A0A077Z566_TRITR Loading...

ShK and DUF1794 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z566, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 235 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	37.4	Very low	35	Very low	240 Å²	240	146.6 Å²	146.6	100%	1.182	81%	0.805	S	S	*	*				0	113.5	0	-76	170.2	172.1	0	0	106.9	A3	M1-A3 PolarHBondContact O-N 3.14Å
2	N	36.2	Very low	34.4	Very low	160 Å²	160	144.1 Å²	144.1	86%	0.856	80%	0.8	S	S	*	*			trans	-64.3	117.4	-179.8	-75.8	-22.4	0	0	0	108.9	Y4	N2-Y4 PolarHBondContact O-N 3.25Å; N2-Y4 VanDerWaalsContact O-N 3.07Å
3	A	36.6	Very low	34.5	Very low	89 Å²	89	138.8 Å²	138.8	74%	0.736	79%	0.786	S	S	*	*			trans	-68.2	104.9	173.3	0	0	0	0	0	108.1	M1 V5	M1-A3 PolarHBondContact O-N 3.14Å; A3-V5 PolarHBondContact O-N 3.4Å; A3-V5 VanDerWaalsContact O-N 3.15Å
4	Y	30	Very low	34.9	Very low	222 Å²	222	136.9 Å²	136.9	87%	0.871	78%	0.779	S	S	*	*			trans	-59	114.2	160.7	-94.3	-94.3	0	0	0	107.2	N2 P6	N2-Y4 PolarHBondContact O-N 3.25Å; N2-Y4 VanDerWaalsContact O-N 3.07Å; Y4-P6 WeakPolarHBondContact O-CD 2.95Å
5	V	34	Very low	34.9	Very low	123 Å²	123	140.2 Å²	140.2	75%	0.745	78%	0.781	S	S	*	*			trans	-87.7	105.3	165.5	-175.1	0	0	0	0	105.9	A3 F7	A3-V5 PolarHBondContact O-N 3.4Å; A3-V5 VanDerWaalsContact O-N 3.15Å; V5-F7 PolarHBondContact O-N 3.21Å
6	P	31.3	Very low	35.5	Very low	112 Å²	112	133.7 Å²	133.7	73%	0.727	74%	0.744	S	S	*	*			trans	-67.7	123.5	174.7	27	-30.8	0	0	0	108.5	Y4 S8	Y4-P6 WeakPolarHBondContact O-CD 2.95Å; P6-S8 PolarHBondContact O-N 2.95Å
7	F	35.1	Very low	36	Very low	204 Å²	204	134.9 Å²	134.9	90%	0.895	75%	0.748	S	S	*	*			trans	-60.2	103.7	166.2	-88.3	-93.4	0	0	0	108.1	V5 P9	V5-F7 PolarHBondContact O-N 3.21Å; F7-P9 WeakPolarHBondContact O-CD 3.42Å
8	S	32.3	Very low	36.6	Very low	85 Å²	85	131.7 Å²	131.7	59%	0.594	74%	0.736	S	S	*	*			trans	-72.6	120.3	164.9	172.7	0	0	0	0	108.2	P6 F10	P6-S8 PolarHBondContact O-N 2.95Å; S8-F10 PolarHBondContact O-N 3.23Å; S8-F10 PolarHBondContact OG-N 3.31Å
9	P	45.3	Very low	37.4	Very low	116 Å²	116	128.1 Å²	128.1	75%	0.753	72%	0.715	S	S	*	*	S	Bend	trans	-74.3	0.2	174.4	28.6	-31.1	0	0	0	113.1	F7	F7-P9 WeakPolarHBondContact O-CD 3.42Å
10	F	30.8	Very low	38.4	Very low	174 Å²	174	126.8 Å²	126.8	76%	0.763	72%	0.715	S	S	*	*			trans	-111	73.4	177.8	-58.8	-78	0	0	0	110.3	S8	S8-F10 PolarHBondContact O-N 3.23Å; S8-F10 PolarHBondContact OG-N 3.31Å
11	A	36	Very low	39.5	Very low	88 Å²	88	127.7 Å²	127.7	73%	0.727	71%	0.713	S	S	*	*			trans	-62.9	137.5	153.9	0	0	0	0	0	107.5	A13	A11-A13 PolarHBondContact O-N 3.4Å
12	P	28.3	Very low	41.2	Very low	116 Å²	116	116.8 Å²	116.8	75%	0.753	66%	0.66	S	S	*	*			trans	-58.5	141	-176.4	25	-32.4	0	0	0	109.1	V14	P12-V14 VanDerWaalsContact C-N 3.31Å; P12-V14 PolarHBondContact O-N 2.97Å
13	A	35.7	Very low	43.1	Very low	75 Å²	75	115.8 Å²	115.8	62%	0.62	65%	0.648	S	S	*	*			trans	-56.7	96.8	173.9	0	0	0	0	0	108.6	A11 F15	A11-A13 PolarHBondContact O-N 3.4Å; A13-F15 VanDerWaalsContact C-N 3.3Å; A13-F15 WeakPolarHBondContact O-CD2 3.2Å; A13-F15 PolarHBondContact O-N 3.33Å
14	V	39.1	Very low	45.1	Very low	112 Å²	112	112.9 Å²	112.9	68%	0.679	62%	0.62	S	S	*	*			trans	-63.6	106.1	158.5	-176	0	0	0	0	103.5	P12 I16	P12-V14 VanDerWaalsContact C-N 3.31Å; P12-V14 PolarHBondContact O-N 2.97Å; V14-I16 HydrophobicContact CB-CG1 4.19Å; V14-I16 HydrophobicContact CG1-CD1 4.21Å; V14-I16 HydrophobicContact CG1-CG1 3.53Å; V14-I16 PolarHBondContact O-N 3.07Å
15	F	36.3	Very low	47.5	Very low	187 Å²	187	110.6 Å²	110.6	82%	0.82	61%	0.612	S	S	*	*			trans	-67.1	74.7	170.6	-69.5	-82.9	0	0	0	107.8	A13 L17	A13-F15 VanDerWaalsContact C-N 3.3Å; A13-F15 WeakPolarHBondContact O-CD2 3.2Å; A13-F15 PolarHBondContact O-N 3.33Å; F15-L17 PolarHBondContact O-N 3.38Å
16	I	44.1	Very low	49.8	Very low	36 Å²	36	106.1 Å²	106.1	19%	0.185	59%	0.586	C	S	.	*			trans	-75.7	106.6	162.3	-53.5	-166.6	0	0	0	104	V14 S18 Y56 F234	V14-I16 HydrophobicContact CB-CG1 4.19Å; V14-I16 HydrophobicContact CG1-CD1 4.21Å; V14-I16 HydrophobicContact CG1-CG1 3.53Å; V14-I16 PolarHBondContact O-N 3.07Å; I16-S18 VanDerWaalsContact C-N 3.35Å; I16-S18 PolarHBondContact O-N 3.22Å; I16-Y56 HydrophobicContact CG2-CD1 3.5Å; I16-Y56 VanDerWaalsContact CG2-CD1 3.5Å; I16-Y56 HydrophobicContact CG2-CG 4.02Å; I16-F234 HydrophobicContact CB-CE2 4.48Å; I16-F234 HydrophobicContact CD1-CE2 3.78Å; I16-F234 HydrophobicContact CD1-CZ 3.74Å; I16-F234 HydrophobicContact CG1-CE2 4.35Å
17	L	43.3	Very low	52.1	Low	155 Å²	155	107.1 Å²	107.1	81%	0.812	59%	0.589	S	S	*	*			trans	-53.3	107.8	166.1	-70.2	169.9	0	0	0	106.1	F15 D19	F15-L17 PolarHBondContact O-N 3.38Å; L17-D19 PolarHBondContact O-N 3.07Å
18	S	47.1	Very low	54.5	Low	76 Å²	76	102.1 Å²	102.1	53%	0.531	57%	0.569	S	S	.	*			trans	-64.9	89	164.5	163.5	0	0	0	0	105.9	I16 S20	I16-S18 VanDerWaalsContact C-N 3.35Å; I16-S18 PolarHBondContact O-N 3.22Å; S18-S20 VanDerWaalsContact C-N 3.28Å; S18-S20 PolarHBondContact O-N 2.93Å
19	D	52.4	Low	56.9	Low	63 Å²	63	98.1 Å²	98.1	34%	0.337	54%	0.541	S	S	.	.			trans	-67.7	97.6	167.4	-176.6	13.2	0	0	0	106.5	L17 H21 C22	L17-D19 PolarHBondContact O-N 3.07Å; D19-H21 PolarHBondContact O-N 3Å; D19-H21 VanDerWaalsContact OD1-CB 3.22Å; D19-H21 WeakPolarHBondContact OD1-CB 3.31Å; D19-H21 IonicContact OD1-CD2 3.78Å; D19-H21 PolarHBondContact OD1-CD2 3.33Å; D19-H21 IonicContact OD1-CG 3.36Å; D19-H21 PolarHBondContact OD1-N 3.15Å; D19-C22 HydrophobicContact CB-CB 4.04Å; D19-C22 WeakPolarHBondContact O-CB 3.42Å; D19-C22 PolarHBondContact O-N 2.73Å
20	S	55.8	Low	58.5	Low	102 Å²	102	96.4 Å²	96.4	71%	0.713	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-12.3	173.7	53.9	0	0	0	0	112.3	S18	S18-S20 VanDerWaalsContact C-N 3.28Å; S18-S20 PolarHBondContact O-N 2.93Å
21	H	62.3	Low	61	Low	147 Å²	147	93.3 Å²	93.3	68%	0.681	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-1.5	173	-59.1	-78.5	0	0	0	114.3	D19 K23	D19-H21 PolarHBondContact O-N 3Å; D19-H21 VanDerWaalsContact OD1-CB 3.22Å; D19-H21 WeakPolarHBondContact OD1-CB 3.31Å; D19-H21 IonicContact OD1-CD2 3.78Å; D19-H21 PolarHBondContact OD1-CD2 3.33Å; D19-H21 IonicContact OD1-CG 3.36Å; D19-H21 PolarHBondContact OD1-N 3.15Å; H21-K23 PolarHBondContact O-N 2.04Å; H21-K23 VanDerWaalsContact O-N 3.09Å
22	C	72.7	Confident	63.3	Low	10 Å²	10	92.9 Å²	92.9	7%	0.068	50%	0.495	C	S	.	.			trans	-89.2	82	-176.5	-150.7	0	0	0	0	112.7	D19 K49 C55	D19-C22 HydrophobicContact CB-CB 4.04Å; D19-C22 WeakPolarHBondContact O-CB 3.42Å; D19-C22 PolarHBondContact O-N 2.73Å; C22-K49 WeakPolarHBondContact SG-CB 2.99Å; C22-C55 HydrophobicContact CB-CB 3.5Å; C22-C55 WeakPolarHBondContact CB-SG 3.35Å; C22-C55 WeakPolarHBondContact SG-CA 3.5Å; C22-C55 WeakPolarHBondContact SG-CB 3.42Å; C22-C55 CovalentContact SG-SG 1.99Å; C22-C55 PolarHBondContact SG-SG 3.15Å
23	K	75.9	Confident	65.9	Low	140 Å²	140	88.2 Å²	88.2	61%	0.609	47%	0.467	S	S	*	.			trans	-120.4	160.1	176.7	61.2	-177	178.9	178.8	0	110.6	H21	H21-K23 PolarHBondContact O-N 2.04Å; H21-K23 VanDerWaalsContact O-N 3.09Å
24	D	79.8	Confident	67.8	Low	27 Å²	27	89.3 Å²	89.3	14%	0.144	47%	0.469	C	S	.	.	B	Isolated β-bridge	trans	-77.4	139.4	166	-72.5	-30	0	0	0	110.1	S26 C29 C48 F50 S51	D24-S26 VanDerWaalsContact C-N 3.32Å; D24-C29 HydrophobicContact CB-CB 3.73Å; D24-C48 WeakPolarHBondContact OD1-CA 3.03Å; D24-F50 WeakPolarHBondContact OD1-CB 3.18Å; D24-F50 PolarHBondContact OD1-N 3.3Å; D24-F50 VanDerWaalsContact OD1-N 3.15Å; D24-S51 PolarHBondContact OD1-N 2.52Å; D24-S51 VanDerWaalsContact OD2-CB 3.29Å; D24-S51 WeakPolarHBondContact OD2-CB 3.03Å; D24-S51 PolarHBondContact OD2-N 2.89Å; D24-S51 PolarHBondContact OD2-OG 3.08Å
25	Y	80.8	Confident	69.9	Low	175 Å²	175	86.7 Å²	86.7	69%	0.686	47%	0.465	S	S	*	.	S	Bend	trans	-71.4	-29.6	175.9	-179.7	-93.1	0	0	0	112.5	W43 N47	Y25-W43 AromaticContact CD1-CH2 3.85Å; Y25-W43 HydrophobicContact CD1-CH2 3.85Å; Y25-W43 AromaticContact CD1-CZ2 3.9Å; Y25-W43 HydrophobicContact CD1-CZ2 3.9Å; Y25-W43 HydrophobicContact CE1-CZ2 4.22Å; Y25-N47 WeakPolarHBondContact CB-O 3.16Å; Y25-N47 HydrophobicContact CG-CB 4.42Å; Y25-N47 PolarHBondContact N-O 3.31Å
26	S	81.3	Confident	72.1	Confident	29 Å²	29	79.7 Å²	79.7	20%	0.203	45%	0.446	C	S	.	.	S	Bend	trans	-137.5	145.7	-173.3	176.9	0	0	0	0	110.9	D24 Q28 C29	D24-S26 VanDerWaalsContact C-N 3.32Å; S26-Q28 PolarHBondContact O-N 3.26Å; S26-Q28 PolarHBondContact OG-N 3.47Å; S26-Q28 VanDerWaalsContact OG-N 3.17Å; S26-C29 WeakPolarHBondContact O-CB 3.29Å; S26-C29 PolarHBondContact O-N 3.05Å; S26-C29 PolarHBondContact O-SG 2.81Å; S26-C29 VanDerWaalsContact O-SG 3.33Å
27	V	80.4	Confident	74.3	Confident	133 Å²	133	81.3 Å²	81.3	81%	0.806	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.1	170.4	-63.6	0	0	0	0	112.7	C29	V27-C29 PolarHBondContact O-N 3.18Å
28	Q	84.2	Confident	76.4	Confident	99 Å²	99	75 Å²	75	46%	0.463	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-10.5	177.7	-65.3	177.5	-21.7	0	0	113.4	S26 I30 D31 W32	S26-Q28 PolarHBondContact O-N 3.26Å; S26-Q28 PolarHBondContact OG-N 3.47Å; S26-Q28 VanDerWaalsContact OG-N 3.17Å; Q28-I30 PolarHBondContact O-N 3.06Å; Q28-I30 VanDerWaalsContact O-N 3.16Å; Q28-D31 PolarHBondContact O-N 3.27Å; Q28-W32 HydrophobicContact CB-CD2 4.17Å; Q28-W32 HydrophobicContact CB-CE3 4.17Å; Q28-W32 HydrophobicContact CB-CH2 3.76Å; Q28-W32 HydrophobicContact CB-CZ2 3.76Å; Q28-W32 HydrophobicContact CB-CZ3 3.94Å; Q28-W32 PolarHBondContact O-N 3.4Å; Q28-W32 VanDerWaalsContact OE1-CH2 3.29Å
29	C	82.7	Confident	78.3	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-56	-32.3	177.7	-78.3	0	0	0	0	112.6	D24 S26 V27 A33 C48 S51	D24-C29 HydrophobicContact CB-CB 3.73Å; S26-C29 WeakPolarHBondContact O-CB 3.29Å; S26-C29 PolarHBondContact O-N 3.05Å; S26-C29 PolarHBondContact O-SG 2.81Å; S26-C29 VanDerWaalsContact O-SG 3.33Å; V27-C29 PolarHBondContact O-N 3.18Å; C29-A33 WeakPolarHBondContact O-CB 3.17Å; C29-A33 PolarHBondContact O-N 2.8Å; C29-C48 VanDerWaalsContact CA-SG 3.52Å; C29-C48 HydrophobicContact CB-CB 3.49Å; C29-C48 VanDerWaalsContact CB-CB 3.49Å; C29-C48 WeakPolarHBondContact CB-SG 3.02Å; C29-C48 WeakPolarHBondContact SG-CA 3.31Å; C29-C48 WeakPolarHBondContact SG-CB 3.45Å; C29-C48 CovalentContact SG-SG 2.04Å; C29-C48 PolarHBondContact SG-SG 3.02Å; C29-S51 WeakPolarHBondContact O-CB 3.35Å
30	I	80.1	Confident	80.1	Confident	80 Å²	80	82 Å²	82	41%	0.41	45%	0.451	S	S	.	.	H	α-helix	trans	-63	-45	177.3	-62.5	171.3	0	0	0	110.8	Q28 S34 S51	Q28-I30 PolarHBondContact O-N 3.06Å; Q28-I30 VanDerWaalsContact O-N 3.16Å; I30-S34 WeakPolarHBondContact O-CB 3.18Å; I30-S34 PolarHBondContact O-N 3.42Å; I30-S34 PolarHBondContact O-OG 3.32Å; I30-S51 PolarHBondContact N-OG 3.27Å
31	D	82.2	Confident	81.8	Confident	109 Å²	109	78.7 Å²	78.7	58%	0.583	43%	0.428	S	S	*	.	H	α-helix	trans	-70.9	-42.5	-179	-61.4	-42	0	0	0	111	Q28 S34 G35	Q28-D31 PolarHBondContact O-N 3.27Å; D31-S34 WeakPolarHBondContact CA-OG 3.35Å; D31-S34 PolarHBondContact O-OG 3.48Å; D31-G35 PolarHBondContact O-N 2.88Å
32	W	85.7	Confident	83.2	Confident	80 Å²	80	77.7 Å²	77.7	30%	0.303	43%	0.427	S	S	.	.	H	α-helix	trans	-65.1	-43.5	176.7	-64	-31.8	0	0	0	112.5	Q28 G35 G36 Q37 W43 V44	Q28-W32 HydrophobicContact CB-CD2 4.17Å; Q28-W32 HydrophobicContact CB-CE3 4.17Å; Q28-W32 HydrophobicContact CB-CH2 3.76Å; Q28-W32 HydrophobicContact CB-CZ2 3.76Å; Q28-W32 HydrophobicContact CB-CZ3 3.94Å; Q28-W32 PolarHBondContact O-N 3.4Å; Q28-W32 VanDerWaalsContact OE1-CH2 3.29Å; W32-G35 CarbonylContact O-C 3.59Å; W32-G35 PolarHBondContact O-N 3.04Å; W32-G36 PolarHBondContact O-N 2.94Å; W32-Q37 HydrophobicContact CB-CB 4Å; W32-Q37 HydrophobicContact CB-CG 4.02Å; W32-Q37 WeakPolarHBondContact O-CB 3.47Å; W32-Q37 VanDerWaalsContact O-CG 3.31Å; W32-Q37 WeakPolarHBondContact O-CG 3.19Å; W32-Q37 PolarHBondContact O-N 3.42Å; W32-W43 HydrophobicContact CE3-CZ3 4.01Å; W32-W43 HydrophobicContact CH2-CH2 4.33Å; W32-W43 HydrophobicContact CH2-CZ3 4.08Å; W32-W43 HydrophobicContact CZ3-CE3 4.42Å; W32-W43 AromaticContact CZ3-CH2 3.89Å; W32-W43 HydrophobicContact CZ3-CH2 3.89Å; W32-W43 AromaticContact CZ3-CZ3 3.4Å; W32-W43 HydrophobicContact CZ3-CZ3 3.4Å; W32-V44 HydrophobicContact CB-CG1 4.38Å; W32-V44 HydrophobicContact CB-CG2 4.22Å; W32-V44 HydrophobicContact CD2-CG2 4.46Å; W32-V44 HydrophobicContact CE3-CG2 4.25Å; W32-V44 HydrophobicContact CG-CG2 4.5Å
33	A	82.7	Confident	84.1	Confident	18 Å²	18	82.8 Å²	82.8	15%	0.149	45%	0.445	C	S	.	.	H	α-helix	trans	-65.1	-43.7	178.5	0	0	0	0	0	111.9	C29 G35 G36 C38 S51	C29-A33 WeakPolarHBondContact O-CB 3.17Å; C29-A33 PolarHBondContact O-N 2.8Å; A33-G35 PolarHBondContact O-N 2.85Å; A33-G36 PolarHBondContact O-N 3.36Å; A33-C38 VanDerWaalsContact CA-SG 3.53Å; A33-C38 WeakPolarHBondContact CB-SG 3.21Å; A33-S51 WeakPolarHBondContact CB-O 3.47Å
34	S	75	Confident	84.8	Confident	97 Å²	97	76.4 Å²	76.4	68%	0.678	42%	0.418	S	S	*	.	H	α-helix	trans	-65.4	-27.8	174.4	57.9	0	0	0	0	113	I30 D31 G36	I30-S34 WeakPolarHBondContact O-CB 3.18Å; I30-S34 PolarHBondContact O-N 3.42Å; I30-S34 PolarHBondContact O-OG 3.32Å; D31-S34 WeakPolarHBondContact CA-OG 3.35Å; D31-S34 PolarHBondContact O-OG 3.48Å; S34-G36 VanDerWaalsContact C-N 3.26Å; S34-G36 PolarHBondContact O-N 3.22Å
35	G	82.6	Confident	85	Confident	57 Å²	57	78.1 Å²	78.1	59%	0.588	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	5.7	170.8	0	0	0	0	0	115.6	D31 W32 A33	D31-G35 PolarHBondContact O-N 2.88Å; W32-G35 CarbonylContact O-C 3.59Å; W32-G35 PolarHBondContact O-N 3.04Å; A33-G35 PolarHBondContact O-N 2.85Å
36	G	83.9	Confident	85.3	Confident	40 Å²	40	77.3 Å²	77.3	41%	0.412	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	10.1	177.5	0	0	0	0	0	115.3	W32 A33 S34 C38	W32-G36 PolarHBondContact O-N 2.94Å; A33-G36 PolarHBondContact O-N 3.36Å; S34-G36 VanDerWaalsContact C-N 3.26Å; S34-G36 PolarHBondContact O-N 3.22Å; G36-C38 PolarHBondContact O-N 2.98Å; G36-C38 VanDerWaalsContact O-N 3.14Å
37	Q	89.4	Confident	85.7	Confident	70 Å²	70	77.8 Å²	77.8	33%	0.327	43%	0.425	S	S	.	.	H	α-helix	trans	-69.2	-12	-177.5	-63.7	-64.8	-38.9	0	0	114	W32 E39 V40 S41 V44	W32-Q37 HydrophobicContact CB-CB 4Å; W32-Q37 HydrophobicContact CB-CG 4.02Å; W32-Q37 WeakPolarHBondContact O-CB 3.47Å; W32-Q37 VanDerWaalsContact O-CG 3.31Å; W32-Q37 WeakPolarHBondContact O-CG 3.19Å; W32-Q37 PolarHBondContact O-N 3.42Å; Q37-E39 PolarHBondContact O-N 2.99Å; Q37-V40 PolarHBondContact O-N 3.19Å; Q37-S41 PolarHBondContact O-N 3.21Å; Q37-V44 HydrophobicContact CB-CB 4.18Å; Q37-V44 HydrophobicContact CB-CG1 3.95Å; Q37-V44 HydrophobicContact CB-CG2 3.94Å
38	C	86.7	Confident	86	Confident	23 Å²	23	71.4 Å²	71.4	16%	0.155	39%	0.387	C	S	.	.	H	α-helix	trans	-64.7	-17.5	178.8	-65.7	0	0	0	0	114.4	A33 G36 Q45 C52	A33-C38 VanDerWaalsContact CA-SG 3.53Å; A33-C38 WeakPolarHBondContact CB-SG 3.21Å; G36-C38 PolarHBondContact O-N 2.98Å; G36-C38 VanDerWaalsContact O-N 3.14Å; C38-Q45 WeakPolarHBondContact O-CG 3.37Å; C38-Q45 PolarHBondContact O-NE2 2.85Å; C38-C52 WeakPolarHBondContact CA-SG 3.29Å; C38-C52 HydrophobicContact CB-CB 3.66Å; C38-C52 WeakPolarHBondContact CB-SG 3.3Å; C38-C52 WeakPolarHBondContact SG-CA 3.47Å; C38-C52 WeakPolarHBondContact SG-CB 3.23Å; C38-C52 CovalentContact SG-SG 2.04Å; C38-C52 PolarHBondContact SG-SG 2.76Å
39	E	87.7	Confident	86	Confident	179 Å²	179	70.7 Å²	70.7	84%	0.836	38%	0.382	S	S	*	.	H	α-helix	trans	-110.4	-15.6	175.8	-65.3	178.5	179.7	0	0	112	Q37 Q45	Q37-E39 PolarHBondContact O-N 2.99Å; E39-Q45 PolarHBondContact O-NE2 3.23Å
40	V	90.4	Very high	85.8	Confident	108 Å²	108	72.7 Å²	72.7	66%	0.655	39%	0.391	S	S	*	.	H	α-helix	trans	-98.5	-39.3	-172.5	-177.6	0	0	0	0	112.2	Q37	Q37-V40 PolarHBondContact O-N 3.19Å
41	S	91.2	Very high	85.8	Confident	32 Å²	32	69.1 Å²	69.1	22%	0.224	37%	0.373	C	S	.	.			trans	-111.2	114.1	-172.2	173.9	0	0	0	0	111.5	Q37 W43 V44 Q45	Q37-S41 PolarHBondContact O-N 3.21Å; S41-W43 PolarHBondContact O-N 3.27Å; S41-W43 PolarHBondContact OG-N 3.45Å; S41-V44 PolarHBondContact O-N 2.97Å; S41-V44 PolarHBondContact OG-N 3.37Å; S41-Q45 WeakPolarHBondContact O-CG 3.42Å; S41-Q45 PolarHBondContact O-N 3.07Å
42	D	91.7	Very high	85.8	Confident	126 Å²	126	64.5 Å²	64.5	67%	0.674	35%	0.349	S	S	*	.	H	α-helix	trans	-55.8	-34.8	173.1	-69.6	-19.2	0	0	0	111.9	Q45 K46	D42-Q45 PolarHBondContact O-N 3.3Å; D42-K46 VanDerWaalsContact O-CB 3.3Å; D42-K46 WeakPolarHBondContact O-CB 3.11Å; D42-K46 PolarHBondContact O-N 3.45Å
43	W	91.5	Very high	85.3	Confident	116 Å²	116	66.6 Å²	66.6	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-65.7	-45	176.8	-171.1	98.4	0	0	0	110.9	Y25 W32 S41 K46 N47	Y25-W43 AromaticContact CD1-CH2 3.85Å; Y25-W43 HydrophobicContact CD1-CH2 3.85Å; Y25-W43 AromaticContact CD1-CZ2 3.9Å; Y25-W43 HydrophobicContact CD1-CZ2 3.9Å; Y25-W43 HydrophobicContact CE1-CZ2 4.22Å; W32-W43 HydrophobicContact CE3-CZ3 4.01Å; W32-W43 HydrophobicContact CH2-CH2 4.33Å; W32-W43 HydrophobicContact CH2-CZ3 4.08Å; W32-W43 HydrophobicContact CZ3-CE3 4.42Å; W32-W43 AromaticContact CZ3-CH2 3.89Å; W32-W43 HydrophobicContact CZ3-CH2 3.89Å; W32-W43 AromaticContact CZ3-CZ3 3.4Å; W32-W43 HydrophobicContact CZ3-CZ3 3.4Å; S41-W43 PolarHBondContact O-N 3.27Å; S41-W43 PolarHBondContact OG-N 3.45Å; W43-K46 PolarHBondContact O-N 3.49Å; W43-N47 HydrophobicContact CD2-CB 4.3Å; W43-N47 VanDerWaalsContact CE2-ND2 3.3Å; W43-N47 HydrophobicContact CE3-CB 4.2Å; W43-N47 HydrophobicContact CH2-CB 3.98Å; W43-N47 HydrophobicContact CZ2-CB 4.1Å; W43-N47 HydrophobicContact CZ3-CB 4.02Å; W43-N47 PolarHBondContact NE1-ND2 2.87Å; W43-N47 VanDerWaalsContact O-CB 3.29Å; W43-N47 WeakPolarHBondContact O-CB 3.34Å; W43-N47 PolarHBondContact O-N 2.61Å; W43-N47 PolarHBondContact O-ND2 3.44Å
44	V	90.1	Very high	85	Confident	6 Å²	6	72.3 Å²	72.3	4%	0.036	38%	0.378	C	S	.	.	H	α-helix	trans	-66.5	-42	177.4	173.3	0	0	0	0	110.3	W32 Q37 S41 K46 N47 C48	W32-V44 HydrophobicContact CB-CG1 4.38Å; W32-V44 HydrophobicContact CB-CG2 4.22Å; W32-V44 HydrophobicContact CD2-CG2 4.46Å; W32-V44 HydrophobicContact CE3-CG2 4.25Å; W32-V44 HydrophobicContact CG-CG2 4.5Å; Q37-V44 HydrophobicContact CB-CB 4.18Å; Q37-V44 HydrophobicContact CB-CG1 3.95Å; Q37-V44 HydrophobicContact CB-CG2 3.94Å; S41-V44 PolarHBondContact O-N 2.97Å; S41-V44 PolarHBondContact OG-N 3.37Å; V44-K46 VanDerWaalsContact C-N 3.29Å; V44-K46 PolarHBondContact O-N 2.85Å; V44-N47 PolarHBondContact O-N 3.02Å; V44-C48 HydrophobicContact CG1-CB 3.87Å; V44-C48 WeakPolarHBondContact O-CA 3.49Å; V44-C48 WeakPolarHBondContact O-CB 3.46Å; V44-C48 PolarHBondContact O-N 3.06Å
45	Q	85.6	Confident	84.8	Confident	64 Å²	64	68.4 Å²	68.4	30%	0.299	35%	0.351	S	S	.	.	H	α-helix	trans	-57	-42.4	175	-74	177.9	34.3	0	0	113	C38 E39 S41 D42	C38-Q45 WeakPolarHBondContact O-CG 3.37Å; C38-Q45 PolarHBondContact O-NE2 2.85Å; E39-Q45 PolarHBondContact O-NE2 3.23Å; S41-Q45 WeakPolarHBondContact O-CG 3.42Å; S41-Q45 PolarHBondContact O-N 3.07Å; D42-Q45 PolarHBondContact O-N 3.3Å
46	K	86.8	Confident	83.9	Confident	157 Å²	157	67 Å²	67	68%	0.683	33%	0.328	S	S	*	.	H	α-helix	trans	-77.8	-36.2	-177.1	-171.9	174.7	-180	178.4	0	113.1	D42 W43 V44 K49	D42-K46 VanDerWaalsContact O-CB 3.3Å; D42-K46 WeakPolarHBondContact O-CB 3.11Å; D42-K46 PolarHBondContact O-N 3.45Å; W43-K46 PolarHBondContact O-N 3.49Å; V44-K46 VanDerWaalsContact C-N 3.29Å; V44-K46 PolarHBondContact O-N 2.85Å; K46-K49 WeakPolarHBondContact O-CE 3.43Å; K46-K49 WeakPolarHBondContact O-CG 3.29Å
47	N	89.3	Confident	83	Confident	39 Å²	39	68 Å²	68	21%	0.209	34%	0.339	C	S	.	.	H	α-helix	trans	-107.3	-18.6	-169.3	-63.7	-68.6	0	0	0	114.5	Y25 W43 V44	Y25-N47 WeakPolarHBondContact CB-O 3.16Å; Y25-N47 HydrophobicContact CG-CB 4.42Å; Y25-N47 PolarHBondContact N-O 3.31Å; W43-N47 HydrophobicContact CD2-CB 4.3Å; W43-N47 VanDerWaalsContact CE2-ND2 3.3Å; W43-N47 HydrophobicContact CE3-CB 4.2Å; W43-N47 HydrophobicContact CH2-CB 3.98Å; W43-N47 HydrophobicContact CZ2-CB 4.1Å; W43-N47 HydrophobicContact CZ3-CB 4.02Å; W43-N47 PolarHBondContact NE1-ND2 2.87Å; W43-N47 VanDerWaalsContact O-CB 3.29Å; W43-N47 WeakPolarHBondContact O-CB 3.34Å; W43-N47 PolarHBondContact O-N 2.61Å; W43-N47 PolarHBondContact O-ND2 3.44Å; V44-N47 PolarHBondContact O-N 3.02Å
48	C	87.5	Confident	81.7	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-111.1	44.6	179	-58.2	0	0	0	0	110.9	D24 C29 V44 F50 S51 C52	D24-C48 WeakPolarHBondContact OD1-CA 3.03Å; C29-C48 VanDerWaalsContact CA-SG 3.52Å; C29-C48 HydrophobicContact CB-CB 3.49Å; C29-C48 VanDerWaalsContact CB-CB 3.49Å; C29-C48 WeakPolarHBondContact CB-SG 3.02Å; C29-C48 WeakPolarHBondContact SG-CA 3.31Å; C29-C48 WeakPolarHBondContact SG-CB 3.45Å; C29-C48 CovalentContact SG-SG 2.04Å; C29-C48 PolarHBondContact SG-SG 3.02Å; V44-C48 HydrophobicContact CG1-CB 3.87Å; V44-C48 WeakPolarHBondContact O-CA 3.49Å; V44-C48 WeakPolarHBondContact O-CB 3.46Å; V44-C48 PolarHBondContact O-N 3.06Å; C48-F50 PolarHBondContact O-N 2.93Å; C48-S51 PolarHBondContact O-N 2.98Å; C48-C52 WeakPolarHBondContact O-CB 3.25Å; C48-C52 PolarHBondContact O-N 3.35Å; C48-C52 PolarHBondContact O-SG 3.23Å; C48-C52 VanDerWaalsContact O-SG 3.4Å
49	K	84.1	Confident	80.8	Confident	83 Å²	83	74.2 Å²	74.2	36%	0.361	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.3	-172.2	-63.3	-179.3	-177.8	179	0	112.6	C22 K46 R53 K54 C55	C22-K49 WeakPolarHBondContact SG-CB 2.99Å; K46-K49 WeakPolarHBondContact O-CE 3.43Å; K46-K49 WeakPolarHBondContact O-CG 3.29Å; K49-R53 PolarHBondContact O-N 2.81Å; K49-K54 HydrophobicContact CB-CB 4.22Å; K49-K54 PolarHBondContact O-N 3.41Å; K49-C55 PolarHBondContact O-N 3.07Å; K49-C55 PolarHBondContact O-SG 3.17Å; K49-C55 VanDerWaalsContact O-SG 3.42Å
50	F	78.3	Confident	80.3	Confident	43 Å²	43	67.4 Å²	67.4	19%	0.189	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-54.9	179.1	-171.4	-83.1	0	0	0	110	D24 C48 C52 R53 C55 Y56	D24-F50 WeakPolarHBondContact OD1-CB 3.18Å; D24-F50 PolarHBondContact OD1-N 3.3Å; D24-F50 VanDerWaalsContact OD1-N 3.15Å; C48-F50 PolarHBondContact O-N 2.93Å; F50-C52 PolarHBondContact O-N 3.27Å; F50-R53 PolarHBondContact O-N 3.2Å; F50-C55 WeakPolarHBondContact CA-SG 3.16Å; F50-C55 PolarHBondContact N-SG 3.38Å; F50-C55 VanDerWaalsContact N-SG 3.41Å; F50-Y56 HydrophobicContact CD2-CE2 4.07Å; F50-Y56 AromaticContact CE2-CE2 3.91Å; F50-Y56 HydrophobicContact CE2-CE2 3.91Å
51	S	80.6	Confident	79.7	Confident	5 Å²	5	68.7 Å²	68.7	4%	0.035	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.9	175.7	-76.5	0	0	0	0	113.3	D24 C29 I30 A33 C48	D24-S51 PolarHBondContact OD1-N 2.52Å; D24-S51 VanDerWaalsContact OD2-CB 3.29Å; D24-S51 WeakPolarHBondContact OD2-CB 3.03Å; D24-S51 PolarHBondContact OD2-N 2.89Å; D24-S51 PolarHBondContact OD2-OG 3.08Å; C29-S51 WeakPolarHBondContact O-CB 3.35Å; I30-S51 PolarHBondContact N-OG 3.27Å; A33-S51 WeakPolarHBondContact CB-O 3.47Å; C48-S51 PolarHBondContact O-N 2.98Å
52	C	82	Confident	79.2	Confident	11 Å²	11	68.6 Å²	68.6	7%	0.074	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	10	177	-66.8	0	0	0	0	115.2	C38 C48 F50 K54	C38-C52 WeakPolarHBondContact CA-SG 3.29Å; C38-C52 HydrophobicContact CB-CB 3.66Å; C38-C52 WeakPolarHBondContact CB-SG 3.3Å; C38-C52 WeakPolarHBondContact SG-CA 3.47Å; C38-C52 WeakPolarHBondContact SG-CB 3.23Å; C38-C52 CovalentContact SG-SG 2.04Å; C38-C52 PolarHBondContact SG-SG 2.76Å; C48-C52 WeakPolarHBondContact O-CB 3.25Å; C48-C52 PolarHBondContact O-N 3.35Å; C48-C52 PolarHBondContact O-SG 3.23Å; C48-C52 VanDerWaalsContact O-SG 3.4Å; F50-C52 PolarHBondContact O-N 3.27Å; C52-K54 HydrophobicContact CB-CG 4.23Å; C52-K54 PolarHBondContact O-N 3.23Å
53	R	73.9	Confident	78.7	Confident	125 Å²	125	63 Å²	63	47%	0.472	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	29.4	175.7	-46.6	175.8	-174.5	-143.5	-6.3	114.1	K49 F50 D64	K49-R53 PolarHBondContact O-N 2.81Å; F50-R53 PolarHBondContact O-N 3.2Å; R53-D64 IonicContact CZ-OD2 2.99Å; R53-D64 IonicContact NE-OD2 3.88Å; R53-D64 IonicContact NH1-OD2 2.73Å; R53-D64 PolarHBondContact NH1-OD2 3.39Å; R53-D64 IonicContact NH2-OD2 3Å; R53-D64 PolarHBondContact NH2-OD2 2.89Å
54	K	76.8	Confident	78.1	Confident	137 Å²	137	57.8 Å²	57.8	60%	0.596	28%	0.278	S	S	*	.			trans	-90.8	-10	177.9	-60.9	-62.2	-175.6	179.8	0	113.1	K49 C52	K49-K54 HydrophobicContact CB-CB 4.22Å; K49-K54 PolarHBondContact O-N 3.41Å; C52-K54 HydrophobicContact CB-CG 4.23Å; C52-K54 PolarHBondContact O-N 3.23Å
55	C	71.2	Confident	77.5	Confident	16 Å²	16	60.8 Å²	60.8	11%	0.108	29%	0.289	C	S	.	.	S	Bend	trans	-72.1	-36.2	-175.6	-64.4	0	0	0	0	115.5	C22 K49 F50	C22-C55 HydrophobicContact CB-CB 3.5Å; C22-C55 WeakPolarHBondContact CB-SG 3.35Å; C22-C55 WeakPolarHBondContact SG-CA 3.5Å; C22-C55 WeakPolarHBondContact SG-CB 3.42Å; C22-C55 CovalentContact SG-SG 1.99Å; C22-C55 PolarHBondContact SG-SG 3.15Å; K49-C55 PolarHBondContact O-N 3.07Å; K49-C55 PolarHBondContact O-SG 3.17Å; K49-C55 VanDerWaalsContact O-SG 3.42Å; F50-C55 WeakPolarHBondContact CA-SG 3.16Å; F50-C55 PolarHBondContact N-SG 3.38Å; F50-C55 VanDerWaalsContact N-SG 3.41Å
56	Y	63.5	Low	77	Confident	26 Å²	26	61 Å²	61	10%	0.102	29%	0.289	C	S	.	.	S	Bend	trans	-137.6	39.5	-159.4	-58.3	-68.9	0	0	0	112.1	I16 F50 F58 L59 P235	I16-Y56 HydrophobicContact CG2-CD1 3.5Å; I16-Y56 VanDerWaalsContact CG2-CD1 3.5Å; I16-Y56 HydrophobicContact CG2-CG 4.02Å; F50-Y56 HydrophobicContact CD2-CE2 4.07Å; F50-Y56 AromaticContact CE2-CE2 3.91Å; F50-Y56 HydrophobicContact CE2-CE2 3.91Å; Y56-F58 PolarHBondContact O-N 3.42Å; Y56-L59 HydrophobicContact CD2-CD1 4.16Å; Y56-L59 HydrophobicContact CD2-CD2 4.18Å; Y56-L59 HydrophobicContact CD2-CG 4.45Å; Y56-L59 HydrophobicContact CG-CD2 4.05Å; Y56-P235 HydrophobicContact CD1-CG 3.75Å; Y56-P235 HydrophobicContact CD2-CB 3.93Å; Y56-P235 HydrophobicContact CD2-CG 3.3Å; Y56-P235 HydrophobicContact CE1-CG 3.53Å; Y56-P235 HydrophobicContact CE2-CB 3.74Å; Y56-P235 HydrophobicContact CE2-CG 3.12Å; Y56-P235 HydrophobicContact CG-CG 3.63Å
57	G	64.2	Low	76.6	Confident	63 Å²	63	55.3 Å²	55.3	65%	0.649	27%	0.27	S	S	*	.	S	Bend	trans	44.7	-141.7	-176.7	0	0	0	0	0	113	L59	G57-L59 PolarHBondContact O-N 3.47Å
58	F	61.8	Low	76.1	Confident	190 Å²	190	54.5 Å²	54.5	83%	0.833	27%	0.268	S	S	*	.	S	Bend	trans	-72.7	95.7	170	-171.5	-94.1	0	0	0	109.7	Y56	Y56-F58 PolarHBondContact O-N 3.42Å
59	L	69.1	Low	75.7	Confident	32 Å²	32	56 Å²	56	17%	0.168	28%	0.279	C	S	.	.			trans	-61.8	132.1	166.7	-79.7	171.3	0	0	0	109.1	Y56 G57 K61 F234 P235	Y56-L59 HydrophobicContact CD2-CD1 4.16Å; Y56-L59 HydrophobicContact CD2-CD2 4.18Å; Y56-L59 HydrophobicContact CD2-CG 4.45Å; Y56-L59 HydrophobicContact CG-CD2 4.05Å; G57-L59 PolarHBondContact O-N 3.47Å; L59-K61 PolarHBondContact O-N 2.04Å; L59-F234 HydrophobicContact CD2-CE1 4.33Å; L59-F234 HydrophobicContact CD2-CZ 4.3Å; L59-P235 HydrophobicContact CD2-CB 4.11Å; L59-P235 HydrophobicContact CD2-CG 4.05Å
60	P	77.4	Confident	75.5	Confident	36 Å²	36	57.7 Å²	57.7	23%	0.234	30%	0.298	C	S	.	.			trans	-56.9	134.1	168.7	-19.7	30.9	0	0	0	109.6	H62 Y63 D64	P60-H62 WeakPolarHBondContact CB-CE1 3.03Å; P60-H62 WeakPolarHBondContact CB-NE2 3.5Å; P60-H62 PolarHBondContact O-N 2.86Å; P60-Y63 HydrophobicContact CB-CD2 4.1Å; P60-Y63 HydrophobicContact CG-CD2 4.13Å; P60-Y63 PolarHBondContact O-N 3.35Å; P60-D64 PolarHBondContact O-N 1.99Å
61	K	77.3	Confident	75.6	Confident	135 Å²	135	57 Å²	57	59%	0.587	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-50.8	-35	-175.1	-172.8	-175.9	177.3	-172.2	0	113.6	L59 Y63 D64	L59-K61 PolarHBondContact O-N 2.04Å; K61-Y63 PolarHBondContact O-N 3.29Å; K61-D64 PolarHBondContact O-N 3.43Å
62	H	81.1	Confident	75.6	Confident	31 Å²	31	56.9 Å²	56.9	14%	0.144	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-70.8	-13.8	179.4	53.5	-97.7	0	0	0	114.5	P60 R107 I108	P60-H62 WeakPolarHBondContact CB-CE1 3.03Å; P60-H62 WeakPolarHBondContact CB-NE2 3.5Å; P60-H62 PolarHBondContact O-N 2.86Å; H62-R107 HydrophobicContact CB-CB 4.33Å; H62-R107 VanDerWaalsContact CD2-CZ 3.48Å; H62-R107 PolarHBondContact CD2-NE 3.33Å; H62-R107 VanDerWaalsContact CD2-NE 3.27Å; H62-R107 PolarHBondContact CD2-NH2 3.04Å; H62-R107 VanDerWaalsContact CD2-NH2 3.35Å; H62-R107 PolarHBondContact CE1-NH2 3.25Å; H62-R107 VanDerWaalsContact CE1-NH2 3.27Å; H62-R107 PolarHBondContact NE2-NH2 3.28Å; H62-R107 CarbonylContact O-C 3.5Å; H62-R107 WeakPolarHBondContact O-CA 3.39Å; H62-I108 WeakPolarHBondContact CB-O 3.47Å; H62-I108 PolarHBondContact O-N 3.23Å
63	Y	80.5	Confident	75.7	Confident	9 Å²	9	64.4 Å²	64.4	4%	0.035	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-105.9	-4	171.9	-70.4	-65.3	0	0	0	112.8	P60 K61 R65 V79 R81 D105 R107 F234 P235	P60-Y63 HydrophobicContact CB-CD2 4.1Å; P60-Y63 HydrophobicContact CG-CD2 4.13Å; P60-Y63 PolarHBondContact O-N 3.35Å; K61-Y63 PolarHBondContact O-N 3.29Å; Y63-R65 PolarHBondContact O-N 2.87Å; Y63-R65 VanDerWaalsContact O-N 3.1Å; Y63-V79 VanDerWaalsContact O-CG1 3.23Å; Y63-V79 WeakPolarHBondContact O-CG1 3.49Å; Y63-R81 PolarHBondContact OH-NH2 3.24Å; Y63-D105 WeakPolarHBondContact CE1-OD1 3.32Å; Y63-D105 VanDerWaalsContact CZ-OD1 3.27Å; Y63-D105 PolarHBondContact OH-OD1 3.16Å; Y63-D105 PolarHBondContact OH-OD2 3.29Å; Y63-R107 HydrophobicContact CD1-CG 4.38Å; Y63-R107 HydrophobicContact CE1-CG 3.64Å; Y63-R107 WeakPolarHBondContact OH-CD 3.14Å; Y63-F234 AromaticContact CD1-CD1 3.76Å; Y63-F234 HydrophobicContact CD1-CD1 3.76Å; Y63-F234 AromaticContact CD1-CE1 3.97Å; Y63-F234 HydrophobicContact CD1-CE1 3.97Å; Y63-F234 AromaticContact CD2-CD1 3.93Å; Y63-F234 HydrophobicContact CD2-CD1 3.93Å; Y63-F234 AromaticContact CD2-CE1 3.36Å; Y63-F234 HydrophobicContact CD2-CE1 3.36Å; Y63-F234 HydrophobicContact CD2-CZ 4.23Å; Y63-F234 HydrophobicContact CE1-CD1 4.1Å; Y63-F234 HydrophobicContact CE1-CE1 4.49Å; Y63-F234 HydrophobicContact CE2-CD1 4.26Å; Y63-F234 AromaticContact CE2-CE1 3.95Å; Y63-F234 HydrophobicContact CE2-CE1 3.95Å; Y63-F234 AromaticContact CG-CD1 3.69Å; Y63-F234 HydrophobicContact CG-CD1 3.69Å; Y63-F234 AromaticContact CG-CE1 3.39Å; Y63-F234 HydrophobicContact CG-CE1 3.39Å; Y63-P235 WeakPolarHBondContact CB-O 3.17Å
64	D	78.3	Confident	76.4	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.027	32%	0.315	C	S	.	.			trans	-79.5	100.1	176.3	176.6	15.5	0	0	0	110.2	R53 P60 K61 H66 S67 I108	R53-D64 IonicContact CZ-OD2 2.99Å; R53-D64 IonicContact NE-OD2 3.88Å; R53-D64 IonicContact NH1-OD2 2.73Å; R53-D64 PolarHBondContact NH1-OD2 3.39Å; R53-D64 IonicContact NH2-OD2 3Å; R53-D64 PolarHBondContact NH2-OD2 2.89Å; P60-D64 PolarHBondContact O-N 1.99Å; K61-D64 PolarHBondContact O-N 3.43Å; D64-H66 PolarHBondContact O-N 2.74Å; D64-H66 VanDerWaalsContact OD1-CB 3.31Å; D64-H66 WeakPolarHBondContact OD1-CB 3.16Å; D64-H66 IonicContact OD1-CD2 3.52Å; D64-H66 IonicContact OD1-CG 3.81Å; D64-H66 PolarHBondContact OD1-N 2.82Å; D64-S67 WeakPolarHBondContact O-CA 3.41Å; D64-S67 WeakPolarHBondContact O-CB 3.37Å; D64-S67 PolarHBondContact O-N 3.02Å; D64-S67 WeakPolarHBondContact OD2-CB 3.48Å; D64-S67 PolarHBondContact OD2-N 3.44Å; D64-S67 PolarHBondContact OD2-OG 3.46Å; D64-I108 WeakPolarHBondContact O-CD1 3.36Å
65	R	79.2	Confident	77	Confident	69 Å²	69	53.6 Å²	53.6	26%	0.26	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-50.3	-32.5	174.4	-175.6	175.1	69.4	-180	2.9	113.4	Y63 S67 A68 A76 V79	Y63-R65 PolarHBondContact O-N 2.87Å; Y63-R65 VanDerWaalsContact O-N 3.1Å; R65-S67 VanDerWaalsContact C-N 3.31Å; R65-A68 WeakPolarHBondContact O-CB 3.22Å; R65-A68 PolarHBondContact O-N 2.9Å; R65-A76 WeakPolarHBondContact CD-O 2.88Å; R65-A76 HydrophobicContact CG-CB 3.72Å; R65-A76 VanDerWaalsContact CG-O 3.23Å; R65-A76 WeakPolarHBondContact CG-O 2.96Å; R65-V79 HydrophobicContact CB-CB 4.32Å
66	H	74.8	Confident	77.7	Confident	68 Å²	68	53.5 Å²	53.5	32%	0.315	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-77.3	-18.9	179.4	-58.6	-86	0	0	0	113	D64 A68	D64-H66 PolarHBondContact O-N 2.74Å; D64-H66 VanDerWaalsContact OD1-CB 3.31Å; D64-H66 WeakPolarHBondContact OD1-CB 3.16Å; D64-H66 IonicContact OD1-CD2 3.52Å; D64-H66 IonicContact OD1-CG 3.81Å; D64-H66 PolarHBondContact OD1-N 2.82Å; H66-A68 PolarHBondContact O-N 3.19Å
67	S	77.2	Confident	78.9	Confident	38 Å²	38	53.1 Å²	53.1	27%	0.266	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-80.2	-0.8	170.8	-70	0	0	0	0	112.7	D64 R65	D64-S67 WeakPolarHBondContact O-CA 3.41Å; D64-S67 WeakPolarHBondContact O-CB 3.37Å; D64-S67 PolarHBondContact O-N 3.02Å; D64-S67 WeakPolarHBondContact OD2-CB 3.48Å; D64-S67 PolarHBondContact OD2-N 3.44Å; D64-S67 PolarHBondContact OD2-OG 3.46Å; R65-S67 VanDerWaalsContact C-N 3.31Å
68	A	79.1	Confident	80.2	Confident	22 Å²	22	50.1 Å²	50.1	18%	0.182	26%	0.255	C	S	.	.	S	Bend	trans	-64.9	131.3	176.2	0	0	0	0	0	110.8	R65 H66 L72 I108	R65-A68 WeakPolarHBondContact O-CB 3.22Å; R65-A68 PolarHBondContact O-N 2.9Å; H66-A68 PolarHBondContact O-N 3.19Å; A68-L72 HydrophobicContact CB-CB 4.25Å; A68-I108 HydrophobicContact CB-CD1 4.01Å
69	P	78.5	Confident	81.5	Confident	33 Å²	33	41.1 Å²	41.1	21%	0.214	22%	0.215	C	C	.	.			trans	-53.5	154.2	170.8	-27	33.9	0	0	0	112.7	D71 L72 N120	P69-D71 VanDerWaalsContact C-N 3.25Å; P69-D71 PolarHBondContact O-N 3Å; P69-D71 VanDerWaalsContact O-N 3.16Å; P69-L72 HydrophobicContact CG-CD1 4.42Å; P69-L72 WeakPolarHBondContact O-CA 3.13Å; P69-L72 WeakPolarHBondContact O-CB 3.12Å; P69-L72 PolarHBondContact O-N 3.19Å; P69-N120 HydrophobicContact CB-CB 4.48Å; P69-N120 HydrophobicContact CG-CB 4.07Å
70	P	80.6	Confident	82.3	Confident	117 Å²	117	39.6 Å²	39.6	76%	0.76	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-52.4	-39.6	-179.3	-28.7	35.5	0	0	0	114.4	L72 K73	P70-L72 PolarHBondContact O-N 3.26Å; P70-K73 WeakPolarHBondContact O-CB 3.43Å; P70-K73 PolarHBondContact O-N 2.96Å
71	D	80.3	Confident	82.7	Confident	29 Å²	29	41.5 Å²	41.5	16%	0.155	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-64.2	-26	178.3	-67.1	-33.2	0	0	0	113	P69 P74 V146 N148	P69-D71 VanDerWaalsContact C-N 3.25Å; P69-D71 PolarHBondContact O-N 3Å; P69-D71 VanDerWaalsContact O-N 3.16Å; D71-P74 WeakPolarHBondContact O-CD 3.45Å; D71-V146 VanDerWaalsContact O-CB 3.29Å; D71-V146 WeakPolarHBondContact O-CB 3.39Å; D71-V146 VanDerWaalsContact O-CG1 3.26Å; D71-V146 WeakPolarHBondContact O-CG1 3.21Å; D71-N148 PolarHBondContact OD1-OD1 2.86Å
72	L	81.6	Confident	83.5	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.016	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-89.1	-1.3	-179.7	-80.3	-172.4	0	0	0	113.7	A68 P69 P70 P74 I75 A76 N120 R122 V146	A68-L72 HydrophobicContact CB-CB 4.25Å; P69-L72 HydrophobicContact CG-CD1 4.42Å; P69-L72 WeakPolarHBondContact O-CA 3.13Å; P69-L72 WeakPolarHBondContact O-CB 3.12Å; P69-L72 PolarHBondContact O-N 3.19Å; P70-L72 PolarHBondContact O-N 3.26Å; L72-P74 VanDerWaalsContact C-CD 3.44Å; L72-I75 HydrophobicContact CD2-CD1 3.71Å; L72-I75 HydrophobicContact CD2-CG1 3.99Å; L72-I75 CarbonylContact O-C 3.48Å; L72-I75 PolarHBondContact O-N 3.16Å; L72-A76 PolarHBondContact O-N 2.89Å; L72-A76 VanDerWaalsContact O-N 3.13Å; L72-N120 HydrophobicContact CD1-CB 4.19Å; L72-N120 VanDerWaalsContact CD1-O 3.25Å; L72-N120 WeakPolarHBondContact CD1-O 3.34Å; L72-N120 VanDerWaalsContact CD2-O 3.32Å; L72-N120 WeakPolarHBondContact CD2-O 3.46Å; L72-N120 HydrophobicContact CG-CB 4.39Å; L72-N120 WeakPolarHBondContact CG-O 2.9Å; L72-R122 HydrophobicContact CD1-CG 4.34Å; L72-R122 HydrophobicContact CD2-CG 4.35Å; L72-R122 PolarHBondContact O-NH2 2.78Å; L72-V146 HydrophobicContact CD2-CG2 3.84Å
73	K	83.4	Confident	83.9	Confident	168 Å²	168	36.9 Å²	36.9	73%	0.73	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-54.5	-43	-179.9	-170.5	178	-178.6	179.9	0	113.4	P70 I75 A76	P70-K73 WeakPolarHBondContact O-CB 3.43Å; P70-K73 PolarHBondContact O-N 2.96Å; K73-I75 PolarHBondContact O-N 2.89Å; K73-A76 VanDerWaalsContact O-CB 3.26Å; K73-A76 WeakPolarHBondContact O-CB 3.45Å; K73-A76 PolarHBondContact O-N 2.92Å
74	P	87.8	Confident	84.4	Confident	36 Å²	36	37 Å²	37	23%	0.234	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-59.7	-32.3	-178.9	-25.5	36.1	0	0	0	113.7	D71 L72 F77 V171	D71-P74 WeakPolarHBondContact O-CD 3.45Å; L72-P74 VanDerWaalsContact C-CD 3.44Å; P74-F77 WeakPolarHBondContact O-CD1 3.42Å; P74-F77 WeakPolarHBondContact O-CE1 3.44Å; P74-V171 HydrophobicContact CB-CB 4.38Å; P74-V171 HydrophobicContact CB-CG1 4.26Å
75	I	89.6	Confident	84.8	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-108.1	15.5	-178.7	58.5	166.5	0	0	0	113	L72 K73 F77 L78 R122 L144 V146 V153 V171 I176	L72-I75 HydrophobicContact CD2-CD1 3.71Å; L72-I75 HydrophobicContact CD2-CG1 3.99Å; L72-I75 CarbonylContact O-C 3.48Å; L72-I75 PolarHBondContact O-N 3.16Å; K73-I75 PolarHBondContact O-N 2.89Å; I75-F77 PolarHBondContact O-N 3.18Å; I75-L78 HydrophobicContact CB-CD1 4.38Å; I75-L78 PolarHBondContact O-N 3.28Å; I75-R122 HydrophobicContact CD1-CG 4.2Å; I75-R122 PolarHBondContact O-NE 2.84Å; I75-R122 PolarHBondContact O-NH2 3.34Å; I75-L144 HydrophobicContact CB-CD2 4.47Å; I75-L144 HydrophobicContact CD1-CB 4.44Å; I75-L144 HydrophobicContact CD1-CD2 3.58Å; I75-L144 HydrophobicContact CD1-CG 3.7Å; I75-L144 HydrophobicContact CG2-CD2 4.45Å; I75-V146 HydrophobicContact CD1-CG2 3.54Å; I75-V146 HydrophobicContact CG1-CG2 3.62Å; I75-V146 HydrophobicContact CG2-CG2 4.41Å; I75-V153 HydrophobicContact CG2-CG1 3.89Å; I75-V171 HydrophobicContact CG2-CG2 3.54Å; I75-I176 HydrophobicContact CG2-CD1 3.7Å
76	A	87.1	Confident	85.2	Confident	13 Å²	13	43.7 Å²	43.7	11%	0.107	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-61.7	-28.9	-179.1	0	0	0	0	0	113.1	R65 L72 K73 L78 V79	R65-A76 WeakPolarHBondContact CD-O 2.88Å; R65-A76 HydrophobicContact CG-CB 3.72Å; R65-A76 VanDerWaalsContact CG-O 3.23Å; R65-A76 WeakPolarHBondContact CG-O 2.96Å; L72-A76 PolarHBondContact O-N 2.89Å; L72-A76 VanDerWaalsContact O-N 3.13Å; K73-A76 VanDerWaalsContact O-CB 3.26Å; K73-A76 WeakPolarHBondContact O-CB 3.45Å; K73-A76 PolarHBondContact O-N 2.92Å; A76-L78 PolarHBondContact O-N 2.79Å; A76-V79 WeakPolarHBondContact O-CG2 3.21Å; A76-V79 PolarHBondContact O-N 2.85Å
77	F	88.3	Confident	85.7	Confident	19 Å²	19	41.6 Å²	41.6	8%	0.083	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-64.2	-21.4	179	66.6	-97.3	0	0	0	114.3	P74 I75 V171 I176 L203 R232	P74-F77 WeakPolarHBondContact O-CD1 3.42Å; P74-F77 WeakPolarHBondContact O-CE1 3.44Å; I75-F77 PolarHBondContact O-N 3.18Å; F77-V171 HydrophobicContact CE1-CG1 4.45Å; F77-I176 HydrophobicContact CZ-CD1 4.01Å; F77-I176 HydrophobicContact CZ-CG1 4Å; F77-L203 HydrophobicContact CB-CD2 3.84Å; F77-L203 HydrophobicContact CD2-CB 3.78Å; F77-L203 HydrophobicContact CD2-CD1 4.26Å; F77-L203 HydrophobicContact CD2-CD2 3.98Å; F77-L203 HydrophobicContact CD2-CG 4.24Å; F77-L203 HydrophobicContact CE2-CB 3.93Å; F77-L203 HydrophobicContact CG-CD2 4.08Å; F77-R232 PolarHBondContact O-NH2 3.5Å
78	L	91.6	Very high	86.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-74.8	-24.9	178.7	-68.2	178.7	0	0	0	113.5	I75 A76 G80 W82 Y106 L144 I176 I201 L209	I75-L78 HydrophobicContact CB-CD1 4.38Å; I75-L78 PolarHBondContact O-N 3.28Å; A76-L78 PolarHBondContact O-N 2.79Å; L78-G80 PolarHBondContact O-N 2.97Å; L78-W82 PolarHBondContact O-NE1 3.1Å; L78-Y106 HydrophobicContact CB-CD1 4.14Å; L78-Y106 HydrophobicContact CB-CD2 4.13Å; L78-Y106 HydrophobicContact CB-CE1 4.35Å; L78-Y106 HydrophobicContact CB-CE2 4.37Å; L78-Y106 HydrophobicContact CB-CG 4.01Å; L78-Y106 HydrophobicContact CD1-CD1 4.46Å; L78-Y106 HydrophobicContact CD1-CE1 4Å; L78-Y106 HydrophobicContact CD2-CE2 4.33Å; L78-Y106 WeakPolarHBondContact O-CB 3.29Å; L78-Y106 WeakPolarHBondContact O-CD2 3.26Å; L78-L144 HydrophobicContact CD1-CD2 3.63Å; L78-I176 HydrophobicContact CD1-CD1 3.69Å; L78-I176 HydrophobicContact CG-CD1 4.48Å; L78-I201 HydrophobicContact CD2-CG2 3.85Å; L78-L209 HydrophobicContact CD2-CD1 3.86Å; L78-L209 HydrophobicContact CD2-CD2 4.12Å
79	V	88	Confident	87.3	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	22%	0.223	C	C	.	.			trans	-49.9	135.2	-179.3	178.6	0	0	0	0	109.9	Y63 R65 A76 I108 R232 P235	Y63-V79 VanDerWaalsContact O-CG1 3.23Å; Y63-V79 WeakPolarHBondContact O-CG1 3.49Å; R65-V79 HydrophobicContact CB-CB 4.32Å; A76-V79 WeakPolarHBondContact O-CG2 3.21Å; A76-V79 PolarHBondContact O-N 2.85Å; V79-I108 HydrophobicContact CG2-CD1 4.3Å; V79-I108 HydrophobicContact CG2-CG1 4.12Å; V79-R232 PolarHBondContact O-NH1 3.18Å; V79-P235 VanDerWaalsContact O-OXT 3.12Å
80	G	87.5	Confident	88	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	120.1	-174.7	179.1	0	0	0	0	0	112.8	L78 Y106 F234 P235	L78-G80 PolarHBondContact O-N 2.97Å; G80-Y106 PolarHBondContact N-O 3.05Å; G80-Y106 PolarHBondContact O-N 3.37Å; G80-F234 WeakPolarHBondContact CA-O 3.27Å; G80-P235 VanDerWaalsContact CA-C 3.45Å; G80-P235 WeakPolarHBondContact CA-O 3.49Å; G80-P235 WeakPolarHBondContact CA-OXT 3.38Å
81	R	85.7	Confident	88.5	Confident	76 Å²	76	44.6 Å²	44.6	29%	0.287	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127.1	178.9	-170	176.7	-71	150.7	6.2	110.2	Y63 Q103 L104 D105 T233 F234	Y63-R81 PolarHBondContact OH-NH2 3.24Å; R81-Q103 HydrophobicContact CG-CG 3.82Å; R81-L104 CarbonylContact C-O 3.56Å; R81-L104 WeakPolarHBondContact CA-O 3.25Å; R81-D105 IonicContact CZ-OD2 2.93Å; R81-D105 IonicContact NE-OD2 3.47Å; R81-D105 PolarHBondContact NE-OD2 3.35Å; R81-D105 VanDerWaalsContact NE-OD2 3.08Å; R81-D105 IonicContact NH2-OD2 2.83Å; R81-D105 PolarHBondContact NH2-OD2 3.01Å; R81-T233 WeakPolarHBondContact CG-OG1 3.42Å; R81-T233 PolarHBondContact O-N 3.21Å; R81-T233 PolarHBondContact O-OG1 3.05Å; R81-T233 VanDerWaalsContact O-OG1 3.14Å; R81-F234 HydrophobicContact CB-CB 3.47Å; R81-F234 VanDerWaalsContact CB-CB 3.47Å; R81-F234 PolarHBondContact N-O 3.03Å; R81-F234 PolarHBondContact O-N 3.02Å
82	W	92.9	Very high	89	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.7	176.9	-55.7	88.7	0	0	0	108.7	L78 Q103 L104 Y106 L203 L209 Y230 T231 R232	L78-W82 PolarHBondContact O-NE1 3.1Å; W82-Q103 CarbonylContact O-C 3.59Å; W82-Q103 VanDerWaalsContact O-CA 3.28Å; W82-Q103 WeakPolarHBondContact O-CA 3.45Å; W82-L104 HydrophobicContact CB-CB 4.17Å; W82-L104 PolarHBondContact N-O 3.27Å; W82-L104 PolarHBondContact O-N 3Å; W82-Y106 AromaticContact CD1-CD2 3.66Å; W82-Y106 AromaticContact CD1-CE2 4Å; W82-Y106 AromaticContact NE1-CD2 3.84Å; W82-L203 HydrophobicContact CH2-CD1 3.59Å; W82-L203 HydrophobicContact CZ2-CD1 4.21Å; W82-L203 HydrophobicContact CZ3-CD1 4.48Å; W82-L209 HydrophobicContact CD2-CB 3.93Å; W82-L209 HydrophobicContact CD2-CD2 3.98Å; W82-L209 HydrophobicContact CE3-CB 3.54Å; W82-L209 HydrophobicContact CE3-CD2 4.46Å; W82-L209 HydrophobicContact CG-CD2 4.07Å; W82-L209 HydrophobicContact CH2-CB 3.99Å; W82-L209 HydrophobicContact CZ2-CB 4.34Å; W82-L209 HydrophobicContact CZ2-CD1 4.49Å; W82-L209 HydrophobicContact CZ3-CB 3.59Å; W82-Y230 HydrophobicContact CB-CD1 4.32Å; W82-Y230 HydrophobicContact CB-CG 4.06Å; W82-T231 WeakPolarHBondContact CA-O 3.19Å; W82-R232 HydrophobicContact CE3-CB 3.84Å; W82-R232 HydrophobicContact CH2-CB 4.2Å; W82-R232 HydrophobicContact CZ3-CB 3.64Å; W82-R232 HydrophobicContact CZ3-CG 4.4Å
83	R	90.1	Very high	89.5	Confident	68 Å²	68	47.1 Å²	47.1	26%	0.257	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	140.6	-178.7	-167.7	172.8	173.7	82.4	14.1	110.5	E85 E102 Q103 W129 T231 T233	R83-E85 IonicContact CZ-OE1 3.44Å; R83-E85 IonicContact NE-OE1 3.7Å; R83-E85 PolarHBondContact NE-OE1 3.4Å; R83-E85 VanDerWaalsContact NH2-CD 3.33Å; R83-E85 IonicContact NH2-OE1 2.9Å; R83-E85 PolarHBondContact NH2-OE1 3.03Å; R83-E85 IonicContact NH2-OE2 3.45Å; R83-E85 PolarHBondContact NH2-OE2 3.17Å; R83-E102 WeakPolarHBondContact CA-O 3.49Å; R83-Q103 HydrophobicContact CB-CG 4.47Å; R83-Q103 HydrophobicContact CG-CB 4.34Å; R83-Q103 HydrophobicContact CG-CG 4.49Å; R83-W129 HydrophobicContact CG-CH2 4.37Å; R83-T231 PolarHBondContact N-O 3.16Å; R83-T231 PolarHBondContact O-N 3.18Å; R83-T233 HydrophobicContact CB-CG2 3.64Å
84	S	91.8	Very high	89.6	Confident	13 Å²	13	42.9 Å²	42.9	9%	0.091	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	125.7	168	-160.7	0	0	0	0	108.2	G87 G101 E102 R229	S84-G87 WeakPolarHBondContact OG-CA 3.23Å; S84-G87 PolarHBondContact OG-N 3.08Å; S84-G101 CarbonylContact O-C 3.59Å; S84-G101 WeakPolarHBondContact O-CA 3.4Å; S84-E102 PolarHBondContact N-O 2.87Å; S84-E102 PolarHBondContact O-N 3.17Å; S84-R229 WeakPolarHBondContact CB-O 3.41Å; S84-R229 PolarHBondContact OG-O 2.9Å
85	E	86.2	Confident	89.6	Confident	67 Å²	67	43.7 Å²	43.7	31%	0.313	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-35.4	176.1	-66	-66.7	169.2	0	0	111.9	R83 G101	R83-E85 IonicContact CZ-OE1 3.44Å; R83-E85 IonicContact NE-OE1 3.7Å; R83-E85 PolarHBondContact NE-OE1 3.4Å; R83-E85 VanDerWaalsContact NH2-CD 3.33Å; R83-E85 IonicContact NH2-OE1 2.9Å; R83-E85 PolarHBondContact NH2-OE1 3.03Å; R83-E85 IonicContact NH2-OE2 3.45Å; R83-E85 PolarHBondContact NH2-OE2 3.17Å; E85-G101 VanDerWaalsContact O-CA 3.3Å; E85-G101 WeakPolarHBondContact O-CA 3.5Å
86	F	86.3	Confident	89.5	Confident	147 Å²	147	48.9 Å²	48.9	65%	0.645	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	2.6	-170.9	-44.1	-72.4	0	0	0	113.8	G88 I131	F86-G88 VanDerWaalsContact C-N 3.3Å; F86-G88 PolarHBondContact O-N 2.89Å; F86-I131 HydrophobicContact CB-CD1 4.28Å; F86-I131 HydrophobicContact CD1-CD1 3.89Å; F86-I131 HydrophobicContact CD1-CG1 3.97Å; F86-I131 HydrophobicContact CD1-CG2 4.05Å; F86-I131 HydrophobicContact CE1-CG2 4.15Å
87	G	86.9	Confident	89.8	Confident	23 Å²	23	53.9 Å²	53.9	24%	0.237	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-10.9	-174.6	0	0	0	0	0	114	S84	S84-G87 WeakPolarHBondContact OG-CA 3.23Å; S84-G87 PolarHBondContact OG-N 3.08Å
88	G	93.3	Very high	89.9	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134.6	177.7	0	0	0	0	0	112.3	F86 T99 Y100 F227	F86-G88 VanDerWaalsContact C-N 3.3Å; F86-G88 PolarHBondContact O-N 2.89Å; G88-T99 CarbonylContact O-C 3.57Å; G88-T99 WeakPolarHBondContact O-CA 3.16Å; G88-T99 WeakPolarHBondContact O-CB 3.13Å; G88-T99 WeakPolarHBondContact O-CG2 3.23Å; G88-Y100 VanDerWaalsContact CA-O 3.27Å; G88-Y100 WeakPolarHBondContact CA-O 3.36Å; G88-Y100 PolarHBondContact N-O 2.92Å; G88-Y100 VanDerWaalsContact N-O 3.1Å; G88-Y100 PolarHBondContact O-N 3.09Å; G88-F227 CarbonylContact C-O 3.49Å; G88-F227 WeakPolarHBondContact CA-O 3.47Å
89	K	95	Very high	89.9	Confident	127 Å²	127	60.1 Å²	60.1	55%	0.552	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.4	175.2	-64.7	177.3	-177.7	178.9	0	108.3	T99 T226 F227	K89-T99 HydrophobicContact CG-CG2 4.09Å; K89-T226 CarbonylContact O-C 3.6Å; K89-T226 VanDerWaalsContact O-CA 3.3Å; K89-T226 WeakPolarHBondContact O-CA 3.45Å; K89-F227 PolarHBondContact N-O 2.9Å; K89-F227 PolarHBondContact O-N 2.75Å
90	A	93.3	Very high	90.2	Very high	4 Å²	4	60.6 Å²	60.6	3%	0.033	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133	172.7	0	0	0	0	0	109.3	N97 F98 Y100 H225 T226	A90-N97 WeakPolarHBondContact O-CA 3.49Å; A90-F98 HydrophobicContact CB-CD1 3.96Å; A90-F98 HydrophobicContact CB-CD2 4.11Å; A90-F98 HydrophobicContact CB-CE1 3.52Å; A90-F98 HydrophobicContact CB-CE2 3.67Å; A90-F98 HydrophobicContact CB-CG 4.24Å; A90-F98 HydrophobicContact CB-CZ 3.35Å; A90-F98 PolarHBondContact N-O 2.63Å; A90-F98 PolarHBondContact O-N 3.25Å; A90-Y100 HydrophobicContact CB-CD1 4.34Å; A90-Y100 HydrophobicContact CB-CE1 4.26Å; A90-H225 WeakPolarHBondContact CA-O 3.36Å; A90-T226 HydrophobicContact CB-CG2 4.18Å
91	K	92.9	Very high	90.3	Very high	142 Å²	142	60.6 Å²	60.6	62%	0.617	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.6	127.3	177.8	171.1	171.7	-179.9	-170.3	0	108.2	N97 D224 H225	K91-N97 WeakPolarHBondContact CB-OD1 3.16Å; K91-N97 VanDerWaalsContact CG-OD1 3.29Å; K91-N97 WeakPolarHBondContact CG-OD1 3.12Å; K91-D224 VanDerWaalsContact O-O 3.13Å; K91-H225 PolarHBondContact N-O 3.07Å; K91-H225 WeakPolarHBondContact O-CA 3.44Å; K91-H225 VanDerWaalsContact O-O 3.1Å
92	F	90.7	Very high	90.7	Very high	9 Å²	9	57.1 Å²	57.1	4%	0.039	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	149.4	169.3	-152.5	-110.9	0	0	0	108.4	T94 I95 M215 T217 H220 Q223 H225	F92-T94 PolarHBondContact O-N 3.42Å; F92-I95 HydrophobicContact CB-CD1 3.63Å; F92-I95 HydrophobicContact CB-CG1 3.7Å; F92-I95 PolarHBondContact O-N 3.49Å; F92-M215 HydrophobicContact CD1-CE 3.93Å; F92-M215 HydrophobicContact CD2-CE 3.85Å; F92-M215 HydrophobicContact CE1-CE 3.73Å; F92-M215 HydrophobicContact CE2-CB 4.28Å; F92-M215 HydrophobicContact CE2-CE 3.63Å; F92-M215 HydrophobicContact CG-CE 4Å; F92-M215 HydrophobicContact CZ-CE 3.58Å; F92-T217 HydrophobicContact CE1-CG2 3.88Å; F92-T217 HydrophobicContact CZ-CG2 3.82Å; F92-H220 HydrophobicContact CE1-CB 4.18Å; F92-H220 HydrophobicContact CZ-CB 3.9Å; F92-Q223 HydrophobicContact CD2-CG 4.12Å; F92-Q223 HydrophobicContact CE2-CG 3.64Å; F92-H225 HydrophobicContact CD2-CB 4.25Å; F92-H225 AromaticContact CD2-ND1 3.61Å; F92-H225 AromaticContact CG-ND1 3.77Å
93	P	90.4	Very high	90.6	Very high	76 Å²	76	58.9 Å²	58.9	49%	0.494	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.6	-174.3	-30.8	38.8	0	0	0	115.3	H220 Q223	P93-H220 WeakPolarHBondContact CB-NE2 3.47Å; P93-Q223 VanDerWaalsContact CD-OE1 3.27Å; P93-Q223 VanDerWaalsContact CG-OE1 3.3Å
94	T	87	Confident	90.7	Very high	80 Å²	80	55.8 Å²	55.8	49%	0.491	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-2.1	-178.1	59	0	0	0	0	114.3	F92	F92-T94 PolarHBondContact O-N 3.42Å
95	I	86.9	Confident	90.5	Very high	53 Å²	53	55.7 Å²	55.7	27%	0.272	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.8	-178.9	71.9	-171	0	0	0	110.3	F92 F98	F92-I95 HydrophobicContact CB-CD1 3.63Å; F92-I95 HydrophobicContact CB-CG1 3.7Å; F92-I95 PolarHBondContact O-N 3.49Å; I95-F98 HydrophobicContact CD1-CE1 4.12Å
96	P	88.6	Confident	90.7	Very high	109 Å²	109	52.7 Å²	52.7	71%	0.708	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.4	142.1	167.6	-21.1	32.9	0	0	0	110.3	F98	P96-F98 WeakPolarHBondContact O-CD1 3.49Å; P96-F98 PolarHBondContact O-N 3.37Å
97	N	91.6	Very high	90.7	Very high	117 Å²	117	49 Å²	49	63%	0.626	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	129.1	171.4	-64.8	-21	0	0	0	109	A90 K91	A90-N97 WeakPolarHBondContact O-CA 3.49Å; K91-N97 WeakPolarHBondContact CB-OD1 3.16Å; K91-N97 VanDerWaalsContact CG-OD1 3.29Å; K91-N97 WeakPolarHBondContact CG-OD1 3.12Å
98	F	90.6	Very high	90.5	Very high	85 Å²	85	48.6 Å²	48.6	37%	0.373	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	162	175.5	69.1	-93.6	0	0	0	111.1	A90 I95 P96 Y100 L137	A90-F98 HydrophobicContact CB-CD1 3.96Å; A90-F98 HydrophobicContact CB-CD2 4.11Å; A90-F98 HydrophobicContact CB-CE1 3.52Å; A90-F98 HydrophobicContact CB-CE2 3.67Å; A90-F98 HydrophobicContact CB-CG 4.24Å; A90-F98 HydrophobicContact CB-CZ 3.35Å; A90-F98 PolarHBondContact N-O 2.63Å; A90-F98 PolarHBondContact O-N 3.25Å; I95-F98 HydrophobicContact CD1-CE1 4.12Å; P96-F98 WeakPolarHBondContact O-CD1 3.49Å; P96-F98 PolarHBondContact O-N 3.37Å; F98-Y100 HydrophobicContact CD2-CD1 4.43Å; F98-Y100 AromaticContact CE2-CD1 3.99Å; F98-Y100 HydrophobicContact CE2-CD1 3.99Å; F98-Y100 HydrophobicContact CE2-CG 4.39Å; F98-L137 HydrophobicContact CE2-CD1 3.76Å; F98-L137 HydrophobicContact CZ-CD1 4.48Å
99	T	92.6	Very high	89.6	Confident	66 Å²	66	49.7 Å²	49.7	41%	0.405	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	146.5	175.7	42	0	0	0	0	109.4	G88 K89 I131	G88-T99 CarbonylContact O-C 3.57Å; G88-T99 WeakPolarHBondContact O-CA 3.16Å; G88-T99 WeakPolarHBondContact O-CB 3.13Å; G88-T99 WeakPolarHBondContact O-CG2 3.23Å; K89-T99 HydrophobicContact CG-CG2 4.09Å; T99-I131 WeakPolarHBondContact O-CD1 3.39Å; T99-I131 VanDerWaalsContact OG1-CD1 3.24Å; T99-I131 WeakPolarHBondContact OG1-CD1 3.19Å
100	Y	92.9	Very high	88.3	Confident	10 Å²	10	48 Å²	48	4%	0.039	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.1	-175.9	68	-84.5	0	0	0	111.3	G88 A90 F98 E102 A128 W129 L137 T226 I228	G88-Y100 VanDerWaalsContact CA-O 3.27Å; G88-Y100 WeakPolarHBondContact CA-O 3.36Å; G88-Y100 PolarHBondContact N-O 2.92Å; G88-Y100 VanDerWaalsContact N-O 3.1Å; G88-Y100 PolarHBondContact O-N 3.09Å; A90-Y100 HydrophobicContact CB-CD1 4.34Å; A90-Y100 HydrophobicContact CB-CE1 4.26Å; F98-Y100 HydrophobicContact CD2-CD1 4.43Å; F98-Y100 AromaticContact CE2-CD1 3.99Å; F98-Y100 HydrophobicContact CE2-CD1 3.99Å; F98-Y100 HydrophobicContact CE2-CG 4.39Å; Y100-E102 HydrophobicContact CD2-CB 4.21Å; Y100-E102 HydrophobicContact CE2-CB 4.05Å; Y100-A128 HydrophobicContact CD2-CB 4.27Å; Y100-W129 WeakPolarHBondContact CA-O 3.36Å; Y100-W129 WeakPolarHBondContact CB-O 3.49Å; Y100-L137 HydrophobicContact CG-CD1 4.16Å; Y100-T226 HydrophobicContact CE1-CG2 4.43Å; Y100-I228 HydrophobicContact CD2-CD1 4.32Å; Y100-I228 HydrophobicContact CE2-CD1 3.68Å
101	G	91.3	Very high	86.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	151.2	166.7	0	0	0	0	0	110.1	S84 E85 A128 W129	S84-G101 CarbonylContact O-C 3.59Å; S84-G101 WeakPolarHBondContact O-CA 3.4Å; E85-G101 VanDerWaalsContact O-CA 3.3Å; E85-G101 WeakPolarHBondContact O-CA 3.5Å; G101-A128 CarbonylContact O-C 3.54Å; G101-A128 WeakPolarHBondContact O-CA 2.94Å; G101-W129 PolarHBondContact N-O 2.82Å; G101-W129 PolarHBondContact O-N 2.9Å
102	E	93.3	Very high	85.3	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.019	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	147.6	175.9	-175.6	175.9	-124.3	0	0	111.3	R83 S84 Y100 L104 F127 A128 W129 H138 I228 Y230	R83-E102 WeakPolarHBondContact CA-O 3.49Å; S84-E102 PolarHBondContact N-O 2.87Å; S84-E102 PolarHBondContact O-N 3.17Å; Y100-E102 HydrophobicContact CD2-CB 4.21Å; Y100-E102 HydrophobicContact CE2-CB 4.05Å; E102-L104 HydrophobicContact CG-CD2 4.09Å; E102-F127 CarbonylContact C-O 3.43Å; E102-F127 VanDerWaalsContact CA-O 3.22Å; E102-F127 WeakPolarHBondContact CA-O 3.18Å; E102-F127 WeakPolarHBondContact CG-O 3.46Å; E102-A128 HydrophobicContact CB-CB 4.44Å; E102-A128 HydrophobicContact CG-CB 4.32Å; E102-W129 VanDerWaalsContact C-CH2 3.43Å; E102-H138 IonicContact OE1-NE2 3.98Å; E102-I228 HydrophobicContact CB-CD1 3.63Å; E102-Y230 HydrophobicContact CB-CE1 4.08Å; E102-Y230 HydrophobicContact CG-CE1 4.18Å; E102-Y230 WeakPolarHBondContact OE2-CE1 3.42Å; E102-Y230 VanDerWaalsContact OE2-CZ 3.29Å; E102-Y230 PolarHBondContact OE2-OH 3.27Å
103	Q	89.9	Confident	83.8	Confident	37 Å²	37	54.4 Å²	54.4	17%	0.173	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.4	170	-175.4	177.8	-71.1	0	0	110.2	R81 W82 R83 A126 F127 W129	R81-Q103 HydrophobicContact CG-CG 3.82Å; W82-Q103 CarbonylContact O-C 3.59Å; W82-Q103 VanDerWaalsContact O-CA 3.28Å; W82-Q103 WeakPolarHBondContact O-CA 3.45Å; R83-Q103 HydrophobicContact CB-CG 4.47Å; R83-Q103 HydrophobicContact CG-CB 4.34Å; R83-Q103 HydrophobicContact CG-CG 4.49Å; Q103-A126 WeakPolarHBondContact O-CA 3.46Å; Q103-F127 PolarHBondContact N-O 2.75Å; Q103-F127 PolarHBondContact O-N 3.17Å; Q103-W129 HydrophobicContact CB-CH2 4Å; Q103-W129 HydrophobicContact CB-CZ3 3.91Å
104	L	92.3	Very high	82.2	Confident	2 Å²	2	61 Å²	61	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	137.8	170.2	-49.2	178.6	0	0	0	109.5	R81 W82 E102 Y106 L124 I125 A126 L209 Y230	R81-L104 CarbonylContact C-O 3.56Å; R81-L104 WeakPolarHBondContact CA-O 3.25Å; W82-L104 HydrophobicContact CB-CB 4.17Å; W82-L104 PolarHBondContact N-O 3.27Å; W82-L104 PolarHBondContact O-N 3Å; E102-L104 HydrophobicContact CG-CD2 4.09Å; L104-Y106 HydrophobicContact CB-CD2 4.31Å; L104-Y106 HydrophobicContact CB-CE2 3.92Å; L104-Y106 HydrophobicContact CD1-CE2 3.86Å; L104-L124 HydrophobicContact CB-CD1 4.4Å; L104-L124 HydrophobicContact CD2-CD1 4.31Å; L104-I125 CarbonylContact C-O 3.56Å; L104-I125 WeakPolarHBondContact CA-O 3.37Å; L104-A126 HydrophobicContact CD2-CB 3.49Å; L104-A126 VanDerWaalsContact CD2-CB 3.49Å; L104-L209 HydrophobicContact CD1-CD2 4.35Å; L104-Y230 HydrophobicContact CD1-CD1 4.49Å; L104-Y230 HydrophobicContact CD1-CD2 4.39Å; L104-Y230 HydrophobicContact CD1-CE1 3.92Å; L104-Y230 HydrophobicContact CD1-CE2 3.81Å; L104-Y230 HydrophobicContact CD2-CE1 4.46Å; L104-Y230 HydrophobicContact CG-CD1 4.41Å; L104-Y230 HydrophobicContact CG-CE1 3.81Å
105	D	89.4	Confident	80.6	Confident	11 Å²	11	60.6 Å²	60.6	6%	0.059	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	107.5	174.3	-156.6	-43.6	0	0	0	108.5	Y63 R81 R107 Q123 I125	Y63-D105 WeakPolarHBondContact CE1-OD1 3.32Å; Y63-D105 VanDerWaalsContact CZ-OD1 3.27Å; Y63-D105 PolarHBondContact OH-OD1 3.16Å; Y63-D105 PolarHBondContact OH-OD2 3.29Å; R81-D105 IonicContact CZ-OD2 2.93Å; R81-D105 IonicContact NE-OD2 3.47Å; R81-D105 PolarHBondContact NE-OD2 3.35Å; R81-D105 VanDerWaalsContact NE-OD2 3.08Å; R81-D105 IonicContact NH2-OD2 2.83Å; R81-D105 PolarHBondContact NH2-OD2 3.01Å; D105-R107 WeakPolarHBondContact OD1-CD 3.26Å; D105-R107 WeakPolarHBondContact OD1-CG 3.24Å; D105-Q123 VanDerWaalsContact O-O 3.11Å; D105-I125 HydrophobicContact CB-CB 4.28Å; D105-I125 PolarHBondContact N-O 2.86Å; D105-I125 PolarHBondContact O-N 2.68Å
106	Y	90.2	Very high	79	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.016	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.2	177.7	-72.4	-81.5	0	0	0	110	L78 G80 W82 L104 Q123 L124	L78-Y106 HydrophobicContact CB-CD1 4.14Å; L78-Y106 HydrophobicContact CB-CD2 4.13Å; L78-Y106 HydrophobicContact CB-CE1 4.35Å; L78-Y106 HydrophobicContact CB-CE2 4.37Å; L78-Y106 HydrophobicContact CB-CG 4.01Å; L78-Y106 HydrophobicContact CD1-CD1 4.46Å; L78-Y106 HydrophobicContact CD1-CE1 4Å; L78-Y106 HydrophobicContact CD2-CE2 4.33Å; L78-Y106 WeakPolarHBondContact O-CB 3.29Å; L78-Y106 WeakPolarHBondContact O-CD2 3.26Å; G80-Y106 PolarHBondContact N-O 3.05Å; G80-Y106 PolarHBondContact O-N 3.37Å; W82-Y106 AromaticContact CD1-CD2 3.66Å; W82-Y106 AromaticContact CD1-CE2 4Å; W82-Y106 AromaticContact NE1-CD2 3.84Å; L104-Y106 HydrophobicContact CB-CD2 4.31Å; L104-Y106 HydrophobicContact CB-CE2 3.92Å; L104-Y106 HydrophobicContact CD1-CE2 3.86Å; Y106-Q123 WeakPolarHBondContact CA-O 3.29Å; Y106-L124 HydrophobicContact CD1-CB 4.49Å; Y106-L124 HydrophobicContact CD1-CD1 4.14Å; Y106-L124 HydrophobicContact CE1-CB 4.32Å; Y106-L124 HydrophobicContact CE1-CD1 3.66Å; Y106-L124 HydrophobicContact CE1-CG 4.41Å; Y106-L124 HydrophobicContact CE2-CD1 4.19Å
107	R	85.1	Confident	77.3	Confident	71 Å²	71	60 Å²	60	27%	0.268	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	139	-176.5	-61.4	172.5	64.5	148.7	-2.7	111.2	H62 Y63 D105 S109 R122 Q123	H62-R107 HydrophobicContact CB-CB 4.33Å; H62-R107 VanDerWaalsContact CD2-CZ 3.48Å; H62-R107 PolarHBondContact CD2-NE 3.33Å; H62-R107 VanDerWaalsContact CD2-NE 3.27Å; H62-R107 PolarHBondContact CD2-NH2 3.04Å; H62-R107 VanDerWaalsContact CD2-NH2 3.35Å; H62-R107 PolarHBondContact CE1-NH2 3.25Å; H62-R107 VanDerWaalsContact CE1-NH2 3.27Å; H62-R107 PolarHBondContact NE2-NH2 3.28Å; H62-R107 CarbonylContact O-C 3.5Å; H62-R107 WeakPolarHBondContact O-CA 3.39Å; Y63-R107 HydrophobicContact CD1-CG 4.38Å; Y63-R107 HydrophobicContact CE1-CG 3.64Å; Y63-R107 WeakPolarHBondContact OH-CD 3.14Å; D105-R107 WeakPolarHBondContact OD1-CD 3.26Å; D105-R107 WeakPolarHBondContact OD1-CG 3.24Å; R107-S109 PolarHBondContact O-N 3.21Å; R107-R122 CarbonylContact O-C 3.43Å; R107-R122 WeakPolarHBondContact O-CA 3.46Å; R107-Q123 HydrophobicContact CB-CB 4.34Å; R107-Q123 PolarHBondContact N-O 3.39Å; R107-Q123 PolarHBondContact O-N 2.9Å
108	I	83.8	Confident	75.3	Confident	14 Å²	14	56 Å²	56	7%	0.072	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	127	167.3	-57.9	161.6	0	0	0	107.7	H62 D64 A68 V79	H62-I108 WeakPolarHBondContact CB-O 3.47Å; H62-I108 PolarHBondContact O-N 3.23Å; D64-I108 WeakPolarHBondContact O-CD1 3.36Å; A68-I108 HydrophobicContact CB-CD1 4.01Å; V79-I108 HydrophobicContact CG2-CD1 4.3Å; V79-I108 HydrophobicContact CG2-CG1 4.12Å
109	S	74.6	Confident	73.4	Confident	23 Å²	23	54.2 Å²	54.2	16%	0.161	30%	0.302	C	S	.	.			trans	-66.2	134.3	176.5	-174.5	0	0	0	0	111.2	R107 N111 Y121	R107-S109 PolarHBondContact O-N 3.21Å; S109-N111 VanDerWaalsContact C-N 3.3Å; S109-N111 PolarHBondContact OG-N 3.13Å; S109-N111 PolarHBondContact OG-O 3.17Å; S109-Y121 VanDerWaalsContact CB-O 3.27Å; S109-Y121 WeakPolarHBondContact CB-O 3.48Å; S109-Y121 PolarHBondContact N-O 2.95Å
110	D	66.3	Low	71.4	Confident	92 Å²	92	52.1 Å²	52.1	49%	0.492	29%	0.289	S	S	.	.	S	Bend	trans	-76.1	-19.9	176.1	-67.9	-42.8	0	0	0	112.8	P112	D110-P112 VanDerWaalsContact O-CD 3.23Å; D110-P112 WeakPolarHBondContact O-CD 3.2Å
111	N	63.3	Low	69.6	Low	134 Å²	134	53.7 Å²	53.7	72%	0.717	30%	0.295	S	S	*	.	S	Bend	trans	-109.4	90.9	-179.4	-71.4	-22.8	0	0	0	109.7	S109 L113	S109-N111 VanDerWaalsContact C-N 3.3Å; S109-N111 PolarHBondContact OG-N 3.13Å; S109-N111 PolarHBondContact OG-O 3.17Å; N111-L113 PolarHBondContact O-N 2.89Å
112	P	61.4	Low	68.4	Low	77 Å²	77	53.7 Å²	53.7	50%	0.5	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-61.2	135.1	165.4	28	-33.6	0	0	0	108.5	D110 F114 N120	D110-P112 VanDerWaalsContact O-CD 3.23Å; D110-P112 WeakPolarHBondContact O-CD 3.2Å; P112-F114 PolarHBondContact O-N 2.96Å; P112-N120 WeakPolarHBondContact CB-OD1 3.42Å
113	L	58.1	Low	67.3	Low	78 Å²	78	56.8 Å²	56.8	41%	0.408	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-61.8	123.1	168.7	-82.8	170.3	0	0	0	108.3	N111 G115 L116 L119 Y121	N111-L113 PolarHBondContact O-N 2.89Å; L113-G115 PolarHBondContact O-N 3.2Å; L113-L116 HydrophobicContact CB-CB 4.37Å; L113-L116 PolarHBondContact O-N 2.91Å; L113-L119 HydrophobicContact CD1-CB 4.07Å; L113-L119 HydrophobicContact CD1-CD1 3.93Å; L113-Y121 HydrophobicContact CD1-CE2 3.38Å; L113-Y121 WeakPolarHBondContact CD1-OH 3.3Å; L113-Y121 HydrophobicContact CG-CE2 3.86Å
114	F	57	Low	66.8	Low	215 Å²	215	55.2 Å²	55.2	94%	0.943	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	125.4	174.2	-100.4	-85.3	0	0	0	110	P112 L116	P112-F114 PolarHBondContact O-N 2.96Å; F114-L116 PolarHBondContact O-N 3.26Å
115	G	53.3	Low	66.3	Low	71 Å²	71	56.7 Å²	56.7	73%	0.732	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-3.8	175.7	0	0	0	0	0	116.6	L113	L113-G115 PolarHBondContact O-N 3.2Å
116	L	54.2	Low	66	Low	86 Å²	86	56.2 Å²	56.2	45%	0.45	31%	0.307	S	S	.	.			trans	-130	71.2	-179.4	-64.1	169.6	0	0	0	111.8	L113 F114 S118 L119	L113-L116 HydrophobicContact CB-CB 4.37Å; L113-L116 PolarHBondContact O-N 2.91Å; F114-L116 PolarHBondContact O-N 3.26Å; L116-S118 PolarHBondContact O-N 2.83Å; L116-L119 HydrophobicContact CB-CB 4.12Å; L116-L119 HydrophobicContact CB-CD1 3.85Å; L116-L119 HydrophobicContact CB-CG 4.18Å; L116-L119 HydrophobicContact CD1-CD1 3.57Å; L116-L119 HydrophobicContact CG-CD1 4.23Å; L116-L119 WeakPolarHBondContact O-CA 3.16Å; L116-L119 WeakPolarHBondContact O-CB 3.35Å; L116-L119 PolarHBondContact O-N 3.02Å
117	P	51.5	Low	65.7	Low	62 Å²	62	59.5 Å²	59.5	40%	0.403	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-61.8	-25.1	-179.6	23.3	-32.3	0	0	0	113.9	L119 N120	P117-L119 PolarHBondContact O-N 2.94Å; P117-N120 WeakPolarHBondContact O-CB 3.39Å; P117-N120 PolarHBondContact O-N 2.67Å; P117-N120 PolarHBondContact O-ND2 2.86Å
118	S	49.8	Very low	65.8	Low	34 Å²	34	56.2 Å²	56.2	24%	0.238	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-64.4	-20.9	171.3	51.1	0	0	0	0	113.7	L116 N120 V146	L116-S118 PolarHBondContact O-N 2.83Å; S118-N120 VanDerWaalsContact C-N 3.32Å; S118-V146 CarbonylContact C-O 3.51Å; S118-V146 WeakPolarHBondContact CA-O 3.33Å; S118-V146 WeakPolarHBondContact CB-O 3.09Å
119	L	50.5	Low	65.9	Low	47 Å²	47	57 Å²	57	25%	0.246	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-97.5	19.3	174.3	-64.9	175.8	0	0	0	111.2	L113 L116 P117 Y121 T145	L113-L119 HydrophobicContact CD1-CB 4.07Å; L113-L119 HydrophobicContact CD1-CD1 3.93Å; L116-L119 HydrophobicContact CB-CB 4.12Å; L116-L119 HydrophobicContact CB-CD1 3.85Å; L116-L119 HydrophobicContact CB-CG 4.18Å; L116-L119 HydrophobicContact CD1-CD1 3.57Å; L116-L119 HydrophobicContact CG-CD1 4.23Å; L116-L119 WeakPolarHBondContact O-CA 3.16Å; L116-L119 WeakPolarHBondContact O-CB 3.35Å; L116-L119 PolarHBondContact O-N 3.02Å; P117-L119 PolarHBondContact O-N 2.94Å; L119-Y121 HydrophobicContact CB-CE1 4.04Å; L119-Y121 HydrophobicContact CB-CE2 4.11Å; L119-Y121 HydrophobicContact CD2-CE1 3.96Å; L119-Y121 WeakPolarHBondContact O-CD1 3.22Å; L119-Y121 WeakPolarHBondContact O-CD2 3.33Å; L119-Y121 WeakPolarHBondContact O-CE2 3.5Å; L119-Y121 PolarHBondContact O-N 3Å; L119-T145 HydrophobicContact CD2-CG2 3.68Å
120	N	50.8	Low	66.3	Low	22 Å²	22	56.3 Å²	56.3	12%	0.118	31%	0.309	C	S	.	.			trans	-62.7	104.2	166.5	-73.2	-25.8	0	0	0	107.6	P69 L72 P112 P117 S118	P69-N120 HydrophobicContact CB-CB 4.48Å; P69-N120 HydrophobicContact CG-CB 4.07Å; L72-N120 HydrophobicContact CD1-CB 4.19Å; L72-N120 VanDerWaalsContact CD1-O 3.25Å; L72-N120 WeakPolarHBondContact CD1-O 3.34Å; L72-N120 VanDerWaalsContact CD2-O 3.32Å; L72-N120 WeakPolarHBondContact CD2-O 3.46Å; L72-N120 HydrophobicContact CG-CB 4.39Å; L72-N120 WeakPolarHBondContact CG-O 2.9Å; P112-N120 WeakPolarHBondContact CB-OD1 3.42Å; P117-N120 WeakPolarHBondContact O-CB 3.39Å; P117-N120 PolarHBondContact O-N 2.67Å; P117-N120 PolarHBondContact O-ND2 2.86Å; S118-N120 VanDerWaalsContact C-N 3.32Å
121	Y	55.7	Low	67	Low	44 Å²	44	54.2 Å²	54.2	17%	0.173	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-85.3	145.6	-163.1	-63.5	-70.1	0	0	0	113.1	S109 L113 L119 F143 T145	S109-Y121 VanDerWaalsContact CB-O 3.27Å; S109-Y121 WeakPolarHBondContact CB-O 3.48Å; S109-Y121 PolarHBondContact N-O 2.95Å; L113-Y121 HydrophobicContact CD1-CE2 3.38Å; L113-Y121 WeakPolarHBondContact CD1-OH 3.3Å; L113-Y121 HydrophobicContact CG-CE2 3.86Å; L119-Y121 HydrophobicContact CB-CE1 4.04Å; L119-Y121 HydrophobicContact CB-CE2 4.11Å; L119-Y121 HydrophobicContact CD2-CE1 3.96Å; L119-Y121 WeakPolarHBondContact O-CD1 3.22Å; L119-Y121 WeakPolarHBondContact O-CD2 3.33Å; L119-Y121 WeakPolarHBondContact O-CE2 3.5Å; L119-Y121 PolarHBondContact O-N 3Å; Y121-F143 VanDerWaalsContact CB-CD1 3.44Å; Y121-F143 HydrophobicContact CD1-CB 3.44Å; Y121-F143 VanDerWaalsContact CD1-CB 3.44Å; Y121-F143 AromaticContact CD1-CD1 3.98Å; Y121-F143 HydrophobicContact CD1-CD1 3.98Å; Y121-F143 AromaticContact CD1-CG 3.8Å; Y121-F143 HydrophobicContact CD1-CG 3.8Å; Y121-F143 HydrophobicContact CD2-CD1 4.36Å; Y121-F143 HydrophobicContact CD2-CE1 4.49Å; Y121-F143 HydrophobicContact CE1-CB 3.99Å; Y121-F143 HydrophobicContact CE1-CG 4.32Å; Y121-F143 HydrophobicContact CG-CB 4.08Å; Y121-F143 AromaticContact CG-CD1 3.7Å; Y121-F143 HydrophobicContact CG-CD1 3.7Å; Y121-F143 HydrophobicContact CG-CE1 4.24Å; Y121-F143 HydrophobicContact CG-CG 4Å; Y121-T145 HydrophobicContact CD1-CG2 3.26Å; Y121-T145 HydrophobicContact CE1-CG2 3.28Å; Y121-T145 HydrophobicContact CG-CG2 4.49Å
122	R	65.2	Low	67.6	Low	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	120.6	151.2	-59.3	-167.7	-175.3	-63	-8.6	109.2	L72 I75 R107 L124 F143 L144	L72-R122 HydrophobicContact CD1-CG 4.34Å; L72-R122 HydrophobicContact CD2-CG 4.35Å; L72-R122 PolarHBondContact O-NH2 2.78Å; I75-R122 HydrophobicContact CD1-CG 4.2Å; I75-R122 PolarHBondContact O-NE 2.84Å; I75-R122 PolarHBondContact O-NH2 3.34Å; R107-R122 CarbonylContact O-C 3.43Å; R107-R122 WeakPolarHBondContact O-CA 3.46Å; R122-L124 PolarHBondContact O-N 3.14Å; R122-F143 VanDerWaalsContact O-CA 3.24Å; R122-F143 WeakPolarHBondContact O-CA 3.44Å; R122-L144 HydrophobicContact CB-CB 4.28Å; R122-L144 PolarHBondContact N-O 3.02Å; R122-L144 PolarHBondContact O-N 3.04Å
123	Q	70	Confident	68.2	Low	68 Å²	68	56 Å²	56	32%	0.318	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	122.1	164.7	-72.1	171.5	34	0	0	107.3	D105 Y106 R107 G142 F143	D105-Q123 VanDerWaalsContact O-O 3.11Å; Y106-Q123 WeakPolarHBondContact CA-O 3.29Å; R107-Q123 HydrophobicContact CB-CB 4.34Å; R107-Q123 PolarHBondContact N-O 3.39Å; R107-Q123 PolarHBondContact O-N 2.9Å; Q123-G142 WeakPolarHBondContact CA-O 3.28Å; Q123-F143 HydrophobicContact CG-CD1 3.94Å; Q123-F143 HydrophobicContact CG-CE1 3.46Å; Q123-F143 VanDerWaalsContact CG-CE1 3.46Å; Q123-F143 HydrophobicContact CG-CZ 4.39Å
124	L	80.4	Confident	69	Low	5 Å²	5	59.6 Å²	59.6	3%	0.026	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.3	166.3	168.7	64.2	0	0	0	107.2	L104 Y106 R122 Y141 G142 L155	L104-L124 HydrophobicContact CB-CD1 4.4Å; L104-L124 HydrophobicContact CD2-CD1 4.31Å; Y106-L124 HydrophobicContact CD1-CB 4.49Å; Y106-L124 HydrophobicContact CD1-CD1 4.14Å; Y106-L124 HydrophobicContact CE1-CB 4.32Å; Y106-L124 HydrophobicContact CE1-CD1 3.66Å; Y106-L124 HydrophobicContact CE1-CG 4.41Å; Y106-L124 HydrophobicContact CE2-CD1 4.19Å; R122-L124 PolarHBondContact O-N 3.14Å; L124-Y141 WeakPolarHBondContact O-CA 3.39Å; L124-G142 PolarHBondContact N-O 3.32Å; L124-G142 PolarHBondContact O-N 2.92Å; L124-L155 HydrophobicContact CD2-CD1 4.03Å
125	I	81.5	Confident	70	Confident	32 Å²	32	55.3 Å²	55.3	16%	0.164	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.4	164.5	-48.3	175.3	0	0	0	107.8	L104 D105 F127 E140 Y141	L104-I125 CarbonylContact C-O 3.56Å; L104-I125 WeakPolarHBondContact CA-O 3.37Å; D105-I125 HydrophobicContact CB-CB 4.28Å; D105-I125 PolarHBondContact N-O 2.86Å; D105-I125 PolarHBondContact O-N 2.68Å; I125-F127 HydrophobicContact CB-CE2 4.28Å; I125-F127 HydrophobicContact CG2-CD2 3.81Å; I125-F127 HydrophobicContact CG2-CE1 4.35Å; I125-F127 HydrophobicContact CG2-CE2 3.12Å; I125-F127 HydrophobicContact CG2-CZ 3.43Å; I125-F127 VanDerWaalsContact CG2-CZ 3.43Å; I125-E140 CarbonylContact C-O 3.58Å; I125-E140 WeakPolarHBondContact CA-O 3.48Å; I125-Y141 HydrophobicContact CB-CD1 4.47Å; I125-Y141 HydrophobicContact CG1-CD1 4.12Å; I125-Y141 HydrophobicContact CG1-CE1 4.42Å; I125-Y141 HydrophobicContact CG2-CD1 3.79Å; I125-Y141 HydrophobicContact CG2-CE1 3.51Å
126	A	83.4	Confident	71.5	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.9	174.8	0	0	0	0	0	109.7	Q103 L104 S139 E140	Q103-A126 WeakPolarHBondContact O-CA 3.46Å; L104-A126 HydrophobicContact CD2-CB 3.49Å; L104-A126 VanDerWaalsContact CD2-CB 3.49Å; A126-S139 CarbonylContact O-C 3.57Å; A126-S139 WeakPolarHBondContact O-CA 3.45Å; A126-E140 HydrophobicContact CB-CB 3.92Å; A126-E140 HydrophobicContact CB-CG 4.07Å; A126-E140 PolarHBondContact N-O 3.46Å; A126-E140 PolarHBondContact O-N 2.92Å
127	F	84.7	Confident	72.9	Confident	73 Å²	73	55 Å²	55	32%	0.32	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	114.5	173.8	-66.4	-77.7	0	0	0	109.2	E102 Q103 I125 W129 S139 Y141	E102-F127 CarbonylContact C-O 3.43Å; E102-F127 VanDerWaalsContact CA-O 3.22Å; E102-F127 WeakPolarHBondContact CA-O 3.18Å; E102-F127 WeakPolarHBondContact CG-O 3.46Å; Q103-F127 PolarHBondContact N-O 2.75Å; Q103-F127 PolarHBondContact O-N 3.17Å; I125-F127 HydrophobicContact CB-CE2 4.28Å; I125-F127 HydrophobicContact CG2-CD2 3.81Å; I125-F127 HydrophobicContact CG2-CE1 4.35Å; I125-F127 HydrophobicContact CG2-CE2 3.12Å; I125-F127 HydrophobicContact CG2-CZ 3.43Å; I125-F127 VanDerWaalsContact CG2-CZ 3.43Å; F127-W129 VanDerWaalsContact O-CE3 3.27Å; F127-W129 WeakPolarHBondContact O-CZ3 3.36Å; F127-S139 WeakPolarHBondContact CD1-OG 3.43Å; F127-Y141 AromaticContact CE1-CZ 3.97Å; F127-Y141 WeakPolarHBondContact CE1-OH 3.22Å; F127-Y141 HydrophobicContact CZ-CE1 4.2Å; F127-Y141 AromaticContact CZ-CZ 3.96Å; F127-Y141 VanDerWaalsContact CZ-OH 3.3Å; F127-Y141 WeakPolarHBondContact CZ-OH 3.11Å
128	A	86.1	Confident	74.6	Confident	2 Å²	2	54 Å²	54	2%	0.017	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	139.5	178	0	0	0	0	0	111.2	Y100 G101 E102 L137 H138	Y100-A128 HydrophobicContact CD2-CB 4.27Å; G101-A128 CarbonylContact O-C 3.54Å; G101-A128 WeakPolarHBondContact O-CA 2.94Å; E102-A128 HydrophobicContact CB-CB 4.44Å; E102-A128 HydrophobicContact CG-CB 4.32Å; A128-L137 HydrophobicContact CB-CB 4.19Å; A128-L137 PolarHBondContact O-N 3Å; A128-H138 VanDerWaalsContact CB-CE1 3.44Å; A128-H138 WeakPolarHBondContact CB-CE1 3.3Å; A128-H138 PolarHBondContact N-O 2.88Å
129	W	85.2	Confident	76.5	Confident	30 Å²	30	52.9 Å²	52.9	11%	0.114	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147.3	178.8	61.6	85.9	0	0	0	112.7	R83 Y100 G101 E102 Q103 F127 E135	R83-W129 HydrophobicContact CG-CH2 4.37Å; Y100-W129 WeakPolarHBondContact CA-O 3.36Å; Y100-W129 WeakPolarHBondContact CB-O 3.49Å; G101-W129 PolarHBondContact N-O 2.82Å; G101-W129 PolarHBondContact O-N 2.9Å; E102-W129 VanDerWaalsContact C-CH2 3.43Å; Q103-W129 HydrophobicContact CB-CH2 4Å; Q103-W129 HydrophobicContact CB-CZ3 3.91Å; F127-W129 VanDerWaalsContact O-CE3 3.27Å; F127-W129 WeakPolarHBondContact O-CZ3 3.36Å; W129-E135 CarbonylContact C-O 3.57Å; W129-E135 WeakPolarHBondContact CA-O 3.35Å
130	G	84.1	Confident	78.6	Confident	10 Å²	10	51.3 Å²	51.3	10%	0.103	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	144.4	174.9	0	0	0	0	0	111.7	K134 E135	G130-K134 WeakPolarHBondContact O-CA 3.41Å; G130-K134 PolarHBondContact O-N 2.94Å; G130-E135 PolarHBondContact N-O 2.94Å
131	I	80.4	Confident	80.5	Confident	48 Å²	48	55.7 Å²	55.7	25%	0.246	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-36.5	-176.9	-72	164.4	0	0	0	112.6	F86 T99 N133	F86-I131 HydrophobicContact CB-CD1 4.28Å; F86-I131 HydrophobicContact CD1-CD1 3.89Å; F86-I131 HydrophobicContact CD1-CG1 3.97Å; F86-I131 HydrophobicContact CD1-CG2 4.05Å; F86-I131 HydrophobicContact CE1-CG2 4.15Å; T99-I131 WeakPolarHBondContact O-CD1 3.39Å; T99-I131 VanDerWaalsContact OG1-CD1 3.24Å; T99-I131 WeakPolarHBondContact OG1-CD1 3.19Å; I131-N133 PolarHBondContact O-N 2.99Å
132	N	75.9	Confident	82.3	Confident	161 Å²	161	54 Å²	54	86%	0.861	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-35.3	-169.2	-66.8	-18.3	0	0	0	113.3
133	N	74.4	Confident	83.5	Confident	87 Å²	87	57.7 Å²	57.7	47%	0.465	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.2	-0.2	-173	54.7	10	0	0	0	113.5	I131 E135	I131-N133 PolarHBondContact O-N 2.99Å; N133-E135 HydrophobicContact CB-CG 4.22Å; N133-E135 VanDerWaalsContact CG-CD 3.44Å; N133-E135 VanDerWaalsContact ND2-CG 3.32Å; N133-E135 WeakPolarHBondContact ND2-CG 3.13Å; N133-E135 PolarHBondContact ND2-OE1 2.88Å; N133-E135 PolarHBondContact ND2-OE2 2.77Å; N133-E135 PolarHBondContact O-N 3.35Å; N133-E135 VanDerWaalsContact O-N 3.16Å; N133-E135 VanDerWaalsContact OD1-CB 3.31Å; N133-E135 WeakPolarHBondContact OD1-CB 3.18Å; N133-E135 PolarHBondContact OD1-N 2.85Å
134	K	73.8	Confident	84.4	Confident	154 Å²	154	54.6 Å²	54.6	67%	0.67	27%	0.272	S	S	*	.			trans	54.5	25.3	-171.6	-57.6	-173.4	178.5	-174.6	0	113.4	G130 S136	G130-K134 WeakPolarHBondContact O-CA 3.41Å; G130-K134 PolarHBondContact O-N 2.94Å; K134-S136 PolarHBondContact O-N 3.04Å
135	E	80	Confident	84.7	Confident	125 Å²	125	55.4 Å²	55.4	58%	0.584	28%	0.277	S	S	*	.			trans	-61.5	136.4	171.1	-80.4	172.6	-170.8	0	0	109.4	W129 G130 N133 L137	W129-E135 CarbonylContact C-O 3.57Å; W129-E135 WeakPolarHBondContact CA-O 3.35Å; G130-E135 PolarHBondContact N-O 2.94Å; N133-E135 HydrophobicContact CB-CG 4.22Å; N133-E135 VanDerWaalsContact CG-CD 3.44Å; N133-E135 VanDerWaalsContact ND2-CG 3.32Å; N133-E135 WeakPolarHBondContact ND2-CG 3.13Å; N133-E135 PolarHBondContact ND2-OE1 2.88Å; N133-E135 PolarHBondContact ND2-OE2 2.77Å; N133-E135 PolarHBondContact O-N 3.35Å; N133-E135 VanDerWaalsContact O-N 3.16Å; N133-E135 VanDerWaalsContact OD1-CB 3.31Å; N133-E135 WeakPolarHBondContact OD1-CB 3.18Å; N133-E135 PolarHBondContact OD1-N 2.85Å; E135-L137 PolarHBondContact O-N 2.85Å
136	S	82.7	Confident	85.1	Confident	77 Å²	77	54 Å²	54	54%	0.538	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	123.1	173.6	-177.7	0	0	0	0	108.8	K134	K134-S136 PolarHBondContact O-N 3.04Å
137	L	84.5	Confident	85.2	Confident	73 Å²	73	60.4 Å²	60.4	38%	0.382	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-53.1	173.8	-66.1	173.1	0	0	0	109.5	F98 Y100 A128 E135	F98-L137 HydrophobicContact CE2-CD1 3.76Å; F98-L137 HydrophobicContact CZ-CD1 4.48Å; Y100-L137 HydrophobicContact CG-CD1 4.16Å; A128-L137 HydrophobicContact CB-CB 4.19Å; A128-L137 PolarHBondContact O-N 3Å; E135-L137 PolarHBondContact O-N 2.85Å
138	H	86.7	Confident	85.2	Confident	42 Å²	42	60 Å²	60	19%	0.194	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	170.4	173.1	63.6	-83	0	0	0	110.2	E102 A128 E140 N160	E102-H138 IonicContact OE1-NE2 3.98Å; A128-H138 VanDerWaalsContact CB-CE1 3.44Å; A128-H138 WeakPolarHBondContact CB-CE1 3.3Å; A128-H138 PolarHBondContact N-O 2.88Å; H138-E140 IonicContact CD2-OE1 3.06Å; H138-E140 IonicContact NE2-OE1 3.99Å; H138-N160 VanDerWaalsContact CA-OD1 3.26Å; H138-N160 WeakPolarHBondContact CA-OD1 3.26Å
139	S	91.2	Very high	85	Confident	9 Å²	9	70.5 Å²	70.5	6%	0.063	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	133.1	170.1	-51.6	0	0	0	0	108.6	A126 F127 M159 N160	A126-S139 CarbonylContact O-C 3.57Å; A126-S139 WeakPolarHBondContact O-CA 3.45Å; F127-S139 WeakPolarHBondContact CD1-OG 3.43Å; S139-M159 VanDerWaalsContact O-CA 3.26Å; S139-M159 WeakPolarHBondContact O-CA 3.34Å; S139-N160 PolarHBondContact N-OD1 3.44Å; S139-N160 PolarHBondContact O-N 3.22Å; S139-N160 PolarHBondContact O-OD1 2.78Å
140	E	93.6	Very high	85.2	Confident	14 Å²	14	71.3 Å²	71.3	7%	0.065	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.2	176.7	-42.1	-172.8	172	0	0	109.4	I125 A126 H138 M159 R199	I125-E140 CarbonylContact C-O 3.58Å; I125-E140 WeakPolarHBondContact CA-O 3.48Å; A126-E140 HydrophobicContact CB-CB 3.92Å; A126-E140 HydrophobicContact CB-CG 4.07Å; A126-E140 PolarHBondContact N-O 3.46Å; A126-E140 PolarHBondContact O-N 2.92Å; H138-E140 IonicContact CD2-OE1 3.06Å; H138-E140 IonicContact NE2-OE1 3.99Å; E140-M159 HydrophobicContact CB-CG 4.39Å; E140-M159 HydrophobicContact CG-CG 4.03Å; E140-R199 IonicContact OE2-NH1 3.24Å; E140-R199 IonicContact OE2-NH2 2.68Å
141	Y	91.9	Very high	85.6	Confident	114 Å²	114	74.5 Å²	74.5	45%	0.447	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.3	172.6	-61.8	-94.4	0	0	0	107.8	L124 I125 F127 T157 V158	L124-Y141 WeakPolarHBondContact O-CA 3.39Å; I125-Y141 HydrophobicContact CB-CD1 4.47Å; I125-Y141 HydrophobicContact CG1-CD1 4.12Å; I125-Y141 HydrophobicContact CG1-CE1 4.42Å; I125-Y141 HydrophobicContact CG2-CD1 3.79Å; I125-Y141 HydrophobicContact CG2-CE1 3.51Å; F127-Y141 AromaticContact CE1-CZ 3.97Å; F127-Y141 WeakPolarHBondContact CE1-OH 3.22Å; F127-Y141 HydrophobicContact CZ-CE1 4.2Å; F127-Y141 AromaticContact CZ-CZ 3.96Å; F127-Y141 VanDerWaalsContact CZ-OH 3.3Å; F127-Y141 WeakPolarHBondContact CZ-OH 3.11Å; Y141-T157 CarbonylContact O-C 3.52Å; Y141-T157 WeakPolarHBondContact O-CA 3.39Å; Y141-V158 PolarHBondContact N-O 2.87Å; Y141-V158 PolarHBondContact O-N 2.91Å
142	G	92	Very high	86.2	Confident	9 Å²	9	75.7 Å²	75.7	9%	0.093	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	-178.9	-172.1	0	0	0	0	0	114.7	Q123 L124 T156	Q123-G142 WeakPolarHBondContact CA-O 3.28Å; L124-G142 PolarHBondContact N-O 3.32Å; L124-G142 PolarHBondContact O-N 2.92Å; G142-T156 CarbonylContact C-O 3.57Å; G142-T156 WeakPolarHBondContact CA-O 3.26Å
143	F	90.1	Very high	87	Confident	78 Å²	78	68.2 Å²	68.2	34%	0.342	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	129.8	176.8	-61.9	-75.2	0	0	0	111.7	Y121 R122 Q123 L155 T156	Y121-F143 VanDerWaalsContact CB-CD1 3.44Å; Y121-F143 HydrophobicContact CD1-CB 3.44Å; Y121-F143 VanDerWaalsContact CD1-CB 3.44Å; Y121-F143 AromaticContact CD1-CD1 3.98Å; Y121-F143 HydrophobicContact CD1-CD1 3.98Å; Y121-F143 AromaticContact CD1-CG 3.8Å; Y121-F143 HydrophobicContact CD1-CG 3.8Å; Y121-F143 HydrophobicContact CD2-CD1 4.36Å; Y121-F143 HydrophobicContact CD2-CE1 4.49Å; Y121-F143 HydrophobicContact CE1-CB 3.99Å; Y121-F143 HydrophobicContact CE1-CG 4.32Å; Y121-F143 HydrophobicContact CG-CB 4.08Å; Y121-F143 AromaticContact CG-CD1 3.7Å; Y121-F143 HydrophobicContact CG-CD1 3.7Å; Y121-F143 HydrophobicContact CG-CE1 4.24Å; Y121-F143 HydrophobicContact CG-CG 4Å; R122-F143 VanDerWaalsContact O-CA 3.24Å; R122-F143 WeakPolarHBondContact O-CA 3.44Å; Q123-F143 HydrophobicContact CG-CD1 3.94Å; Q123-F143 HydrophobicContact CG-CE1 3.46Å; Q123-F143 VanDerWaalsContact CG-CE1 3.46Å; Q123-F143 HydrophobicContact CG-CZ 4.39Å; F143-L155 WeakPolarHBondContact O-CA 3.43Å; F143-T156 PolarHBondContact N-O 2.7Å; F143-T156 PolarHBondContact O-N 3.24Å; F143-T156 PolarHBondContact O-OG1 2.85Å
144	L	89	Confident	87.9	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126.2	169.8	-172.5	65.7	0	0	0	109.3	I75 L78 R122 V153 G154 L155	I75-L144 HydrophobicContact CB-CD2 4.47Å; I75-L144 HydrophobicContact CD1-CB 4.44Å; I75-L144 HydrophobicContact CD1-CD2 3.58Å; I75-L144 HydrophobicContact CD1-CG 3.7Å; I75-L144 HydrophobicContact CG2-CD2 4.45Å; L78-L144 HydrophobicContact CD1-CD2 3.63Å; R122-L144 HydrophobicContact CB-CB 4.28Å; R122-L144 PolarHBondContact N-O 3.02Å; R122-L144 PolarHBondContact O-N 3.04Å; L144-V153 HydrophobicContact CD1-CB 4.22Å; L144-G154 WeakPolarHBondContact CA-O 3.45Å; L144-L155 HydrophobicContact CB-CD1 4.19Å; L144-L155 HydrophobicContact CD1-CB 3.85Å; L144-L155 HydrophobicContact CD1-CD1 4.22Å
145	T	88.3	Confident	88.8	Confident	22 Å²	22	57.6 Å²	57.6	14%	0.135	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.9	-175.1	57.3	0	0	0	0	110.7	L119 Y121 V153 G154	L119-T145 HydrophobicContact CD2-CG2 3.68Å; Y121-T145 HydrophobicContact CD1-CG2 3.26Å; Y121-T145 HydrophobicContact CE1-CG2 3.28Å; Y121-T145 HydrophobicContact CG-CG2 4.49Å; T145-V153 CarbonylContact O-C 3.41Å; T145-V153 WeakPolarHBondContact O-CA 3.42Å; T145-V153 WeakPolarHBondContact O-CB 3.16Å; T145-G154 PolarHBondContact N-O 2.86Å; T145-G154 PolarHBondContact O-N 3.08Å; T145-G154 PolarHBondContact OG1-O 2.83Å
146	V	88.3	Confident	89.4	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.012	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	124.7	175.4	-176	0	0	0	0	108.3	D71 L72 I75 S118 N148 T150 M152 V153	D71-V146 VanDerWaalsContact O-CB 3.29Å; D71-V146 WeakPolarHBondContact O-CB 3.39Å; D71-V146 VanDerWaalsContact O-CG1 3.26Å; D71-V146 WeakPolarHBondContact O-CG1 3.21Å; L72-V146 HydrophobicContact CD2-CG2 3.84Å; I75-V146 HydrophobicContact CD1-CG2 3.54Å; I75-V146 HydrophobicContact CG1-CG2 3.62Å; I75-V146 HydrophobicContact CG2-CG2 4.41Å; S118-V146 CarbonylContact C-O 3.51Å; S118-V146 WeakPolarHBondContact CA-O 3.33Å; S118-V146 WeakPolarHBondContact CB-O 3.09Å; V146-N148 PolarHBondContact O-N 2.99Å; V146-T150 WeakPolarHBondContact CG1-O 3.01Å; V146-M152 WeakPolarHBondContact CA-O 3.23Å; V146-V153 HydrophobicContact CG2-CG1 3.93Å
147	K	87.2	Confident	90	Very high	136 Å²	136	50.8 Å²	50.8	59%	0.591	24%	0.244	S	C	*	.			trans	-64.1	126.7	174.3	174.5	-178.1	-175.9	177.3	0	109.1	R149 T150 M152	K147-R149 PolarHBondContact O-N 2.92Å; K147-T150 VanDerWaalsContact CB-OG1 3.29Å; K147-T150 WeakPolarHBondContact CB-OG1 3.33Å; K147-T150 HydrophobicContact CD-CG2 4.24Å; K147-T150 HydrophobicContact CG-CG2 4.17Å; K147-T150 PolarHBondContact O-N 2.92Å; K147-T150 PolarHBondContact O-OG1 3.17Å; K147-M152 HydrophobicContact CB-CB 4.07Å; K147-M152 HydrophobicContact CD-CB 4.22Å; K147-M152 PolarHBondContact N-O 2.94Å
148	N	83.5	Confident	90.4	Very high	64 Å²	64	51.6 Å²	51.6	34%	0.342	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.9	127.8	-173.2	-176.1	-5.9	0	0	0	112.3	D71 V146 T150	D71-N148 PolarHBondContact OD1-OD1 2.86Å; V146-N148 PolarHBondContact O-N 2.99Å; N148-T150 WeakPolarHBondContact O-CG2 3.29Å; N148-T150 PolarHBondContact O-N 2.8Å; N148-T150 VanDerWaalsContact O-N 3.16Å
149	R	82.4	Confident	90.7	Very high	223 Å²	223	50.7 Å²	50.7	84%	0.842	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	28.6	178.1	-72	174.5	-68	174.9	1.3	114.6	K147	K147-R149 PolarHBondContact O-N 2.92Å
150	T	89.6	Confident	90.6	Very high	47 Å²	47	54.7 Å²	54.7	29%	0.288	27%	0.269	S	S	.	.	S	Bend	trans	-132.6	173.1	173.2	74.2	0	0	0	0	110.8	V146 K147 N148 M152	V146-T150 WeakPolarHBondContact CG1-O 3.01Å; K147-T150 VanDerWaalsContact CB-OG1 3.29Å; K147-T150 WeakPolarHBondContact CB-OG1 3.33Å; K147-T150 HydrophobicContact CD-CG2 4.24Å; K147-T150 HydrophobicContact CG-CG2 4.17Å; K147-T150 PolarHBondContact O-N 2.92Å; K147-T150 PolarHBondContact O-OG1 3.17Å; N148-T150 WeakPolarHBondContact O-CG2 3.29Å; N148-T150 PolarHBondContact O-N 2.8Å; N148-T150 VanDerWaalsContact O-N 3.16Å; T150-M152 VanDerWaalsContact C-N 3.35Å; T150-M152 PolarHBondContact OG1-N 2.82Å
151	N	91.6	Very high	90.3	Very high	77 Å²	77	57 Å²	57	41%	0.412	28%	0.282	S	S	.	.	S	Bend	trans	-94.6	6.9	169.5	-66.3	-24.6	0	0	0	112.7	E170 V171	N151-E170 HydrophobicContact CB-CG 3.86Å; N151-E170 WeakPolarHBondContact O-CA 3.43Å; N151-V171 HydrophobicContact CB-CB 4.42Å; N151-V171 WeakPolarHBondContact CB-O 3.38Å; N151-V171 PolarHBondContact O-N 3.19Å
152	M	93.7	Very high	90.2	Very high	73 Å²	73	52.5 Å²	52.5	36%	0.36	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	131.5	179.2	-64	-61.2	-61.2	0	0	110	V146 K147 T150 G169 E170	V146-M152 WeakPolarHBondContact CA-O 3.23Å; K147-M152 HydrophobicContact CB-CB 4.07Å; K147-M152 HydrophobicContact CD-CB 4.22Å; K147-M152 PolarHBondContact N-O 2.94Å; T150-M152 VanDerWaalsContact C-N 3.35Å; T150-M152 PolarHBondContact OG1-N 2.82Å; M152-G169 CarbonylContact C-O 3.52Å; M152-G169 VanDerWaalsContact CA-O 3.29Å; M152-G169 WeakPolarHBondContact CA-O 3.39Å; M152-G169 WeakPolarHBondContact CE-O 3.33Å; M152-E170 HydrophobicContact SD-CB 4.05Å; M152-E170 HydrophobicContact SD-CG 4.34Å
153	V	92.3	Very high	90.2	Very high	5 Å²	5	53.1 Å²	53.1	3%	0.03	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	145.9	-179.2	-73.2	0	0	0	0	111.4	I75 L144 T145 V146 E168 G169 V171 I176 L178	I75-V153 HydrophobicContact CG2-CG1 3.89Å; L144-V153 HydrophobicContact CD1-CB 4.22Å; T145-V153 CarbonylContact O-C 3.41Å; T145-V153 WeakPolarHBondContact O-CA 3.42Å; T145-V153 WeakPolarHBondContact O-CB 3.16Å; V146-V153 HydrophobicContact CG2-CG1 3.93Å; V153-E168 WeakPolarHBondContact O-CA 3.2Å; V153-G169 PolarHBondContact N-O 3.48Å; V153-G169 PolarHBondContact O-N 2.85Å; V153-V171 HydrophobicContact CB-CG2 4.46Å; V153-V171 HydrophobicContact CG1-CG2 3.48Å; V153-V171 VanDerWaalsContact CG1-CG2 3.48Å; V153-V171 HydrophobicContact CG2-CG2 4.11Å; V153-I176 HydrophobicContact CG2-CG2 3.67Å; V153-L178 HydrophobicContact CB-CD2 4.5Å; V153-L178 HydrophobicContact CG2-CD2 3.68Å
154	G	92.9	Very high	90.5	Very high	13 Å²	13	52.1 Å²	52.1	13%	0.134	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.7	171.8	0	0	0	0	0	110.1	L144 T145 E167	L144-G154 WeakPolarHBondContact CA-O 3.45Å; T145-G154 PolarHBondContact N-O 2.86Å; T145-G154 PolarHBondContact O-N 3.08Å; T145-G154 PolarHBondContact OG1-O 2.83Å; G154-E167 CarbonylContact C-O 3.53Å; G154-E167 WeakPolarHBondContact CA-O 3.49Å
155	L	93.3	Very high	90.8	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.3	173.9	178.2	62.6	0	0	0	109	L124 F143 L144 T157 E167 L178	L124-L155 HydrophobicContact CD2-CD1 4.03Å; F143-L155 WeakPolarHBondContact O-CA 3.43Å; L144-L155 HydrophobicContact CB-CD1 4.19Å; L144-L155 HydrophobicContact CD1-CB 3.85Å; L144-L155 HydrophobicContact CD1-CD1 4.22Å; L155-T157 HydrophobicContact CD1-CG2 3.91Å; L155-T157 HydrophobicContact CD2-CG2 4.05Å; L155-T157 HydrophobicContact CG-CG2 3.76Å; L155-E167 HydrophobicContact CB-CB 4.3Å; L155-E167 PolarHBondContact N-O 2.82Å; L155-E167 PolarHBondContact O-N 2.79Å; L155-L178 HydrophobicContact CB-CD1 3.87Å; L155-L178 HydrophobicContact CB-CD2 4.27Å; L155-L178 HydrophobicContact CD2-CD1 3.76Å; L155-L178 HydrophobicContact CG-CD1 4.46Å
156	T	93.4	Very high	91.2	Very high	60 Å²	60	53.4 Å²	53.4	37%	0.368	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127	172.4	53	0	0	0	0	108.6	G142 F143 T165 V166	G142-T156 CarbonylContact C-O 3.57Å; G142-T156 WeakPolarHBondContact CA-O 3.26Å; F143-T156 PolarHBondContact N-O 2.7Å; F143-T156 PolarHBondContact O-N 3.24Å; F143-T156 PolarHBondContact O-OG1 2.85Å; T156-T165 WeakPolarHBondContact CA-O 2.98Å; T156-V166 HydrophobicContact CG2-CG1 4.46Å; T156-V166 HydrophobicContact CG2-CG2 4.39Å
157	T	94.2	Very high	91.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	149.8	179.7	76.1	0	0	0	0	112.1	Y141 L155 M159 T164 T165	Y141-T157 CarbonylContact O-C 3.52Å; Y141-T157 WeakPolarHBondContact O-CA 3.39Å; L155-T157 HydrophobicContact CD1-CG2 3.91Å; L155-T157 HydrophobicContact CD2-CG2 4.05Å; L155-T157 HydrophobicContact CG-CG2 3.76Å; T157-M159 WeakPolarHBondContact OG1-CE 3.34Å; T157-T164 CarbonylContact O-C 3.59Å; T157-T164 WeakPolarHBondContact O-CA 3.44Å; T157-T164 WeakPolarHBondContact O-CB 3.38Å; T157-T164 PolarHBondContact O-OG1 3.37Å; T157-T165 PolarHBondContact N-O 2.79Å; T157-T165 PolarHBondContact O-N 2.96Å; T157-T165 PolarHBondContact OG1-OG1 3.06Å
158	V	93.7	Very high	92.1	Very high	90 Å²	90	51.9 Å²	51.9	55%	0.545	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128.8	168.9	-179.7	0	0	0	0	107.3	Y141	Y141-V158 PolarHBondContact N-O 2.87Å; Y141-V158 PolarHBondContact O-N 2.91Å
159	M	91.9	Very high	92.8	Very high	23 Å²	23	49.2 Å²	49.2	11%	0.113	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145	-173.8	-53.5	176.9	-153.5	0	0	110.7	S139 E140 T157 N161 G162 F163 T165	S139-M159 VanDerWaalsContact O-CA 3.26Å; S139-M159 WeakPolarHBondContact O-CA 3.34Å; E140-M159 HydrophobicContact CB-CG 4.39Å; E140-M159 HydrophobicContact CG-CG 4.03Å; T157-M159 WeakPolarHBondContact OG1-CE 3.34Å; M159-N161 WeakPolarHBondContact CB-OD1 3.43Å; M159-N161 PolarHBondContact O-N 2.89Å; M159-G162 PolarHBondContact O-N 2.82Å; M159-G162 VanDerWaalsContact O-N 3.07Å; M159-F163 HydrophobicContact CB-CB 4.36Å; M159-F163 HydrophobicContact CE-CB 4.36Å; M159-F163 HydrophobicContact CG-CB 4.44Å; M159-F163 PolarHBondContact N-O 2.89Å; M159-F163 HydrophobicContact SD-CB 3.86Å; M159-T165 HydrophobicContact CE-CG2 3.55Å
160	N	89.5	Confident	93.4	Very high	93 Å²	93	43.2 Å²	43.2	50%	0.497	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-13.3	179.9	70.9	-29	0	0	0	114.2	H138 S139 G162	H138-N160 VanDerWaalsContact CA-OD1 3.26Å; H138-N160 WeakPolarHBondContact CA-OD1 3.26Å; S139-N160 PolarHBondContact N-OD1 3.44Å; S139-N160 PolarHBondContact O-N 3.22Å; S139-N160 PolarHBondContact O-OD1 2.78Å; N160-G162 VanDerWaalsContact C-N 3.26Å
161	N	88	Confident	93.7	Very high	62 Å²	62	41.2 Å²	41.2	33%	0.332	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	5.1	172.6	65	-6	0	0	0	113.1	M159 F163	M159-N161 WeakPolarHBondContact CB-OD1 3.43Å; M159-N161 PolarHBondContact O-N 2.89Å; N161-F163 HydrophobicContact CB-CD2 4.48Å; N161-F163 WeakPolarHBondContact OD1-CD2 3.06Å; N161-F163 PolarHBondContact OD1-N 2.81Å
162	G	89.7	Confident	93.8	Very high	19 Å²	19	42.2 Å²	42.2	20%	0.196	24%	0.239	C	C	.	.	S	Bend	trans	89.2	14.9	173.7	0	0	0	0	0	115.1	M159 N160 R185 I186	M159-G162 PolarHBondContact O-N 2.82Å; M159-G162 VanDerWaalsContact O-N 3.07Å; N160-G162 VanDerWaalsContact C-N 3.26Å; G162-R185 WeakPolarHBondContact O-CA 3.4Å; G162-I186 PolarHBondContact O-N 2.79Å
163	F	92.4	Very high	93.7	Very high	23 Å²	23	41.6 Å²	41.6	10%	0.101	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	149.7	170.2	-71.1	-95.9	0	0	0	111.4	M159 N161 V183 G184 R185 D191	M159-F163 HydrophobicContact CB-CB 4.36Å; M159-F163 HydrophobicContact CE-CB 4.36Å; M159-F163 HydrophobicContact CG-CB 4.44Å; M159-F163 PolarHBondContact N-O 2.89Å; M159-F163 HydrophobicContact SD-CB 3.86Å; N161-F163 HydrophobicContact CB-CD2 4.48Å; N161-F163 WeakPolarHBondContact OD1-CD2 3.06Å; N161-F163 PolarHBondContact OD1-N 2.81Å; F163-V183 HydrophobicContact CD1-CG2 4.1Å; F163-G184 CarbonylContact C-O 3.54Å; F163-G184 WeakPolarHBondContact CA-O 3.42Å; F163-R185 HydrophobicContact CD1-CB 4.28Å; F163-R185 HydrophobicContact CE1-CB 4.28Å; F163-D191 HydrophobicContact CE2-CB 4.35Å; F163-D191 WeakPolarHBondContact CE2-OD2 3.45Å; F163-D191 HydrophobicContact CZ-CB 3.92Å
164	T	94.8	Very high	93.8	Very high	57 Å²	57	45.6 Å²	45.6	35%	0.35	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	138.4	165.2	-178.3	0	0	0	0	108.8	T157 V183 G184	T157-T164 CarbonylContact O-C 3.59Å; T157-T164 WeakPolarHBondContact O-CA 3.44Å; T157-T164 WeakPolarHBondContact O-CB 3.38Å; T157-T164 PolarHBondContact O-OG1 3.37Å; T164-V183 CarbonylContact O-C 3.5Å; T164-V183 WeakPolarHBondContact O-CA 3.35Å; T164-G184 PolarHBondContact N-O 2.87Å; T164-G184 PolarHBondContact O-N 2.72Å
165	T	95.9	Very high	94	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	147.2	-177.3	65.7	0	0	0	0	111.2	T156 T157 M159 E167 L180 D182 V183 M197	T156-T165 WeakPolarHBondContact CA-O 2.98Å; T157-T165 PolarHBondContact N-O 2.79Å; T157-T165 PolarHBondContact O-N 2.96Å; T157-T165 PolarHBondContact OG1-OG1 3.06Å; M159-T165 HydrophobicContact CE-CG2 3.55Å; T165-E167 PolarHBondContact OG1-OE1 2.83Å; T165-L180 HydrophobicContact CG2-CD1 4.06Å; T165-D182 WeakPolarHBondContact CA-O 3.46Å; T165-V183 HydrophobicContact CG2-CG2 4.13Å; T165-M197 HydrophobicContact CG2-CE 3.7Å
166	V	97	Very high	94.1	Very high	49 Å²	49	48.2 Å²	48.2	30%	0.297	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.6	164.6	-176.1	0	0	0	0	106.6	T156 V181 D182	T156-V166 HydrophobicContact CG2-CG1 4.46Å; T156-V166 HydrophobicContact CG2-CG2 4.39Å; V166-V181 HydrophobicContact CG1-CB 4.47Å; V166-V181 PolarHBondContact O-N 2.8Å; V166-D182 HydrophobicContact CB-CB 4.25Å; V166-D182 HydrophobicContact CG2-CB 4.41Å; V166-D182 PolarHBondContact N-O 3.17Å; V166-D182 PolarHBondContact O-N 3.45Å
167	E	97.5	Very high	94.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.8	177.9	-50.4	169.8	-145.1	0	0	109.3	G154 L155 T165 L178 K179 L180 R199	G154-E167 CarbonylContact C-O 3.53Å; G154-E167 WeakPolarHBondContact CA-O 3.49Å; L155-E167 HydrophobicContact CB-CB 4.3Å; L155-E167 PolarHBondContact N-O 2.82Å; L155-E167 PolarHBondContact O-N 2.79Å; T165-E167 PolarHBondContact OG1-OE1 2.83Å; E167-L178 HydrophobicContact CB-CB 3.97Å; E167-L178 HydrophobicContact CB-CD2 4.44Å; E167-K179 CarbonylContact C-O 3.52Å; E167-K179 WeakPolarHBondContact CA-O 3.09Å; E167-L180 HydrophobicContact CG-CD1 4.18Å; E167-R199 IonicContact OE1-CZ 3.08Å; E167-R199 IonicContact OE1-NE 2.7Å; E167-R199 PolarHBondContact OE1-NE 3.45Å; E167-R199 IonicContact OE1-NH2 3.11Å; E167-R199 PolarHBondContact OE1-NH2 3.21Å; E167-R199 WeakPolarHBondContact OE2-CB 3.38Å; E167-R199 IonicContact OE2-CZ 2.72Å; E167-R199 IonicContact OE2-NE 2.75Å; E167-R199 PolarHBondContact OE2-NE 3.09Å; E167-R199 IonicContact OE2-NH2 3.87Å
168	E	97.1	Very high	94.6	Very high	105 Å²	105	47.5 Å²	47.5	49%	0.491	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	147.9	177.9	-67.6	-173.1	176.6	0	0	111.2	V153 K179 V181	V153-E168 WeakPolarHBondContact O-CA 3.2Å; E168-K179 PolarHBondContact N-O 3.12Å; E168-K179 PolarHBondContact O-N 3.02Å; E168-V181 HydrophobicContact CB-CG2 3.74Å; E168-V181 HydrophobicContact CG-CG2 3.73Å
169	G	97.2	Very high	94.8	Very high	8 Å²	8	49 Å²	49	8%	0.082	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	-173	-170.1	0	0	0	0	0	114.8	M152 V153 V177	M152-G169 CarbonylContact C-O 3.52Å; M152-G169 VanDerWaalsContact CA-O 3.29Å; M152-G169 WeakPolarHBondContact CA-O 3.39Å; M152-G169 WeakPolarHBondContact CE-O 3.33Å; V153-G169 PolarHBondContact N-O 3.48Å; V153-G169 PolarHBondContact O-N 2.85Å; G169-V177 WeakPolarHBondContact CA-O 3.36Å
170	E	96.3	Very high	95.1	Very high	98 Å²	98	48.9 Å²	48.9	46%	0.458	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146.2	177.9	-171.2	174.3	-165.9	0	0	111.3	N151 M152 V177	N151-E170 HydrophobicContact CB-CG 3.86Å; N151-E170 WeakPolarHBondContact O-CA 3.43Å; M152-E170 HydrophobicContact SD-CB 4.05Å; M152-E170 HydrophobicContact SD-CG 4.34Å; E170-V177 PolarHBondContact N-O 3.07Å; E170-V177 PolarHBondContact O-N 2.86Å; E170-V177 VanDerWaalsContact O-N 3.17Å
171	V	94.6	Very high	95.5	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.024	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.3	170.9	-173	0	0	0	0	109.7	P74 I75 F77 N151 V153 K175 I176	P74-V171 HydrophobicContact CB-CB 4.38Å; P74-V171 HydrophobicContact CB-CG1 4.26Å; I75-V171 HydrophobicContact CG2-CG2 3.54Å; F77-V171 HydrophobicContact CE1-CG1 4.45Å; N151-V171 HydrophobicContact CB-CB 4.42Å; N151-V171 WeakPolarHBondContact CB-O 3.38Å; N151-V171 PolarHBondContact O-N 3.19Å; V153-V171 HydrophobicContact CB-CG2 4.46Å; V153-V171 HydrophobicContact CG1-CG2 3.48Å; V153-V171 VanDerWaalsContact CG1-CG2 3.48Å; V153-V171 HydrophobicContact CG2-CG2 4.11Å; V171-K175 CarbonylContact C-O 3.6Å; V171-K175 WeakPolarHBondContact CA-O 3.3Å; V171-I176 HydrophobicContact CG1-CG1 4.29Å; V171-I176 HydrophobicContact CG2-CD1 4.23Å; V171-I176 HydrophobicContact CG2-CG1 4.05Å; V171-I176 HydrophobicContact CG2-CG2 4.31Å
172	T	95	Very high	95.8	Very high	98 Å²	98	50.7 Å²	50.7	60%	0.601	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	103	174.7	-57	0	0	0	0	109.3	N174 K175	T172-N174 PolarHBondContact O-N 2.98Å; T172-N174 VanDerWaalsContact O-N 3.12Å; T172-K175 PolarHBondContact N-O 2.89Å; T172-K175 PolarHBondContact O-N 3.48Å; T172-K175 VanDerWaalsContact O-N 3.09Å
173	G	92	Very high	96.1	Very high	60 Å²	60	51.8 Å²	51.8	62%	0.619	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	-113.5	-175	0	0	0	0	0	111.2
174	N	93.2	Very high	96.1	Very high	90 Å²	90	52 Å²	52	48%	0.481	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	9.4	-177.9	-72.7	-0.2	0	0	0	113.3	T172 L203	T172-N174 PolarHBondContact O-N 2.98Å; T172-N174 VanDerWaalsContact O-N 3.12Å; N174-L203 HydrophobicContact CB-CB 4.1Å; N174-L203 PolarHBondContact O-N 2.81Å
175	K	97	Very high	96	Very high	71 Å²	71	55.3 Å²	55.3	31%	0.309	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.9	-177.2	-176.1	173.3	-178.5	-177.2	0	110.7	V171 T172 V177 E200 I201 T202	V171-K175 CarbonylContact C-O 3.6Å; V171-K175 WeakPolarHBondContact CA-O 3.3Å; T172-K175 PolarHBondContact N-O 2.89Å; T172-K175 PolarHBondContact O-N 3.48Å; T172-K175 VanDerWaalsContact O-N 3.09Å; K175-V177 HydrophobicContact CD-CG2 4.26Å; K175-V177 HydrophobicContact CG-CG2 4.24Å; K175-E200 VanDerWaalsContact CE-CD 3.5Å; K175-E200 WeakPolarHBondContact CE-OE1 3.27Å; K175-E200 WeakPolarHBondContact CE-OE2 3.48Å; K175-E200 IonicContact NZ-OE1 2.98Å; K175-E200 PolarHBondContact NZ-OE1 2.88Å; K175-E200 IonicContact NZ-OE2 3.62Å; K175-E200 PolarHBondContact NZ-OE2 2.81Å; K175-I201 CarbonylContact C-O 3.58Å; K175-I201 WeakPolarHBondContact CA-O 3.43Å; K175-T202 HydrophobicContact CB-CG2 4.42Å
176	I	96.7	Very high	95.7	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.1	171.1	-46.3	-173.5	0	0	0	107.7	I75 F77 L78 V153 V171 L178 E200 I201	I75-I176 HydrophobicContact CG2-CD1 3.7Å; F77-I176 HydrophobicContact CZ-CD1 4.01Å; F77-I176 HydrophobicContact CZ-CG1 4Å; L78-I176 HydrophobicContact CD1-CD1 3.69Å; L78-I176 HydrophobicContact CG-CD1 4.48Å; V153-I176 HydrophobicContact CG2-CG2 3.67Å; V171-I176 HydrophobicContact CG1-CG1 4.29Å; V171-I176 HydrophobicContact CG2-CD1 4.23Å; V171-I176 HydrophobicContact CG2-CG1 4.05Å; V171-I176 HydrophobicContact CG2-CG2 4.31Å; I176-L178 HydrophobicContact CG2-CD1 4.42Å; I176-L178 HydrophobicContact CG2-CD2 4.46Å; I176-L178 HydrophobicContact CG2-CG 4.02Å; I176-E200 CarbonylContact O-C 3.59Å; I176-E200 WeakPolarHBondContact O-CA 3.15Å; I176-I201 HydrophobicContact CB-CB 4.34Å; I176-I201 PolarHBondContact N-O 2.49Å; I176-I201 PolarHBondContact O-N 2.8Å
177	V	98.1	Very high	95.3	Very high	44 Å²	44	60.8 Å²	60.8	27%	0.267	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	113.2	171.6	-177.9	0	0	0	0	108.3	G169 E170 K175 I198 R199 E200	G169-V177 WeakPolarHBondContact CA-O 3.36Å; E170-V177 PolarHBondContact N-O 3.07Å; E170-V177 PolarHBondContact O-N 2.86Å; E170-V177 VanDerWaalsContact O-N 3.17Å; K175-V177 HydrophobicContact CD-CG2 4.26Å; K175-V177 HydrophobicContact CG-CG2 4.24Å; V177-I198 HydrophobicContact CG1-CG2 3.99Å; V177-R199 WeakPolarHBondContact CA-O 3.2Å; V177-E200 HydrophobicContact CG1-CG 4.46Å; V177-E200 HydrophobicContact CG2-CG 4.24Å
178	L	98	Very high	94.9	Very high	1 Å²	1	70 Å²	70	1%	0.005	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	141.1	178.1	-67.5	161.9	0	0	0	109.3	V153 L155 E167 I176 I198 R199	V153-L178 HydrophobicContact CB-CD2 4.5Å; V153-L178 HydrophobicContact CG2-CD2 3.68Å; L155-L178 HydrophobicContact CB-CD1 3.87Å; L155-L178 HydrophobicContact CB-CD2 4.27Å; L155-L178 HydrophobicContact CD2-CD1 3.76Å; L155-L178 HydrophobicContact CG-CD1 4.46Å; E167-L178 HydrophobicContact CB-CB 3.97Å; E167-L178 HydrophobicContact CB-CD2 4.44Å; I176-L178 HydrophobicContact CG2-CD1 4.42Å; I176-L178 HydrophobicContact CG2-CD2 4.46Å; I176-L178 HydrophobicContact CG2-CG 4.02Å; L178-I198 CarbonylContact O-C 3.59Å; L178-I198 WeakPolarHBondContact O-CA 3.32Å; L178-R199 HydrophobicContact CB-CB 4.23Å; L178-R199 PolarHBondContact N-O 2.84Å; L178-R199 PolarHBondContact O-N 3.41Å
179	K	98.3	Very high	94.2	Very high	121 Å²	121	66 Å²	66	53%	0.526	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	143	174.3	-63.7	-173.1	177.6	-177.7	0	109.6	E167 E168 V181 M197 I198	E167-K179 CarbonylContact C-O 3.52Å; E167-K179 WeakPolarHBondContact CA-O 3.09Å; E168-K179 PolarHBondContact N-O 3.12Å; E168-K179 PolarHBondContact O-N 3.02Å; K179-V181 PolarHBondContact O-N 3.36Å; K179-M197 WeakPolarHBondContact CA-O 3.31Å; K179-I198 HydrophobicContact CG-CG1 4.41Å
180	L	98.1	Very high	93.2	Very high	22 Å²	22	77.1 Å²	77.1	12%	0.115	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	128	175.6	-168.3	64.4	0	0	0	110	T165 E167 D182 V183 V194 M197	T165-L180 HydrophobicContact CG2-CD1 4.06Å; E167-L180 HydrophobicContact CG-CD1 4.18Å; L180-D182 VanDerWaalsContact CD1-O 3.31Å; L180-D182 WeakPolarHBondContact CD1-O 3.17Å; L180-V183 HydrophobicContact CD1-CB 4.27Å; L180-V183 HydrophobicContact CD2-CB 4.08Å; L180-V183 HydrophobicContact CD2-CG1 4.03Å; L180-V194 HydrophobicContact CD2-CG1 4.37Å; L180-M197 HydrophobicContact CB-CB 4.13Å; L180-M197 HydrophobicContact CD1-CE 3.75Å; L180-M197 HydrophobicContact CD2-CB 4.46Å; L180-M197 HydrophobicContact CD2-CE 4.22Å; L180-M197 HydrophobicContact CD2-CG 4.24Å; L180-M197 HydrophobicContact CG-CE 4.47Å; L180-M197 PolarHBondContact N-O 2.89Å
181	V	97.6	Very high	92.3	Very high	88 Å²	88	76.7 Å²	76.7	53%	0.533	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-42	173.2	175.9	0	0	0	0	110	V166 E168 K179	V166-V181 HydrophobicContact CG1-CB 4.47Å; V166-V181 PolarHBondContact O-N 2.8Å; E168-V181 HydrophobicContact CB-CG2 3.74Å; E168-V181 HydrophobicContact CG-CG2 3.73Å; K179-V181 PolarHBondContact O-N 3.36Å
182	D	96.1	Very high	91.5	Very high	105 Å²	105	80.7 Å²	80.7	56%	0.561	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149	149.7	178.1	-165.1	18.1	0	0	0	111.5	T165 V166 L180	T165-D182 WeakPolarHBondContact CA-O 3.46Å; V166-D182 HydrophobicContact CB-CB 4.25Å; V166-D182 HydrophobicContact CG2-CB 4.41Å; V166-D182 PolarHBondContact N-O 3.17Å; V166-D182 PolarHBondContact O-N 3.45Å; L180-D182 VanDerWaalsContact CD1-O 3.31Å; L180-D182 WeakPolarHBondContact CD1-O 3.17Å
183	V	94.8	Very high	91	Very high	42 Å²	42	78.2 Å²	78.2	26%	0.255	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	118.1	177	59.1	0	0	0	0	110.8	F163 T164 T165 L180	F163-V183 HydrophobicContact CD1-CG2 4.1Å; T164-V183 CarbonylContact O-C 3.5Å; T164-V183 WeakPolarHBondContact O-CA 3.35Å; T165-V183 HydrophobicContact CG2-CG2 4.13Å; L180-V183 HydrophobicContact CD1-CB 4.27Å; L180-V183 HydrophobicContact CD2-CB 4.08Å; L180-V183 HydrophobicContact CD2-CG1 4.03Å
184	G	93.4	Very high	90.9	Very high	26 Å²	26	76.7 Å²	76.7	27%	0.268	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	145.5	169.8	0	0	0	0	0	111.1	F163 T164	F163-G184 CarbonylContact C-O 3.54Å; F163-G184 WeakPolarHBondContact CA-O 3.42Å; T164-G184 PolarHBondContact N-O 2.87Å; T164-G184 PolarHBondContact O-N 2.72Å
185	R	91.1	Very high	90.9	Very high	128 Å²	128	76.9 Å²	76.9	48%	0.483	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	145.6	174	70.1	-179.8	-167.2	148.6	5.2	111.6	G162 F163 D191	G162-R185 WeakPolarHBondContact O-CA 3.4Å; F163-R185 HydrophobicContact CD1-CB 4.28Å; F163-R185 HydrophobicContact CE1-CB 4.28Å; R185-D191 PolarHBondContact NH1-O 3.1Å
186	I	91.4	Very high	90.8	Very high	61 Å²	61	76.1 Å²	76.1	31%	0.313	38%	0.383	S	S	.	.			trans	-64.1	138	168.8	61.5	178.5	0	0	0	110.4	G162 W188 S189	G162-I186 PolarHBondContact O-N 2.79Å; I186-W188 HydrophobicContact CB-CZ2 4.31Å; I186-W188 HydrophobicContact CD1-CZ2 4.37Å; I186-W188 PolarHBondContact O-N 3.25Å; I186-S189 PolarHBondContact O-N 2.87Å; I186-S189 VanDerWaalsContact O-N 3.11Å
187	S	88.6	Confident	90.9	Very high	104 Å²	104	76.9 Å²	76.9	73%	0.727	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-20.1	-169.8	55.5	0	0	0	0	114.6
188	W	88.7	Confident	90.9	Very high	193 Å²	193	76.3 Å²	76.3	73%	0.731	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	7.5	177	60.6	86	0	0	0	113.9	I186	I186-W188 HydrophobicContact CB-CZ2 4.31Å; I186-W188 HydrophobicContact CD1-CZ2 4.37Å; I186-W188 PolarHBondContact O-N 3.25Å
189	S	81.6	Confident	90.9	Very high	21 Å²	21	76.6 Å²	76.6	15%	0.147	38%	0.382	C	S	.	.			trans	-67.5	134.9	166.4	178.6	0	0	0	0	109.6	I186 D191	I186-S189 PolarHBondContact O-N 2.87Å; I186-S189 VanDerWaalsContact O-N 3.11Å; S189-D191 PolarHBondContact OG-N 2.87Å; S189-D191 PolarHBondContact OG-OD2 2.95Å
190	R	77	Confident	90.8	Very high	243 Å²	243	72.9 Å²	72.9	92%	0.917	37%	0.367	S	S	*	.			trans	-91.9	-1.8	-177.8	-65.2	-174.8	178.6	-179.4	-0.1	113.3
191	D	77.2	Confident	90.8	Very high	88 Å²	88	72 Å²	72	47%	0.471	36%	0.362	S	S	.	.	S	Bend	trans	-68.6	147.6	-176.9	-64.6	-30.7	0	0	0	111.5	F163 R185 S189	F163-D191 HydrophobicContact CE2-CB 4.35Å; F163-D191 WeakPolarHBondContact CE2-OD2 3.45Å; F163-D191 HydrophobicContact CZ-CB 3.92Å; R185-D191 PolarHBondContact NH1-O 3.1Å; S189-D191 PolarHBondContact OG-N 2.87Å; S189-D191 PolarHBondContact OG-OD2 2.95Å
192	L	77.6	Confident	90.8	Very high	89 Å²	89	69.2 Å²	69.2	47%	0.466	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-60.6	144.2	175.8	-70	176.3	0	0	0	110.1	V194	L192-V194 PolarHBondContact O-N 2.7Å; L192-V194 VanDerWaalsContact O-N 3.16Å
193	P	83.9	Confident	90.8	Very high	46 Å²	46	65.2 Å²	65.2	30%	0.299	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-60	121.7	177.1	-20.4	31.8	0	0	0	111.1	L218	P193-L218 PolarHBondContact O-N 2.97Å
194	V	90.7	Very high	90.8	Very high	27 Å²	27	67.3 Å²	67.3	16%	0.164	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	128	162.8	179.2	0	0	0	0	107.2	L180 L192 M197 M215	L180-V194 HydrophobicContact CD2-CG1 4.37Å; L192-V194 PolarHBondContact O-N 2.7Å; L192-V194 VanDerWaalsContact O-N 3.16Å; V194-M197 HydrophobicContact CG1-CG 3.65Å; V194-M197 HydrophobicContact CG1-SD 4.09Å; V194-M215 HydrophobicContact CG1-CG 4.01Å; V194-M215 HydrophobicContact CG1-SD 4.38Å; V194-M215 HydrophobicContact CG2-CG 4.46Å; V194-M215 HydrophobicContact CG2-SD 3.83Å
195	L	92.7	Very high	90.8	Very high	94 Å²	94	69.6 Å²	69.6	49%	0.492	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-42.3	179	-65.3	-176.1	0	0	0	111.6	E216	L195-E216 HydrophobicContact CB-CG 4.31Å; L195-E216 PolarHBondContact N-O 2.86Å
196	D	96	Very high	90.6	Very high	56 Å²	56	69.5 Å²	69.5	30%	0.299	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	155.7	-177.2	-160	-9.3	0	0	0	110.2	E216 M222	D196-E216 HydrophobicContact CB-CB 4.16Å; D196-E216 PolarHBondContact N-O 2.91Å; D196-E216 PolarHBondContact O-N 3.01Å; D196-M222 HydrophobicContact CB-CE 3.65Å
197	M	97.3	Very high	90.5	Very high	15 Å²	15	70.6 Å²	70.6	7%	0.074	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	146.2	174	-61.7	-172.1	-59.4	0	0	111.1	T165 K179 L180 V194 L213 Q214 M215	T165-M197 HydrophobicContact CG2-CE 3.7Å; K179-M197 WeakPolarHBondContact CA-O 3.31Å; L180-M197 HydrophobicContact CB-CB 4.13Å; L180-M197 HydrophobicContact CD1-CE 3.75Å; L180-M197 HydrophobicContact CD2-CB 4.46Å; L180-M197 HydrophobicContact CD2-CE 4.22Å; L180-M197 HydrophobicContact CD2-CG 4.24Å; L180-M197 HydrophobicContact CG-CE 4.47Å; L180-M197 PolarHBondContact N-O 2.89Å; V194-M197 HydrophobicContact CG1-CG 3.65Å; V194-M197 HydrophobicContact CG1-SD 4.09Å; M197-L213 HydrophobicContact CB-CD1 4.22Å; M197-L213 HydrophobicContact SD-CD1 4.38Å; M197-L213 HydrophobicContact SD-CD2 4.45Å; M197-Q214 VanDerWaalsContact CA-O 3.24Å; M197-Q214 WeakPolarHBondContact CA-O 3.31Å; M197-M215 HydrophobicContact CG-CG 4.25Å
198	I	98.3	Very high	90.7	Very high	32 Å²	32	67.1 Å²	67.1	16%	0.164	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.5	170.4	-56.3	176.6	0	0	0	108.1	V177 L178 K179 E200 L213 Q214 M222	V177-I198 HydrophobicContact CG1-CG2 3.99Å; L178-I198 CarbonylContact O-C 3.59Å; L178-I198 WeakPolarHBondContact O-CA 3.32Å; K179-I198 HydrophobicContact CG-CG1 4.41Å; I198-E200 HydrophobicContact CG2-CG 4.41Å; I198-L213 WeakPolarHBondContact O-CA 3.45Å; I198-Q214 HydrophobicContact CB-CB 4.29Å; I198-Q214 PolarHBondContact N-O 3.16Å; I198-Q214 PolarHBondContact O-N 2.95Å; I198-M222 HydrophobicContact CD1-CE 4.24Å; I198-M222 HydrophobicContact CD1-CG 4.46Å; I198-M222 HydrophobicContact CD1-SD 4.42Å; I198-M222 HydrophobicContact CG1-CE 4.02Å; I198-M222 HydrophobicContact CG1-SD 4.31Å
199	R	97.9	Very high	91.1	Very high	7 Å²	7	57.9 Å²	57.9	3%	0.026	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.1	175.1	-173.9	-170.3	-55.5	-102.4	5	109.6	E140 E167 V177 L178 I201 Q211 R212 L213	E140-R199 IonicContact OE2-NH1 3.24Å; E140-R199 IonicContact OE2-NH2 2.68Å; E167-R199 IonicContact OE1-CZ 3.08Å; E167-R199 IonicContact OE1-NE 2.7Å; E167-R199 PolarHBondContact OE1-NE 3.45Å; E167-R199 IonicContact OE1-NH2 3.11Å; E167-R199 PolarHBondContact OE1-NH2 3.21Å; E167-R199 WeakPolarHBondContact OE2-CB 3.38Å; E167-R199 IonicContact OE2-CZ 2.72Å; E167-R199 IonicContact OE2-NE 2.75Å; E167-R199 PolarHBondContact OE2-NE 3.09Å; E167-R199 IonicContact OE2-NH2 3.87Å; V177-R199 WeakPolarHBondContact CA-O 3.2Å; L178-R199 HydrophobicContact CB-CB 4.23Å; L178-R199 PolarHBondContact N-O 2.84Å; L178-R199 PolarHBondContact O-N 3.41Å; R199-I201 HydrophobicContact CG-CG1 4.24Å; R199-Q211 HydrophobicContact CG-CG 4.24Å; R199-Q211 VanDerWaalsContact NH1-NE2 3.14Å; R199-R212 CarbonylContact C-O 3.54Å; R199-R212 WeakPolarHBondContact CA-O 3.41Å; R199-L213 HydrophobicContact CB-CD1 3.93Å; R199-L213 HydrophobicContact CG-CD1 4.42Å
200	E	98	Very high	91.8	Very high	43 Å²	43	58.2 Å²	58.2	20%	0.201	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.9	171.2	-55.3	-162	142.1	0	0	109.9	K175 I176 V177 I198 Q211 R212	K175-E200 VanDerWaalsContact CE-CD 3.5Å; K175-E200 WeakPolarHBondContact CE-OE1 3.27Å; K175-E200 WeakPolarHBondContact CE-OE2 3.48Å; K175-E200 IonicContact NZ-OE1 2.98Å; K175-E200 PolarHBondContact NZ-OE1 2.88Å; K175-E200 IonicContact NZ-OE2 3.62Å; K175-E200 PolarHBondContact NZ-OE2 2.81Å; I176-E200 CarbonylContact O-C 3.59Å; I176-E200 WeakPolarHBondContact O-CA 3.15Å; V177-E200 HydrophobicContact CG1-CG 4.46Å; V177-E200 HydrophobicContact CG2-CG 4.24Å; I198-E200 HydrophobicContact CG2-CG 4.41Å; E200-Q211 CarbonylContact O-C 3.55Å; E200-Q211 VanDerWaalsContact O-CA 3.26Å; E200-Q211 WeakPolarHBondContact O-CA 3.37Å; E200-R212 HydrophobicContact CB-CB 4.39Å; E200-R212 PolarHBondContact N-O 2.91Å; E200-R212 PolarHBondContact O-N 3.37Å
201	I	96.9	Very high	92.8	Very high	3 Å²	3	47 Å²	47	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	121	174	-56.7	169.3	0	0	0	107.5	L78 K175 I176 R199 L209 E210 Q211	L78-I201 HydrophobicContact CD2-CG2 3.85Å; K175-I201 CarbonylContact C-O 3.58Å; K175-I201 WeakPolarHBondContact CA-O 3.43Å; I176-I201 HydrophobicContact CB-CB 4.34Å; I176-I201 PolarHBondContact N-O 2.49Å; I176-I201 PolarHBondContact O-N 2.8Å; R199-I201 HydrophobicContact CG-CG1 4.24Å; I201-L209 HydrophobicContact CG2-CD1 3.74Å; I201-L209 HydrophobicContact CG2-CD2 4.11Å; I201-L209 HydrophobicContact CG2-CG 4.06Å; I201-E210 CarbonylContact C-O 3.6Å; I201-E210 WeakPolarHBondContact CA-O 3.49Å; I201-Q211 HydrophobicContact CG1-CG 4.16Å
202	T	97.5	Very high	93.8	Very high	30 Å²	30	46.9 Å²	46.9	18%	0.184	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	123	-177.3	-51.5	0	0	0	0	110.2	K175 I204 E210	K175-T202 HydrophobicContact CB-CG2 4.42Å; T202-I204 HydrophobicContact CG2-CD1 3.9Å; T202-I204 PolarHBondContact O-N 2.87Å; T202-E210 PolarHBondContact N-O 2.9Å; T202-E210 PolarHBondContact O-N 3.47Å
203	L	96	Very high	94.7	Very high	21 Å²	21	43.5 Å²	43.5	11%	0.11	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	109.5	167.3	-175.3	80.6	0	0	0	108.8	F77 W82 N174 D205 L209	F77-L203 HydrophobicContact CB-CD2 3.84Å; F77-L203 HydrophobicContact CD2-CB 3.78Å; F77-L203 HydrophobicContact CD2-CD1 4.26Å; F77-L203 HydrophobicContact CD2-CD2 3.98Å; F77-L203 HydrophobicContact CD2-CG 4.24Å; F77-L203 HydrophobicContact CE2-CB 3.93Å; F77-L203 HydrophobicContact CG-CD2 4.08Å; W82-L203 HydrophobicContact CH2-CD1 3.59Å; W82-L203 HydrophobicContact CZ2-CD1 4.21Å; W82-L203 HydrophobicContact CZ3-CD1 4.48Å; N174-L203 HydrophobicContact CB-CB 4.1Å; N174-L203 PolarHBondContact O-N 2.81Å; L203-D205 WeakPolarHBondContact CD1-O 3.45Å; L203-D205 VanDerWaalsContact CG-O 3.3Å; L203-D205 WeakPolarHBondContact CG-O 3.42Å; L203-L209 HydrophobicContact CB-CD1 4.24Å; L203-L209 HydrophobicContact CD1-CD1 4.14Å
204	I	96.1	Very high	95.4	Very high	87 Å²	87	43.9 Å²	43.9	45%	0.446	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-45.1	-178.3	-55.4	-61	0	0	0	110.1	T202 T208 E210	T202-I204 HydrophobicContact CG2-CD1 3.9Å; T202-I204 PolarHBondContact O-N 2.87Å; I204-T208 HydrophobicContact CB-CG2 4.04Å; I204-T208 HydrophobicContact CG1-CG2 4.21Å; I204-T208 PolarHBondContact N-O 2.82Å; I204-E210 HydrophobicContact CD1-CB 4.22Å; I204-E210 HydrophobicContact CG1-CB 4.05Å
205	D	92.5	Very high	95.6	Very high	74 Å²	74	43.6 Å²	43.6	40%	0.396	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	-179.1	174.8	64	59.4	0	0	0	109.4	L203 N207 T208	L203-D205 WeakPolarHBondContact CD1-O 3.45Å; L203-D205 VanDerWaalsContact CG-O 3.3Å; L203-D205 WeakPolarHBondContact CG-O 3.42Å; D205-N207 PolarHBondContact O-N 2.83Å; D205-N207 WeakPolarHBondContact OD1-CA 3.41Å; D205-N207 PolarHBondContact OD1-N 3.18Å; D205-T208 VanDerWaalsContact CG-OG1 3.29Å; D205-T208 PolarHBondContact N-O 2.93Å; D205-T208 PolarHBondContact O-N 3.11Å; D205-T208 WeakPolarHBondContact OD1-CB 3.48Å; D205-T208 PolarHBondContact OD1-N 2.82Å; D205-T208 PolarHBondContact OD1-OG1 2.87Å; D205-T208 VanDerWaalsContact OD1-OG1 3.08Å; D205-T208 VanDerWaalsContact OD2-CB 3.23Å; D205-T208 WeakPolarHBondContact OD2-CB 3.26Å; D205-T208 PolarHBondContact OD2-OG1 2.83Å
206	E	86.6	Confident	95.7	Very high	126 Å²	126	42 Å²	42	59%	0.589	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-27.8	-175.9	-63.3	-175.2	161.1	0	0	114.5	R232	E206-R232 PolarHBondContact O-NE 2.92Å
207	N	89.5	Confident	95.6	Very high	84 Å²	84	39.7 Å²	39.7	45%	0.449	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-1.9	-173.4	-65.7	-47.8	0	0	0	113.9	D205 T231 R232	D205-N207 PolarHBondContact O-N 2.83Å; D205-N207 WeakPolarHBondContact OD1-CA 3.41Å; D205-N207 PolarHBondContact OD1-N 3.18Å; N207-T231 CarbonylContact O-C 3.56Å; N207-T231 WeakPolarHBondContact O-CA 3.26Å; N207-R232 HydrophobicContact CB-CB 4.46Å; N207-R232 PolarHBondContact O-N 2.99Å
208	T	93.8	Very high	95.2	Very high	30 Å²	30	44.9 Å²	44.9	18%	0.184	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	115.5	-177.4	-53.6	0	0	0	0	111.3	I204 D205 R229	I204-T208 HydrophobicContact CB-CG2 4.04Å; I204-T208 HydrophobicContact CG1-CG2 4.21Å; I204-T208 PolarHBondContact N-O 2.82Å; D205-T208 VanDerWaalsContact CG-OG1 3.29Å; D205-T208 PolarHBondContact N-O 2.93Å; D205-T208 PolarHBondContact O-N 3.11Å; D205-T208 WeakPolarHBondContact OD1-CB 3.48Å; D205-T208 PolarHBondContact OD1-N 2.82Å; D205-T208 PolarHBondContact OD1-OG1 2.87Å; D205-T208 VanDerWaalsContact OD1-OG1 3.08Å; D205-T208 VanDerWaalsContact OD2-CB 3.23Å; D205-T208 WeakPolarHBondContact OD2-CB 3.26Å; D205-T208 PolarHBondContact OD2-OG1 2.83Å; T208-R229 HydrophobicContact CG2-CG 3.63Å
209	L	95.5	Very high	94.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	138.9	172.2	-167.7	75.2	0	0	0	109.3	L78 W82 L104 I201 L203 R229 Y230	L78-L209 HydrophobicContact CD2-CD1 3.86Å; L78-L209 HydrophobicContact CD2-CD2 4.12Å; W82-L209 HydrophobicContact CD2-CB 3.93Å; W82-L209 HydrophobicContact CD2-CD2 3.98Å; W82-L209 HydrophobicContact CE3-CB 3.54Å; W82-L209 HydrophobicContact CE3-CD2 4.46Å; W82-L209 HydrophobicContact CG-CD2 4.07Å; W82-L209 HydrophobicContact CH2-CB 3.99Å; W82-L209 HydrophobicContact CZ2-CB 4.34Å; W82-L209 HydrophobicContact CZ2-CD1 4.49Å; W82-L209 HydrophobicContact CZ3-CB 3.59Å; L104-L209 HydrophobicContact CD1-CD2 4.35Å; I201-L209 HydrophobicContact CG2-CD1 3.74Å; I201-L209 HydrophobicContact CG2-CD2 4.11Å; I201-L209 HydrophobicContact CG2-CG 4.06Å; L203-L209 HydrophobicContact CB-CD1 4.24Å; L203-L209 HydrophobicContact CD1-CD1 4.14Å; L209-R229 CarbonylContact O-C 3.56Å; L209-R229 WeakPolarHBondContact O-CA 3.36Å; L209-Y230 HydrophobicContact CB-CD2 4.1Å; L209-Y230 HydrophobicContact CD2-CD2 4.17Å; L209-Y230 HydrophobicContact CD2-CE2 4.5Å; L209-Y230 HydrophobicContact CG-CD2 4.35Å; L209-Y230 PolarHBondContact N-O 3.42Å; L209-Y230 WeakPolarHBondContact O-CD2 3.49Å; L209-Y230 PolarHBondContact O-N 3.19Å
210	E	97.5	Very high	94.7	Very high	28 Å²	28	49.5 Å²	49.5	13%	0.131	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.1	173.8	-175.7	172	109.4	0	0	109.7	I201 T202 I204 F227 I228 R229	I201-E210 CarbonylContact C-O 3.6Å; I201-E210 WeakPolarHBondContact CA-O 3.49Å; T202-E210 PolarHBondContact N-O 2.9Å; T202-E210 PolarHBondContact O-N 3.47Å; I204-E210 HydrophobicContact CD1-CB 4.22Å; I204-E210 HydrophobicContact CG1-CB 4.05Å; E210-F227 HydrophobicContact CG-CE2 3.73Å; E210-F227 HydrophobicContact CG-CZ 4.01Å; E210-F227 WeakPolarHBondContact OE2-CE2 3.19Å; E210-F227 WeakPolarHBondContact OE2-CZ 3.48Å; E210-I228 WeakPolarHBondContact CA-O 3.46Å; E210-R229 IonicContact OE2-CZ 3.68Å; E210-R229 IonicContact OE2-NE 3.68Å; E210-R229 PolarHBondContact OE2-NE 2.86Å; E210-R229 IonicContact OE2-NH2 3.92Å; E210-R229 PolarHBondContact OE2-NH2 3.29Å
211	Q	97.5	Very high	94.5	Very high	7 Å²	7	57.6 Å²	57.6	3%	0.033	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136	172.7	-176.6	173.6	-70.8	0	0	110.4	R199 E200 I201 I228 Y230	R199-Q211 HydrophobicContact CG-CG 4.24Å; R199-Q211 VanDerWaalsContact NH1-NE2 3.14Å; E200-Q211 CarbonylContact O-C 3.55Å; E200-Q211 VanDerWaalsContact O-CA 3.26Å; E200-Q211 WeakPolarHBondContact O-CA 3.37Å; I201-Q211 HydrophobicContact CG1-CG 4.16Å; Q211-I228 HydrophobicContact CB-CG2 3.88Å; Q211-I228 PolarHBondContact N-O 3.49Å; Q211-I228 PolarHBondContact O-N 2.91Å; Q211-Y230 HydrophobicContact CB-CE2 3.82Å
212	R	97.8	Very high	94.5	Very high	85 Å²	85	59.9 Å²	59.9	32%	0.321	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.9	173.6	-58.6	-175.1	67.3	-172.5	-0.2	108.9	R199 E200 D224 T226 F227	R199-R212 CarbonylContact C-O 3.54Å; R199-R212 WeakPolarHBondContact CA-O 3.41Å; E200-R212 HydrophobicContact CB-CB 4.39Å; E200-R212 PolarHBondContact N-O 2.91Å; E200-R212 PolarHBondContact O-N 3.37Å; R212-D224 IonicContact CZ-OD2 3.48Å; R212-D224 IonicContact NH2-OD1 3.5Å; R212-D224 IonicContact NH2-OD2 3.98Å; R212-D224 PolarHBondContact NH2-OD2 2.77Å; R212-T226 WeakPolarHBondContact CA-O 3.24Å; R212-F227 HydrophobicContact CG-CD2 3.77Å; R212-F227 HydrophobicContact CG-CE2 4.31Å
213	L	97.3	Very high	94.5	Very high	18 Å²	18	61.5 Å²	61.5	9%	0.094	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.2	173	-172.6	66.5	0	0	0	108.5	M197 I198 R199 H225 T226	M197-L213 HydrophobicContact CB-CD1 4.22Å; M197-L213 HydrophobicContact SD-CD1 4.38Å; M197-L213 HydrophobicContact SD-CD2 4.45Å; I198-L213 WeakPolarHBondContact O-CA 3.45Å; R199-L213 HydrophobicContact CB-CD1 3.93Å; R199-L213 HydrophobicContact CG-CD1 4.42Å; L213-H225 WeakPolarHBondContact O-CA 3.14Å; L213-H225 WeakPolarHBondContact O-CB 3.47Å; L213-H225 PolarHBondContact O-N 3.16Å; L213-T226 VanDerWaalsContact CB-OG1 3.26Å; L213-T226 WeakPolarHBondContact CB-OG1 3.24Å; L213-T226 PolarHBondContact N-O 3.29Å; L213-T226 PolarHBondContact O-N 2.83Å; L213-T226 VanDerWaalsContact O-N 3.07Å
214	Q	97.8	Very high	94.5	Very high	54 Å²	54	64 Å²	64	25%	0.252	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	145.7	166.5	-51.5	-169.3	-70.1	0	0	108.7	M197 I198 M222 Q223 D224	M197-Q214 VanDerWaalsContact CA-O 3.24Å; M197-Q214 WeakPolarHBondContact CA-O 3.31Å; I198-Q214 HydrophobicContact CB-CB 4.29Å; I198-Q214 PolarHBondContact N-O 3.16Å; I198-Q214 PolarHBondContact O-N 2.95Å; Q214-M222 HydrophobicContact CB-CG 4.19Å; Q214-M222 HydrophobicContact CB-SD 3.54Å; Q214-M222 VanDerWaalsContact CB-SD 3.54Å; Q214-Q223 CarbonylContact C-O 3.53Å; Q214-Q223 WeakPolarHBondContact CA-O 3.3Å; Q214-Q223 WeakPolarHBondContact CB-O 3.37Å; Q214-D224 PolarHBondContact NE2-OD1 2.92Å
215	M	95.8	Very high	94.5	Very high	21 Å²	21	61.8 Å²	61.8	10%	0.103	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.9	-177.5	-173.9	175	66.4	0	0	110.3	F92 V194 M197 T217 Q223 H225	F92-M215 HydrophobicContact CD1-CE 3.93Å; F92-M215 HydrophobicContact CD2-CE 3.85Å; F92-M215 HydrophobicContact CE1-CE 3.73Å; F92-M215 HydrophobicContact CE2-CB 4.28Å; F92-M215 HydrophobicContact CE2-CE 3.63Å; F92-M215 HydrophobicContact CG-CE 4Å; F92-M215 HydrophobicContact CZ-CE 3.58Å; V194-M215 HydrophobicContact CG1-CG 4.01Å; V194-M215 HydrophobicContact CG1-SD 4.38Å; V194-M215 HydrophobicContact CG2-CG 4.46Å; V194-M215 HydrophobicContact CG2-SD 3.83Å; M197-M215 HydrophobicContact CG-CG 4.25Å; M215-T217 HydrophobicContact CE-CG2 3.91Å; M215-T217 HydrophobicContact CG-CG2 4.22Å; M215-T217 HydrophobicContact SD-CG2 4.27Å; M215-Q223 PolarHBondContact N-O 2.72Å; M215-Q223 PolarHBondContact O-N 3.01Å; M215-H225 HydrophobicContact CB-CB 3.79Å
216	E	95.2	Very high	94.7	Very high	61 Å²	61	59.2 Å²	59.2	29%	0.285	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.9	167.8	-177.3	160.7	-171.9	0	0	109.6	L195 D196 M222	L195-E216 HydrophobicContact CB-CG 4.31Å; L195-E216 PolarHBondContact N-O 2.86Å; D196-E216 HydrophobicContact CB-CB 4.16Å; D196-E216 PolarHBondContact N-O 2.91Å; D196-E216 PolarHBondContact O-N 3.01Å; E216-M222 HydrophobicContact CB-CB 4.2Å; E216-M222 HydrophobicContact CB-CE 3.84Å; E216-M222 HydrophobicContact CB-SD 4.3Å
217	T	92.7	Very high	95.2	Very high	8 Å²	8	56 Å²	56	5%	0.049	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	168.6	177.7	63.1	0	0	0	0	109.2	F92 M215 T219 H220	F92-T217 HydrophobicContact CE1-CG2 3.88Å; F92-T217 HydrophobicContact CZ-CG2 3.82Å; M215-T217 HydrophobicContact CE-CG2 3.91Å; M215-T217 HydrophobicContact CG-CG2 4.22Å; M215-T217 HydrophobicContact SD-CG2 4.27Å; T217-T219 PolarHBondContact O-N 3.42Å; T217-H220 PolarHBondContact N-O 3.48Å; T217-H220 PolarHBondContact O-N 2.86Å; T217-H220 PolarHBondContact OG1-N 2.86Å
218	L	89.4	Confident	95.6	Very high	124 Å²	124	52 Å²	52	65%	0.649	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-30.6	177.2	-173.5	65.3	0	0	0	114	P193	P193-L218 PolarHBondContact O-N 2.97Å
219	T	90.9	Very high	95.7	Very high	85 Å²	85	56.6 Å²	56.6	52%	0.521	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-13	-174.7	51.8	0	0	0	0	114.1	T217	T217-T219 PolarHBondContact O-N 3.42Å
220	H	93.6	Very high	95.7	Very high	50 Å²	50	56.6 Å²	56.6	23%	0.231	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	125.2	-173.2	-62	86.8	0	0	0	110.8	F92 P93 T217	F92-H220 HydrophobicContact CE1-CB 4.18Å; F92-H220 HydrophobicContact CZ-CB 3.9Å; P93-H220 WeakPolarHBondContact CB-NE2 3.47Å; T217-H220 PolarHBondContact N-O 3.48Å; T217-H220 PolarHBondContact O-N 2.86Å; T217-H220 PolarHBondContact OG1-N 2.86Å
221	R	95.3	Very high	95.5	Very high	213 Å²	213	59.3 Å²	59.3	80%	0.804	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.7	159.7	174.3	-62.2	-175.8	-178.7	-173.4	-0.3	111.8	Q223	R221-Q223 PolarHBondContact O-N 3.29Å; R221-Q223 PolarHBondContact O-NE2 2.98Å
222	M	97.3	Very high	95	Very high	51 Å²	51	60.5 Å²	60.5	25%	0.251	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-44.8	120.4	175.4	-171.8	63	71.3	0	0	112.3	D196 I198 Q214 E216	D196-M222 HydrophobicContact CB-CE 3.65Å; I198-M222 HydrophobicContact CD1-CE 4.24Å; I198-M222 HydrophobicContact CD1-CG 4.46Å; I198-M222 HydrophobicContact CD1-SD 4.42Å; I198-M222 HydrophobicContact CG1-CE 4.02Å; I198-M222 HydrophobicContact CG1-SD 4.31Å; Q214-M222 HydrophobicContact CB-CG 4.19Å; Q214-M222 HydrophobicContact CB-SD 3.54Å; Q214-M222 VanDerWaalsContact CB-SD 3.54Å; E216-M222 HydrophobicContact CB-CB 4.2Å; E216-M222 HydrophobicContact CB-CE 3.84Å; E216-M222 HydrophobicContact CB-SD 4.3Å
223	Q	96.6	Very high	94.3	Very high	64 Å²	64	59.5 Å²	59.5	30%	0.299	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	165.6	179.1	68.1	-165.4	-89.4	0	0	111.2	F92 P93 Q214 M215 R221 H225	F92-Q223 HydrophobicContact CD2-CG 4.12Å; F92-Q223 HydrophobicContact CE2-CG 3.64Å; P93-Q223 VanDerWaalsContact CD-OE1 3.27Å; P93-Q223 VanDerWaalsContact CG-OE1 3.3Å; Q214-Q223 CarbonylContact C-O 3.53Å; Q214-Q223 WeakPolarHBondContact CA-O 3.3Å; Q214-Q223 WeakPolarHBondContact CB-O 3.37Å; M215-Q223 PolarHBondContact N-O 2.72Å; M215-Q223 PolarHBondContact O-N 3.01Å; R221-Q223 PolarHBondContact O-N 3.29Å; R221-Q223 PolarHBondContact O-NE2 2.98Å; Q223-H225 PolarHBondContact O-N 2.9Å
224	D	96.2	Very high	93.4	Very high	75 Å²	75	60.2 Å²	60.2	40%	0.401	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	126.1	176.3	-72	3.6	0	0	0	111.1	K91 R212 Q214	K91-D224 VanDerWaalsContact O-O 3.13Å; R212-D224 IonicContact CZ-OD2 3.48Å; R212-D224 IonicContact NH2-OD1 3.5Å; R212-D224 IonicContact NH2-OD2 3.98Å; R212-D224 PolarHBondContact NH2-OD2 2.77Å; Q214-D224 PolarHBondContact NE2-OD1 2.92Å
225	H	95.6	Very high	92.1	Very high	39 Å²	39	58 Å²	58	18%	0.181	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-50.3	177.9	-178	47.6	0	0	0	111.4	A90 K91 F92 L213 M215 Q223	A90-H225 WeakPolarHBondContact CA-O 3.36Å; K91-H225 PolarHBondContact N-O 3.07Å; K91-H225 WeakPolarHBondContact O-CA 3.44Å; K91-H225 VanDerWaalsContact O-O 3.1Å; F92-H225 HydrophobicContact CD2-CB 4.25Å; F92-H225 AromaticContact CD2-ND1 3.61Å; F92-H225 AromaticContact CG-ND1 3.77Å; L213-H225 WeakPolarHBondContact O-CA 3.14Å; L213-H225 WeakPolarHBondContact O-CB 3.47Å; L213-H225 PolarHBondContact O-N 3.16Å; M215-H225 HydrophobicContact CB-CB 3.79Å; Q223-H225 PolarHBondContact O-N 2.9Å
226	T	96.3	Very high	91.9	Very high	20 Å²	20	59.9 Å²	59.9	12%	0.123	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.9	176.5	71.5	0	0	0	0	112.7	K89 A90 Y100 R212 L213	K89-T226 CarbonylContact O-C 3.6Å; K89-T226 VanDerWaalsContact O-CA 3.3Å; K89-T226 WeakPolarHBondContact O-CA 3.45Å; A90-T226 HydrophobicContact CB-CG2 4.18Å; Y100-T226 HydrophobicContact CE1-CG2 4.43Å; R212-T226 WeakPolarHBondContact CA-O 3.24Å; L213-T226 VanDerWaalsContact CB-OG1 3.26Å; L213-T226 WeakPolarHBondContact CB-OG1 3.24Å; L213-T226 PolarHBondContact N-O 3.29Å; L213-T226 PolarHBondContact O-N 2.83Å; L213-T226 VanDerWaalsContact O-N 3.07Å
227	F	97.6	Very high	91.7	Very high	60 Å²	60	59.8 Å²	59.8	26%	0.263	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	136.1	172.1	170.8	-82.6	0	0	0	108.1	G88 K89 E210 R212	G88-F227 CarbonylContact C-O 3.49Å; G88-F227 WeakPolarHBondContact CA-O 3.47Å; K89-F227 PolarHBondContact N-O 2.9Å; K89-F227 PolarHBondContact O-N 2.75Å; E210-F227 HydrophobicContact CG-CE2 3.73Å; E210-F227 HydrophobicContact CG-CZ 4.01Å; E210-F227 WeakPolarHBondContact OE2-CE2 3.19Å; E210-F227 WeakPolarHBondContact OE2-CZ 3.48Å; R212-F227 HydrophobicContact CG-CD2 3.77Å; R212-F227 HydrophobicContact CG-CE2 4.31Å
228	I	97.4	Very high	91.6	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	142.1	176.8	-178.3	160.6	0	0	0	111.2	Y100 E102 E210 Q211 Y230	Y100-I228 HydrophobicContact CD2-CD1 4.32Å; Y100-I228 HydrophobicContact CE2-CD1 3.68Å; E102-I228 HydrophobicContact CB-CD1 3.63Å; E210-I228 WeakPolarHBondContact CA-O 3.46Å; Q211-I228 HydrophobicContact CB-CG2 3.88Å; Q211-I228 PolarHBondContact N-O 3.49Å; Q211-I228 PolarHBondContact O-N 2.91Å; I228-Y230 HydrophobicContact CB-CE2 4.47Å; I228-Y230 HydrophobicContact CD1-CD1 4.14Å; I228-Y230 HydrophobicContact CD1-CE1 3.49Å; I228-Y230 VanDerWaalsContact CD1-CE1 3.49Å; I228-Y230 HydrophobicContact CG1-CD1 4.17Å; I228-Y230 HydrophobicContact CG1-CE1 3.76Å; I228-Y230 HydrophobicContact CG1-CE2 4.21Å; I228-Y230 HydrophobicContact CG2-CE1 4.21Å; I228-Y230 HydrophobicContact CG2-CE2 3.66Å; I228-Y230 WeakPolarHBondContact CG2-OH 3.37Å
229	R	97.1	Very high	91.8	Very high	125 Å²	125	59.1 Å²	59.1	47%	0.472	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.6	172.4	-171.9	174	-69.3	167.2	-1.2	109.6	S84 T208 L209 E210	S84-R229 WeakPolarHBondContact CB-O 3.41Å; S84-R229 PolarHBondContact OG-O 2.9Å; T208-R229 HydrophobicContact CG2-CG 3.63Å; L209-R229 CarbonylContact O-C 3.56Å; L209-R229 WeakPolarHBondContact O-CA 3.36Å; E210-R229 IonicContact OE2-CZ 3.68Å; E210-R229 IonicContact OE2-NE 3.68Å; E210-R229 PolarHBondContact OE2-NE 2.86Å; E210-R229 IonicContact OE2-NH2 3.92Å; E210-R229 PolarHBondContact OE2-NH2 3.29Å
230	Y	95	Very high	91.8	Very high	1 Å²	1	57.5 Å²	57.5	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	152.7	-177.8	-45.1	-94.5	0	0	0	111.3	W82 E102 L104 L209 Q211 I228	W82-Y230 HydrophobicContact CB-CD1 4.32Å; W82-Y230 HydrophobicContact CB-CG 4.06Å; E102-Y230 HydrophobicContact CB-CE1 4.08Å; E102-Y230 HydrophobicContact CG-CE1 4.18Å; E102-Y230 WeakPolarHBondContact OE2-CE1 3.42Å; E102-Y230 VanDerWaalsContact OE2-CZ 3.29Å; E102-Y230 PolarHBondContact OE2-OH 3.27Å; L104-Y230 HydrophobicContact CD1-CD1 4.49Å; L104-Y230 HydrophobicContact CD1-CD2 4.39Å; L104-Y230 HydrophobicContact CD1-CE1 3.92Å; L104-Y230 HydrophobicContact CD1-CE2 3.81Å; L104-Y230 HydrophobicContact CD2-CE1 4.46Å; L104-Y230 HydrophobicContact CG-CD1 4.41Å; L104-Y230 HydrophobicContact CG-CE1 3.81Å; L209-Y230 HydrophobicContact CB-CD2 4.1Å; L209-Y230 HydrophobicContact CD2-CD2 4.17Å; L209-Y230 HydrophobicContact CD2-CE2 4.5Å; L209-Y230 HydrophobicContact CG-CD2 4.35Å; L209-Y230 PolarHBondContact N-O 3.42Å; L209-Y230 WeakPolarHBondContact O-CD2 3.49Å; L209-Y230 PolarHBondContact O-N 3.19Å; Q211-Y230 HydrophobicContact CB-CE2 3.82Å; I228-Y230 HydrophobicContact CB-CE2 4.47Å; I228-Y230 HydrophobicContact CD1-CD1 4.14Å; I228-Y230 HydrophobicContact CD1-CE1 3.49Å; I228-Y230 VanDerWaalsContact CD1-CE1 3.49Å; I228-Y230 HydrophobicContact CG1-CD1 4.17Å; I228-Y230 HydrophobicContact CG1-CE1 3.76Å; I228-Y230 HydrophobicContact CG1-CE2 4.21Å; I228-Y230 HydrophobicContact CG2-CE1 4.21Å; I228-Y230 HydrophobicContact CG2-CE2 3.66Å; I228-Y230 WeakPolarHBondContact CG2-OH 3.37Å
231	T	92.4	Very high	91.7	Very high	85 Å²	85	58 Å²	58	52%	0.521	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	139.2	164.2	-54.5	0	0	0	0	109.2	W82 R83 N207 T233	W82-T231 WeakPolarHBondContact CA-O 3.19Å; R83-T231 PolarHBondContact N-O 3.16Å; R83-T231 PolarHBondContact O-N 3.18Å; N207-T231 CarbonylContact O-C 3.56Å; N207-T231 WeakPolarHBondContact O-CA 3.26Å; T231-T233 PolarHBondContact O-N 2.89Å
232	R	88.3	Confident	91.4	Very high	32 Å²	32	46.9 Å²	46.9	12%	0.121	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	122.8	170.2	-170.6	-176.6	-69.2	-82.6	4.9	109.4	F77 V79 W82 E206 N207 F234 P235	F77-R232 PolarHBondContact O-NH2 3.5Å; V79-R232 PolarHBondContact O-NH1 3.18Å; W82-R232 HydrophobicContact CE3-CB 3.84Å; W82-R232 HydrophobicContact CH2-CB 4.2Å; W82-R232 HydrophobicContact CZ3-CB 3.64Å; W82-R232 HydrophobicContact CZ3-CG 4.4Å; E206-R232 PolarHBondContact O-NE 2.92Å; N207-R232 HydrophobicContact CB-CB 4.46Å; N207-R232 PolarHBondContact O-N 2.99Å; R232-F234 WeakPolarHBondContact CG-O 3.29Å; R232-P235 PolarHBondContact NH1-OXT 2.98Å
233	T	82.5	Confident	91	Very high	64 Å²	64	46.6 Å²	46.6	39%	0.393	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-19.1	178.5	56.6	0	0	0	0	112.9	R81 R83 T231	R81-T233 WeakPolarHBondContact CG-OG1 3.42Å; R81-T233 PolarHBondContact O-N 3.21Å; R81-T233 PolarHBondContact O-OG1 3.05Å; R81-T233 VanDerWaalsContact O-OG1 3.14Å; R83-T233 HydrophobicContact CB-CG2 3.64Å; T231-T233 PolarHBondContact O-N 2.89Å
234	F	77.8	Confident	90.5	Very high	32 Å²	32	45.2 Å²	45.2	14%	0.14	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	143.8	173.3	-162.4	-95.7	0	0	0	110.1	I16 L59 Y63 G80 R81 R232	I16-F234 HydrophobicContact CB-CE2 4.48Å; I16-F234 HydrophobicContact CD1-CE2 3.78Å; I16-F234 HydrophobicContact CD1-CZ 3.74Å; I16-F234 HydrophobicContact CG1-CE2 4.35Å; L59-F234 HydrophobicContact CD2-CE1 4.33Å; L59-F234 HydrophobicContact CD2-CZ 4.3Å; Y63-F234 AromaticContact CD1-CD1 3.76Å; Y63-F234 HydrophobicContact CD1-CD1 3.76Å; Y63-F234 AromaticContact CD1-CE1 3.97Å; Y63-F234 HydrophobicContact CD1-CE1 3.97Å; Y63-F234 AromaticContact CD2-CD1 3.93Å; Y63-F234 HydrophobicContact CD2-CD1 3.93Å; Y63-F234 AromaticContact CD2-CE1 3.36Å; Y63-F234 HydrophobicContact CD2-CE1 3.36Å; Y63-F234 HydrophobicContact CD2-CZ 4.23Å; Y63-F234 HydrophobicContact CE1-CD1 4.1Å; Y63-F234 HydrophobicContact CE1-CE1 4.49Å; Y63-F234 HydrophobicContact CE2-CD1 4.26Å; Y63-F234 AromaticContact CE2-CE1 3.95Å; Y63-F234 HydrophobicContact CE2-CE1 3.95Å; Y63-F234 AromaticContact CG-CD1 3.69Å; Y63-F234 HydrophobicContact CG-CD1 3.69Å; Y63-F234 AromaticContact CG-CE1 3.39Å; Y63-F234 HydrophobicContact CG-CE1 3.39Å; G80-F234 WeakPolarHBondContact CA-O 3.27Å; R81-F234 HydrophobicContact CB-CB 3.47Å; R81-F234 VanDerWaalsContact CB-CB 3.47Å; R81-F234 PolarHBondContact N-O 3.03Å; R81-F234 PolarHBondContact O-N 3.02Å; R232-F234 WeakPolarHBondContact CG-O 3.29Å
235	P	70.2	Confident	90	Very high	9 Å²	9	42.5 Å²	42.5	6%	0.058	21%	0.207	C	C	.	.			trans	-61.9	0	-179.4	-20.2	34.2	0	0	0	113.8	Y56 L59 Y63 V79 G80 R232	Y56-P235 HydrophobicContact CD1-CG 3.75Å; Y56-P235 HydrophobicContact CD2-CB 3.93Å; Y56-P235 HydrophobicContact CD2-CG 3.3Å; Y56-P235 HydrophobicContact CE1-CG 3.53Å; Y56-P235 HydrophobicContact CE2-CB 3.74Å; Y56-P235 HydrophobicContact CE2-CG 3.12Å; Y56-P235 HydrophobicContact CG-CG 3.63Å; L59-P235 HydrophobicContact CD2-CB 4.11Å; L59-P235 HydrophobicContact CD2-CG 4.05Å; Y63-P235 WeakPolarHBondContact CB-O 3.17Å; V79-P235 VanDerWaalsContact O-OXT 3.12Å; G80-P235 VanDerWaalsContact CA-C 3.45Å; G80-P235 WeakPolarHBondContact CA-O 3.49Å; G80-P235 WeakPolarHBondContact CA-OXT 3.38Å; R232-P235 PolarHBondContact NH1-OXT 2.98Å

Retrieved 235 of 235 residues in 90.1 ms (Link to these results)

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