A0A077Z9A8_TRITR Loading...

Major sperm protein

Central component in molecular interactions underlying sperm crawling. Forms an extensive filament system that extends from sperm villipoda, along the leading edge of the pseudopod.

AlphaFold DB , UniProt , Accession A0A077Z9A8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 238 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48	Very low	56.8	Low	179 Å²	179	79.5 Å²	79.5	88%	0.882	45%	0.448	S	S	*	.				0	109.8	0	-167.6	-176.7	-126.9	0	0	108.5	K122	M1-K122 PolarHBondContact O-NZ 2.81Å; M1-K122 VanDerWaalsContact O-NZ 3.15Å
2	E	49.4	Very low	59.8	Low	124 Å²	124	72.9 Å²	72.9	58%	0.579	41%	0.411	S	S	*	.			trans	-75.8	142.5	-170.3	-55.9	-170.7	157.8	0	0	112.9	K9 T11	E2-K9 IonicContact OE1-NZ 3.68Å; E2-K9 IonicContact OE2-NZ 3.05Å; E2-K9 PolarHBondContact OE2-NZ 2.85Å; E2-T11 HydrophobicContact CB-CG2 4.21Å; E2-T11 HydrophobicContact CG-CG2 4Å
3	F	51.1	Low	62.5	Low	7 Å²	7	71.1 Å²	71.1	3%	0.031	40%	0.397	C	S	.	.			trans	-88.1	148.1	163.9	-51.4	-84.3	0	0	0	109	K9 A10 V12 I44 A95 D121 K122	F3-K9 VanDerWaalsContact O-CA 3.3Å; F3-K9 WeakPolarHBondContact O-CA 2.83Å; F3-A10 WeakPolarHBondContact CB-O 3.34Å; F3-A10 HydrophobicContact CD2-CB 3.45Å; F3-A10 VanDerWaalsContact CD2-CB 3.45Å; F3-A10 WeakPolarHBondContact CD2-O 3.29Å; F3-A10 HydrophobicContact CE2-CB 3.99Å; F3-A10 HydrophobicContact CG-CB 4.45Å; F3-A10 WeakPolarHBondContact CG-O 3.3Å; F3-A10 PolarHBondContact N-O 3.15Å; F3-V12 HydrophobicContact CE2-CB 4.25Å; F3-V12 HydrophobicContact CE2-CG2 3.93Å; F3-V12 HydrophobicContact CZ-CB 3.97Å; F3-V12 HydrophobicContact CZ-CG2 3.79Å; F3-I44 HydrophobicContact CE2-CD1 4.14Å; F3-A95 HydrophobicContact CE1-CB 4.37Å; F3-A95 HydrophobicContact CZ-CB 4Å; F3-D121 HydrophobicContact CD1-CB 3.52Å; F3-D121 WeakPolarHBondContact CD1-O 2.85Å; F3-D121 HydrophobicContact CE1-CB 3.82Å; F3-D121 HydrophobicContact CG-CB 4.24Å; F3-K122 HydrophobicContact CD1-CB 3.71Å; F3-K122 HydrophobicContact CD1-CD 3.9Å; F3-K122 HydrophobicContact CD1-CG 4.13Å; F3-K122 HydrophobicContact CE1-CB 3.27Å; F3-K122 HydrophobicContact CE1-CD 3.13Å; F3-K122 HydrophobicContact CE1-CG 3.25Å; F3-K122 HydrophobicContact CE2-CD 4.26Å; F3-K122 HydrophobicContact CZ-CB 4.27Å; F3-K122 HydrophobicContact CZ-CD 3.27Å; F3-K122 HydrophobicContact CZ-CG 3.77Å
4	V	44.7	Very low	65	Low	114 Å²	114	66.9 Å²	66.9	69%	0.691	37%	0.374	S	S	*	.			trans	-130.1	94.8	159.1	-177.9	0	0	0	0	105.7	G6	V4-G6 WeakPolarHBondContact CG1-O 3.41Å
5	S	46.1	Very low	67.1	Low	39 Å²	39	69.3 Å²	69.3	27%	0.273	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-116.8	96	173.1	-159.8	0	0	0	0	106.7	R8 D121	S5-R8 PolarHBondContact N-O 3.46Å; S5-D121 WeakPolarHBondContact CB-OD1 3.36Å; S5-D121 PolarHBondContact OG-OD1 3.07Å
6	G	50.2	Low	68.9	Low	61 Å²	61	68.1 Å²	68.1	63%	0.629	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	-163.6	-156.4	0	0	0	0	0	111.4	V4 R8	V4-G6 WeakPolarHBondContact CG1-O 3.41Å; G6-R8 PolarHBondContact O-N 2.77Å
7	S	50.5	Low	70.3	Confident	126 Å²	126	69.3 Å²	69.3	88%	0.881	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	4.8	179.3	48.7	0	0	0	0	115.1
8	R	60.3	Low	71.4	Confident	78 Å²	78	71.4 Å²	71.4	29%	0.294	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-94.6	111.6	-175.2	-60	-171.5	-175.4	-155.8	1.4	110.3	S5 G6 E42 E100	S5-R8 PolarHBondContact N-O 3.46Å; G6-R8 PolarHBondContact O-N 2.77Å; R8-E42 IonicContact CZ-OE2 3.6Å; R8-E42 IonicContact NH1-OE2 3.31Å; R8-E42 PolarHBondContact NH1-OE2 3.4Å; R8-E100 IonicContact CZ-OE2 2.81Å; R8-E100 IonicContact NH1-OE2 3.83Å; R8-E100 IonicContact NH2-OE2 3.81Å; R8-E100 PolarHBondContact NH2-OE2 2.94Å
9	K	63.6	Low	72.6	Confident	126 Å²	126	69 Å²	69	55%	0.548	38%	0.381	S	S	.	.			trans	-84.3	109.8	166	-68.3	-171.5	176.6	-153.8	0	109.1	E2 F3	E2-K9 IonicContact OE1-NZ 3.68Å; E2-K9 IonicContact OE2-NZ 3.05Å; E2-K9 PolarHBondContact OE2-NZ 2.85Å; F3-K9 VanDerWaalsContact O-CA 3.3Å; F3-K9 WeakPolarHBondContact O-CA 2.83Å
10	A	75.4	Confident	73.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	36%	0.363	C	S	.	.			trans	-112.6	170.5	163.7	0	0	0	0	0	109.4	F3 S40 I44 V97	F3-A10 WeakPolarHBondContact CB-O 3.34Å; F3-A10 HydrophobicContact CD2-CB 3.45Å; F3-A10 VanDerWaalsContact CD2-CB 3.45Å; F3-A10 WeakPolarHBondContact CD2-O 3.29Å; F3-A10 HydrophobicContact CE2-CB 3.99Å; F3-A10 HydrophobicContact CG-CB 4.45Å; F3-A10 WeakPolarHBondContact CG-O 3.3Å; F3-A10 PolarHBondContact N-O 3.15Å; A10-S40 VanDerWaalsContact CA-CB 3.44Å; A10-S40 WeakPolarHBondContact CB-OG 3.44Å; A10-I44 HydrophobicContact CB-CD1 4.02Å; A10-V97 HydrophobicContact CB-CG2 3.53Å
11	T	85.4	Confident	74.6	Confident	20 Å²	20	67.2 Å²	67.2	12%	0.123	37%	0.367	C	S	.	.			trans	-151.2	116.2	178	33.1	0	0	0	0	108.1	E2 N39	E2-T11 HydrophobicContact CB-CG2 4.21Å; E2-T11 HydrophobicContact CG-CG2 4Å; T11-N39 PolarHBondContact O-N 3.03Å; T11-N39 WeakPolarHBondContact OG1-CB 3.36Å; T11-N39 PolarHBondContact OG1-O 2.87Å
12	V	93.4	Very high	76.6	Confident	1 Å²	1	59 Å²	59	1%	0.006	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.5	163.7	178.8	0	0	0	0	108.5	F3 V14 Y37 I44 L65 A95 K122	F3-V12 HydrophobicContact CE2-CB 4.25Å; F3-V12 HydrophobicContact CE2-CG2 3.93Å; F3-V12 HydrophobicContact CZ-CB 3.97Å; F3-V12 HydrophobicContact CZ-CG2 3.79Å; V12-V14 HydrophobicContact CG1-CG2 4.25Å; V12-Y37 WeakPolarHBondContact CA-O 3.41Å; V12-I44 HydrophobicContact CG2-CB 4.35Å; V12-I44 HydrophobicContact CG2-CD1 3.39Å; V12-I44 HydrophobicContact CG2-CG1 4.43Å; V12-I44 HydrophobicContact CG2-CG2 3.69Å; V12-L65 HydrophobicContact CG1-CD1 4.34Å; V12-L65 HydrophobicContact CG2-CD1 4.32Å; V12-A95 HydrophobicContact CB-CB 4.39Å; V12-A95 HydrophobicContact CG2-CB 3.87Å; V12-K122 PolarHBondContact O-NZ 2.85Å
13	E	95	Very high	78.4	Confident	49 Å²	49	54.7 Å²	54.7	23%	0.229	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	143	169.5	-61.2	169.8	-163.7	0	0	109.1	Y15 L36 Y37 N39	E13-Y15 HydrophobicContact CB-CE2 3.7Å; E13-Y15 PolarHBondContact OE2-OH 2.9Å; E13-L36 WeakPolarHBondContact O-CA 3.1Å; E13-Y37 PolarHBondContact N-O 2.9Å; E13-Y37 PolarHBondContact O-N 2.79Å; E13-N39 PolarHBondContact OE1-ND2 2.69Å
14	V	96.6	Very high	79.8	Confident	12 Å²	12	58.2 Å²	58.2	7%	0.073	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.3	-175.9	-174.6	0	0	0	0	108.1	V12 P16 V17 I34 Q35 L36 V93 C124 L126	V12-V14 HydrophobicContact CG1-CG2 4.25Å; V14-P16 CarbonylContact C-O 3.57Å; V14-P16 CarbonylContact O-C 3.54Å; V14-V17 WeakPolarHBondContact O-CA 3.45Å; V14-I34 HydrophobicContact CG1-CG2 3.54Å; V14-Q35 WeakPolarHBondContact CA-O 3.41Å; V14-L36 HydrophobicContact CB-CD2 4.35Å; V14-L36 HydrophobicContact CG1-CD2 3.97Å; V14-L36 HydrophobicContact CG2-CD2 3.85Å; V14-V93 HydrophobicContact CG1-CG2 4.27Å; V14-V93 HydrophobicContact CG2-CB 4.43Å; V14-V93 HydrophobicContact CG2-CG2 4.43Å; V14-C124 HydrophobicContact CG2-CB 3.8Å; V14-L126 HydrophobicContact CG1-CD1 4.23Å; V14-L126 HydrophobicContact CG1-CD2 3.92Å; V14-L126 HydrophobicContact CG1-CG 4.48Å
15	Y	96.7	Very high	81.4	Confident	103 Å²	103	54.9 Å²	54.9	40%	0.404	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	124.4	178.9	-61.1	-85.3	0	0	0	109.5	E13 V17 I34 Q35 M70	E13-Y15 HydrophobicContact CB-CE2 3.7Å; E13-Y15 PolarHBondContact OE2-OH 2.9Å; Y15-V17 HydrophobicContact CD1-CG2 4.49Å; Y15-I34 CarbonylContact O-C 3.58Å; Y15-I34 VanDerWaalsContact O-CA 3.3Å; Y15-I34 WeakPolarHBondContact O-CA 3.15Å; Y15-Q35 PolarHBondContact N-O 2.83Å; Y15-Q35 PolarHBondContact O-N 3.01Å; Y15-M70 HydrophobicContact CD2-CE 4.43Å
16	P	96.1	Very high	82.8	Confident	51 Å²	51	56.3 Å²	56.3	33%	0.331	31%	0.306	S	S	.	.	S	Bend	cis	-62.8	157.1	-3.3	29.6	-35.8	0	0	0	112.1	V14 T19 I20 L126	V14-P16 CarbonylContact C-O 3.57Å; V14-P16 CarbonylContact O-C 3.54Å; P16-T19 WeakPolarHBondContact CB-O 3.48Å; P16-T19 WeakPolarHBondContact CG-O 3.49Å; P16-I20 HydrophobicContact CG-CG1 4.03Å; P16-L126 HydrophobicContact CG-CD2 4.4Å; P16-L126 WeakPolarHBondContact O-CD2 3.36Å
17	V	92.2	Very high	84	Confident	88 Å²	88	59 Å²	59	53%	0.533	31%	0.306	S	S	.	.	S	Bend	trans	-71.7	-47.5	-171.3	-177.3	0	0	0	0	111.1	V14 Y15	V14-V17 WeakPolarHBondContact O-CA 3.45Å; Y15-V17 HydrophobicContact CD1-CG2 4.49Å
18	D	91.3	Very high	85.6	Confident	107 Å²	107	58 Å²	58	57%	0.572	29%	0.29	S	S	*	.	S	Bend	trans	-124.7	-23.5	-168.7	-60.9	-47	0	0	0	114.2	L126 E127	D18-L126 CarbonylContact O-C 3.49Å; D18-L126 WeakPolarHBondContact O-CA 3.39Å; D18-E127 PolarHBondContact O-N 3.2Å
19	T	94.2	Very high	87.1	Confident	26 Å²	26	57.4 Å²	57.4	16%	0.16	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	135.4	-169	-50.1	0	0	0	0	113	P16 H21 E127 K129	P16-T19 WeakPolarHBondContact CB-O 3.48Å; P16-T19 WeakPolarHBondContact CG-O 3.49Å; T19-H21 WeakPolarHBondContact CG2-NE2 3.36Å; T19-E127 CarbonylContact C-O 3.45Å; T19-E127 VanDerWaalsContact CA-O 3.29Å; T19-E127 WeakPolarHBondContact CA-O 3.49Å; T19-E127 HydrophobicContact CG2-CB 4.39Å; T19-K129 HydrophobicContact CG2-CB 3.98Å; T19-K129 HydrophobicContact CG2-CD 3.71Å; T19-K129 HydrophobicContact CG2-CG 3.61Å
20	I	94.2	Very high	88.4	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.4	169.1	-56.7	166.7	0	0	0	107.4	P16 F22 A32 I34 V75 C91 L126 E127 V128 K129	P16-I20 HydrophobicContact CG-CG1 4.03Å; I20-F22 HydrophobicContact CG2-CD2 4.29Å; I20-F22 HydrophobicContact CG2-CE2 3.66Å; I20-F22 HydrophobicContact CG2-CZ 3.9Å; I20-A32 HydrophobicContact CG2-CB 3.53Å; I20-I34 HydrophobicContact CD1-CD1 3.54Å; I20-I34 HydrophobicContact CD1-CG1 3.66Å; I20-I34 HydrophobicContact CG1-CG1 4.29Å; I20-V75 HydrophobicContact CD1-CG2 4.42Å; I20-C91 HydrophobicContact CD1-CB 4.41Å; I20-L126 HydrophobicContact CD1-CB 4.28Å; I20-L126 HydrophobicContact CD1-CD2 4.15Å; I20-L126 HydrophobicContact CG1-CB 4.4Å; I20-L126 HydrophobicContact CG1-CD2 4.04Å; I20-E127 PolarHBondContact N-O 3.04Å; I20-V128 WeakPolarHBondContact O-CA 3.39Å; I20-K129 PolarHBondContact O-N 2.91Å
21	H	92.2	Very high	89.4	Confident	97 Å²	97	57.5 Å²	57.5	45%	0.449	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.3	-179.8	-69.1	-101.2	0	0	0	110.4	T19 K129 D131	T19-H21 WeakPolarHBondContact CG2-NE2 3.36Å; H21-K129 WeakPolarHBondContact CA-O 3.11Å; H21-D131 WeakPolarHBondContact CB-OD2 3.45Å; H21-D131 IonicContact CE1-OD1 2.87Å; H21-D131 IonicContact CE1-OD2 3.99Å; H21-D131 IonicContact CG-OD2 3.96Å; H21-D131 IonicContact ND1-OD1 3.81Å; H21-D131 PolarHBondContact ND1-OD1 2.65Å; H21-D131 VanDerWaalsContact ND1-OD1 3.07Å; H21-D131 IonicContact ND1-OD2 3.63Å; H21-D131 PolarHBondContact ND1-OD2 3.24Å
22	F	90.7	Very high	89.8	Confident	7 Å²	7	57.5 Å²	57.5	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	151.6	169.8	-72.5	-67.7	0	0	0	107.6	I20 Q30 A32 V75 C77 V128 K129 F130 D131	I20-F22 HydrophobicContact CG2-CD2 4.29Å; I20-F22 HydrophobicContact CG2-CE2 3.66Å; I20-F22 HydrophobicContact CG2-CZ 3.9Å; F22-Q30 VanDerWaalsContact CA-OE1 3.32Å; F22-Q30 HydrophobicContact CD1-CB 3.68Å; F22-Q30 HydrophobicContact CE1-CB 4.23Å; F22-A32 HydrophobicContact CD1-CB 4.41Å; F22-A32 HydrophobicContact CE1-CB 3.6Å; F22-A32 HydrophobicContact CZ-CB 3.7Å; F22-V75 HydrophobicContact CE2-CG1 4.46Å; F22-V75 HydrophobicContact CZ-CB 4.24Å; F22-V75 HydrophobicContact CZ-CG1 3.84Å; F22-C77 HydrophobicContact CD1-CB 3.73Å; F22-C77 HydrophobicContact CD2-CB 4Å; F22-C77 HydrophobicContact CE1-CB 3.54Å; F22-C77 HydrophobicContact CE2-CB 3.84Å; F22-C77 HydrophobicContact CG-CB 3.96Å; F22-C77 HydrophobicContact CZ-CB 3.61Å; F22-V128 HydrophobicContact CD2-CG1 3.57Å; F22-V128 HydrophobicContact CE2-CG1 3.78Å; F22-K129 PolarHBondContact N-O 2.94Å; F22-F130 HydrophobicContact CB-CD1 3.87Å; F22-F130 HydrophobicContact CB-CE1 3.95Å; F22-F130 HydrophobicContact CD2-CE1 4.49Å; F22-F130 CarbonylContact O-C 3.55Å; F22-F130 VanDerWaalsContact O-CA 3.25Å; F22-F130 WeakPolarHBondContact O-CA 3.31Å; F22-D131 PolarHBondContact O-N 2.87Å
23	S	86.3	Confident	90	Very high	32 Å²	32	59.4 Å²	59.4	22%	0.224	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	158	167.2	52.3	0	0	0	0	111.8	S25 Q30 D131 D133	S23-S25 PolarHBondContact O-N 3.49Å; S23-Q30 PolarHBondContact O-NE2 3.35Å; S23-Q30 PolarHBondContact O-OE1 3.47Å; S23-Q30 PolarHBondContact OG-NE2 3.37Å; S23-Q30 PolarHBondContact OG-OE1 3.02Å; S23-D131 CarbonylContact C-O 3.55Å; S23-D133 VanDerWaalsContact CB-CG 3.45Å; S23-D133 WeakPolarHBondContact CB-OD1 3.14Å; S23-D133 WeakPolarHBondContact CB-OD2 3.21Å
24	R	80.4	Confident	90.1	Very high	81 Å²	81	57 Å²	57	31%	0.306	30%	0.304	S	S	.	.	S	Bend	trans	-78.4	-3.9	172.4	-154.6	-179.4	-158.4	176	24	113.2	F26 M85 D131	R24-F26 HydrophobicContact CG-CE2 4.09Å; R24-F26 HydrophobicContact CG-CZ 3.9Å; R24-F26 VanDerWaalsContact O-CD2 3.31Å; R24-F26 WeakPolarHBondContact O-CD2 3.35Å; R24-F26 WeakPolarHBondContact O-CE2 3.43Å; R24-F26 PolarHBondContact O-N 2.96Å; R24-M85 VanDerWaalsContact CZ-SD 3.53Å; R24-M85 PolarHBondContact NH2-SD 3.09Å; R24-D131 WeakPolarHBondContact CB-O 3.34Å; R24-D131 PolarHBondContact N-O 2.88Å
25	S	78.9	Confident	90.2	Very high	45 Å²	45	60.3 Å²	60.3	32%	0.315	32%	0.319	S	S	.	.			trans	-53.4	110.5	174.3	-73.7	0	0	0	0	111.7	S23 Q30 D133	S23-S25 PolarHBondContact O-N 3.49Å; S25-Q30 PolarHBondContact O-NE2 2.68Å; S25-D133 PolarHBondContact N-OD2 2.74Å; S25-D133 PolarHBondContact OG-OD2 2.81Å
26	F	74.9	Confident	90.2	Very high	68 Å²	68	55.4 Å²	55.4	30%	0.298	30%	0.299	S	S	.	.	S	Bend	trans	-79.5	159.3	175.1	-56.4	-72.9	0	0	0	110.6	R24 I28 R79 P81	R24-F26 HydrophobicContact CG-CE2 4.09Å; R24-F26 HydrophobicContact CG-CZ 3.9Å; R24-F26 VanDerWaalsContact O-CD2 3.31Å; R24-F26 WeakPolarHBondContact O-CD2 3.35Å; R24-F26 WeakPolarHBondContact O-CE2 3.43Å; R24-F26 PolarHBondContact O-N 2.96Å; F26-I28 PolarHBondContact O-N 3.25Å; F26-R79 HydrophobicContact CD1-CG 4.45Å; F26-R79 HydrophobicContact CE1-CG 4.47Å; F26-P81 HydrophobicContact CB-CB 3.96Å; F26-P81 HydrophobicContact CD1-CB 4.33Å; F26-P81 HydrophobicContact CD2-CB 4.47Å; F26-P81 HydrophobicContact CG-CB 4.01Å
27	D	76	Confident	90.2	Very high	119 Å²	119	55.7 Å²	55.7	64%	0.636	29%	0.294	S	S	*	.	S	Bend	trans	63.7	2.8	178.2	-57.4	-36.4	0	0	0	116.5	P81	D27-P81 VanDerWaalsContact OD1-CD 3.28Å; D27-P81 WeakPolarHBondContact OD1-CD 3.41Å
28	I	84.2	Confident	90.4	Very high	105 Å²	105	51.5 Å²	51.5	54%	0.538	27%	0.269	S	S	.	.	S	Bend	trans	-109.9	131	173.9	-59	176.7	0	0	0	109	F26 Q30	F26-I28 PolarHBondContact O-N 3.25Å; I28-Q30 PolarHBondContact O-N 3.05Å
29	T	90.7	Very high	90.5	Very high	64 Å²	64	49.6 Å²	49.6	39%	0.393	26%	0.259	S	S	.	.			trans	-68.5	122	170.5	-67.1	0	0	0	0	109.3	R76 T78	T29-R76 HydrophobicContact CG2-CG 3.43Å; T29-R76 VanDerWaalsContact CG2-CG 3.43Å; T29-R76 PolarHBondContact OG1-NH2 3.4Å; T29-T78 HydrophobicContact CG2-CG2 4.02Å; T29-T78 WeakPolarHBondContact OG1-CG2 3.44Å
30	Q	92.3	Very high	90.4	Very high	19 Å²	19	48.7 Å²	48.7	9%	0.089	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	151	178.1	-57.1	178.5	37	0	0	111.6	F22 S23 S25 I28 R76 C77	F22-Q30 VanDerWaalsContact CA-OE1 3.32Å; F22-Q30 HydrophobicContact CD1-CB 3.68Å; F22-Q30 HydrophobicContact CE1-CB 4.23Å; S23-Q30 PolarHBondContact O-NE2 3.35Å; S23-Q30 PolarHBondContact O-OE1 3.47Å; S23-Q30 PolarHBondContact OG-NE2 3.37Å; S23-Q30 PolarHBondContact OG-OE1 3.02Å; S25-Q30 PolarHBondContact O-NE2 2.68Å; I28-Q30 PolarHBondContact O-N 3.05Å; Q30-R76 WeakPolarHBondContact O-CA 3.44Å; Q30-C77 PolarHBondContact N-O 2.78Å; Q30-C77 PolarHBondContact O-N 3.07Å
31	L	94.7	Very high	90.3	Very high	110 Å²	110	53 Å²	53	58%	0.576	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	130	-178.2	-64.1	-179.7	0	0	0	110.5	L74 V75 R76	L31-L74 HydrophobicContact CB-CD1 4.22Å; L31-L74 HydrophobicContact CD1-CD1 4.43Å; L31-L74 HydrophobicContact CD2-CD1 4.2Å; L31-L74 HydrophobicContact CD2-CD2 4.01Å; L31-L74 HydrophobicContact CD2-CG 4.12Å; L31-V75 WeakPolarHBondContact CA-O 3.48Å; L31-R76 HydrophobicContact CD2-CB 3.96Å; L31-R76 HydrophobicContact CD2-CG 4.11Å
32	A	95.4	Very high	90.3	Very high	19 Å²	19	50.7 Å²	50.7	16%	0.157	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	172.7	167.6	0	0	0	0	0	109.5	I20 F22 V75	I20-A32 HydrophobicContact CG2-CB 3.53Å; F22-A32 HydrophobicContact CD1-CB 4.41Å; F22-A32 HydrophobicContact CE1-CB 3.6Å; F22-A32 HydrophobicContact CZ-CB 3.7Å; A32-V75 HydrophobicContact CB-CB 4.36Å; A32-V75 PolarHBondContact N-O 2.87Å; A32-V75 PolarHBondContact O-N 2.81Å
33	S	96.6	Very high	90.4	Very high	41 Å²	41	56 Å²	56	29%	0.287	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.4	174.1	67.2	0	0	0	0	112.9	K72 I73	S33-K72 WeakPolarHBondContact OG-CE 3.25Å; S33-I73 CarbonylContact C-O 3.47Å; S33-I73 VanDerWaalsContact CA-O 3.24Å; S33-I73 WeakPolarHBondContact CA-O 3.49Å
34	I	97.2	Very high	90.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	138.8	168.9	-56.9	164.6	0	0	0	107.4	V14 Y15 I20 L36 L48 F58 I73 V75	V14-I34 HydrophobicContact CG1-CG2 3.54Å; Y15-I34 CarbonylContact O-C 3.58Å; Y15-I34 VanDerWaalsContact O-CA 3.3Å; Y15-I34 WeakPolarHBondContact O-CA 3.15Å; I20-I34 HydrophobicContact CD1-CD1 3.54Å; I20-I34 HydrophobicContact CD1-CG1 3.66Å; I20-I34 HydrophobicContact CG1-CG1 4.29Å; I34-L36 HydrophobicContact CG2-CD2 3.85Å; I34-L48 HydrophobicContact CD1-CD2 3.86Å; I34-F58 HydrophobicContact CD1-CE1 4.43Å; I34-I73 HydrophobicContact CB-CB 4.41Å; I34-I73 PolarHBondContact N-O 2.82Å; I34-I73 PolarHBondContact O-N 3.42Å; I34-V75 HydrophobicContact CD1-CG2 3.58Å; I34-V75 HydrophobicContact CG1-CG2 3.69Å
35	Q	97.8	Very high	91.4	Very high	80 Å²	80	50.6 Å²	50.6	37%	0.374	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.4	170	-46.6	-173	18.2	0	0	109.5	V14 Y15 M70 K71	V14-Q35 WeakPolarHBondContact CA-O 3.41Å; Y15-Q35 PolarHBondContact N-O 2.83Å; Y15-Q35 PolarHBondContact O-N 3.01Å; Q35-M70 HydrophobicContact CB-CG 4.2Å; Q35-M70 HydrophobicContact CB-SD 3.58Å; Q35-M70 VanDerWaalsContact CB-SD 3.58Å; Q35-K71 WeakPolarHBondContact CA-O 3.37Å
36	L	97.7	Very high	92.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.6	176.5	-53.8	-178.3	0	0	0	108.8	E13 V14 I34 Y46 L65 M70 K71 I73 V93	E13-L36 WeakPolarHBondContact O-CA 3.1Å; V14-L36 HydrophobicContact CB-CD2 4.35Å; V14-L36 HydrophobicContact CG1-CD2 3.97Å; V14-L36 HydrophobicContact CG2-CD2 3.85Å; I34-L36 HydrophobicContact CG2-CD2 3.85Å; L36-Y46 HydrophobicContact CD1-CD1 4.21Å; L36-Y46 HydrophobicContact CD1-CD2 3.7Å; L36-Y46 HydrophobicContact CD1-CE2 4.11Å; L36-Y46 HydrophobicContact CD1-CG 3.76Å; L36-L65 HydrophobicContact CB-CD1 3.75Å; L36-L65 HydrophobicContact CB-CD2 4.02Å; L36-L65 HydrophobicContact CD1-CD1 4.4Å; L36-M70 CarbonylContact O-C 3.58Å; L36-M70 WeakPolarHBondContact O-CA 3.39Å; L36-M70 VanDerWaalsContact O-SD 3.34Å; L36-K71 PolarHBondContact N-O 3.22Å; L36-K71 PolarHBondContact O-N 3.37Å; L36-I73 HydrophobicContact CD1-CD1 4.48Å; L36-I73 HydrophobicContact CD1-CG1 4.1Å; L36-I73 HydrophobicContact CG-CG1 4.22Å; L36-V93 HydrophobicContact CD1-CG1 4.24Å; L36-V93 HydrophobicContact CD2-CG1 3.93Å; L36-V93 HydrophobicContact CD2-CG2 4Å
37	Y	96.8	Very high	93.1	Very high	57 Å²	57	47 Å²	47	22%	0.224	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.9	174.8	-177	-131.2	0	0	0	110.2	V12 E13 N39 M70	V12-Y37 WeakPolarHBondContact CA-O 3.41Å; E13-Y37 PolarHBondContact N-O 2.9Å; E13-Y37 PolarHBondContact O-N 2.79Å; Y37-N39 HydrophobicContact CD1-CB 3.77Å; Y37-N39 HydrophobicContact CE1-CB 3.44Å; Y37-N39 VanDerWaalsContact CE1-CB 3.44Å; Y37-M70 HydrophobicContact CD2-CE 4.23Å; Y37-M70 HydrophobicContact CG-CE 4.07Å
38	N	95.9	Very high	94.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	104.5	168.8	178.4	4.1	0	0	0	109.1	S40 E42 I44 L65 Q66 F68 R69	N38-S40 PolarHBondContact O-N 2.85Å; N38-S40 WeakPolarHBondContact OD1-CB 3.39Å; N38-S40 PolarHBondContact OD1-N 2.78Å; N38-S40 PolarHBondContact OD1-OG 2.83Å; N38-E42 PolarHBondContact ND2-O 3.12Å; N38-I44 HydrophobicContact CB-CD1 4.33Å; N38-I44 VanDerWaalsContact OD1-CD1 3.25Å; N38-I44 WeakPolarHBondContact OD1-CD1 3.43Å; N38-L65 HydrophobicContact CB-CB 3.86Å; N38-L65 HydrophobicContact CB-CD1 4.4Å; N38-L65 PolarHBondContact ND2-O 3.29Å; N38-Q66 WeakPolarHBondContact CB-O 3.35Å; N38-Q66 PolarHBondContact ND2-O 2.73Å; N38-Q66 VanDerWaalsContact ND2-O 3.12Å; N38-F68 WeakPolarHBondContact O-CA 3.45Å; N38-F68 PolarHBondContact O-N 2.91Å; N38-R69 PolarHBondContact N-O 3.13Å; N38-R69 VanDerWaalsContact N-O 3.13Å
39	N	93.5	Very high	94.6	Very high	68 Å²	68	42.5 Å²	42.5	36%	0.364	21%	0.211	S	C	.	.			trans	-92.9	30.4	179.1	-166.3	12.4	0	0	0	111.9	T11 E13 Y37	T11-N39 PolarHBondContact O-N 3.03Å; T11-N39 WeakPolarHBondContact OG1-CB 3.36Å; T11-N39 PolarHBondContact OG1-O 2.87Å; E13-N39 PolarHBondContact OE1-ND2 2.69Å; Y37-N39 HydrophobicContact CD1-CB 3.77Å; Y37-N39 HydrophobicContact CE1-CB 3.44Å; Y37-N39 VanDerWaalsContact CE1-CB 3.44Å
40	S	92.3	Very high	94.9	Very high	6 Å²	6	41 Å²	41	4%	0.042	20%	0.201	C	C	.	.	S	Bend	trans	-129.1	169.3	180	79.5	0	0	0	0	112.7	A10 N38 E42 P67 F68	A10-S40 VanDerWaalsContact CA-CB 3.44Å; A10-S40 WeakPolarHBondContact CB-OG 3.44Å; N38-S40 PolarHBondContact O-N 2.85Å; N38-S40 WeakPolarHBondContact OD1-CB 3.39Å; N38-S40 PolarHBondContact OD1-N 2.78Å; N38-S40 PolarHBondContact OD1-OG 2.83Å; S40-E42 VanDerWaalsContact C-N 3.32Å; S40-E42 PolarHBondContact OG-N 3.02Å; S40-E42 PolarHBondContact OG-O 3.24Å; S40-P67 VanDerWaalsContact O-CA 3.29Å; S40-P67 WeakPolarHBondContact O-CA 3.39Å; S40-P67 WeakPolarHBondContact O-CB 3.35Å; S40-F68 PolarHBondContact O-N 3.01Å
41	T	92.7	Very high	95	Very high	95 Å²	95	43.1 Å²	43.1	58%	0.583	22%	0.216	S	C	*	.	S	Bend	trans	-81	-11.3	175.1	52.9	0	0	0	0	113.4	P67 F68	T41-P67 WeakPolarHBondContact O-CG 3.41Å; T41-F68 HydrophobicContact CG2-CE2 3.95Å; T41-F68 HydrophobicContact CG2-CZ 3.7Å
42	E	91.3	Very high	94.9	Very high	48 Å²	48	38 Å²	38	22%	0.224	19%	0.189	C	C	.	.	S	Bend	trans	-94.3	154.6	-175.3	-58.2	-64.7	123.8	0	0	111.4	R8 N38 S40 V97	R8-E42 IonicContact CZ-OE2 3.6Å; R8-E42 IonicContact NH1-OE2 3.31Å; R8-E42 PolarHBondContact NH1-OE2 3.4Å; N38-E42 PolarHBondContact ND2-O 3.12Å; S40-E42 VanDerWaalsContact C-N 3.32Å; S40-E42 PolarHBondContact OG-N 3.02Å; S40-E42 PolarHBondContact OG-O 3.24Å; E42-V97 HydrophobicContact CB-CG1 3.82Å; E42-V97 HydrophobicContact CG-CG1 4.06Å
43	W	92.7	Very high	94.9	Very high	118 Å²	118	41 Å²	41	45%	0.447	21%	0.207	S	C	.	.			trans	-75.2	140.3	167.2	-78.1	77.6	0	0	0	110.2	F64 Q66 L98	W43-F64 HydrophobicContact CE3-CB 4.06Å; W43-F64 HydrophobicContact CZ3-CB 4.18Å; W43-Q66 HydrophobicContact CD2-CG 4.31Å; W43-Q66 HydrophobicContact CE3-CG 3.93Å; W43-Q66 HydrophobicContact CH2-CB 4.48Å; W43-Q66 HydrophobicContact CH2-CG 3.17Å; W43-Q66 HydrophobicContact CZ2-CG 3.53Å; W43-Q66 HydrophobicContact CZ3-CB 4.43Å; W43-Q66 HydrophobicContact CZ3-CG 3.36Å; W43-L98 HydrophobicContact CB-CB 3.97Å; W43-L98 HydrophobicContact CB-CD2 4.09Å; W43-L98 WeakPolarHBondContact O-CB 3.35Å; W43-L98 PolarHBondContact O-N 3.47Å
44	I	92.8	Very high	94.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.1	-178.1	-59.9	179.7	0	0	0	110.1	F3 A10 V12 N38 F64 L65 A95 H96	F3-I44 HydrophobicContact CE2-CD1 4.14Å; A10-I44 HydrophobicContact CB-CD1 4.02Å; V12-I44 HydrophobicContact CG2-CB 4.35Å; V12-I44 HydrophobicContact CG2-CD1 3.39Å; V12-I44 HydrophobicContact CG2-CG1 4.43Å; V12-I44 HydrophobicContact CG2-CG2 3.69Å; N38-I44 HydrophobicContact CB-CD1 4.33Å; N38-I44 VanDerWaalsContact OD1-CD1 3.25Å; N38-I44 WeakPolarHBondContact OD1-CD1 3.43Å; I44-F64 CarbonylContact O-C 3.49Å; I44-F64 VanDerWaalsContact O-CA 3.31Å; I44-F64 WeakPolarHBondContact O-CA 3.31Å; I44-L65 HydrophobicContact CB-CB 4.35Å; I44-L65 PolarHBondContact N-O 2.86Å; I44-L65 PolarHBondContact O-N 2.94Å; I44-A95 HydrophobicContact CG2-CB 3.93Å; I44-H96 CarbonylContact C-O 3.53Å; I44-H96 WeakPolarHBondContact CA-O 3.34Å
45	A	94.1	Very high	94.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	138.6	167.4	0	0	0	0	0	110	G63 F64 A95 H96 Y110 W111	A45-G63 WeakPolarHBondContact CA-O 3.47Å; A45-F64 HydrophobicContact CB-CD1 3.81Å; A45-F64 HydrophobicContact CB-CE1 3.77Å; A45-A95 WeakPolarHBondContact O-CA 3.45Å; A45-H96 PolarHBondContact N-O 3.32Å; A45-H96 PolarHBondContact O-N 3.04Å; A45-Y110 HydrophobicContact CB-CD1 3.83Å; A45-Y110 HydrophobicContact CB-CE1 3.19Å; A45-W111 HydrophobicContact CB-CZ2 3.98Å
46	Y	95.2	Very high	94.2	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.016	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150.4	174	70	-88.5	0	0	0	112.5	L36 L48 P60 Y62 G63 L65 I73 V94 W111	L36-Y46 HydrophobicContact CD1-CD1 4.21Å; L36-Y46 HydrophobicContact CD1-CD2 3.7Å; L36-Y46 HydrophobicContact CD1-CE2 4.11Å; L36-Y46 HydrophobicContact CD1-CG 3.76Å; Y46-L48 HydrophobicContact CD2-CD1 3.7Å; Y46-L48 HydrophobicContact CE2-CD1 3.78Å; Y46-P60 VanDerWaalsContact OH-CG 3.24Å; Y46-P60 WeakPolarHBondContact OH-CG 3.22Å; Y46-Y62 WeakPolarHBondContact O-CA 3Å; Y46-G63 VanDerWaalsContact CD1-C 3.42Å; Y46-G63 VanDerWaalsContact CD1-O 3.25Å; Y46-G63 WeakPolarHBondContact CD1-O 2.95Å; Y46-G63 VanDerWaalsContact CZ-CA 3.45Å; Y46-G63 PolarHBondContact N-O 2.95Å; Y46-G63 PolarHBondContact O-N 2.79Å; Y46-G63 VanDerWaalsContact O-N 3.09Å; Y46-L65 HydrophobicContact CD1-CD1 4.28Å; Y46-L65 HydrophobicContact CD1-CD2 4.12Å; Y46-L65 HydrophobicContact CD1-CG 3.73Å; Y46-L65 HydrophobicContact CE1-CD2 3.97Å; Y46-L65 HydrophobicContact CE1-CG 4.05Å; Y46-I73 HydrophobicContact CE2-CD1 3.71Å; Y46-I73 WeakPolarHBondContact OH-CD1 3.49Å; Y46-V94 CarbonylContact C-O 3.48Å; Y46-V94 VanDerWaalsContact CA-O 3.23Å; Y46-V94 WeakPolarHBondContact CA-O 3.1Å; Y46-W111 VanDerWaalsContact C-CZ2 3.49Å; Y46-W111 PolarHBondContact O-NE1 2.8Å
47	K	95.4	Very high	94.2	Very high	35 Å²	35	44.8 Å²	44.8	15%	0.152	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	131.8	171.8	170.2	175.7	-172.7	164.1	0	109.4	R49 Y62 V94 W111	K47-R49 HydrophobicContact CG-CG 4.41Å; K47-Y62 HydrophobicContact CB-CD1 3.87Å; K47-Y62 HydrophobicContact CB-CE1 4.13Å; K47-Y62 HydrophobicContact CD-CD1 3.97Å; K47-Y62 HydrophobicContact CD-CE1 3.37Å; K47-Y62 WeakPolarHBondContact CE-OH 3.18Å; K47-Y62 HydrophobicContact CG-CD1 3.66Å; K47-Y62 HydrophobicContact CG-CE1 3.41Å; K47-Y62 VanDerWaalsContact CG-CE1 3.41Å; K47-V94 PolarHBondContact N-O 2.81Å; K47-V94 PolarHBondContact O-N 2.92Å; K47-W111 HydrophobicContact CB-CD2 3.88Å; K47-W111 HydrophobicContact CB-CE3 4.35Å; K47-W111 HydrophobicContact CB-CG 4.33Å; K47-W111 HydrophobicContact CB-CH2 4.27Å; K47-W111 HydrophobicContact CB-CZ2 3.78Å; K47-W111 HydrophobicContact CD-CD2 4.3Å; K47-W111 HydrophobicContact CD-CE3 4.35Å; K47-W111 HydrophobicContact CD-CG 4.5Å
48	L	96.6	Very high	94.2	Very high	9 Å²	9	43.5 Å²	43.5	5%	0.047	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	139.4	172.5	-65	97	0	0	0	110.7	I34 Y46 F58 G61 I73 T92 V93	I34-L48 HydrophobicContact CD1-CD2 3.86Å; Y46-L48 HydrophobicContact CD2-CD1 3.7Å; Y46-L48 HydrophobicContact CE2-CD1 3.78Å; L48-F58 HydrophobicContact CB-CB 4.24Å; L48-F58 HydrophobicContact CB-CD1 4.06Å; L48-F58 HydrophobicContact CB-CD2 3.48Å; L48-F58 VanDerWaalsContact CB-CD2 3.48Å; L48-F58 HydrophobicContact CB-CE1 4.26Å; L48-F58 HydrophobicContact CB-CE2 3.73Å; L48-F58 HydrophobicContact CB-CG 3.65Å; L48-F58 HydrophobicContact CB-CZ 4.1Å; L48-F58 HydrophobicContact CD2-CB 4.39Å; L48-F58 HydrophobicContact CD2-CD1 3.47Å; L48-F58 VanDerWaalsContact CD2-CD1 3.47Å; L48-F58 HydrophobicContact CD2-CD2 4.48Å; L48-F58 HydrophobicContact CD2-CE1 3.74Å; L48-F58 HydrophobicContact CD2-CG 3.86Å; L48-F58 HydrophobicContact CD2-CZ 4.36Å; L48-F58 HydrophobicContact CG-CD1 4.33Å; L48-F58 HydrophobicContact CG-CG 4.25Å; L48-G61 WeakPolarHBondContact CD1-O 3.3Å; L48-G61 PolarHBondContact N-O 3.35Å; L48-I73 HydrophobicContact CD1-CG1 4.47Å; L48-I73 HydrophobicContact CD1-CG2 4.1Å; L48-I73 HydrophobicContact CD2-CG2 3.98Å; L48-T92 WeakPolarHBondContact CA-O 3.41Å; L48-V93 HydrophobicContact CD2-CG2 4.3Å; L48-V93 HydrophobicContact CG-CG2 4.45Å
49	R	95.7	Very high	94.3	Very high	119 Å²	119	53 Å²	53	45%	0.449	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	154.9	174.4	-58.2	-174.5	-175.7	-163.6	0.3	109.3	K47 C91 T92 V94	K47-R49 HydrophobicContact CG-CG 4.41Å; R49-C91 CarbonylContact O-C 3.56Å; R49-C91 WeakPolarHBondContact O-CA 3.14Å; R49-T92 PolarHBondContact N-O 2.89Å; R49-T92 PolarHBondContact O-N 3.18Å; R49-V94 HydrophobicContact CG-CG2 4.43Å
50	T	96	Very high	94.5	Very high	32 Å²	32	52.1 Å²	52.1	20%	0.196	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	151	176.5	177.5	0	0	0	0	109.8	S52 P53 I56 F58 R90	T50-S52 PolarHBondContact OG1-N 2.73Å; T50-S52 VanDerWaalsContact OG1-N 3.07Å; T50-P53 HydrophobicContact CG2-CB 4.1Å; T50-I56 HydrophobicContact CG2-CB 4.26Å; T50-F58 HydrophobicContact CG2-CE2 4.01Å; T50-R90 WeakPolarHBondContact CA-O 3.24Å
51	T	94.5	Very high	94.7	Very high	64 Å²	64	52.6 Å²	52.6	39%	0.393	27%	0.265	S	S	.	.	S	Bend	trans	-71.6	-18.9	168.4	43	0	0	0	0	112.9	P53 R87 E89 R90	T51-P53 WeakPolarHBondContact O-CD 3.25Å; T51-R87 PolarHBondContact O-NH2 2.72Å; T51-R87 VanDerWaalsContact O-NH2 3.17Å; T51-E89 WeakPolarHBondContact CB-OE2 3.45Å; T51-E89 PolarHBondContact OG1-OE2 2.89Å; T51-R90 HydrophobicContact CG2-CB 4.05Å; T51-R90 PolarHBondContact N-O 2.89Å; T51-R90 PolarHBondContact OG1-N 2.92Å; T51-R90 PolarHBondContact OG1-O 2.89Å
52	S	92.8	Very high	94.9	Very high	2 Å²	2	52 Å²	52	1%	0.014	25%	0.253	C	S	.	.			trans	-127.5	74.1	-176	-101.3	0	0	0	0	111.2	T50 A54 E55 I56 E89	T50-S52 PolarHBondContact OG1-N 2.73Å; T50-S52 VanDerWaalsContact OG1-N 3.07Å; S52-A54 PolarHBondContact O-N 3.1Å; S52-E55 WeakPolarHBondContact CA-OE2 3.31Å; S52-E55 WeakPolarHBondContact CB-OE2 3.49Å; S52-E55 PolarHBondContact O-N 3.1Å; S52-E55 PolarHBondContact OG-OE2 3.31Å; S52-I56 WeakPolarHBondContact O-CA 3.39Å; S52-I56 WeakPolarHBondContact O-CB 2.95Å; S52-I56 PolarHBondContact O-N 2.88Å; S52-E89 WeakPolarHBondContact CB-OE2 3.48Å; S52-E89 PolarHBondContact OG-OE1 3.45Å; S52-E89 PolarHBondContact OG-OE2 2.87Å
53	P	94.9	Very high	95.1	Very high	83 Å²	83	50.1 Å²	50.1	54%	0.539	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-16.3	-176.7	29.3	-35.7	0	0	0	113.1	T50 T51 K57	T50-P53 HydrophobicContact CG2-CB 4.1Å; T51-P53 WeakPolarHBondContact O-CD 3.25Å; P53-K57 WeakPolarHBondContact O-CE 3.5Å; P53-K57 PolarHBondContact O-NZ 2.76Å
54	A	92	Very high	95.2	Very high	63 Å²	63	46.7 Å²	46.7	52%	0.521	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-46	173.9	0	0	0	0	0	110.5	S52	S52-A54 PolarHBondContact O-N 3.1Å
55	E	91.4	Very high	95.3	Very high	24 Å²	24	46.8 Å²	46.8	11%	0.112	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-34.3	-176.5	-55.1	68.9	-123.4	0	0	113	S52 C77 T78	S52-E55 WeakPolarHBondContact CA-OE2 3.31Å; S52-E55 WeakPolarHBondContact CB-OE2 3.49Å; S52-E55 PolarHBondContact O-N 3.1Å; S52-E55 PolarHBondContact OG-OE2 3.31Å; E55-C77 CarbonylContact O-C 3.54Å; E55-C77 WeakPolarHBondContact O-CA 3.35Å; E55-T78 WeakPolarHBondContact CA-O 3.41Å; E55-T78 WeakPolarHBondContact CB-O 3.49Å; E55-T78 PolarHBondContact O-N 3.16Å; E55-T78 PolarHBondContact O-OG1 3.28Å
56	I	94.7	Very high	95.4	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122.3	-171.7	-58.3	173.5	0	0	0	111	T50 S52 F58 V75 R76 E89 V128	T50-I56 HydrophobicContact CG2-CB 4.26Å; S52-I56 WeakPolarHBondContact O-CA 3.39Å; S52-I56 WeakPolarHBondContact O-CB 2.95Å; S52-I56 PolarHBondContact O-N 2.88Å; I56-F58 HydrophobicContact CG2-CE1 4.1Å; I56-F58 HydrophobicContact CG2-CE2 4.44Å; I56-F58 HydrophobicContact CG2-CZ 3.91Å; I56-V75 HydrophobicContact CG2-CG1 3.81Å; I56-R76 CarbonylContact C-O 3.59Å; I56-R76 WeakPolarHBondContact CA-O 3.29Å; I56-E89 HydrophobicContact CD1-CB 4.43Å; I56-V128 HydrophobicContact CD1-CG1 4.31Å; I56-V128 HydrophobicContact CD1-CG2 4.15Å
57	K	97	Very high	95.4	Very high	110 Å²	110	52.7 Å²	52.7	48%	0.478	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	139.5	178.3	-55.5	-64.4	-175.1	-179.4	0	111.5	P53 R76	P53-K57 WeakPolarHBondContact O-CE 3.5Å; P53-K57 PolarHBondContact O-NZ 2.76Å; K57-R76 HydrophobicContact CB-CB 4.4Å; K57-R76 PolarHBondContact N-O 3.47Å; K57-R76 PolarHBondContact O-N 2.9Å
58	F	97.9	Very high	95.4	Very high	29 Å²	29	56.3 Å²	56.3	13%	0.127	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	141.1	178.2	-54.2	-71.4	0	0	0	111.7	I34 L48 T50 I56 I73 L74 V75 C91	I34-F58 HydrophobicContact CD1-CE1 4.43Å; L48-F58 HydrophobicContact CB-CB 4.24Å; L48-F58 HydrophobicContact CB-CD1 4.06Å; L48-F58 HydrophobicContact CB-CD2 3.48Å; L48-F58 VanDerWaalsContact CB-CD2 3.48Å; L48-F58 HydrophobicContact CB-CE1 4.26Å; L48-F58 HydrophobicContact CB-CE2 3.73Å; L48-F58 HydrophobicContact CB-CG 3.65Å; L48-F58 HydrophobicContact CB-CZ 4.1Å; L48-F58 HydrophobicContact CD2-CB 4.39Å; L48-F58 HydrophobicContact CD2-CD1 3.47Å; L48-F58 VanDerWaalsContact CD2-CD1 3.47Å; L48-F58 HydrophobicContact CD2-CD2 4.48Å; L48-F58 HydrophobicContact CD2-CE1 3.74Å; L48-F58 HydrophobicContact CD2-CG 3.86Å; L48-F58 HydrophobicContact CD2-CZ 4.36Å; L48-F58 HydrophobicContact CG-CD1 4.33Å; L48-F58 HydrophobicContact CG-CG 4.25Å; T50-F58 HydrophobicContact CG2-CE2 4.01Å; I56-F58 HydrophobicContact CG2-CE1 4.1Å; I56-F58 HydrophobicContact CG2-CE2 4.44Å; I56-F58 HydrophobicContact CG2-CZ 3.91Å; F58-I73 HydrophobicContact CB-CG2 4.33Å; F58-L74 CarbonylContact C-O 3.53Å; F58-L74 WeakPolarHBondContact CA-O 3.23Å; F58-V75 HydrophobicContact CD1-CB 4.47Å; F58-V75 HydrophobicContact CD1-CG1 4.08Å; F58-V75 HydrophobicContact CD1-CG2 4.02Å; F58-V75 HydrophobicContact CE1-CG1 3.87Å; F58-V75 HydrophobicContact CE1-CG2 4.15Å; F58-C91 HydrophobicContact CE1-CB 4.36Å; F58-C91 HydrophobicContact CZ-CB 4.04Å; F58-C91 VanDerWaalsContact CZ-SG 3.57Å
59	R	97.3	Very high	95.5	Very high	199 Å²	199	63.4 Å²	63.4	75%	0.751	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.9	115.1	170.5	-71.2	-157.3	175	172.1	1.1	112.6	L74	R59-L74 HydrophobicContact CB-CB 4.49Å; R59-L74 PolarHBondContact N-O 2.85Å; R59-L74 PolarHBondContact O-N 2.92Å
60	P	97.2	Very high	95.5	Very high	51 Å²	51	61.9 Å²	61.9	33%	0.331	31%	0.307	S	S	.	.	S	Bend	cis	-69.3	148.9	-13.7	31.7	-36.6	0	0	0	112	Y46 I73	Y46-P60 VanDerWaalsContact OH-CG 3.24Å; Y46-P60 WeakPolarHBondContact OH-CG 3.22Å; P60-I73 HydrophobicContact CG-CD1 3.69Å; P60-I73 WeakPolarHBondContact O-CG2 3.45Å
61	G	96.8	Very high	95.6	Very high	16 Å²	16	64.9 Å²	64.9	17%	0.165	32%	0.317	C	S	.	.	S	Bend	trans	-84.6	-14.7	174.7	0	0	0	0	0	114.7	L48	L48-G61 WeakPolarHBondContact CD1-O 3.3Å; L48-G61 PolarHBondContact N-O 3.35Å
62	Y	95.7	Very high	95.8	Very high	82 Å²	82	68.3 Å²	68.3	32%	0.322	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	149.3	-177.8	-53.7	-100.9	0	0	0	108.6	Y46 K47 W111	Y46-Y62 WeakPolarHBondContact O-CA 3Å; K47-Y62 HydrophobicContact CB-CD1 3.87Å; K47-Y62 HydrophobicContact CB-CE1 4.13Å; K47-Y62 HydrophobicContact CD-CD1 3.97Å; K47-Y62 HydrophobicContact CD-CE1 3.37Å; K47-Y62 WeakPolarHBondContact CE-OH 3.18Å; K47-Y62 HydrophobicContact CG-CD1 3.66Å; K47-Y62 HydrophobicContact CG-CE1 3.41Å; K47-Y62 VanDerWaalsContact CG-CE1 3.41Å; Y62-W111 HydrophobicContact CD1-CB 4.21Å; Y62-W111 AromaticContact CD1-CD1 3.61Å; Y62-W111 AromaticContact CD1-CG 3.99Å; Y62-W111 HydrophobicContact CD1-CG 3.99Å; Y62-W111 HydrophobicContact CE1-CB 4.4Å
63	G	96.3	Very high	96	Very high	9 Å²	9	68.2 Å²	68.2	9%	0.093	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.1	-169	173.3	0	0	0	0	0	113.5	A45 Y46 A107	A45-G63 WeakPolarHBondContact CA-O 3.47Å; Y46-G63 VanDerWaalsContact CD1-C 3.42Å; Y46-G63 VanDerWaalsContact CD1-O 3.25Å; Y46-G63 WeakPolarHBondContact CD1-O 2.95Å; Y46-G63 VanDerWaalsContact CZ-CA 3.45Å; Y46-G63 PolarHBondContact N-O 2.95Å; Y46-G63 PolarHBondContact O-N 2.79Å; Y46-G63 VanDerWaalsContact O-N 3.09Å; G63-A107 VanDerWaalsContact CA-CB 3.44Å
64	F	95.3	Very high	96.2	Very high	45 Å²	45	67.7 Å²	67.7	20%	0.197	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144.3	172.4	-55.5	-69.6	0	0	0	110	W43 I44 A45 L98 A104 A107 Y110	W43-F64 HydrophobicContact CE3-CB 4.06Å; W43-F64 HydrophobicContact CZ3-CB 4.18Å; I44-F64 CarbonylContact O-C 3.49Å; I44-F64 VanDerWaalsContact O-CA 3.31Å; I44-F64 WeakPolarHBondContact O-CA 3.31Å; A45-F64 HydrophobicContact CB-CD1 3.81Å; A45-F64 HydrophobicContact CB-CE1 3.77Å; F64-L98 HydrophobicContact CE1-CD1 4.18Å; F64-A104 HydrophobicContact CE1-CB 3.78Å; F64-A104 HydrophobicContact CE2-CB 3.66Å; F64-A104 HydrophobicContact CZ-CB 3.19Å; F64-A107 HydrophobicContact CD2-CB 4.22Å; F64-A107 HydrophobicContact CE2-CB 3.69Å; F64-A107 VanDerWaalsContact CZ-CA 3.48Å; F64-A107 HydrophobicContact CZ-CB 3.85Å; F64-Y110 HydrophobicContact CE1-CD1 4.05Å; F64-Y110 HydrophobicContact CE1-CE1 4.46Å; F64-Y110 HydrophobicContact CE1-CG 4.1Å; F64-Y110 HydrophobicContact CZ-CD1 4.43Å; F64-Y110 HydrophobicContact CZ-CG 4.16Å
65	L	95.5	Very high	96.4	Very high	3 Å²	3	64.7 Å²	64.7	2%	0.016	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.3	170.8	-61.4	172.1	0	0	0	108.3	V12 L36 N38 I44 Y46 K71	V12-L65 HydrophobicContact CG1-CD1 4.34Å; V12-L65 HydrophobicContact CG2-CD1 4.32Å; L36-L65 HydrophobicContact CB-CD1 3.75Å; L36-L65 HydrophobicContact CB-CD2 4.02Å; L36-L65 HydrophobicContact CD1-CD1 4.4Å; N38-L65 HydrophobicContact CB-CB 3.86Å; N38-L65 HydrophobicContact CB-CD1 4.4Å; N38-L65 PolarHBondContact ND2-O 3.29Å; I44-L65 HydrophobicContact CB-CB 4.35Å; I44-L65 PolarHBondContact N-O 2.86Å; I44-L65 PolarHBondContact O-N 2.94Å; Y46-L65 HydrophobicContact CD1-CD1 4.28Å; Y46-L65 HydrophobicContact CD1-CD2 4.12Å; Y46-L65 HydrophobicContact CD1-CG 3.73Å; Y46-L65 HydrophobicContact CE1-CD2 3.97Å; Y46-L65 HydrophobicContact CE1-CG 4.05Å; L65-K71 HydrophobicContact CD2-CB 3.34Å; L65-K71 HydrophobicContact CD2-CG 4.22Å
66	Q	94.9	Very high	96.6	Very high	91 Å²	91	69.2 Å²	69.2	43%	0.425	31%	0.31	S	S	.	.			trans	-66.1	152	169.3	-81.8	177.8	-16.4	0	0	110.8	N38 W43 F68 R69	N38-Q66 WeakPolarHBondContact CB-O 3.35Å; N38-Q66 PolarHBondContact ND2-O 2.73Å; N38-Q66 VanDerWaalsContact ND2-O 3.12Å; W43-Q66 HydrophobicContact CD2-CG 4.31Å; W43-Q66 HydrophobicContact CE3-CG 3.93Å; W43-Q66 HydrophobicContact CH2-CB 4.48Å; W43-Q66 HydrophobicContact CH2-CG 3.17Å; W43-Q66 HydrophobicContact CZ2-CG 3.53Å; W43-Q66 HydrophobicContact CZ3-CB 4.43Å; W43-Q66 HydrophobicContact CZ3-CG 3.36Å; Q66-F68 PolarHBondContact O-N 2.84Å; Q66-R69 HydrophobicContact CB-CB 3.85Å; Q66-R69 HydrophobicContact CB-CG 3.53Å; Q66-R69 PolarHBondContact O-N 2.76Å
67	P	95.1	Very high	96.5	Very high	36 Å²	36	69 Å²	69	23%	0.234	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	133.3	168.3	-28.8	36.4	0	0	0	111.9	S40 T41 R69	S40-P67 VanDerWaalsContact O-CA 3.29Å; S40-P67 WeakPolarHBondContact O-CA 3.39Å; S40-P67 WeakPolarHBondContact O-CB 3.35Å; T41-P67 WeakPolarHBondContact O-CG 3.41Å; P67-R69 PolarHBondContact O-N 2.83Å; P67-R69 VanDerWaalsContact O-N 3.09Å
68	F	96.4	Very high	96.2	Very high	112 Å²	112	65.9 Å²	65.9	49%	0.491	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	26.7	177.5	-47.8	-65.4	0	0	0	115.2	N38 S40 T41 Q66	N38-F68 WeakPolarHBondContact O-CA 3.45Å; N38-F68 PolarHBondContact O-N 2.91Å; S40-F68 PolarHBondContact O-N 3.01Å; T41-F68 HydrophobicContact CG2-CE2 3.95Å; T41-F68 HydrophobicContact CG2-CZ 3.7Å; Q66-F68 PolarHBondContact O-N 2.84Å
69	R	97.5	Very high	95.3	Very high	157 Å²	157	65.6 Å²	65.6	59%	0.592	30%	0.297	S	S	*	.			trans	-114.1	148.4	176.9	-65.8	-59.7	-169.2	169.7	-0.7	112.2	N38 Q66 P67	N38-R69 PolarHBondContact N-O 3.13Å; N38-R69 VanDerWaalsContact N-O 3.13Å; Q66-R69 HydrophobicContact CB-CB 3.85Å; Q66-R69 HydrophobicContact CB-CG 3.53Å; Q66-R69 PolarHBondContact O-N 2.76Å; P67-R69 PolarHBondContact O-N 2.83Å; P67-R69 VanDerWaalsContact O-N 3.09Å
70	M	96.9	Very high	93.8	Very high	87 Å²	87	61 Å²	61	43%	0.429	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	142.3	172.6	-171.4	69.1	79.6	0	0	110.1	Y15 Q35 L36 Y37	Y15-M70 HydrophobicContact CD2-CE 4.43Å; Q35-M70 HydrophobicContact CB-CG 4.2Å; Q35-M70 HydrophobicContact CB-SD 3.58Å; Q35-M70 VanDerWaalsContact CB-SD 3.58Å; L36-M70 CarbonylContact O-C 3.58Å; L36-M70 WeakPolarHBondContact O-CA 3.39Å; L36-M70 VanDerWaalsContact O-SD 3.34Å; Y37-M70 HydrophobicContact CD2-CE 4.23Å; Y37-M70 HydrophobicContact CG-CE 4.07Å
71	K	97.9	Very high	92.2	Very high	95 Å²	95	62.1 Å²	62.1	41%	0.413	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.3	171.3	-170.9	72	175.7	-175.6	0	110.6	Q35 L36 L65 I73	Q35-K71 WeakPolarHBondContact CA-O 3.37Å; L36-K71 PolarHBondContact N-O 3.22Å; L36-K71 PolarHBondContact O-N 3.37Å; L65-K71 HydrophobicContact CD2-CB 3.34Å; L65-K71 HydrophobicContact CD2-CG 4.22Å; K71-I73 HydrophobicContact CG-CD1 3.91Å
72	K	98.1	Very high	90.5	Very high	137 Å²	137	68.8 Å²	68.8	60%	0.596	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	131.6	169.9	-172.1	175	-177.6	175.6	0	110.3	S33	S33-K72 WeakPolarHBondContact OG-CE 3.25Å
73	I	98.1	Very high	88.8	Confident	0 Å²	0	68 Å²	68	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127	175	-50.3	-60.2	0	0	0	107.6	S33 I34 L36 Y46 L48 F58 P60 K71	S33-I73 CarbonylContact C-O 3.47Å; S33-I73 VanDerWaalsContact CA-O 3.24Å; S33-I73 WeakPolarHBondContact CA-O 3.49Å; I34-I73 HydrophobicContact CB-CB 4.41Å; I34-I73 PolarHBondContact N-O 2.82Å; I34-I73 PolarHBondContact O-N 3.42Å; L36-I73 HydrophobicContact CD1-CD1 4.48Å; L36-I73 HydrophobicContact CD1-CG1 4.1Å; L36-I73 HydrophobicContact CG-CG1 4.22Å; Y46-I73 HydrophobicContact CE2-CD1 3.71Å; Y46-I73 WeakPolarHBondContact OH-CD1 3.49Å; L48-I73 HydrophobicContact CD1-CG1 4.47Å; L48-I73 HydrophobicContact CD1-CG2 4.1Å; L48-I73 HydrophobicContact CD2-CG2 3.98Å; F58-I73 HydrophobicContact CB-CG2 4.33Å; P60-I73 HydrophobicContact CG-CD1 3.69Å; P60-I73 WeakPolarHBondContact O-CG2 3.45Å; K71-I73 HydrophobicContact CG-CD1 3.91Å
74	L	97.8	Very high	87	Confident	72 Å²	72	73.7 Å²	73.7	38%	0.377	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	131.3	173.3	-170.6	71.3	0	0	0	109.5	L31 F58 R59	L31-L74 HydrophobicContact CB-CD1 4.22Å; L31-L74 HydrophobicContact CD1-CD1 4.43Å; L31-L74 HydrophobicContact CD2-CD1 4.2Å; L31-L74 HydrophobicContact CD2-CD2 4.01Å; L31-L74 HydrophobicContact CD2-CG 4.12Å; F58-L74 CarbonylContact C-O 3.53Å; F58-L74 WeakPolarHBondContact CA-O 3.23Å; R59-L74 HydrophobicContact CB-CB 4.49Å; R59-L74 PolarHBondContact N-O 2.85Å; R59-L74 PolarHBondContact O-N 2.92Å
75	V	97.3	Very high	85.3	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.2	173.4	-167.7	0	0	0	0	107.6	I20 F22 L31 A32 I34 I56 F58	I20-V75 HydrophobicContact CD1-CG2 4.42Å; F22-V75 HydrophobicContact CE2-CG1 4.46Å; F22-V75 HydrophobicContact CZ-CB 4.24Å; F22-V75 HydrophobicContact CZ-CG1 3.84Å; L31-V75 WeakPolarHBondContact CA-O 3.48Å; A32-V75 HydrophobicContact CB-CB 4.36Å; A32-V75 PolarHBondContact N-O 2.87Å; A32-V75 PolarHBondContact O-N 2.81Å; I34-V75 HydrophobicContact CD1-CG2 3.58Å; I34-V75 HydrophobicContact CG1-CG2 3.69Å; I56-V75 HydrophobicContact CG2-CG1 3.81Å; F58-V75 HydrophobicContact CD1-CB 4.47Å; F58-V75 HydrophobicContact CD1-CG1 4.08Å; F58-V75 HydrophobicContact CD1-CG2 4.02Å; F58-V75 HydrophobicContact CE1-CG1 3.87Å; F58-V75 HydrophobicContact CE1-CG2 4.15Å
76	R	95.6	Very high	84	Confident	118 Å²	118	86.1 Å²	86.1	45%	0.445	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.4	175.1	-179.9	-175.5	166.3	176.3	1.9	108.5	T29 Q30 L31 I56 K57	T29-R76 HydrophobicContact CG2-CG 3.43Å; T29-R76 VanDerWaalsContact CG2-CG 3.43Å; T29-R76 PolarHBondContact OG1-NH2 3.4Å; Q30-R76 WeakPolarHBondContact O-CA 3.44Å; L31-R76 HydrophobicContact CD2-CB 3.96Å; L31-R76 HydrophobicContact CD2-CG 4.11Å; I56-R76 CarbonylContact C-O 3.59Å; I56-R76 WeakPolarHBondContact CA-O 3.29Å; K57-R76 HydrophobicContact CB-CB 4.4Å; K57-R76 PolarHBondContact N-O 3.47Å; K57-R76 PolarHBondContact O-N 2.9Å
77	C	93.1	Very high	82.9	Confident	1 Å²	1	87.6 Å²	87.6	1%	0.007	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.4	172.5	-173.2	0	0	0	0	109.7	F22 Q30 E55	F22-C77 HydrophobicContact CD1-CB 3.73Å; F22-C77 HydrophobicContact CD2-CB 4Å; F22-C77 HydrophobicContact CE1-CB 3.54Å; F22-C77 HydrophobicContact CE2-CB 3.84Å; F22-C77 HydrophobicContact CG-CB 3.96Å; F22-C77 HydrophobicContact CZ-CB 3.61Å; Q30-C77 PolarHBondContact N-O 2.78Å; Q30-C77 PolarHBondContact O-N 3.07Å; E55-C77 CarbonylContact O-C 3.54Å; E55-C77 WeakPolarHBondContact O-CA 3.35Å
78	T	90	Very high	82.4	Confident	44 Å²	44	90.5 Å²	90.5	27%	0.27	43%	0.433	S	S	.	.			trans	-124.9	92.4	170.9	49.5	0	0	0	0	107.4	T29 E55	T29-T78 HydrophobicContact CG2-CG2 4.02Å; T29-T78 WeakPolarHBondContact OG1-CG2 3.44Å; E55-T78 WeakPolarHBondContact CA-O 3.41Å; E55-T78 WeakPolarHBondContact CB-O 3.49Å; E55-T78 PolarHBondContact O-N 3.16Å; E55-T78 PolarHBondContact O-OG1 3.28Å
79	R	79.1	Confident	82.1	Confident	22 Å²	22	85.5 Å²	85.5	8%	0.083	41%	0.411	C	S	.	.			trans	-94.9	131.8	178.6	-169.4	168.5	-176.3	150.9	4.8	109.9	F26 E83 D84 F130	F26-R79 HydrophobicContact CD1-CG 4.45Å; F26-R79 HydrophobicContact CE1-CG 4.47Å; R79-E83 PolarHBondContact NH2-O 3.37Å; R79-D84 PolarHBondContact NH2-O 3.36Å; R79-F130 HydrophobicContact CB-CE1 4.33Å
80	L	66	Low	81.9	Confident	103 Å²	103	84 Å²	84	54%	0.539	41%	0.405	S	S	.	.			trans	-86.2	147.7	173.1	-65.4	174.9	0	0	0	109.7	D82	L80-D82 PolarHBondContact O-N 3.02Å; L80-D82 VanDerWaalsContact O-N 3.08Å
81	P	62.8	Low	81.8	Confident	75 Å²	75	80 Å²	80	49%	0.487	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.8	-173.1	21.3	-32	0	0	0	115	F26 D27	F26-P81 HydrophobicContact CB-CB 3.96Å; F26-P81 HydrophobicContact CD1-CB 4.33Å; F26-P81 HydrophobicContact CD2-CB 4.47Å; F26-P81 HydrophobicContact CG-CB 4.01Å; D27-P81 VanDerWaalsContact OD1-CD 3.28Å; D27-P81 WeakPolarHBondContact OD1-CD 3.41Å
82	D	62.4	Low	81.8	Confident	156 Å²	156	77 Å²	77	83%	0.834	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-0.3	-167.9	-135.7	6.3	0	0	0	114.1	L80	L80-D82 PolarHBondContact O-N 3.02Å; L80-D82 VanDerWaalsContact O-N 3.08Å
83	E	59.3	Low	81.6	Confident	65 Å²	65	70.5 Å²	70.5	30%	0.304	35%	0.347	S	S	.	.	S	Bend	trans	-93.6	108.8	-176.9	-64.3	-165	152.8	0	0	111.4	R79 M85	R79-E83 PolarHBondContact NH2-O 3.37Å; E83-M85 PolarHBondContact O-N 2.68Å
84	D	58.2	Low	81.4	Confident	129 Å²	129	70.6 Å²	70.6	69%	0.69	35%	0.347	S	S	*	.			trans	1	100.5	167.9	-71.5	-36	0	0	0	113.8	R79 E86 R87	R79-D84 PolarHBondContact NH2-O 3.36Å; D84-E86 PolarHBondContact O-N 3.07Å; D84-R87 HydrophobicContact CB-CB 4.43Å; D84-R87 PolarHBondContact O-N 3.09Å
85	M	60.5	Low	81.2	Confident	126 Å²	126	67.2 Å²	67.2	62%	0.621	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-16	177.2	-83.1	178.9	9.4	0	0	113.6	R24 E83	R24-M85 VanDerWaalsContact CZ-SD 3.53Å; R24-M85 PolarHBondContact NH2-SD 3.09Å; E83-M85 PolarHBondContact O-N 2.68Å
86	E	66.5	Low	80.8	Confident	183 Å²	183	67.5 Å²	67.5	86%	0.855	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-8.2	-178.5	-61.6	-176.7	176.5	0	0	113.9	D84 T88	D84-E86 PolarHBondContact O-N 3.07Å; E86-T88 PolarHBondContact O-N 3.45Å; E86-T88 VanDerWaalsContact O-N 3.09Å
87	R	73.1	Confident	80.6	Confident	122 Å²	122	62.4 Å²	62.4	46%	0.46	31%	0.313	S	S	.	.			trans	-68.3	114.7	-178.4	-166.1	174.2	159.3	161.1	-2.3	110.6	T51 D84 E89	T51-R87 PolarHBondContact O-NH2 2.72Å; T51-R87 VanDerWaalsContact O-NH2 3.17Å; D84-R87 HydrophobicContact CB-CB 4.43Å; D84-R87 PolarHBondContact O-N 3.09Å; R87-E89 WeakPolarHBondContact CD-OE1 3.24Å; R87-E89 VanDerWaalsContact CG-OE1 3.24Å; R87-E89 WeakPolarHBondContact CG-OE1 3.44Å; R87-E89 IonicContact CZ-OE1 2.79Å; R87-E89 IonicContact NE-OE1 3.73Å; R87-E89 PolarHBondContact NE-OE1 3.14Å; R87-E89 IonicContact NH2-OE1 3.95Å; R87-E89 PolarHBondContact O-N 2.89Å
88	T	84	Confident	80.4	Confident	97 Å²	97	63.2 Å²	63.2	60%	0.595	32%	0.318	S	S	*	.			trans	-75.5	103.4	176.7	-56.8	0	0	0	0	109.6	E86 R90	E86-T88 PolarHBondContact O-N 3.45Å; E86-T88 VanDerWaalsContact O-N 3.09Å; T88-R90 HydrophobicContact CG2-CG 4.36Å
89	E	89.7	Confident	80.2	Confident	7 Å²	7	63.7 Å²	63.7	3%	0.033	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	139.7	177.7	-69.4	-51.4	144.8	0	0	112.3	T51 S52 I56 R87 V128 F130	T51-E89 WeakPolarHBondContact CB-OE2 3.45Å; T51-E89 PolarHBondContact OG1-OE2 2.89Å; S52-E89 WeakPolarHBondContact CB-OE2 3.48Å; S52-E89 PolarHBondContact OG-OE1 3.45Å; S52-E89 PolarHBondContact OG-OE2 2.87Å; I56-E89 HydrophobicContact CD1-CB 4.43Å; R87-E89 WeakPolarHBondContact CD-OE1 3.24Å; R87-E89 VanDerWaalsContact CG-OE1 3.24Å; R87-E89 WeakPolarHBondContact CG-OE1 3.44Å; R87-E89 IonicContact CZ-OE1 2.79Å; R87-E89 IonicContact NE-OE1 3.73Å; R87-E89 PolarHBondContact NE-OE1 3.14Å; R87-E89 IonicContact NH2-OE1 3.95Å; R87-E89 PolarHBondContact O-N 2.89Å; E89-V128 HydrophobicContact CB-CB 3.75Å; E89-V128 HydrophobicContact CB-CG1 4.23Å; E89-V128 HydrophobicContact CB-CG2 4.33Å; E89-V128 PolarHBondContact O-N 2.87Å; E89-F130 HydrophobicContact CG-CE2 4.41Å
90	R	93.9	Very high	80.4	Confident	126 Å²	126	70.1 Å²	70.1	48%	0.475	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	133.1	-176.8	-59.5	180	72.1	169.1	5.1	111.1	T50 T51 T88 L126	T50-R90 WeakPolarHBondContact CA-O 3.24Å; T51-R90 HydrophobicContact CG2-CB 4.05Å; T51-R90 PolarHBondContact N-O 2.89Å; T51-R90 PolarHBondContact OG1-N 2.92Å; T51-R90 PolarHBondContact OG1-O 2.89Å; T88-R90 HydrophobicContact CG2-CG 4.36Å; R90-L126 WeakPolarHBondContact CA-O 3.32Å
91	C	95.5	Very high	81.2	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.007	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	154.3	163.9	-64.7	0	0	0	0	109.4	I20 R49 F58 P125 L126 V128	I20-C91 HydrophobicContact CD1-CB 4.41Å; R49-C91 CarbonylContact O-C 3.56Å; R49-C91 WeakPolarHBondContact O-CA 3.14Å; F58-C91 HydrophobicContact CE1-CB 4.36Å; F58-C91 HydrophobicContact CZ-CB 4.04Å; F58-C91 VanDerWaalsContact CZ-SG 3.57Å; C91-P125 WeakPolarHBondContact O-CA 3.4Å; C91-L126 HydrophobicContact CB-CB 4.36Å; C91-L126 HydrophobicContact CB-CD1 4.43Å; C91-L126 PolarHBondContact N-O 2.92Å; C91-L126 PolarHBondContact O-N 3.25Å; C91-V128 HydrophobicContact CB-CG2 4.48Å; C91-V128 VanDerWaalsContact SG-CG2 3.56Å
92	T	95.8	Very high	82.1	Confident	34 Å²	34	68.1 Å²	68.1	21%	0.209	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	123.7	174	-57	0	0	0	0	110.1	L48 R49 V94 K123 C124	L48-T92 WeakPolarHBondContact CA-O 3.41Å; R49-T92 PolarHBondContact N-O 2.89Å; R49-T92 PolarHBondContact O-N 3.18Å; T92-V94 HydrophobicContact CG2-CG2 4.24Å; T92-K123 HydrophobicContact CG2-CB 4.01Å; T92-C124 WeakPolarHBondContact CA-O 3.36Å
93	V	95.7	Very high	82.8	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	117.7	168.8	-179.2	0	0	0	0	107.9	V14 L36 L48 K123 C124 L126	V14-V93 HydrophobicContact CG1-CG2 4.27Å; V14-V93 HydrophobicContact CG2-CB 4.43Å; V14-V93 HydrophobicContact CG2-CG2 4.43Å; L36-V93 HydrophobicContact CD1-CG1 4.24Å; L36-V93 HydrophobicContact CD2-CG1 3.93Å; L36-V93 HydrophobicContact CD2-CG2 4Å; L48-V93 HydrophobicContact CD2-CG2 4.3Å; L48-V93 HydrophobicContact CG-CG2 4.45Å; V93-K123 CarbonylContact O-C 3.5Å; V93-K123 WeakPolarHBondContact O-CA 3.34Å; V93-C124 HydrophobicContact CB-CB 4.24Å; V93-C124 PolarHBondContact N-O 2.62Å; V93-C124 PolarHBondContact O-N 2.86Å; V93-L126 HydrophobicContact CG2-CD1 3.87Å
94	V	93.2	Very high	83.2	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.006	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	128.4	171.3	-175.2	0	0	0	0	107.7	Y46 K47 R49 T92 W111 I120 K123	Y46-V94 CarbonylContact C-O 3.48Å; Y46-V94 VanDerWaalsContact CA-O 3.23Å; Y46-V94 WeakPolarHBondContact CA-O 3.1Å; K47-V94 PolarHBondContact N-O 2.81Å; K47-V94 PolarHBondContact O-N 2.92Å; R49-V94 HydrophobicContact CG-CG2 4.43Å; T92-V94 HydrophobicContact CG2-CG2 4.24Å; V94-W111 HydrophobicContact CG1-CH2 3.97Å; V94-W111 HydrophobicContact CG1-CZ3 4.33Å; V94-I120 HydrophobicContact CG1-CG1 4.35Å; V94-I120 HydrophobicContact CG1-CG2 3.78Å; V94-K123 HydrophobicContact CG2-CG 4.49Å
95	A	92.6	Very high	84.2	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.008	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.8	179.2	0	0	0	0	0	110.7	F3 V12 I44 A45 D121 K122	F3-A95 HydrophobicContact CE1-CB 4.37Å; F3-A95 HydrophobicContact CZ-CB 4Å; V12-A95 HydrophobicContact CB-CB 4.39Å; V12-A95 HydrophobicContact CG2-CB 3.87Å; I44-A95 HydrophobicContact CG2-CB 3.93Å; A45-A95 WeakPolarHBondContact O-CA 3.45Å; A95-D121 PolarHBondContact O-N 2.86Å; A95-K122 PolarHBondContact N-O 3.33Å; A95-K122 PolarHBondContact O-N 2.74Å
96	H	90.4	Very high	85.7	Confident	7 Å²	7	66.9 Å²	66.9	3%	0.032	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	137.1	177.2	177.7	-100.8	0	0	0	110.5	I44 A45 L98 Y110 W111 M114 L119 D121	I44-H96 CarbonylContact C-O 3.53Å; I44-H96 WeakPolarHBondContact CA-O 3.34Å; A45-H96 PolarHBondContact N-O 3.32Å; A45-H96 PolarHBondContact O-N 3.04Å; H96-L98 PolarHBondContact O-N 3.35Å; H96-Y110 PolarHBondContact ND1-OH 3.04Å; H96-W111 HydrophobicContact CB-CH2 4.16Å; H96-M114 WeakPolarHBondContact CE1-CE 3.39Å; H96-M114 WeakPolarHBondContact ND1-CE 3.34Å; H96-L119 PolarHBondContact CD2-O 3.35Å; H96-L119 WeakPolarHBondContact NE2-CB 3.07Å; H96-D121 WeakPolarHBondContact CA-OD2 3.5Å; H96-D121 VanDerWaalsContact CD2-CG 3.46Å; H96-D121 IonicContact CD2-OD1 3.71Å; H96-D121 IonicContact CD2-OD2 2.68Å; H96-D121 PolarHBondContact CD2-OD2 3.42Å; H96-D121 IonicContact CG-OD2 3.34Å; H96-D121 IonicContact NE2-OD2 3.73Å
97	V	90.2	Very high	87	Confident	10 Å²	10	58.7 Å²	58.7	6%	0.061	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	124.1	176.9	178	0	0	0	0	109.3	A10 E42 P99 D121	A10-V97 HydrophobicContact CB-CG2 3.53Å; E42-V97 HydrophobicContact CB-CG1 3.82Å; E42-V97 HydrophobicContact CG-CG1 4.06Å; V97-P99 VanDerWaalsContact O-CD 3.31Å; V97-P99 WeakPolarHBondContact O-CD 3.46Å; V97-D121 PolarHBondContact N-OD2 3.32Å
98	L	88.8	Confident	87.8	Confident	19 Å²	19	58.9 Å²	58.9	10%	0.099	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-66.2	121.8	-179.8	-170.7	64.1	0	0	0	109.3	W43 F64 H96 V102 A104 Y110	W43-L98 HydrophobicContact CB-CB 3.97Å; W43-L98 HydrophobicContact CB-CD2 4.09Å; W43-L98 WeakPolarHBondContact O-CB 3.35Å; W43-L98 PolarHBondContact O-N 3.47Å; F64-L98 HydrophobicContact CE1-CD1 4.18Å; H96-L98 PolarHBondContact O-N 3.35Å; L98-V102 HydrophobicContact CD1-CB 4.14Å; L98-V102 HydrophobicContact CD1-CG1 3.89Å; L98-V102 HydrophobicContact CG-CB 4.31Å; L98-A104 HydrophobicContact CD1-CB 4.32Å; L98-A104 HydrophobicContact CD2-CB 4.46Å; L98-Y110 HydrophobicContact CD1-CD2 3.89Å; L98-Y110 HydrophobicContact CD1-CE1 4.46Å; L98-Y110 HydrophobicContact CD1-CE2 3.24Å
99	P	85.7	Confident	88.1	Confident	53 Å²	53	58.3 Å²	58.3	34%	0.344	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-60.9	146.5	179.5	-22.8	33.5	0	0	0	111.7	V97 V102 M114	V97-P99 VanDerWaalsContact O-CD 3.31Å; V97-P99 WeakPolarHBondContact O-CD 3.46Å; P99-V102 HydrophobicContact CB-CG2 3.94Å; P99-V102 HydrophobicContact CG-CG2 4.32Å; P99-V102 WeakPolarHBondContact O-CB 3.41Å; P99-V102 PolarHBondContact O-N 2.91Å; P99-M114 HydrophobicContact CG-CE 4.35Å
100	E	83	Confident	88.2	Confident	158 Å²	158	58.7 Å²	58.7	74%	0.738	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	140.1	178.4	-167.3	170.7	174.8	0	0	111.4	R8 V102	R8-E100 IonicContact CZ-OE2 2.81Å; R8-E100 IonicContact NH1-OE2 3.83Å; R8-E100 IonicContact NH2-OE2 3.81Å; R8-E100 PolarHBondContact NH2-OE2 2.94Å; E100-V102 VanDerWaalsContact C-N 3.27Å; E100-V102 PolarHBondContact O-N 3.17Å
101	G	83.2	Confident	88	Confident	72 Å²	72	53.8 Å²	53.8	74%	0.742	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-12.6	-176.6	0	0	0	0	0	115.3	K103	G101-K103 PolarHBondContact O-N 3.02Å; G101-K103 VanDerWaalsContact O-N 3.1Å
102	V	82.1	Confident	87.6	Confident	63 Å²	63	59.8 Å²	59.8	38%	0.382	32%	0.322	S	S	.	.			trans	-75.5	102.8	175.6	-179.1	0	0	0	0	110.1	L98 P99 E100 A104 Y110	L98-V102 HydrophobicContact CD1-CB 4.14Å; L98-V102 HydrophobicContact CD1-CG1 3.89Å; L98-V102 HydrophobicContact CG-CB 4.31Å; P99-V102 HydrophobicContact CB-CG2 3.94Å; P99-V102 HydrophobicContact CG-CG2 4.32Å; P99-V102 WeakPolarHBondContact O-CB 3.41Å; P99-V102 PolarHBondContact O-N 2.91Å; E100-V102 VanDerWaalsContact C-N 3.27Å; E100-V102 PolarHBondContact O-N 3.17Å; V102-A104 VanDerWaalsContact C-N 3.32Å; V102-A104 HydrophobicContact CG1-CB 4.18Å; V102-A104 PolarHBondContact O-N 2.99Å; V102-A104 VanDerWaalsContact O-N 3.1Å; V102-Y110 HydrophobicContact CG1-CD2 4.26Å; V102-Y110 HydrophobicContact CG1-CE2 4.28Å
103	K	76.5	Confident	87.1	Confident	197 Å²	197	62.2 Å²	62.2	86%	0.857	34%	0.34	S	S	*	.			trans	-81.6	79.7	168.1	-65.2	-175.1	-177.9	179.7	0	109.4	G101 V105	G101-K103 PolarHBondContact O-N 3.02Å; G101-K103 VanDerWaalsContact O-N 3.1Å; K103-V105 PolarHBondContact O-N 2.82Å; K103-V105 VanDerWaalsContact O-N 3.16Å
104	A	68.4	Low	86.4	Confident	31 Å²	31	63.7 Å²	63.7	26%	0.256	35%	0.348	S	S	.	.			trans	-74	108.6	179.1	0	0	0	0	0	110.7	F64 L98 V102 Y110	F64-A104 HydrophobicContact CE1-CB 3.78Å; F64-A104 HydrophobicContact CE2-CB 3.66Å; F64-A104 HydrophobicContact CZ-CB 3.19Å; L98-A104 HydrophobicContact CD1-CB 4.32Å; L98-A104 HydrophobicContact CD2-CB 4.46Å; V102-A104 VanDerWaalsContact C-N 3.32Å; V102-A104 HydrophobicContact CG1-CB 4.18Å; V102-A104 PolarHBondContact O-N 2.99Å; V102-A104 VanDerWaalsContact O-N 3.1Å; A104-Y110 HydrophobicContact CB-CD2 4.41Å
105	V	80.4	Confident	84.9	Confident	149 Å²	149	70 Å²	70	90%	0.903	38%	0.379	S	S	*	.	S	Bend	trans	-77.1	-38.4	176.1	-177.5	0	0	0	0	110.7	K103	K103-V105 PolarHBondContact O-N 2.82Å; K103-V105 VanDerWaalsContact O-N 3.16Å
106	N	91	Very high	83	Confident	73 Å²	73	78.8 Å²	78.8	39%	0.39	42%	0.417	S	S	.	.			trans	-133.1	126.2	-175.8	-176.8	-5.6	0	0	0	110.9	Y108 D109 Y110	N106-Y108 VanDerWaalsContact C-N 3.33Å; N106-Y108 PolarHBondContact O-N 3.08Å; N106-Y108 WeakPolarHBondContact OD1-CB 3.25Å; N106-Y108 PolarHBondContact OD1-N 2.95Å; N106-D109 HydrophobicContact CB-CB 4.29Å; N106-D109 VanDerWaalsContact CB-OD2 3.32Å; N106-D109 WeakPolarHBondContact CB-OD2 3.45Å; N106-D109 PolarHBondContact ND2-OD2 3.48Å; N106-D109 PolarHBondContact O-N 2.82Å; N106-Y110 PolarHBondContact O-N 2.86Å; N106-Y110 VanDerWaalsContact O-N 3.14Å
107	A	92.9	Very high	81.6	Confident	11 Å²	11	81.8 Å²	81.8	9%	0.091	44%	0.436	C	S	.	.	H	α-helix	trans	-65.3	-34.7	179	0	0	0	0	0	112.9	G63 F64 Y110 W111	G63-A107 VanDerWaalsContact CA-CB 3.44Å; F64-A107 HydrophobicContact CD2-CB 4.22Å; F64-A107 HydrophobicContact CE2-CB 3.69Å; F64-A107 VanDerWaalsContact CZ-CA 3.48Å; F64-A107 HydrophobicContact CZ-CB 3.85Å; A107-Y110 PolarHBondContact O-N 2.9Å; A107-W111 PolarHBondContact O-N 2.85Å
108	Y	91.4	Very high	80.2	Confident	126 Å²	126	89.6 Å²	89.6	49%	0.494	48%	0.478	S	S	.	.	H	α-helix	trans	-62.8	-46.6	178.3	179.8	-98.4	0	0	0	111.5	N106 W111 K112	N106-Y108 VanDerWaalsContact C-N 3.33Å; N106-Y108 PolarHBondContact O-N 3.08Å; N106-Y108 WeakPolarHBondContact OD1-CB 3.25Å; N106-Y108 PolarHBondContact OD1-N 2.95Å; Y108-W111 PolarHBondContact O-N 2.87Å; Y108-K112 HydrophobicContact CE1-CD 4.37Å; Y108-K112 WeakPolarHBondContact O-CB 3.41Å; Y108-K112 PolarHBondContact O-N 3.09Å
109	D	90.1	Very high	79.1	Confident	85 Å²	85	92.3 Å²	92.3	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-67.4	-39.6	-179.5	-61.9	-37.3	0	0	0	111.5	N106 W111 K112 S113	N106-D109 HydrophobicContact CB-CB 4.29Å; N106-D109 VanDerWaalsContact CB-OD2 3.32Å; N106-D109 WeakPolarHBondContact CB-OD2 3.45Å; N106-D109 PolarHBondContact ND2-OD2 3.48Å; N106-D109 PolarHBondContact O-N 2.82Å; D109-W111 PolarHBondContact O-N 2.84Å; D109-K112 PolarHBondContact O-N 3.19Å; D109-K112 VanDerWaalsContact O-N 3.17Å; D109-S113 PolarHBondContact O-N 2.99Å; D109-S113 PolarHBondContact O-OG 2.55Å
110	Y	90.7	Very high	78.1	Confident	15 Å²	15	92.9 Å²	92.9	6%	0.059	49%	0.491	C	S	.	.	H	α-helix	trans	-56.3	-49	172.4	172.8	-95.8	0	0	0	112.1	A45 F64 H96 L98 V102 A104 N106 A107 K112 S113 M114	A45-Y110 HydrophobicContact CB-CD1 3.83Å; A45-Y110 HydrophobicContact CB-CE1 3.19Å; F64-Y110 HydrophobicContact CE1-CD1 4.05Å; F64-Y110 HydrophobicContact CE1-CE1 4.46Å; F64-Y110 HydrophobicContact CE1-CG 4.1Å; F64-Y110 HydrophobicContact CZ-CD1 4.43Å; F64-Y110 HydrophobicContact CZ-CG 4.16Å; H96-Y110 PolarHBondContact ND1-OH 3.04Å; L98-Y110 HydrophobicContact CD1-CD2 3.89Å; L98-Y110 HydrophobicContact CD1-CE1 4.46Å; L98-Y110 HydrophobicContact CD1-CE2 3.24Å; V102-Y110 HydrophobicContact CG1-CD2 4.26Å; V102-Y110 HydrophobicContact CG1-CE2 4.28Å; A104-Y110 HydrophobicContact CB-CD2 4.41Å; N106-Y110 PolarHBondContact O-N 2.86Å; N106-Y110 VanDerWaalsContact O-N 3.14Å; A107-Y110 PolarHBondContact O-N 2.9Å; Y110-K112 VanDerWaalsContact C-N 3.26Å; Y110-K112 PolarHBondContact O-N 2.88Å; Y110-S113 PolarHBondContact O-N 2.69Å; Y110-S113 PolarHBondContact O-OG 2.86Å; Y110-M114 HydrophobicContact CD1-SD 4.35Å; Y110-M114 HydrophobicContact CE1-CE 4.15Å; Y110-M114 HydrophobicContact CE1-CG 4.37Å; Y110-M114 HydrophobicContact CE1-SD 3.48Å; Y110-M114 WeakPolarHBondContact CE1-SD 3.39Å; Y110-M114 HydrophobicContact CE2-CE 3.66Å; Y110-M114 HydrophobicContact CE2-CG 4.38Å; Y110-M114 HydrophobicContact CE2-SD 3.99Å; Y110-M114 WeakPolarHBondContact O-CB 3.32Å; Y110-M114 PolarHBondContact O-N 2.83Å; Y110-M114 WeakPolarHBondContact OH-CE 3.45Å; Y110-M114 PolarHBondContact OH-SD 2.82Å; Y110-M114 VanDerWaalsContact OH-SD 3.35Å
111	W	89.9	Confident	77.7	Confident	24 Å²	24	86.8 Å²	86.8	9%	0.091	46%	0.464	C	S	.	.	H	α-helix	trans	-69.8	-23.5	178.8	-78.7	110.5	0	0	0	113.4	A45 Y46 K47 Y62 V94 H96 A107 Y108 D109	A45-W111 HydrophobicContact CB-CZ2 3.98Å; Y46-W111 VanDerWaalsContact C-CZ2 3.49Å; Y46-W111 PolarHBondContact O-NE1 2.8Å; K47-W111 HydrophobicContact CB-CD2 3.88Å; K47-W111 HydrophobicContact CB-CE3 4.35Å; K47-W111 HydrophobicContact CB-CG 4.33Å; K47-W111 HydrophobicContact CB-CH2 4.27Å; K47-W111 HydrophobicContact CB-CZ2 3.78Å; K47-W111 HydrophobicContact CD-CD2 4.3Å; K47-W111 HydrophobicContact CD-CE3 4.35Å; K47-W111 HydrophobicContact CD-CG 4.5Å; Y62-W111 HydrophobicContact CD1-CB 4.21Å; Y62-W111 AromaticContact CD1-CD1 3.61Å; Y62-W111 AromaticContact CD1-CG 3.99Å; Y62-W111 HydrophobicContact CD1-CG 3.99Å; Y62-W111 HydrophobicContact CE1-CB 4.4Å; V94-W111 HydrophobicContact CG1-CH2 3.97Å; V94-W111 HydrophobicContact CG1-CZ3 4.33Å; H96-W111 HydrophobicContact CB-CH2 4.16Å; A107-W111 PolarHBondContact O-N 2.85Å; Y108-W111 PolarHBondContact O-N 2.87Å; D109-W111 PolarHBondContact O-N 2.84Å
112	K	87.8	Confident	77.8	Confident	127 Å²	127	84.9 Å²	84.9	55%	0.552	44%	0.435	S	S	*	.	H	α-helix	trans	-77.9	-37.2	174.9	-169.5	-179.8	178.7	-173.7	0	111.9	Y108 D109 Y110 M115	Y108-K112 HydrophobicContact CE1-CD 4.37Å; Y108-K112 WeakPolarHBondContact O-CB 3.41Å; Y108-K112 PolarHBondContact O-N 3.09Å; D109-K112 PolarHBondContact O-N 3.19Å; D109-K112 VanDerWaalsContact O-N 3.17Å; Y110-K112 VanDerWaalsContact C-N 3.26Å; Y110-K112 PolarHBondContact O-N 2.88Å; K112-M115 WeakPolarHBondContact O-CG 3.44Å
113	S	85.8	Confident	78.3	Confident	84 Å²	84	87.9 Å²	87.9	59%	0.587	44%	0.443	S	S	*	.	H	α-helix	trans	-75.4	-28.3	176.9	65.2	0	0	0	0	112.9	D109 Y110 M115	D109-S113 PolarHBondContact O-N 2.99Å; D109-S113 PolarHBondContact O-OG 2.55Å; Y110-S113 PolarHBondContact O-N 2.69Å; Y110-S113 PolarHBondContact O-OG 2.86Å; S113-M115 PolarHBondContact O-N 3.17Å
114	M	80.7	Confident	79	Confident	32 Å²	32	79.3 Å²	79.3	16%	0.158	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-0.3	178.3	-93.3	-160.1	161.9	0	0	116.5	H96 P99 Y110 F116 T117	H96-M114 WeakPolarHBondContact CE1-CE 3.39Å; H96-M114 WeakPolarHBondContact ND1-CE 3.34Å; P99-M114 HydrophobicContact CG-CE 4.35Å; Y110-M114 HydrophobicContact CD1-SD 4.35Å; Y110-M114 HydrophobicContact CE1-CE 4.15Å; Y110-M114 HydrophobicContact CE1-CG 4.37Å; Y110-M114 HydrophobicContact CE1-SD 3.48Å; Y110-M114 WeakPolarHBondContact CE1-SD 3.39Å; Y110-M114 HydrophobicContact CE2-CE 3.66Å; Y110-M114 HydrophobicContact CE2-CG 4.38Å; Y110-M114 HydrophobicContact CE2-SD 3.99Å; Y110-M114 WeakPolarHBondContact O-CB 3.32Å; Y110-M114 PolarHBondContact O-N 2.83Å; Y110-M114 WeakPolarHBondContact OH-CE 3.45Å; Y110-M114 PolarHBondContact OH-SD 2.82Å; Y110-M114 VanDerWaalsContact OH-SD 3.35Å; M114-F116 PolarHBondContact O-N 3.24Å; M114-T117 PolarHBondContact O-N 3.04Å; M114-T117 PolarHBondContact O-OG1 3.02Å
115	M	61.8	Low	80.3	Confident	132 Å²	132	80.9 Å²	80.9	65%	0.65	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-6.4	-170.7	-69.6	-89.9	-156.1	0	0	115.4	K112 S113	K112-M115 WeakPolarHBondContact O-CG 3.44Å; S113-M115 PolarHBondContact O-N 3.17Å
116	F	53	Low	81	Confident	186 Å²	186	73.8 Å²	73.8	82%	0.816	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-1.1	-172.9	-56.3	-71.7	0	0	0	115.3	M114	M114-F116 PolarHBondContact O-N 3.24Å
117	T	60.5	Low	81.2	Confident	70 Å²	70	74 Å²	74	43%	0.429	37%	0.371	S	S	.	.			trans	-112.4	126.2	-179.4	57.8	0	0	0	0	110.3	M114 L119	M114-T117 PolarHBondContact O-N 3.04Å; M114-T117 PolarHBondContact O-OG1 3.02Å; T117-L119 HydrophobicContact CG2-CD1 4.12Å; T117-L119 PolarHBondContact O-N 3.45Å
118	N	60	Low	81.2	Confident	175 Å²	175	73.9 Å²	73.9	94%	0.936	37%	0.369	S	S	*	.			trans	-65.4	24	173.6	-69.6	-40.8	0	0	0	113.9	I120	N118-I120 PolarHBondContact O-N 3.03Å
119	L	65.2	Low	81.2	Confident	75 Å²	75	71.6 Å²	71.6	39%	0.393	36%	0.361	S	S	.	.			trans	-84	60.1	-176.5	-63.3	168.3	0	0	0	110.2	H96 T117	H96-L119 PolarHBondContact CD2-O 3.35Å; H96-L119 WeakPolarHBondContact NE2-CB 3.07Å; T117-L119 HydrophobicContact CG2-CD1 4.12Å; T117-L119 PolarHBondContact O-N 3.45Å
120	I	65	Low	81.1	Confident	66 Å²	66	69.8 Å²	69.8	34%	0.338	35%	0.35	S	S	.	.			trans	-94.5	104.4	165	-62.2	175.8	0	0	0	107.1	V94 N118 K123	V94-I120 HydrophobicContact CG1-CG1 4.35Å; V94-I120 HydrophobicContact CG1-CG2 3.78Å; N118-I120 PolarHBondContact O-N 3.03Å; I120-K123 HydrophobicContact CG2-CD 4.37Å; I120-K123 HydrophobicContact CG2-CG 3.71Å
121	D	75.3	Confident	80.8	Confident	30 Å²	30	72.5 Å²	72.5	16%	0.16	37%	0.365	C	S	.	.			trans	-73.7	-40.9	-176.9	-61.6	-30.4	0	0	0	111.5	F3 S5 A95 H96 V97	F3-D121 HydrophobicContact CD1-CB 3.52Å; F3-D121 WeakPolarHBondContact CD1-O 2.85Å; F3-D121 HydrophobicContact CE1-CB 3.82Å; F3-D121 HydrophobicContact CG-CB 4.24Å; S5-D121 WeakPolarHBondContact CB-OD1 3.36Å; S5-D121 PolarHBondContact OG-OD1 3.07Å; A95-D121 PolarHBondContact O-N 2.86Å; H96-D121 WeakPolarHBondContact CA-OD2 3.5Å; H96-D121 VanDerWaalsContact CD2-CG 3.46Å; H96-D121 IonicContact CD2-OD1 3.71Å; H96-D121 IonicContact CD2-OD2 2.68Å; H96-D121 PolarHBondContact CD2-OD2 3.42Å; H96-D121 IonicContact CG-OD2 3.34Å; H96-D121 IonicContact NE2-OD2 3.73Å; V97-D121 PolarHBondContact N-OD2 3.32Å
122	K	85.9	Confident	80.2	Confident	31 Å²	31	77.1 Å²	77.1	14%	0.135	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	159	164	98.7	-159.3	-94.8	-167.3	0	114.8	M1 F3 V12 A95 C124	M1-K122 PolarHBondContact O-NZ 2.81Å; M1-K122 VanDerWaalsContact O-NZ 3.15Å; F3-K122 HydrophobicContact CD1-CB 3.71Å; F3-K122 HydrophobicContact CD1-CD 3.9Å; F3-K122 HydrophobicContact CD1-CG 4.13Å; F3-K122 HydrophobicContact CE1-CB 3.27Å; F3-K122 HydrophobicContact CE1-CD 3.13Å; F3-K122 HydrophobicContact CE1-CG 3.25Å; F3-K122 HydrophobicContact CE2-CD 4.26Å; F3-K122 HydrophobicContact CZ-CB 4.27Å; F3-K122 HydrophobicContact CZ-CD 3.27Å; F3-K122 HydrophobicContact CZ-CG 3.77Å; V12-K122 PolarHBondContact O-NZ 2.85Å; A95-K122 PolarHBondContact N-O 3.33Å; A95-K122 PolarHBondContact O-N 2.74Å; K122-C124 WeakPolarHBondContact CE-SG 3.38Å
123	K	91	Very high	79.1	Confident	127 Å²	127	74.2 Å²	74.2	55%	0.552	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.9	170.4	-60.8	178.8	-176.7	171.3	0	107.6	T92 V93 V94 I120 P125	T92-K123 HydrophobicContact CG2-CB 4.01Å; V93-K123 CarbonylContact O-C 3.5Å; V93-K123 WeakPolarHBondContact O-CA 3.34Å; V94-K123 HydrophobicContact CG2-CG 4.49Å; I120-K123 HydrophobicContact CG2-CD 4.37Å; I120-K123 HydrophobicContact CG2-CG 3.71Å; K123-P125 WeakPolarHBondContact O-CD 2.81Å
124	C	93	Very high	77.4	Confident	17 Å²	17	75.1 Å²	75.1	12%	0.115	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	99.1	172	-48.1	0	0	0	0	107.2	V14 T92 V93 K122	V14-C124 HydrophobicContact CG2-CB 3.8Å; T92-C124 WeakPolarHBondContact CA-O 3.36Å; V93-C124 HydrophobicContact CB-CB 4.24Å; V93-C124 PolarHBondContact N-O 2.62Å; V93-C124 PolarHBondContact O-N 2.86Å; K122-C124 WeakPolarHBondContact CE-SG 3.38Å
125	P	94.7	Very high	75.9	Confident	63 Å²	63	83.5 Å²	83.5	41%	0.409	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139.9	174.1	30.6	-32.7	0	0	0	109.9	C91 K123	C91-P125 WeakPolarHBondContact O-CA 3.4Å; K123-P125 WeakPolarHBondContact O-CD 2.81Å
126	L	95.9	Very high	75.2	Confident	1 Å²	1	84.5 Å²	84.5	1%	0.005	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	131.4	167.4	-55.5	98.6	0	0	0	108.6	V14 P16 D18 I20 R90 C91 V93	V14-L126 HydrophobicContact CG1-CD1 4.23Å; V14-L126 HydrophobicContact CG1-CD2 3.92Å; V14-L126 HydrophobicContact CG1-CG 4.48Å; P16-L126 HydrophobicContact CG-CD2 4.4Å; P16-L126 WeakPolarHBondContact O-CD2 3.36Å; D18-L126 CarbonylContact O-C 3.49Å; D18-L126 WeakPolarHBondContact O-CA 3.39Å; I20-L126 HydrophobicContact CD1-CB 4.28Å; I20-L126 HydrophobicContact CD1-CD2 4.15Å; I20-L126 HydrophobicContact CG1-CB 4.4Å; I20-L126 HydrophobicContact CG1-CD2 4.04Å; R90-L126 WeakPolarHBondContact CA-O 3.32Å; C91-L126 HydrophobicContact CB-CB 4.36Å; C91-L126 HydrophobicContact CB-CD1 4.43Å; C91-L126 PolarHBondContact N-O 2.92Å; C91-L126 PolarHBondContact O-N 3.25Å; V93-L126 HydrophobicContact CG2-CD1 3.87Å
127	E	94.5	Very high	75	Confident	78 Å²	78	80.6 Å²	80.6	36%	0.364	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	144	169.3	-165.4	-179.8	178.5	0	0	109.9	D18 T19 I20 K129	D18-E127 PolarHBondContact O-N 3.2Å; T19-E127 CarbonylContact C-O 3.45Å; T19-E127 VanDerWaalsContact CA-O 3.29Å; T19-E127 WeakPolarHBondContact CA-O 3.49Å; T19-E127 HydrophobicContact CG2-CB 4.39Å; I20-E127 PolarHBondContact N-O 3.04Å; E127-K129 HydrophobicContact CG-CG 4.28Å; E127-K129 WeakPolarHBondContact OE1-CE 3.11Å; E127-K129 IonicContact OE1-NZ 2.74Å; E127-K129 WeakPolarHBondContact OE2-CE 3.24Å; E127-K129 IonicContact OE2-NZ 3.07Å; E127-K129 PolarHBondContact OE2-NZ 3.31Å
128	V	93.1	Very high	74.9	Confident	7 Å²	7	82.8 Å²	82.8	4%	0.042	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	115	174.2	-179.3	0	0	0	0	107.8	I20 F22 I56 E89 C91 F130	I20-V128 WeakPolarHBondContact O-CA 3.39Å; F22-V128 HydrophobicContact CD2-CG1 3.57Å; F22-V128 HydrophobicContact CE2-CG1 3.78Å; I56-V128 HydrophobicContact CD1-CG1 4.31Å; I56-V128 HydrophobicContact CD1-CG2 4.15Å; E89-V128 HydrophobicContact CB-CB 3.75Å; E89-V128 HydrophobicContact CB-CG1 4.23Å; E89-V128 HydrophobicContact CB-CG2 4.33Å; E89-V128 PolarHBondContact O-N 2.87Å; C91-V128 HydrophobicContact CB-CG2 4.48Å; C91-V128 VanDerWaalsContact SG-CG2 3.56Å; V128-F130 HydrophobicContact CG1-CE2 3.94Å; V128-F130 HydrophobicContact CG1-CZ 4.01Å
129	K	90.8	Very high	74.8	Confident	79 Å²	79	82.9 Å²	82.9	34%	0.343	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.6	179.4	-69.5	-170.4	-172	172.4	0	111.2	T19 I20 H21 F22 E127	T19-K129 HydrophobicContact CG2-CB 3.98Å; T19-K129 HydrophobicContact CG2-CD 3.71Å; T19-K129 HydrophobicContact CG2-CG 3.61Å; I20-K129 PolarHBondContact O-N 2.91Å; H21-K129 WeakPolarHBondContact CA-O 3.11Å; F22-K129 PolarHBondContact N-O 2.94Å; E127-K129 HydrophobicContact CG-CG 4.28Å; E127-K129 WeakPolarHBondContact OE1-CE 3.11Å; E127-K129 IonicContact OE1-NZ 2.74Å; E127-K129 WeakPolarHBondContact OE2-CE 3.24Å; E127-K129 IonicContact OE2-NZ 3.07Å; E127-K129 PolarHBondContact OE2-NZ 3.31Å
130	F	88	Confident	74.7	Confident	47 Å²	47	84.4 Å²	84.4	21%	0.206	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	98.4	176.1	-63.1	-89.3	0	0	0	107.7	F22 R79 E89 V128	F22-F130 HydrophobicContact CB-CD1 3.87Å; F22-F130 HydrophobicContact CB-CE1 3.95Å; F22-F130 HydrophobicContact CD2-CE1 4.49Å; F22-F130 CarbonylContact O-C 3.55Å; F22-F130 VanDerWaalsContact O-CA 3.25Å; F22-F130 WeakPolarHBondContact O-CA 3.31Å; R79-F130 HydrophobicContact CB-CE1 4.33Å; E89-F130 HydrophobicContact CG-CE2 4.41Å; V128-F130 HydrophobicContact CG1-CE2 3.94Å; V128-F130 HydrophobicContact CG1-CZ 4.01Å
131	D	85	Confident	74.6	Confident	72 Å²	72	87.5 Å²	87.5	39%	0.385	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	137.4	179.3	-60.5	-31.7	0	0	0	108.8	H21 F22 S23 R24 D133	H21-D131 WeakPolarHBondContact CB-OD2 3.45Å; H21-D131 IonicContact CE1-OD1 2.87Å; H21-D131 IonicContact CE1-OD2 3.99Å; H21-D131 IonicContact CG-OD2 3.96Å; H21-D131 IonicContact ND1-OD1 3.81Å; H21-D131 PolarHBondContact ND1-OD1 2.65Å; H21-D131 VanDerWaalsContact ND1-OD1 3.07Å; H21-D131 IonicContact ND1-OD2 3.63Å; H21-D131 PolarHBondContact ND1-OD2 3.24Å; F22-D131 PolarHBondContact O-N 2.87Å; S23-D131 CarbonylContact C-O 3.55Å; R24-D131 WeakPolarHBondContact CB-O 3.34Å; R24-D131 PolarHBondContact N-O 2.88Å; D131-D133 PolarHBondContact O-N 2.89Å; D131-D133 VanDerWaalsContact O-N 3.08Å
132	L	76.5	Confident	74	Confident	120 Å²	120	91.4 Å²	91.4	63%	0.628	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-57.4	118.7	163.9	-77.4	164.6	0	0	0	106.6	S134	L132-S134 PolarHBondContact O-N 2.89Å
133	D	65.4	Low	72.4	Confident	67 Å²	67	97 Å²	97	36%	0.358	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-47.8	120.8	169.9	-73.7	-51.7	0	0	0	106.9	S23 S25 D131 Y135	S23-D133 VanDerWaalsContact CB-CG 3.45Å; S23-D133 WeakPolarHBondContact CB-OD1 3.14Å; S23-D133 WeakPolarHBondContact CB-OD2 3.21Å; S25-D133 PolarHBondContact N-OD2 2.74Å; S25-D133 PolarHBondContact OG-OD2 2.81Å; D131-D133 PolarHBondContact O-N 2.89Å; D131-D133 VanDerWaalsContact O-N 3.08Å; D133-Y135 VanDerWaalsContact C-N 3.3Å; D133-Y135 PolarHBondContact O-N 3.01Å
134	S	49.6	Very low	70.6	Confident	102 Å²	102	95.4 Å²	95.4	71%	0.713	54%	0.536	S	S	*	.			trans	-54.3	111.3	158.6	53.6	0	0	0	0	103.8	L132 D136	L132-S134 PolarHBondContact O-N 2.89Å; S134-D136 PolarHBondContact O-N 2.66Å
135	Y	49.2	Very low	68.6	Low	209 Å²	209	99.6 Å²	99.6	82%	0.82	57%	0.565	S	S	*	*			trans	-54.3	95.8	171.9	-71.6	-91.6	0	0	0	106.3	D133 V137	D133-Y135 VanDerWaalsContact C-N 3.3Å; D133-Y135 PolarHBondContact O-N 3.01Å; Y135-V137 PolarHBondContact O-N 2.65Å
136	D	48.9	Very low	66.6	Low	152 Å²	152	106.5 Å²	106.5	81%	0.813	59%	0.585	S	S	*	*			trans	-65.4	88.2	148	-91.6	-25.5	0	0	0	103	S134 P138	S134-D136 PolarHBondContact O-N 2.66Å; D136-P138 WeakPolarHBondContact O-CD 3.28Å
137	V	47.4	Very low	64.6	Low	105 Å²	105	112 Å²	112	64%	0.636	62%	0.619	S	S	*	*			trans	-44.6	116.3	168	173.4	0	0	0	0	104.8	Y135 E139	Y135-V137 PolarHBondContact O-N 2.65Å; V137-E139 PolarHBondContact O-N 2.99Å
138	P	58.6	Low	62.4	Low	115 Å²	115	112.3 Å²	112.3	75%	0.747	63%	0.629	S	S	*	*			trans	-58.7	117.2	171.2	22.9	-28.4	0	0	0	104.9	D136 P140	D136-P138 WeakPolarHBondContact O-CD 3.28Å; P138-P140 VanDerWaalsContact O-N 3.1Å
139	E	58.3	Low	60.6	Low	177 Å²	177	117.3 Å²	117.3	83%	0.827	66%	0.664	S	S	*	*			trans	-45	126.2	174.5	-95.3	-163.4	148.5	0	0	107.2	V137 V141	V137-E139 PolarHBondContact O-N 2.99Å; E139-V141 PolarHBondContact O-N 3.22Å
140	P	63.1	Low	58.7	Low	107 Å²	107	118.9 Å²	118.9	70%	0.695	69%	0.685	S	S	*	*			trans	-58.3	113.5	175.2	23.5	-30.9	0	0	0	106.5	P138 S142	P138-P140 VanDerWaalsContact O-N 3.1Å; P140-S142 PolarHBondContact O-N 2.94Å
141	V	61.5	Low	57	Low	132 Å²	132	124.1 Å²	124.1	80%	0.8	71%	0.714	S	S	*	*			trans	-46.4	111.1	165.3	-91.6	0	0	0	0	106.4	E139 T143	E139-V141 PolarHBondContact O-N 3.22Å; V141-T143 PolarHBondContact O-N 2.83Å
142	S	63.4	Low	55.7	Low	111 Å²	111	128.1 Å²	128.1	78%	0.776	73%	0.734	S	S	*	*			trans	-59.5	99.4	-178	-74.6	0	0	0	0	108.5	P140 S144	P140-S142 PolarHBondContact O-N 2.94Å; S142-S144 PolarHBondContact O-N 3.08Å
143	T	52.6	Low	54.3	Low	148 Å²	148	126.8 Å²	126.8	91%	0.908	74%	0.74	S	S	*	*			trans	-73.7	72.8	165	32.9	0	0	0	0	108.5	V141	V141-T143 PolarHBondContact O-N 2.83Å
144	S	53.6	Low	53.5	Low	94 Å²	94	129.4 Å²	129.4	66%	0.657	76%	0.759	S	S	*	*			trans	-118.8	110.2	157.1	71.1	0	0	0	0	105.5	S142	S142-S144 PolarHBondContact O-N 3.08Å
145	S	50.7	Low	53.4	Low	105 Å²	105	130.5 Å²	130.5	73%	0.734	76%	0.761	S	S	*	*				-153	117.3	77.5	20.9	0	0	0	0	111.8	T147	S145-T147 PolarHBondContact O-N 3.3Å
146	Y	51.8	Low	53.6	Low	208 Å²	208	125.9 Å²	125.9	82%	0.816	76%	0.76	S	S	*	*			trans	-68.9	107.6	155.6	-172.4	-94.5	0	0	0	107.5	S148	Y146-S148 WeakPolarHBondContact CE1-OG 3.21Å; Y146-S148 PolarHBondContact OH-OG 3.27Å
147	T	54.1	Low	53.5	Low	118 Å²	118	124.2 Å²	124.2	72%	0.724	76%	0.759	S	S	*	*			trans	-119.4	93.1	162.2	4.5	0	0	0	0	107.3	S145 S149	S145-T147 PolarHBondContact O-N 3.3Å; T147-S149 PolarHBondContact O-N 3.19Å
148	S	49.8	Very low	54	Low	84 Å²	84	124 Å²	124	59%	0.587	76%	0.76	S	S	*	*			trans	-56.8	113.8	159.5	-93.7	0	0	0	0	109.2	Y146	Y146-S148 WeakPolarHBondContact CE1-OG 3.21Å; Y146-S148 PolarHBondContact OH-OG 3.27Å
149	S	55.4	Low	53.9	Low	111 Å²	111	126.3 Å²	126.3	78%	0.776	76%	0.761	S	S	*	*			trans	-141.7	123.7	162.6	-67.3	0	0	0	0	109	T147	T147-S149 PolarHBondContact O-N 3.19Å
150	S	50.7	Low	53.6	Low	112 Å²	112	126.2 Å²	126.2	78%	0.783	76%	0.761	S	S	*	*			trans	-62.8	141.6	-175.8	51.1	0	0	0	0	114.5
151	I	50.7	Low	53.4	Low	158 Å²	158	126.1 Å²	126.1	81%	0.81	76%	0.763	S	S	*	*			trans	2.7	120.7	141.4	-51.4	170.2	0	0	0	115
152	I	58.6	Low	53.1	Low	155 Å²	155	128.5 Å²	128.5	80%	0.795	77%	0.765	S	S	*	*				-165	129.2	126.4	-82.1	138.2	0	0	0	107.4
153	A	46.6	Very low	52.8	Low	92 Å²	92	128.4 Å²	128.4	76%	0.76	76%	0.764	S	S	*	*			trans	-88.5	129.1	174.9	0	0	0	0	0	110.5
154	T	49.8	Very low	52.7	Low	123 Å²	123	127.6 Å²	127.6	76%	0.755	76%	0.76	S	S	*	*			trans	-164.7	113.8	148.5	12	0	0	0	0	111
155	T	47.3	Very low	52.4	Low	125 Å²	125	129.8 Å²	129.8	77%	0.767	77%	0.769	S	S	*	*			trans	6.5	146.7	140.3	51.5	0	0	0	0	121.2
156	S	51.7	Low	52.9	Low	112 Å²	112	130.3 Å²	130.3	78%	0.783	77%	0.773	S	S	*	*			trans	105	103.2	139.5	73.8	0	0	0	0	120.2
157	S	48.7	Very low	52.9	Low	116 Å²	116	125.1 Å²	125.1	81%	0.811	77%	0.767	S	S	*	*				63.2	169.4	120.8	-133.2	0	0	0	0	120.2
158	P	57.3	Low	53.5	Low	101 Å²	101	125.1 Å²	125.1	66%	0.656	77%	0.771	S	S	*	*				-123.2	-168	-95.2	37.6	-17.6	0	0	0	113.3
159	E	55.8	Low	53.9	Low	164 Å²	164	129.3 Å²	129.3	77%	0.766	78%	0.782	S	S	*	*			trans	95.3	117.4	155.4	-69	179.2	154.8	0	0	120.8
160	E	52.7	Low	54.4	Low	174 Å²	174	129.6 Å²	129.6	81%	0.813	78%	0.784	S	S	*	*			trans	74.7	151.6	132.1	-70.9	-166.2	113.2	0	0	123.3
161	S	58	Low	54.7	Low	105 Å²	105	129.6 Å²	129.6	73%	0.734	78%	0.779	S	S	*	*			trans	102.3	84.7	161.8	-53.2	0	0	0	0	118.1
162	E	55.4	Low	55.5	Low	183 Å²	183	129.5 Å²	129.5	86%	0.855	78%	0.779	S	S	*	*				52.1	146	112.8	-68.7	-171.5	123.6	0	0	123.1
163	S	57.6	Low	54.8	Low	109 Å²	109	127.4 Å²	127.4	76%	0.762	77%	0.773	S	S	*	*			trans	85.2	140.9	156	84.3	0	0	0	0	115.5
164	T	49.6	Very low	55.7	Low	131 Å²	131	128.5 Å²	128.5	80%	0.804	78%	0.775	S	S	*	*			cis	-159.8	146.4	7.3	-18.4	0	0	0	0	109.1
165	T	47.8	Very low	55.5	Low	139 Å²	139	128.6 Å²	128.6	85%	0.853	78%	0.776	S	S	*	*			trans	-62.3	144.3	175.7	-19.2	0	0	0	0	112.7
166	S	62.1	Low	55.9	Low	117 Å²	117	127.5 Å²	127.5	82%	0.818	77%	0.773	S	S	*	*			trans	-139.5	120	158.8	-166	0	0	0	0	110.7
167	S	50.9	Low	56	Low	98 Å²	98	127.7 Å²	127.7	69%	0.685	78%	0.775	S	S	*	*			trans	-96.3	145.6	-179	-176.1	0	0	0	0	109.4
168	S	66.5	Low	56.3	Low	118 Å²	118	127.1 Å²	127.1	83%	0.825	77%	0.77	S	S	*	*			trans	-136.4	96	169.5	-46.4	0	0	0	0	109.1
169	E	57.9	Low	56.4	Low	172 Å²	172	127.6 Å²	127.6	80%	0.804	78%	0.776	S	S	*	*			trans	-74.5	141.3	163.2	-73.4	176.6	102.1	0	0	109.8
170	S	67.5	Low	56	Low	118 Å²	118	131.4 Å²	131.4	83%	0.825	78%	0.784	S	S	*	*			trans	-134.5	113.9	156	63.6	0	0	0	0	109.4
171	V	55.3	Low	56.6	Low	112 Å²	112	132.4 Å²	132.4	68%	0.679	79%	0.789	S	S	*	*			trans	-99.6	126.5	174.9	170.4	0	0	0	0	106.7
172	I	67.8	Low	56.1	Low	156 Å²	156	133 Å²	133	80%	0.8	79%	0.793	S	S	*	*			trans	-130.2	102.4	162.1	-44.7	178.4	0	0	0	108.1
173	T	44.1	Very low	56.3	Low	110 Å²	110	127.8 Å²	127.8	68%	0.675	79%	0.788	S	S	*	*			trans	-84	133.6	167.6	-47.5	0	0	0	0	108.2
174	S	66.8	Low	56.1	Low	116 Å²	116	127.9 Å²	127.9	81%	0.811	78%	0.784	S	S	*	*			trans	-140.1	112.3	163.3	-73.3	0	0	0	0	110.2
175	T	45.1	Very low	55.5	Low	124 Å²	124	131.1 Å²	131.1	76%	0.761	78%	0.783	S	S	*	*			trans	-78.6	148.5	177.3	-36.9	0	0	0	0	110.8
176	S	55	Low	55.8	Low	103 Å²	103	131 Å²	131	72%	0.72	78%	0.782	S	S	*	*			trans	164.8	106.4	145.7	-72.8	0	0	0	0	108.6
177	S	53.9	Low	54.8	Low	116 Å²	116	131.4 Å²	131.4	81%	0.811	78%	0.78	S	S	*	*				62.8	136.4	97.3	76.6	0	0	0	0	112.6
178	S	56	Low	55.2	Low	103 Å²	103	133.2 Å²	133.2	72%	0.72	79%	0.787	S	S	*	*			cis	-177.6	164	29.5	161.8	0	0	0	0	109.1
179	S	58.9	Low	54.1	Low	112 Å²	112	132.5 Å²	132.5	78%	0.783	78%	0.782	S	S	*	*			trans	85.2	112.4	150.3	23.4	0	0	0	0	121.2
180	R	47.4	Very low	53.8	Low	243 Å²	243	129.6 Å²	129.6	92%	0.917	78%	0.781	S	S	*	*			trans	-62.6	149.6	160.7	-68.2	162.3	142.6	165.7	-7.6	111.8
181	E	65.3	Low	53.5	Low	196 Å²	196	131 Å²	131	92%	0.916	78%	0.777	S	S	*	*			trans	-152.2	130.2	137.3	-154.2	169.9	138.3	0	0	111.1
182	S	47.4	Very low	53	Low	117 Å²	117	132 Å²	132	82%	0.818	78%	0.779	S	S	*	*			trans	-98.3	133.8	178	-58.2	0	0	0	0	108.8
183	G	58.8	Low	52.4	Low	74 Å²	74	130.5 Å²	130.5	76%	0.763	78%	0.782	S	S	*	*			trans	-147	94.6	-179.6	0	0	0	0	0	113.7
184	T	53.2	Low	52.6	Low	111 Å²	111	130.6 Å²	130.6	68%	0.681	78%	0.783	S	S	*	*			trans	15.7	133.2	144.5	-31.7	0	0	0	0	121.9
185	Y	38.2	Very low	52.1	Low	199 Å²	199	131.8 Å²	131.8	78%	0.78	79%	0.785	S	S	*	*			trans	-54.7	148	167.5	38.7	-89.8	0	0	0	115.9
186	T	54.2	Low	52.3	Low	135 Å²	135	130.9 Å²	130.9	83%	0.828	78%	0.78	S	S	*	*			trans	-149.8	119.7	148.1	-54.1	0	0	0	0	110.1
187	T	41.5	Very low	51.9	Low	127 Å²	127	131.8 Å²	131.8	78%	0.779	78%	0.781	S	S	*	*			trans	-94.7	132	174.4	-64.4	0	0	0	0	108.7
188	T	58.4	Low	51.8	Low	135 Å²	135	132.1 Å²	132.1	83%	0.828	78%	0.783	S	S	*	*			trans	-140.3	108.5	158.2	46.9	0	0	0	0	109.7
189	S	43.2	Very low	51.2	Low	103 Å²	103	132.5 Å²	132.5	72%	0.72	79%	0.786	S	S	*	*			trans	-80	141.9	167.1	52.6	0	0	0	0	110.8
190	S	51.4	Low	50.9	Low	111 Å²	111	133.4 Å²	133.4	78%	0.776	79%	0.792	S	S	*	*			trans	179.9	146.1	150.2	-80	0	0	0	0	109.7
191	I	60.9	Low	50.9	Low	147 Å²	147	125.3 Å²	125.3	75%	0.754	79%	0.785	S	S	*	*			cis	-161.4	149.3	-13.5	-77.2	145.2	0	0	0	104.2
192	D	45.7	Very low	50.5	Low	133 Å²	133	121.8 Å²	121.8	71%	0.711	78%	0.782	S	S	*	*			trans	2.6	140.2	162.5	-69.7	-45.1	0	0	0	122.8
193	S	55.3	Low	50.3	Low	125 Å²	125	121.1 Å²	121.1	87%	0.874	78%	0.777	S	S	*	*				-164.8	125.7	112.4	-78.9	0	0	0	0	112.9
194	T	47.4	Very low	50.4	Low	112 Å²	112	124.4 Å²	124.4	69%	0.687	78%	0.782	S	S	*	*			trans	-81.8	140	-176.9	-53.3	0	0	0	0	112.9
195	T	56.6	Low	50.1	Low	141 Å²	141	123.8 Å²	123.8	87%	0.865	79%	0.788	S	S	*	*			trans	-158	97	140.7	-18.1	0	0	0	0	113.6
196	T	50.1	Low	50.8	Low	106 Å²	106	118.3 Å²	118.3	65%	0.65	79%	0.792	S	S	*	*				29	113.5	129.4	-13.4	0	0	0	0	122.7
197	V	46.7	Very low	50.5	Low	122 Å²	122	123.2 Å²	123.2	74%	0.739	80%	0.795	S	S	*	*			trans	26.2	138.1	134.6	-54.2	0	0	0	0	122.6
198	S	51.4	Low	50.8	Low	122 Å²	122	121.6 Å²	121.6	85%	0.853	79%	0.789	S	S	*	*				-172.9	142.4	104.5	-74.5	0	0	0	0	112.2
199	S	43.6	Very low	50.1	Low	112 Å²	112	120.9 Å²	120.9	78%	0.783	79%	0.785	S	S	*	*			trans	-114.3	145.1	-172.6	43.2	0	0	0	0	111.6
200	S	51.7	Low	50.5	Low	131 Å²	131	122.4 Å²	122.4	92%	0.916	79%	0.789	S	S	*	*			trans	168.8	141.6	154.7	29.4	0	0	0	0	107.1
201	G	49.1	Very low	50	Low	73 Å²	73	122 Å²	122	75%	0.753	79%	0.787	S	S	*	*			cis	156.6	146.2	5.3	0	0	0	0	0	107.5
202	S	55.7	Low	49.6	Very low	122 Å²	122	121.9 Å²	121.9	85%	0.853	79%	0.793	S	S	*	*			trans	84.5	116.2	156.3	-158	0	0	0	0	121.4
203	S	44.5	Very low	49.5	Very low	102 Å²	102	122.1 Å²	122.1	71%	0.713	80%	0.799	S	S	*	*			trans	-55.6	155.8	158.3	51.6	0	0	0	0	115.7
204	V	59.5	Low	49.1	Very low	143 Å²	143	119 Å²	119	87%	0.867	79%	0.786	S	S	*	*				-158.3	137.5	128.9	166	0	0	0	0	109.4
205	A	46.4	Very low	49	Very low	99 Å²	99	120.4 Å²	120.4	82%	0.818	80%	0.795	S	S	*	*			trans	-77.8	153.3	177	0	0	0	0	0	113.3
206	G	53.8	Low	48.8	Very low	83 Å²	83	119.1 Å²	119.1	86%	0.856	79%	0.792	S	S	*	*			trans	-168.4	113.8	170.6	0	0	0	0	0	112.5
207	R	47.1	Very low	48.7	Very low	239 Å²	239	119.9 Å²	119.9	90%	0.902	80%	0.796	S	S	*	*			trans	-95.2	150.8	-173.8	173.3	-176.1	165.6	177.7	-2.2	110.8
208	S	47.8	Very low	49.1	Very low	93 Å²	93	122 Å²	122	65%	0.65	80%	0.798	S	S	*	*			trans	132.4	103	142.2	-83.4	0	0	0	0	116.3
209	T	44.2	Very low	48.9	Very low	120 Å²	120	121.2 Å²	121.2	74%	0.736	79%	0.793	S	S	*	*				34.6	130	116.9	61	0	0	0	0	121.7
210	V	51	Low	49.4	Very low	134 Å²	134	124 Å²	124	81%	0.812	79%	0.791	S	S	*	*				135.2	126	124.5	179.7	0	0	0	0	112.7
211	S	42.5	Very low	49.4	Very low	104 Å²	104	123.4 Å²	123.4	73%	0.727	78%	0.782	S	S	*	*			trans	-47.5	150.2	174.1	-38.8	0	0	0	0	116
212	T	51.5	Low	49.5	Very low	143 Å²	143	126.7 Å²	126.7	88%	0.877	79%	0.787	S	S	*	*				-163.3	146.4	128.7	-3	0	0	0	0	114
213	T	44.5	Very low	49.1	Very low	138 Å²	138	123.7 Å²	123.7	85%	0.847	78%	0.775	S	S	*	*			trans	-50.1	155.5	174.5	-39.1	0	0	0	0	116.5
214	G	47	Very low	49.9	Very low	59 Å²	59	124.7 Å²	124.7	61%	0.608	78%	0.782	S	S	*	*			trans	145.8	88.5	155.1	0	0	0	0	0	113.1
215	T	45.2	Very low	49.2	Very low	143 Å²	143	127.5 Å²	127.5	88%	0.877	79%	0.786	S	S	*	*				43.9	107.6	102.4	59.3	0	0	0	0	115.3
216	S	51.9	Low	49.8	Very low	113 Å²	113	127.2 Å²	127.2	79%	0.79	78%	0.783	S	S	*	*			trans	-164.4	131.3	134.9	-169	0	0	0	0	111.5
217	V	48.6	Very low	49.7	Very low	123 Å²	123	130 Å²	130	75%	0.745	78%	0.784	S	S	*	*			trans	-35.1	144	162	-86.6	0	0	0	0	115.6
218	E	53.6	Low	50	Low	167 Å²	167	123 Å²	123	78%	0.78	78%	0.778	S	S	*	*			trans	-157.1	115.5	136.9	-112	175.9	175.1	0	0	110.9	F220	E218-F220 HydrophobicContact CB-CD2 4.44Å; E218-F220 HydrophobicContact CB-CE2 4.08Å; E218-F220 HydrophobicContact CG-CE2 4.09Å
219	S	47.1	Very low	50.5	Low	105 Å²	105	123.6 Å²	123.6	73%	0.734	78%	0.782	S	S	*	*			trans	-95.2	125.1	173.4	39.7	0	0	0	0	109.4
220	F	55	Low	51.3	Low	171 Å²	171	125.7 Å²	125.7	75%	0.75	79%	0.789	S	S	*	*			trans	-120.3	93.3	174.1	-80.7	-83.5	0	0	0	111.3	E218	E218-F220 HydrophobicContact CB-CD2 4.44Å; E218-F220 HydrophobicContact CB-CE2 4.08Å; E218-F220 HydrophobicContact CG-CE2 4.09Å
221	T	52.3	Low	51.4	Low	118 Å²	118	122.4 Å²	122.4	72%	0.724	78%	0.782	S	S	*	*				14	119.1	120.9	-44.9	0	0	0	0	119.6
222	V	49.6	Very low	51.9	Low	141 Å²	141	122.9 Å²	122.9	86%	0.855	79%	0.785	S	S	*	*			trans	75.8	132.7	130.9	177.7	0	0	0	0	121.7
223	G	47.6	Very low	52.2	Low	59 Å²	59	124.7 Å²	124.7	61%	0.608	78%	0.781	S	S	*	*			trans	118.9	133.6	147.1	0	0	0	0	0	112.8
224	S	60.8	Low	52.9	Low	123 Å²	123	122.7 Å²	122.7	86%	0.86	77%	0.769	S	S	*	*			cis	-164.1	138.3	9.5	-54.6	0	0	0	0	107.6
225	E	46.1	Very low	53.5	Low	202 Å²	202	128.5 Å²	128.5	94%	0.944	78%	0.78	S	S	*	*			trans	-90	124.3	166.9	-160.7	177.1	143.9	0	0	107.4
226	A	58.7	Low	54.2	Low	93 Å²	93	131.1 Å²	131.1	77%	0.769	78%	0.782	S	S	*	*			trans	-143.6	117.7	173.5	0	0	0	0	0	110.7
227	T	50.8	Low	54.8	Low	141 Å²	141	131.3 Å²	131.3	87%	0.865	78%	0.783	S	S	*	*			trans	-54.4	147	167.4	40.3	0	0	0	0	115.4
228	A	54.5	Low	55.8	Low	93 Å²	93	140.3 Å²	140.3	77%	0.769	81%	0.806	S	S	*	*			trans	158.6	109.5	132	0	0	0	0	0	109
229	S	57.2	Low	55.9	Low	105 Å²	105	139 Å²	139	73%	0.734	81%	0.808	S	S	*	*				58.2	109.6	87.4	-176.6	0	0	0	0	113.8
230	N	62.9	Low	56.3	Low	165 Å²	165	140.8 Å²	140.8	88%	0.882	81%	0.812	S	S	*	*				-165.1	113.9	126.3	-92.2	-12.9	0	0	0	110.1
231	G	52.7	Low	56.4	Low	65 Å²	65	139.1 Å²	139.1	67%	0.67	82%	0.815	S	S	*	*			trans	-89	160.7	167.5	0	0	0	0	0	112.2
232	S	51.8	Low	56.7	Low	113 Å²	113	140.4 Å²	140.4	79%	0.79	82%	0.82	S	S	*	*			trans	45.7	128.4	151.1	70.2	0	0	0	0	119.8
233	F	59.1	Low	57.1	Low	181 Å²	181	140.3 Å²	140.3	79%	0.794	82%	0.818	S	S	*	*				-173.4	135.9	101.8	-140.5	-125.8	0	0	0	112.9
234	T	58.6	Low	57.7	Low	97 Å²	97	145.7 Å²	145.7	60%	0.595	83%	0.832	S	S	*	*			trans	59.2	114.5	145.3	44.3	0	0	0	0	124.3
235	E	59	Low	57.5	Low	181 Å²	181	147.4 Å²	147.4	85%	0.846	83%	0.83	S	S	*	*				5	131.5	117.5	-77.3	-178.7	130.1	0	0	118.6
236	Q	59.6	Low	58.4	Low	198 Å²	198	143.2 Å²	143.2	93%	0.925	82%	0.821	S	S	*	*				-154.5	121	124.3	-108.9	174.4	10.7	0	0	109.1
237	S	64.6	Low	58.4	Low	116 Å²	116	147.3 Å²	147.3	81%	0.811	83%	0.826	S	S	*	*			trans	-123.8	117.9	164.8	-60.3	0	0	0	0	107
238	Y	69.7	Low	59.1	Low	313 Å²	313	147.9 Å²	147.9	100%	1.227	82%	0.822	S	S	*	*			trans	-154.5	0	154.1	-115	-78.3	0	0	0	107.6

Retrieved 238 of 238 residues in 225.3 ms (Link to these results)

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