OD2-CD 3.27Å; D376-R379 WeakPolarHBondContact OD2-CD 3.36Å; R379-L381 HydrophobicContact CB-CB 4.46Å; R379-L381 HydrophobicContact CB-CD1 4.3Å; R379-L381 HydrophobicContact CB-CG 4.01Å; R379-L381 VanDerWaalsContact CZ-CD1 3.47Å; R379-L381 PolarHBondContact O-N 2.97Å; R379-T397 WeakPolarHBondContact O-CG2 3.26Å
380	G	87.6	Confident	90.2	Very high	3 Å²	3	29.9 Å²	29.9	3%	0.031	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	65	24.9	-172.3	0	0	0	0	0	112.8	D376 M396	D376-G380 WeakPolarHBondContact O-CA 3.13Å; D376-G380 PolarHBondContact O-N 3.19Å; G380-M396 WeakPolarHBondContact O-CA 3.24Å; G380-M396 WeakPolarHBondContact O-CB 3.22Å; G380-M396 PolarHBondContact O-N 2.78Å
381	L	91.8	Very high	90.4	Very high	16 Å²	16	29.9 Å²	29.9	8%	0.084	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	140.6	177.8	-66.8	-176.8	0	0	0	110.5	L17 L32 M375 D376 R379 W394	L17-L381 HydrophobicContact CD1-CD2 3.48Å; L17-L381 VanDerWaalsContact CD1-CD2 3.48Å; L32-L381 HydrophobicContact CD1-CB 4.01Å; L32-L381 WeakPolarHBondContact CD1-O 3.45Å; M375-L381 WeakPolarHBondContact CA-O 3.47Å; M375-L381 VanDerWaalsContact CG-O 3.27Å; M375-L381 WeakPolarHBondContact CG-O 3.41Å; D376-L381 PolarHBondContact N-O 3.14Å; D376-L381 PolarHBondContact O-N 3.37Å; R379-L381 HydrophobicContact CB-CB 4.46Å; R379-L381 HydrophobicContact CB-CD1 4.3Å; R379-L381 HydrophobicContact CB-CG 4.01Å; R379-L381 VanDerWaalsContact CZ-CD1 3.47Å; R379-L381 PolarHBondContact O-N 2.97Å; L381-W394 WeakPolarHBondContact CA-O 3.22Å
382	M	93.3	Very high	90.6	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.8	176.5	177.6	-176.5	72	0	0	109.3	I266 M373 D374 M375 T384 I393 W394 M396	I266-M382 HydrophobicContact CD1-CE 3.63Å; M373-M382 HydrophobicContact CG-CG 3.73Å; M373-M382 HydrophobicContact CG-SD 3.91Å; M373-M382 HydrophobicContact SD-CG 4.04Å; M373-M382 HydrophobicContact SD-SD 3.47Å; D374-M382 CarbonylContact O-C 3.56Å; D374-M382 WeakPolarHBondContact O-CA 3.49Å; M375-M382 HydrophobicContact CB-CB 4.49Å; M375-M382 HydrophobicContact CG-CB 4.27Å; M382-T384 HydrophobicContact CE-CG2 4.01Å; M382-T384 HydrophobicContact CG-CG2 4.32Å; M382-T384 HydrophobicContact SD-CG2 4.38Å; M382-I393 CarbonylContact O-C 3.22Å; M382-I393 WeakPolarHBondContact O-CA 3.15Å; M382-W394 HydrophobicContact CB-CB 4.38Å; M382-W394 HydrophobicContact CE-CB 3.84Å; M382-W394 HydrophobicContact CE-CG 3.77Å; M382-W394 PolarHBondContact N-O 3.5Å; M382-W394 PolarHBondContact O-N 3.03Å; M382-M396 HydrophobicContact CB-CG 3.66Å; M382-M396 HydrophobicContact CE-CE 4.39Å; M382-M396 HydrophobicContact CE-CG 4Å; M382-M396 HydrophobicContact CE-SD 3.6Å; M382-M396 VanDerWaalsContact CE-SD 3.6Å; M382-M396 HydrophobicContact SD-CE 4.39Å; M382-M396 HydrophobicContact SD-CG 4.09Å; M382-M396 HydrophobicContact SD-SD 4.15Å
383	V	94.5	Very high	90.7	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.6	172.7	66.8	0	0	0	0	109.4	A30 L32 V39 M373 D374 V391 K392 I393	A30-V383 HydrophobicContact CB-CG1 4.34Å; A30-V383 HydrophobicContact CB-CG2 3.94Å; L32-V383 HydrophobicContact CD1-CB 4.27Å; L32-V383 HydrophobicContact CD1-CG1 4.23Å; L32-V383 HydrophobicContact CD2-CB 4.32Å; L32-V383 HydrophobicContact CG-CB 3.99Å; L32-V383 HydrophobicContact CG-CG1 3.85Å; V39-V383 HydrophobicContact CG1-CG2 4.1Å; M373-V383 VanDerWaalsContact CA-O 3.31Å; M373-V383 WeakPolarHBondContact CA-O 3.33Å; D374-V383 HydrophobicContact CB-CG1 3.78Å; D374-V383 PolarHBondContact N-O 3.41Å; D374-V383 VanDerWaalsContact N-O 3.08Å; D374-V383 PolarHBondContact O-N 3.22Å; V383-V391 HydrophobicContact CG2-CG1 3.26Å; V383-K392 WeakPolarHBondContact CA-O 3.17Å; V383-I393 HydrophobicContact CG2-CG1 4.4Å
384	T	94.3	Very high	90.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.7	173.5	64.9	0	0	0	0	109.9	H368 I370 M373 M382 K392 W394	H368-T384 PolarHBondContact CE1-OG1 2.82Å; H368-T384 PolarHBondContact NE2-OG1 2.97Å; I370-T384 HydrophobicContact CD1-CG2 4.28Å; I370-T384 HydrophobicContact CG2-CG2 4.32Å; M373-T384 HydrophobicContact CB-CG2 4.45Å; M373-T384 HydrophobicContact CG-CG2 4.25Å; M382-T384 HydrophobicContact CE-CG2 4.01Å; M382-T384 HydrophobicContact CG-CG2 4.32Å; M382-T384 HydrophobicContact SD-CG2 4.38Å; T384-K392 PolarHBondContact N-O 3.47Å; T384-K392 PolarHBondContact O-N 3.33Å; T384-W394 PolarHBondContact OG1-NE1 2.89Å
385	C	93.6	Very high	90.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	159.7	175.2	71.5	0	0	0	0	111	V27 A30 A371 H372 V391	V27-C385 HydrophobicContact CB-CB 3.95Å; V27-C385 HydrophobicContact CG1-CB 3.73Å; V27-C385 PolarHBondContact O-SG 2.74Å; V27-C385 VanDerWaalsContact O-SG 3.37Å; A30-C385 HydrophobicContact CB-CB 3.96Å; A371-C385 PolarHBondContact N-O 3.39Å; H372-C385 PolarHBondContact N-O 3.08Å; H372-C385 PolarHBondContact O-N 3.19Å; H372-C385 VanDerWaalsContact O-N 3.09Å; C385-V391 HydrophobicContact CB-CG1 4.47Å; C385-V391 HydrophobicContact CB-CG2 3.91Å
386	G	88.8	Confident	90.3	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.01	14%	0.141	C	C	.	.			trans	-170.4	-151.7	173.7	0	0	0	0	0	114.6	V27 N369 D388 R389	V27-G386 PolarHBondContact N-O 3.44Å; V27-G386 VanDerWaalsContact N-O 3.09Å; N369-G386 WeakPolarHBondContact O-CA 3.48Å; G386-D388 PolarHBondContact O-N 2.97Å; G386-R389 PolarHBondContact O-N 2.84Å
387	S	87.8	Confident	90.2	Very high	69 Å²	69	27.6 Å²	27.6	48%	0.483	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-8.4	-173	62.8	0	0	0	0	114.1	N369 R389	N369-S387 PolarHBondContact ND2-OG 2.91Å; S387-R389 PolarHBondContact O-N 2.95Å
388	D	87.9	Confident	90.1	Very high	49 Å²	49	31 Å²	31	26%	0.262	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	0.7	177.3	69.6	-23.7	0	0	0	113.1	H368 G386 I390	H368-D388 HydrophobicContact CB-CB 4.42Å; H368-D388 WeakPolarHBondContact CB-OD2 3.41Å; H368-D388 IonicContact CG-OD2 2.86Å; H368-D388 VanDerWaalsContact CG-OD2 3.3Å; H368-D388 VanDerWaalsContact ND1-CG 3.32Å; H368-D388 IonicContact ND1-OD1 3.66Å; H368-D388 PolarHBondContact ND1-OD1 2.91Å; H368-D388 IonicContact ND1-OD2 3.7Å; H368-D388 PolarHBondContact ND1-OD2 3.47Å; G386-D388 PolarHBondContact O-N 2.97Å; D388-I390 WeakPolarHBondContact O-CG1 3.25Å; D388-I390 PolarHBondContact O-N 2.82Å; D388-I390 PolarHBondContact OD1-N 2.91Å
389	R	91.1	Very high	90	Very high	129 Å²	129	29 Å²	29	49%	0.487	14%	0.142	S	C	.	.	S	Bend	trans	67.6	6	179.1	-38.9	177.5	-176.6	169	-0.8	113.8	H23 S24 D25 G386 S387	H23-R389 HydrophobicContact CB-CB 4.49Å; S24-R389 WeakPolarHBondContact O-CD 3.28Å; S24-R389 PolarHBondContact O-NE 3.11Å; S24-R389 PolarHBondContact O-NH1 2.68Å; D25-R389 WeakPolarHBondContact O-CB 3.42Å; D25-R389 WeakPolarHBondContact O-CG 3.27Å; G386-R389 PolarHBondContact O-N 2.84Å; S387-R389 PolarHBondContact O-N 2.95Å
390	I	91.1	Very high	89.7	Confident	34 Å²	34	26.1 Å²	26.1	17%	0.174	13%	0.132	C	C	.	.			trans	-107.4	139.6	-176.7	-57.1	175.6	0	0	0	108.4	K19 E21 D388 K392	K19-I390 HydrophobicContact CB-CG2 4.2Å; E21-I390 HydrophobicContact CG-CD1 4.47Å; E21-I390 HydrophobicContact CG-CG1 4.16Å; E21-I390 HydrophobicContact CG-CG2 4.38Å; D388-I390 WeakPolarHBondContact O-CG1 3.25Å; D388-I390 PolarHBondContact O-N 2.82Å; D388-I390 PolarHBondContact OD1-N 2.91Å; I390-K392 HydrophobicContact CG2-CG 4.12Å
391	V	93.2	Very high	88.6	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127	167.8	-176.4	0	0	0	0	108.6	K19 I20 V27 A30 V39 T41 V383 C385	K19-V391 WeakPolarHBondContact CA-O 3.27Å; I20-V391 HydrophobicContact CB-CB 4.19Å; I20-V391 PolarHBondContact N-O 3.34Å; I20-V391 PolarHBondContact O-N 3.44Å; V27-V391 HydrophobicContact CB-CG2 4.3Å; V27-V391 HydrophobicContact CG1-CG2 3.87Å; V27-V391 HydrophobicContact CG2-CG2 4.12Å; A30-V391 HydrophobicContact CB-CG1 4.02Å; V39-V391 HydrophobicContact CG1-CG1 4.34Å; T41-V391 HydrophobicContact CG2-CG1 4.49Å; T41-V391 HydrophobicContact CG2-CG2 3.8Å; V383-V391 HydrophobicContact CG2-CG1 3.26Å; C385-V391 HydrophobicContact CB-CG1 4.47Å; C385-V391 HydrophobicContact CB-CG2 3.91Å
392	K	93.9	Very high	86.8	Confident	10 Å²	10	28.6 Å²	28.6	4%	0.043	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.5	-179.1	-69.1	-178.5	-175.7	157.3	0	109.8	L16 K19 G366 K367 H368 V383 T384 I390 W394	L16-K392 HydrophobicContact CD1-CB 3.72Å; L16-K392 HydrophobicContact CD1-CD 4.13Å; L16-K392 HydrophobicContact CD1-CG 4.01Å; K19-K392 HydrophobicContact CG-CG 4.39Å; G366-K392 PolarHBondContact O-NZ 3.15Å; K367-K392 PolarHBondContact O-NZ 3.35Å; K367-K392 VanDerWaalsContact O-NZ 3.1Å; H368-K392 VanDerWaalsContact CB-NZ 3.28Å; V383-K392 WeakPolarHBondContact CA-O 3.17Å; T384-K392 PolarHBondContact N-O 3.47Å; T384-K392 PolarHBondContact O-N 3.33Å; I390-K392 HydrophobicContact CG2-CG 4.12Å; K392-W394 HydrophobicContact CB-CZ2 4.16Å; K392-W394 HydrophobicContact CD-CH2 4.42Å; K392-W394 HydrophobicContact CD-CZ2 3.59Å
393	I	93.1	Very high	84.5	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.2	175.6	-55.7	175.2	0	0	0	108.3	L17 N18 I20 V39 Y59 M382 V383	L17-I393 HydrophobicContact CD1-CG2 4.48Å; L17-I393 PolarHBondContact N-O 2.7Å; N18-I393 PolarHBondContact N-O 3.41Å; N18-I393 PolarHBondContact O-N 2.96Å; I20-I393 HydrophobicContact CD1-CD1 4.13Å; V39-I393 HydrophobicContact CG2-CD1 3.63Å; V39-I393 HydrophobicContact CG2-CG1 4.28Å; Y59-I393 HydrophobicContact CD2-CD1 4.22Å; Y59-I393 HydrophobicContact CE1-CD1 3.95Å; Y59-I393 HydrophobicContact CE2-CD1 3.43Å; Y59-I393 VanDerWaalsContact CE2-CD1 3.43Å; Y59-I393 VanDerWaalsContact OH-CD1 3.27Å; Y59-I393 WeakPolarHBondContact OH-CD1 3.45Å; M382-I393 CarbonylContact O-C 3.22Å; M382-I393 WeakPolarHBondContact O-CA 3.15Å; V383-I393 HydrophobicContact CG2-CG1 4.4Å
394	W	92.3	Very high	82.1	Confident	13 Å²	13	38.7 Å²	38.7	5%	0.049	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	142.1	-174.6	-53.8	87.5	0	0	0	110.5	P14 V15 L16 G366 L381 M382 T384 K392	P14-W394 HydrophobicContact CB-CE3 4.2Å; V15-W394 CarbonylContact O-C 3.6Å; V15-W394 WeakPolarHBondContact O-CA 3.47Å; L16-W394 HydrophobicContact CB-CE3 3.8Å; L16-W394 HydrophobicContact CB-CH2 4.26Å; L16-W394 HydrophobicContact CB-CZ3 3.67Å; L16-W394 HydrophobicContact CD1-CD2 3.91Å; L16-W394 HydrophobicContact CD1-CE3 4.04Å; L16-W394 HydrophobicContact CD1-CH2 4.09Å; L16-W394 HydrophobicContact CD1-CZ2 3.95Å; L16-W394 HydrophobicContact CD1-CZ3 4.14Å; L16-W394 HydrophobicContact CG-CZ3 4.41Å; G366-W394 WeakPolarHBondContact O-CZ2 3.43Å; L381-W394 WeakPolarHBondContact CA-O 3.22Å; M382-W394 HydrophobicContact CB-CB 4.38Å; M382-W394 HydrophobicContact CE-CB 3.84Å; M382-W394 HydrophobicContact CE-CG 3.77Å; M382-W394 PolarHBondContact N-O 3.5Å; M382-W394 PolarHBondContact O-N 3.03Å; T384-W394 PolarHBondContact OG1-NE1 2.89Å; K392-W394 HydrophobicContact CB-CZ2 4.16Å; K392-W394 HydrophobicContact CD-CH2 4.42Å; K392-W394 HydrophobicContact CD-CZ2 3.59Å
395	D	91.3	Very high	79.3	Confident	43 Å²	43	42.5 Å²	42.5	23%	0.23	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	115.9	163.9	-173.7	-10.5	0	0	0	109.1	P14 V15 L17 T397	P14-D395 WeakPolarHBondContact CA-O 3.27Å; V15-D395 HydrophobicContact CB-CB 4.24Å; V15-D395 PolarHBondContact N-O 2.85Å; V15-D395 PolarHBondContact O-N 3.48Å; L17-D395 HydrophobicContact CD1-CB 4.01Å; L17-D395 HydrophobicContact CD2-CB 4.09Å; L17-D395 HydrophobicContact CG-CB 3.97Å; D395-T397 WeakPolarHBondContact OD1-CB 3.47Å; D395-T397 WeakPolarHBondContact OD1-CG2 3.39Å; D395-T397 PolarHBondContact OD1-N 2.87Å; D395-T397 PolarHBondContact OD1-OG1 2.97Å; D395-T397 PolarHBondContact OD2-OG1 2.79Å
396	M	88.8	Confident	76.6	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.285	C	S	.	.			trans	-104.8	3.5	178.7	-64.8	-65.9	-70.6	0	0	112.2	P14 L258 V268 M375 G380 M382 Q398 V399 V400	P14-M396 HydrophobicContact CB-SD 3.53Å; P14-M396 VanDerWaalsContact CB-SD 3.53Å; L258-M396 HydrophobicContact CD2-CE 4.02Å; V268-M396 HydrophobicContact CG2-CE 4.13Å; M375-M396 HydrophobicContact CE-CB 3.99Å; G380-M396 WeakPolarHBondContact O-CA 3.24Å; G380-M396 WeakPolarHBondContact O-CB 3.22Å; G380-M396 PolarHBondContact O-N 2.78Å; M382-M396 HydrophobicContact CB-CG 3.66Å; M382-M396 HydrophobicContact CE-CE 4.39Å; M382-M396 HydrophobicContact CE-CG 4Å; M382-M396 HydrophobicContact CE-SD 3.6Å; M382-M396 VanDerWaalsContact CE-SD 3.6Å; M382-M396 HydrophobicContact SD-CE 4.39Å; M382-M396 HydrophobicContact SD-CG 4.09Å; M382-M396 HydrophobicContact SD-SD 4.15Å; M396-Q398 VanDerWaalsContact C-N 3.27Å; M396-Q398 PolarHBondContact O-N 3.1Å; M396-V399 HydrophobicContact CE-CB 4.17Å; M396-V399 HydrophobicContact CE-CG1 4.06Å; M396-V399 PolarHBondContact O-N 3.47Å; M396-V400 HydrophobicContact CB-CG2 4.09Å; M396-V400 HydrophobicContact CE-CG2 4.13Å; M396-V400 PolarHBondContact O-N 2.96Å
397	T	86.6	Confident	73.9	Confident	33 Å²	33	51.7 Å²	51.7	20%	0.202	31%	0.313	C	S	.	.	I	π-helix	trans	-55.3	-40.2	-173.9	55.7	0	0	0	0	112.7	R379 D395 G401 S402	R379-T397 WeakPolarHBondContact O-CG2 3.26Å; D395-T397 WeakPolarHBondContact OD1-CB 3.47Å; D395-T397 WeakPolarHBondContact OD1-CG2 3.39Å; D395-T397 PolarHBondContact OD1-N 2.87Å; D395-T397 PolarHBondContact OD1-OG1 2.97Å; D395-T397 PolarHBondContact OD2-OG1 2.79Å; T397-G401 CarbonylContact O-C 3.59Å; T397-G401 WeakPolarHBondContact O-CA 3.22Å; T397-G401 PolarHBondContact O-N 3.23Å; T397-S402 PolarHBondContact O-N 2.86Å
398	Q	82	Confident	71.2	Confident	126 Å²	126	58.2 Å²	58.2	59%	0.589	33%	0.333	S	S	*	.	I	π-helix	trans	-71.9	-33.7	178.6	-62.1	-168.3	1.4	0	0	113	A12 M396	A12-Q398 HydrophobicContact CB-CB 4.01Å; A12-Q398 WeakPolarHBondContact CB-O 3.48Å; M396-Q398 VanDerWaalsContact C-N 3.27Å; M396-Q398 PolarHBondContact O-N 3.1Å
399	V	81.7	Confident	68.1	Low	13 Å²	13	60.7 Å²	60.7	8%	0.079	36%	0.355	C	S	.	.	I	π-helix	trans	-80.5	-48.2	-174.7	-178.8	0	0	0	0	110.4	A12 P14 V268 H364 M396	A12-V399 HydrophobicContact CB-CG2 4.38Å; P14-V399 HydrophobicContact CB-CG2 4.49Å; V268-V399 HydrophobicContact CB-CG1 4.36Å; V268-V399 HydrophobicContact CG2-CG1 3.64Å; H364-V399 WeakPolarHBondContact NE2-CG1 3.48Å; M396-V399 HydrophobicContact CE-CB 4.17Å; M396-V399 HydrophobicContact CE-CG1 4.06Å; M396-V399 PolarHBondContact O-N 3.47Å
400	V	78.1	Confident	65.4	Low	7 Å²	7	60.5 Å²	60.5	4%	0.042	37%	0.37	C	S	.	.	I	π-helix	trans	-87.9	-26.3	-174.8	172.2	0	0	0	0	111.6	R8 L251 T254 Q256 L258 M375 M396	R8-V400 PolarHBondContact NH1-O 2.85Å; L251-V400 HydrophobicContact CD1-CB 4.27Å; L251-V400 HydrophobicContact CD1-CG1 3.22Å; L251-V400 HydrophobicContact CD1-CG2 4.03Å; T254-V400 HydrophobicContact CG2-CG1 4.12Å; Q256-V400 VanDerWaalsContact OE1-CA 3.27Å; Q256-V400 PolarHBondContact OE1-O 3.44Å; L258-V400 HydrophobicContact CD2-CG2 4.2Å; M375-V400 HydrophobicContact CE-CB 4.32Å; M375-V400 HydrophobicContact CE-CG1 4.17Å; M375-V400 HydrophobicContact CE-CG2 4.1Å; M396-V400 HydrophobicContact CB-CG2 4.09Å; M396-V400 HydrophobicContact CE-CG2 4.13Å; M396-V400 PolarHBondContact O-N 2.96Å
401	G	66.3	Low	62.6	Low	20 Å²	20	73.7 Å²	73.7	21%	0.206	42%	0.418	C	S	.	.	I	π-helix	trans	78.9	108.8	-168.1	0	0	0	0	0	109.9	T397	T397-G401 CarbonylContact O-C 3.59Å; T397-G401 WeakPolarHBondContact O-CA 3.22Å; T397-G401 PolarHBondContact O-N 3.23Å
402	S	52.7	Low	61.1	Low	51 Å²	51	77.4 Å²	77.4	36%	0.357	44%	0.438	S	S	.	.			trans	-69.6	139.7	173.8	57.2	0	0	0	0	111.6	T397 L404	T397-S402 PolarHBondContact O-N 2.86Å; S402-L404 VanDerWaalsContact C-N 3.34Å; S402-L404 PolarHBondContact O-N 2.69Å
403	S	46.1	Very low	59.4	Low	89 Å²	89	80.9 Å²	80.9	62%	0.622	46%	0.459	S	S	*	.	S	Bend	trans	-84.1	4.3	176	77	0	0	0	0	115.2
404	L	42.6	Very low	57.5	Low	124 Å²	124	85.4 Å²	85.4	65%	0.649	48%	0.484	S	S	*	.			trans	-112.3	42.9	-178.6	-83.4	164.5	0	0	0	114.1	S402	S402-L404 VanDerWaalsContact C-N 3.34Å; S402-L404 PolarHBondContact O-N 2.69Å
405	A	36.2	Very low	55.5	Low	81 Å²	81	89.6 Å²	89.6	67%	0.669	51%	0.51	S	S	*	.	S	Bend	trans	-103	40.4	166.3	0	0	0	0	0	112.6
406	T	36.2	Very low	53.2	Low	135 Å²	135	92.6 Å²	92.6	83%	0.828	53%	0.528	S	S	*	.	S	Bend	trans	-161.3	94.3	156.8	50	0	0	0	0	108.8
407	G	32	Very low	50.9	Low	58 Å²	58	98.7 Å²	98.7	60%	0.598	56%	0.563	S	S	*	*	S	Bend	trans	173.9	-12.2	173.9	0	0	0	0	0	120.5
408	F	31.5	Very low	48.3	Very low	206 Å²	206	103.4 Å²	103.4	90%	0.904	59%	0.589	S	S	*	*			trans	-142.1	95.8	169.3	-77.6	-78.4	0	0	0	109.9
409	S	23.9	Very low	45.7	Very low	102 Å²	102	101.7 Å²	101.7	71%	0.713	59%	0.589	S	S	*	*			trans	-81.6	127.9	158	177.8	0	0	0	0	106.8	R411	S409-R411 PolarHBondContact O-N 3.4Å
410	P	34.8	Very low	42.7	Very low	124 Å²	124	109.1 Å²	109.1	81%	0.805	63%	0.631	S	S	*	*			trans	-71.5	122.1	170.1	30.1	-29.1	0	0	0	107.3
411	R	32.1	Very low	39.5	Very low	312 Å²	312	118.4 Å²	118.4	100%	1.177	68%	0.684	S	S	*	*			trans	-118.8	0	156.6	-86.2	-167.6	176.4	-173.5	-0.1	108.3	S409	S409-R411 PolarHBondContact O-N 3.4Å

Retrieved 411 of 411 residues in 123 ms (Link to these results)

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