G4VSZ9_SCHMA Loading...

PHD finger-like domain-containing protein 5A

AlphaFold DB , UniProt , Accession G4VSZ9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 110 aa.

						>G4VSZ9_SCHMA|G4VSZ9
MAKHHPDLIFCRKQPGVAIGRLCEKCDGKCVICDSYVRPCTLVRICDECNYGSYQGRCVICGGPGVSDAYYCRQCTCLEKDRDGCPKIVNLGSAKTDLFYERKKYGFKKR
					

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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	56.2	Low	79.5	Confident	99 Å²	99	75.9 Å²	75.9	49%	0.488	39%	0.388	S	S	.	.				0	-34.2	0	-89.8	170.5	135	0	0	111.3	K3 H4 H5 L8 D34 I60	M1-K3 PolarHBondContact O-N 2.86Å; M1-H4 PolarHBondContact O-N 2.8Å; M1-H5 PolarHBondContact O-CD2 2.96Å; M1-H5 VanDerWaalsContact O-CD2 3.26Å; M1-H5 PolarHBondContact O-N 2.74Å; M1-L8 WeakPolarHBondContact O-CD1 3.18Å; M1-D34 PolarHBondContact N-OD1 2.54Å; M1-D34 PolarHBondContact N-OD2 3.49Å; M1-I60 HydrophobicContact CB-CG2 4.26Å
2	A	59.9	Low	80.7	Confident	8 Å²	8	78.5 Å²	78.5	7%	0.066	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-41.1	-177.3	0	0	0	0	0	113.4	F10 D34 I88	A2-F10 HydrophobicContact CB-CE1 4.26Å; A2-F10 HydrophobicContact CB-CZ 3.88Å; A2-D34 PolarHBondContact N-OD1 3.02Å; A2-D34 PolarHBondContact N-OD2 3.27Å; A2-I88 HydrophobicContact CB-CD1 3.96Å
3	K	66.4	Low	81.7	Confident	157 Å²	157	79.5 Å²	79.5	68%	0.683	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-21.3	-178.6	-153.6	-173.6	-179.2	-172.4	0	113.5	M1 D34	M1-K3 PolarHBondContact O-N 2.86Å; K3-D34 PolarHBondContact N-OD2 2.83Å
4	H	78.3	Confident	82.6	Confident	143 Å²	143	86.3 Å²	86.3	66%	0.662	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-16.9	-177.5	-62.5	-74.7	0	0	0	113.2	M1 D34	M1-H4 PolarHBondContact O-N 2.8Å; H4-D34 IonicContact CD2-OD2 3.64Å
5	H	79.1	Confident	83.4	Confident	51 Å²	51	84.8 Å²	84.8	24%	0.236	42%	0.42	C	S	.	.			trans	-121.5	98.9	-175.7	-70.9	-61.4	0	0	0	108.6	M1 D7 L8 A94	M1-H5 PolarHBondContact O-CD2 2.96Å; M1-H5 VanDerWaalsContact O-CD2 3.26Å; M1-H5 PolarHBondContact O-N 2.74Å; H5-D7 VanDerWaalsContact C-OD1 3.31Å; H5-D7 WeakPolarHBondContact CA-OD1 3.34Å; H5-D7 VanDerWaalsContact CB-OD1 3.25Å; H5-D7 WeakPolarHBondContact CB-OD1 3.11Å; H5-D7 PolarHBondContact O-N 3.3Å; H5-L8 HydrophobicContact CB-CD1 3.61Å; H5-L8 HydrophobicContact CB-CG 3.76Å; H5-L8 PolarHBondContact O-N 2.8Å; H5-A94 WeakPolarHBondContact CE1-CB 3.35Å
6	P	84.2	Confident	84	Confident	131 Å²	131	80.7 Å²	80.7	85%	0.851	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-14	-176.5	29.6	-35.4	0	0	0	112.8	L8	P6-L8 VanDerWaalsContact C-N 3.29Å
7	D	87.7	Confident	84.6	Confident	48 Å²	48	82.7 Å²	82.7	26%	0.257	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-14.9	175.9	54.5	-57.2	0	0	0	113.3	H5 I9 N90 G92 S93	H5-D7 VanDerWaalsContact C-OD1 3.31Å; H5-D7 WeakPolarHBondContact CA-OD1 3.34Å; H5-D7 VanDerWaalsContact CB-OD1 3.25Å; H5-D7 WeakPolarHBondContact CB-OD1 3.11Å; H5-D7 PolarHBondContact O-N 3.3Å; D7-I9 PolarHBondContact O-N 2.93Å; D7-N90 PolarHBondContact O-ND2 2.77Å; D7-G92 WeakPolarHBondContact OD2-CA 3.27Å; D7-S93 PolarHBondContact OD2-N 3.49Å; D7-S93 PolarHBondContact OD2-OG 3.21Å
8	L	87.6	Confident	85.1	Confident	26 Å²	26	78.9 Å²	78.9	14%	0.136	41%	0.406	C	S	.	.			trans	-77.2	126.1	-177.4	-63	175.2	0	0	0	111.9	M1 H5 P6 I88	M1-L8 WeakPolarHBondContact O-CD1 3.18Å; H5-L8 HydrophobicContact CB-CD1 3.61Å; H5-L8 HydrophobicContact CB-CG 3.76Å; H5-L8 PolarHBondContact O-N 2.8Å; P6-L8 VanDerWaalsContact C-N 3.29Å; L8-I88 HydrophobicContact CB-CD1 4.28Å; L8-I88 HydrophobicContact CB-CG2 4.22Å; L8-I88 HydrophobicContact CD1-CD1 3.99Å; L8-I88 HydrophobicContact CD2-CG2 3.92Å
9	I	90.4	Very high	85.6	Confident	103 Å²	103	78.5 Å²	78.5	53%	0.528	40%	0.404	S	S	.	.			trans	-104.7	123.1	-176.6	-57.7	171.9	0	0	0	108.9	D7 I88 V89 N90	D7-I9 PolarHBondContact O-N 2.93Å; I9-I88 WeakPolarHBondContact O-CA 3.25Å; I9-V89 HydrophobicContact CB-CG2 4.14Å; I9-V89 HydrophobicContact CG2-CG2 3.97Å; I9-V89 VanDerWaalsContact O-CG2 3.24Å; I9-V89 WeakPolarHBondContact O-CG2 3.36Å; I9-V89 PolarHBondContact O-N 3.2Å; I9-N90 PolarHBondContact N-OD1 2.72Å
10	F	92	Very high	86	Confident	45 Å²	45	74.6 Å²	74.6	20%	0.197	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-82	145.7	172.6	-63.2	-76.9	0	0	0	111.1	A2 R12 P86 I88	A2-F10 HydrophobicContact CB-CE1 4.26Å; A2-F10 HydrophobicContact CB-CZ 3.88Å; F10-R12 HydrophobicContact CB-CG 3.99Å; F10-P86 WeakPolarHBondContact CD1-O 3.38Å; F10-I88 HydrophobicContact CD1-CG1 4.1Å; F10-I88 HydrophobicContact CE1-CD1 4.38Å; F10-I88 HydrophobicContact CE1-CG1 4.05Å
11	C	93.3	Very high	86.5	Confident	24 Å²	24	75.5 Å²	75.5	16%	0.162	38%	0.382	C	S	.	.			trans	-62.3	-45.5	179.1	-178	0	0	0	0	113	K13 C46 C49 C85 K87 V89	C11-K13 PolarHBondContact O-N 3.29Å; C11-K13 VanDerWaalsContact SG-CG 3.55Å; C11-C46 VanDerWaalsContact SG-SG 3.69Å; C11-C49 VanDerWaalsContact SG-SG 3.63Å; C11-C85 HydrophobicContact CB-CB 4.17Å; C11-K87 WeakPolarHBondContact CB-O 3.35Å; C11-K87 PolarHBondContact N-O 2.75Å; C11-V89 HydrophobicContact CB-CG1 4.08Å
12	R	92.8	Very high	88.3	Confident	107 Å²	107	70.9 Å²	70.9	40%	0.404	36%	0.359	S	S	.	.			trans	56	10.1	179.4	-55.4	-64	-164.7	173.2	17.9	116.2	F10 D83 C85	F10-R12 HydrophobicContact CB-CG 3.99Å; R12-D83 IonicContact CZ-OD2 3.76Å; R12-D83 VanDerWaalsContact NH1-CG 3.32Å; R12-D83 IonicContact NH1-OD2 3.74Å; R12-D83 PolarHBondContact NH1-OD2 3.09Å; R12-D83 IonicContact NH2-OD2 3.41Å; R12-D83 PolarHBondContact NH2-OD2 3.12Å; R12-C85 PolarHBondContact N-O 2.82Å
13	K	94.7	Very high	90	Very high	91 Å²	91	71 Å²	71	40%	0.396	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-66.1	161.7	170.3	-67.9	-179.3	-178.2	-175.2	0	111.3	C11 C46 E48 C85	C11-K13 PolarHBondContact O-N 3.29Å; C11-K13 VanDerWaalsContact SG-CG 3.55Å; K13-C46 HydrophobicContact CB-CB 3.86Å; K13-E48 IonicContact NZ-OE1 2.75Å; K13-E48 PolarHBondContact NZ-OE1 2.96Å; K13-E48 IonicContact NZ-OE2 2.58Å; K13-E48 PolarHBondContact NZ-OE2 3.21Å; K13-C85 VanDerWaalsContact O-CB 3.27Å; K13-C85 WeakPolarHBondContact O-CB 3.35Å; K13-C85 PolarHBondContact O-N 3.07Å
14	Q	93.8	Very high	91.3	Very high	175 Å²	175	71 Å²	71	82%	0.818	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-55.8	124.8	178.6	-170.3	166	11.1	0	0	110.6	C46	Q14-C46 WeakPolarHBondContact O-CA 3.36Å; Q14-C46 WeakPolarHBondContact O-CB 3.35Å
15	P	94.4	Very high	91.9	Very high	64 Å²	64	72.8 Å²	72.8	42%	0.416	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-69.3	135.5	-179.5	26.8	-30.6	0	0	0	109.8	R44	P15-R44 HydrophobicContact CB-CB 3.78Å
16	G	92.9	Very high	92.4	Very high	19 Å²	19	70.6 Å²	70.6	20%	0.196	36%	0.358	C	S	.	.			trans	-92.5	-158	176.5	0	0	0	0	0	111.7	I45	G16-I45 PolarHBondContact N-O 3.11Å
17	V	93.7	Very high	92.8	Very high	115 Å²	115	68.5 Å²	68.5	70%	0.697	34%	0.34	S	S	*	.	S	Bend	trans	-81	-19.3	177.9	-69.3	0	0	0	0	113.1	R44	V17-R44 PolarHBondContact O-NH1 2.84Å
18	A	94	Very high	93	Very high	14 Å²	14	68.3 Å²	68.3	12%	0.116	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-67	134.3	-174.6	0	0	0	0	0	112.9	R44 I45 N50	A18-R44 WeakPolarHBondContact O-CA 3.2Å; A18-I45 HydrophobicContact CB-CD1 4.24Å; A18-I45 HydrophobicContact CB-CG1 3.8Å; A18-I45 WeakPolarHBondContact O-CG1 3.3Å; A18-I45 PolarHBondContact O-N 3.45Å; A18-N50 HydrophobicContact CB-CB 3.9Å; A18-N50 WeakPolarHBondContact CB-ND2 3.26Å
19	I	94.5	Very high	93.3	Very high	71 Å²	71	68.6 Å²	68.6	36%	0.364	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-83.1	131.6	177.6	-60.6	173.3	0	0	0	109.3	L42 D68	I19-L42 HydrophobicContact CG2-CD2 4.13Å; I19-D68 HydrophobicContact CG2-CB 4.16Å
20	G	94.4	Very high	93.4	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-69.7	141.2	174.1	0	0	0	0	0	111.6	V43 A69	G20-V43 PolarHBondContact N-O 2.93Å; G20-A69 VanDerWaalsContact O-CB 3.31Å; G20-A69 WeakPolarHBondContact O-CB 3.36Å; G20-A69 PolarHBondContact O-N 3.44Å
21	R	95.3	Very high	93.4	Very high	94 Å²	94	61.7 Å²	61.7	36%	0.355	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	154.6	178	-59.6	-78.8	-96	-151.3	-6.5	111.2	C58 V59 V66 S67 D68	R21-C58 CarbonylContact O-C 3.42Å; R21-C58 WeakPolarHBondContact O-CA 3.5Å; R21-V59 WeakPolarHBondContact O-CG2 3.46Å; R21-V59 PolarHBondContact O-N 3.33Å; R21-V66 PolarHBondContact NH2-O 3.35Å; R21-S67 CarbonylContact C-O 3.51Å; R21-S67 WeakPolarHBondContact CA-O 3.21Å; R21-D68 WeakPolarHBondContact CD-OD1 3.34Å; R21-D68 IonicContact CZ-OD1 2.75Å; R21-D68 IonicContact NE-OD1 3.36Å; R21-D68 IonicContact NH1-OD1 3.95Å; R21-D68 PolarHBondContact NH1-OD1 2.8Å
22	L	94.8	Very high	93.4	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145.7	171.7	-65.4	172.5	0	0	0	109.8	C26 K29 V59 I60 G65 V66 S67 A69	L22-C26 HydrophobicContact CB-CB 4.39Å; L22-C26 WeakPolarHBondContact CD1-O 3.35Å; L22-C26 HydrophobicContact CD2-CB 4.25Å; L22-K29 WeakPolarHBondContact CD1-O 3.48Å; L22-V59 HydrophobicContact CD2-CB 4.48Å; L22-I60 HydrophobicContact CD2-CD1 3.77Å; L22-I60 HydrophobicContact CD2-CG1 3.84Å; L22-G65 CarbonylContact O-C 3.55Å; L22-G65 WeakPolarHBondContact O-CA 3.2Å; L22-V66 PolarHBondContact O-N 3.35Å; L22-S67 PolarHBondContact N-O 3.08Å; L22-S67 PolarHBondContact O-N 3.09Å; L22-A69 HydrophobicContact CD1-CB 4.05Å; L22-A69 HydrophobicContact CD2-CB 4.22Å; L22-A69 HydrophobicContact CG-CB 3.74Å
23	C	94.8	Very high	93.3	Very high	10 Å²	10	57.7 Å²	57.7	7%	0.068	30%	0.303	C	S	.	.			trans	-79.5	166.4	171.2	69.8	0	0	0	0	110.7	K25 C26 D27 C58 C61 P64	C23-K25 PolarHBondContact O-N 2.92Å; C23-C26 CarbonylContact O-C 3.54Å; C23-C26 WeakPolarHBondContact O-CA 3.44Å; C23-C26 PolarHBondContact O-N 2.99Å; C23-C26 VanDerWaalsContact SG-SG 3.7Å; C23-D27 PolarHBondContact O-N 3.28Å; C23-C58 HydrophobicContact CB-CB 3.87Å; C23-C58 PolarHBondContact N-SG 2.9Å; C23-C61 PolarHBondContact SG-SG 3.41Å; C23-P64 VanDerWaalsContact CA-O 3.3Å; C23-P64 WeakPolarHBondContact CA-O 2.78Å; C23-P64 WeakPolarHBondContact CB-O 3.06Å
24	E	94	Very high	93.1	Very high	157 Å²	157	54 Å²	54	73%	0.734	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-51.7	-35.3	178.7	-60.6	176.2	166.2	0	0	113.7	C26 V66	E24-C26 VanDerWaalsContact C-N 3.29Å; E24-C26 PolarHBondContact O-N 3.22Å; E24-V66 HydrophobicContact CG-CG2 3.84Å
25	K	90.7	Very high	92.9	Very high	182 Å²	182	47 Å²	47	79%	0.791	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-75	-20.4	179.3	-60.3	-176.3	-179.3	-177.1	0	113.8	C23 K29	C23-K25 PolarHBondContact O-N 2.92Å; K25-K29 PolarHBondContact O-NZ 2.91Å
26	C	90.8	Very high	92.7	Very high	5 Å²	5	51.1 Å²	51.1	3%	0.034	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-110	5.1	-177.5	-65.9	0	0	0	0	112	L22 C23 E24 K29 I60	L22-C26 HydrophobicContact CB-CB 4.39Å; L22-C26 WeakPolarHBondContact CD1-O 3.35Å; L22-C26 HydrophobicContact CD2-CB 4.25Å; C23-C26 CarbonylContact O-C 3.54Å; C23-C26 WeakPolarHBondContact O-CA 3.44Å; C23-C26 PolarHBondContact O-N 2.99Å; C23-C26 VanDerWaalsContact SG-SG 3.7Å; E24-C26 VanDerWaalsContact C-N 3.29Å; E24-C26 PolarHBondContact O-N 3.22Å; C26-K29 HydrophobicContact CB-CD 4.47Å; C26-K29 WeakPolarHBondContact O-CB 3.48Å; C26-K29 WeakPolarHBondContact O-CG 3.46Å; C26-K29 PolarHBondContact O-N 3.34Å; C26-I60 HydrophobicContact CB-CD1 4.27Å
27	D	92.8	Very high	92.7	Very high	86 Å²	86	55 Å²	55	46%	0.46	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	144.2	-172.5	-164.1	17.2	0	0	0	112.3	C23 K29 S67	C23-D27 PolarHBondContact O-N 3.28Å; D27-K29 PolarHBondContact O-N 2.84Å; D27-K29 VanDerWaalsContact O-N 3.09Å; D27-S67 VanDerWaalsContact CG-OG 3.26Å; D27-S67 WeakPolarHBondContact OD1-CB 3.47Å; D27-S67 PolarHBondContact OD1-OG 3.04Å
28	G	91	Very high	92.7	Very high	45 Å²	45	58.8 Å²	58.8	46%	0.464	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	-4	-177.2	0	0	0	0	0	116.2	Y36	G28-Y36 WeakPolarHBondContact O-CA 3.2Å
29	K	93	Very high	92.7	Very high	32 Å²	32	62.4 Å²	62.4	14%	0.139	31%	0.31	C	S	.	.			trans	-77	133.7	-179.6	-67.6	175.6	-179.3	154.9	0	111.8	L22 K25 C26 D27 V31 Y36 I60	L22-K29 WeakPolarHBondContact CD1-O 3.48Å; K25-K29 PolarHBondContact O-NZ 2.91Å; C26-K29 HydrophobicContact CB-CD 4.47Å; C26-K29 WeakPolarHBondContact O-CB 3.48Å; C26-K29 WeakPolarHBondContact O-CG 3.46Å; C26-K29 PolarHBondContact O-N 3.34Å; D27-K29 PolarHBondContact O-N 2.84Å; D27-K29 VanDerWaalsContact O-N 3.09Å; K29-V31 PolarHBondContact O-N 2.75Å; K29-Y36 HydrophobicContact CD-CE1 4.15Å; K29-Y36 WeakPolarHBondContact CE-OH 3.13Å; K29-Y36 HydrophobicContact CG-CD1 3.88Å; K29-Y36 HydrophobicContact CG-CE1 3.36Å; K29-Y36 PolarHBondContact NZ-OH 3.05Å; K29-I60 HydrophobicContact CB-CD1 4.15Å
30	C	93.8	Very high	92.6	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.02	31%	0.314	C	S	.	.			trans	-61.9	131.1	162.2	179.8	0	0	0	0	110.2	I32 D34 S35 Y70 C72 C75	C30-I32 PolarHBondContact O-N 3.21Å; C30-D34 WeakPolarHBondContact O-CA 3.38Å; C30-D34 PolarHBondContact O-N 2.76Å; C30-S35 WeakPolarHBondContact CB-O 3.46Å; C30-S35 WeakPolarHBondContact CB-OG 3.37Å; C30-S35 PolarHBondContact N-O 3.09Å; C30-Y70 WeakPolarHBondContact CA-O 3.36Å; C30-C72 HydrophobicContact CB-CB 3.87Å; C30-C72 PolarHBondContact SG-N 3.2Å; C30-C75 VanDerWaalsContact SG-SG 3.66Å
31	V	92.5	Very high	92.6	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-25	-174.3	-155.1	0	0	0	0	113.3	K29 V43 V59 I60 A69 P86	K29-V31 PolarHBondContact O-N 2.75Å; V31-V43 HydrophobicContact CG2-CB 4.39Å; V31-V43 HydrophobicContact CG2-CG1 4.3Å; V31-V43 HydrophobicContact CG2-CG2 3.41Å; V31-V43 VanDerWaalsContact CG2-CG2 3.41Å; V31-V59 HydrophobicContact CG1-CB 4.2Å; V31-V59 HydrophobicContact CG1-CG1 3.49Å; V31-V59 VanDerWaalsContact CG1-CG1 3.49Å; V31-I60 HydrophobicContact CG1-CG1 4.14Å; V31-A69 HydrophobicContact CG2-CB 4.15Å; V31-P86 HydrophobicContact CB-CB 4.31Å; V31-P86 HydrophobicContact CG1-CB 3.85Å; V31-P86 HydrophobicContact CG1-CG 4.1Å
32	I	92.1	Very high	92.6	Very high	20 Å²	20	63 Å²	63	10%	0.103	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-54	-175.9	-60.9	-172.5	0	0	0	111.6	C30 Y71 K80	C30-I32 PolarHBondContact O-N 3.21Å; I32-Y71 HydrophobicContact CD1-CD1 3.93Å; I32-Y71 HydrophobicContact CD1-CE1 3.71Å; I32-Y71 HydrophobicContact CG1-CD1 4.07Å; I32-Y71 HydrophobicContact CG1-CE1 3.92Å; I32-K80 HydrophobicContact CD1-CB 3.54Å; I32-K80 WeakPolarHBondContact CD1-O 3.34Å; I32-K80 HydrophobicContact CG2-CD 4.01Å
33	C	90.6	Very high	92.7	Very high	26 Å²	26	63 Å²	63	18%	0.176	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	2.9	-172.4	67.6	0	0	0	0	114.4	S35 C72	C33-S35 PolarHBondContact O-N 3.43Å; C33-S35 PolarHBondContact SG-OG 3.38Å; C33-C72 PolarHBondContact SG-SG 3.11Å
34	D	90.2	Very high	92.7	Very high	13 Å²	13	68 Å²	68	7%	0.07	34%	0.344	C	S	.	.			trans	58.3	13.7	-178.6	-63	-61.7	0	0	0	115	M1 A2 K3 H4 C30	M1-D34 PolarHBondContact N-OD1 2.54Å; M1-D34 PolarHBondContact N-OD2 3.49Å; A2-D34 PolarHBondContact N-OD1 3.02Å; A2-D34 PolarHBondContact N-OD2 3.27Å; K3-D34 PolarHBondContact N-OD2 2.83Å; H4-D34 IonicContact CD2-OD2 3.64Å; C30-D34 WeakPolarHBondContact O-CA 3.38Å; C30-D34 PolarHBondContact O-N 2.76Å
35	S	90.4	Very high	92.7	Very high	30 Å²	30	60.7 Å²	60.7	21%	0.21	31%	0.31	C	S	.	.			trans	-74.7	143	178	66.6	0	0	0	0	111.7	C30 C33 C72	C30-S35 WeakPolarHBondContact CB-O 3.46Å; C30-S35 WeakPolarHBondContact CB-OG 3.37Å; C30-S35 PolarHBondContact N-O 3.09Å; C33-S35 PolarHBondContact O-N 3.43Å; C33-S35 PolarHBondContact SG-OG 3.38Å; S35-C72 WeakPolarHBondContact OG-CB 3.38Å; S35-C72 PolarHBondContact OG-SG 3.14Å; S35-C72 VanDerWaalsContact OG-SG 3.38Å
36	Y	91	Very high	93	Very high	149 Å²	149	52.3 Å²	52.3	58%	0.584	27%	0.274	S	S	*	.			trans	-91.8	-3	178.3	-61.7	-88.2	0	0	0	115	G28 K29	G28-Y36 WeakPolarHBondContact O-CA 3.2Å; K29-Y36 HydrophobicContact CD-CE1 4.15Å; K29-Y36 WeakPolarHBondContact CE-OH 3.13Å; K29-Y36 HydrophobicContact CG-CD1 3.88Å; K29-Y36 HydrophobicContact CG-CE1 3.36Å; K29-Y36 PolarHBondContact NZ-OH 3.05Å
37	V	92.6	Very high	93.1	Very high	101 Å²	101	57 Å²	57	61%	0.612	30%	0.299	S	S	*	.	S	Bend	trans	-107.3	143.7	-168.5	-68.5	0	0	0	0	112.3
38	R	92.6	Very high	93.1	Very high	195 Å²	195	58.9 Å²	58.9	74%	0.736	31%	0.305	S	S	*	.			trans	55.1	63.6	171.3	-59.5	177.7	174.2	-177.7	-2.5	113.6	C72 R73	R38-C72 CarbonylContact O-C 3.56Å; R38-C72 WeakPolarHBondContact O-CA 3.31Å; R38-R73 HydrophobicContact CB-CB 4.27Å; R38-R73 PolarHBondContact O-N 2.76Å
39	P	94.5	Very high	93.2	Very high	90 Å²	90	57.5 Å²	57.5	58%	0.584	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.1	137.5	167.3	27.7	-33.8	0	0	0	109.9	Y70	P39-Y70 HydrophobicContact CB-CD1 4.1Å; P39-Y70 HydrophobicContact CB-CD2 4.45Å; P39-Y70 HydrophobicContact CB-CG 3.8Å
40	C	93.6	Very high	93.2	Very high	66 Å²	66	57.9 Å²	57.9	45%	0.446	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	-54.2	-173.6	-167.1	0	0	0	0	111.8	Y71 R73	C40-Y71 PolarHBondContact N-O 3.29Å; C40-R73 HydrophobicContact CB-CB 3.93Å; C40-R73 HydrophobicContact CB-CG 4.43Å
41	T	94.4	Very high	93.2	Very high	42 Å²	42	66.4 Å²	66.4	26%	0.258	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135.1	-176	-45.2	0	0	0	0	110.4	Y70 Y71 T76	T41-Y70 CarbonylContact O-C 3.51Å; T41-Y70 WeakPolarHBondContact O-CA 3.31Å; T41-Y71 HydrophobicContact CG2-CD2 4.43Å; T41-Y71 PolarHBondContact N-O 3.27Å; T41-Y71 PolarHBondContact O-N 3.07Å; T41-T76 WeakPolarHBondContact OG1-CG2 3.35Å; T41-T76 PolarHBondContact OG1-OG1 2.71Å
42	L	94.9	Very high	93.2	Very high	70 Å²	70	68.2 Å²	68.2	37%	0.366	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	139.7	170.9	-90	159.7	0	0	0	111.2	I19 D68 Y70	I19-L42 HydrophobicContact CG2-CD2 4.13Å; L42-D68 HydrophobicContact CD2-CB 4.19Å; L42-Y70 HydrophobicContact CB-CE1 4.49Å; L42-Y70 HydrophobicContact CD2-CD1 4.22Å; L42-Y70 HydrophobicContact CD2-CE1 3.6Å; L42-Y70 HydrophobicContact CD2-CE2 4.12Å; L42-Y70 HydrophobicContact CG-CD1 4.14Å; L42-Y70 HydrophobicContact CG-CE1 3.53Å
43	V	95.7	Very high	93.1	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	37%	0.366	C	S	.	.			trans	-84.5	131.4	179.8	172.9	0	0	0	0	110.8	G20 V31 A69 Y71 P86	G20-V43 PolarHBondContact N-O 2.93Å; V31-V43 HydrophobicContact CG2-CB 4.39Å; V31-V43 HydrophobicContact CG2-CG1 4.3Å; V31-V43 HydrophobicContact CG2-CG2 3.41Å; V31-V43 VanDerWaalsContact CG2-CG2 3.41Å; V43-A69 HydrophobicContact CB-CB 3.82Å; V43-A69 WeakPolarHBondContact CB-O 3.46Å; V43-A69 HydrophobicContact CG1-CB 4.31Å; V43-A69 HydrophobicContact CG2-CB 3.91Å; V43-A69 WeakPolarHBondContact CG2-O 3.47Å; V43-A69 PolarHBondContact N-O 2.92Å; V43-Y71 HydrophobicContact CB-CD2 4.43Å; V43-Y71 HydrophobicContact CB-CE2 4Å; V43-Y71 HydrophobicContact CG1-CE2 4.28Å; V43-Y71 HydrophobicContact CG2-CD1 4.28Å; V43-Y71 HydrophobicContact CG2-CD2 3.58Å; V43-Y71 HydrophobicContact CG2-CE1 4.21Å; V43-Y71 HydrophobicContact CG2-CE2 3.52Å; V43-Y71 HydrophobicContact CG2-CG 4Å; V43-P86 HydrophobicContact CG1-CG 3.41Å; V43-P86 VanDerWaalsContact CG1-CG 3.41Å
44	R	95.3	Very high	93.1	Very high	117 Å²	117	76.1 Å²	76.1	44%	0.442	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-108.3	137.8	173.4	-62.6	-78.3	-177.6	143.7	8.2	110.1	P15 V17 A18 P86	P15-R44 HydrophobicContact CB-CB 3.78Å; V17-R44 PolarHBondContact O-NH1 2.84Å; A18-R44 WeakPolarHBondContact O-CA 3.2Å; R44-P86 WeakPolarHBondContact O-CD 3.46Å
45	I	95.4	Very high	93.1	Very high	3 Å²	3	81.2 Å²	81.2	2%	0.015	41%	0.405	C	S	.	.			trans	-111.2	150.1	178.2	40.9	173.8	0	0	0	110.3	G16 A18 N50 V59 K87	G16-I45 PolarHBondContact N-O 3.11Å; A18-I45 HydrophobicContact CB-CD1 4.24Å; A18-I45 HydrophobicContact CB-CG1 3.8Å; A18-I45 WeakPolarHBondContact O-CG1 3.3Å; A18-I45 PolarHBondContact O-N 3.45Å; I45-N50 HydrophobicContact CD1-CB 3.8Å; I45-N50 HydrophobicContact CG1-CB 4.37Å; I45-V59 HydrophobicContact CG2-CG2 4.11Å; I45-K87 HydrophobicContact CG2-CB 4.31Å; I45-K87 HydrophobicContact CG2-CD 4.41Å
46	C	95.6	Very high	93.1	Very high	5 Å²	5	81.3 Å²	81.3	3%	0.034	41%	0.411	C	S	.	.			trans	-68	155.3	175	66.9	0	0	0	0	111.1	C11 K13 Q14 E48 C49 N50 C85	C11-C46 VanDerWaalsContact SG-SG 3.69Å; K13-C46 HydrophobicContact CB-CB 3.86Å; Q14-C46 WeakPolarHBondContact O-CA 3.36Å; Q14-C46 WeakPolarHBondContact O-CB 3.35Å; C46-E48 VanDerWaalsContact C-N 3.26Å; C46-E48 PolarHBondContact O-N 3.23Å; C46-C49 PolarHBondContact O-N 3.34Å; C46-C49 VanDerWaalsContact O-N 3.11Å; C46-C49 WeakPolarHBondContact SG-CB 3.24Å; C46-C49 PolarHBondContact SG-SG 2.96Å; C46-N50 PolarHBondContact O-N 3.13Å; C46-C85 HydrophobicContact CB-CB 3.89Å; C46-C85 PolarHBondContact N-SG 3.3Å
47	D	92.9	Very high	93.3	Very high	105 Å²	105	78.6 Å²	78.6	56%	0.561	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-35.4	-175	-62.3	-39.6	0	0	0	112.4	C49 N50 Y51	D47-C49 PolarHBondContact O-N 2.91Å; D47-N50 CarbonylContact O-C 3.42Å; D47-N50 PolarHBondContact O-N 3.39Å; D47-N50 VanDerWaalsContact O-N 3.15Å; D47-Y51 PolarHBondContact O-N 3.04Å
48	E	93.2	Very high	93.4	Very high	124 Å²	124	73.8 Å²	73.8	58%	0.579	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-64.9	-38.2	177.3	-163.6	-179.4	142.1	0	0	112.6	K13 C46 N50 Y51	K13-E48 IonicContact NZ-OE1 2.75Å; K13-E48 PolarHBondContact NZ-OE1 2.96Å; K13-E48 IonicContact NZ-OE2 2.58Å; K13-E48 PolarHBondContact NZ-OE2 3.21Å; C46-E48 VanDerWaalsContact C-N 3.26Å; C46-E48 PolarHBondContact O-N 3.23Å; E48-N50 PolarHBondContact O-N 3.07Å; E48-Y51 PolarHBondContact O-N 3.07Å
49	C	93.8	Very high	93.4	Very high	16 Å²	16	64.6 Å²	64.6	11%	0.108	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-75.4	-9.1	177.2	-84	0	0	0	0	113.8	C11 C46 D47 K87	C11-C49 VanDerWaalsContact SG-SG 3.63Å; C46-C49 PolarHBondContact O-N 3.34Å; C46-C49 VanDerWaalsContact O-N 3.11Å; C46-C49 WeakPolarHBondContact SG-CB 3.24Å; C46-C49 PolarHBondContact SG-SG 2.96Å; D47-C49 PolarHBondContact O-N 2.91Å; C49-K87 HydrophobicContact CB-CB 4.21Å; C49-K87 HydrophobicContact CB-CD 3.99Å; C49-K87 HydrophobicContact CB-CG 4.26Å; C49-K87 PolarHBondContact O-NZ 3.26Å
50	N	93	Very high	93.2	Very high	40 Å²	40	60.9 Å²	60.9	21%	0.214	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-118	21.1	177.4	-163.9	46.7	0	0	0	112.4	A18 I45 C46 D47 E48 Q55	A18-N50 HydrophobicContact CB-CB 3.9Å; A18-N50 WeakPolarHBondContact CB-ND2 3.26Å; I45-N50 HydrophobicContact CD1-CB 3.8Å; I45-N50 HydrophobicContact CG1-CB 4.37Å; C46-N50 PolarHBondContact O-N 3.13Å; D47-N50 CarbonylContact O-C 3.42Å; D47-N50 PolarHBondContact O-N 3.39Å; D47-N50 VanDerWaalsContact O-N 3.15Å; E48-N50 PolarHBondContact O-N 3.07Å; N50-Q55 WeakPolarHBondContact O-CG 3.19Å; N50-Q55 WeakPolarHBondContact OD1-CA 3.22Å
51	Y	92.5	Very high	93	Very high	183 Å²	183	59.5 Å²	59.5	72%	0.718	30%	0.302	S	S	*	.	S	Bend	trans	-91.7	133.8	-178.1	-174.7	-106	0	0	0	112.8	D47 E48 S53 Y54	D47-Y51 PolarHBondContact O-N 3.04Å; E48-Y51 PolarHBondContact O-N 3.07Å; Y51-S53 PolarHBondContact O-N 2.98Å; Y51-Y54 WeakPolarHBondContact O-CB 3.44Å; Y51-Y54 PolarHBondContact O-N 3.24Å; Y51-Y54 VanDerWaalsContact O-N 3.08Å
52	G	92.6	Very high	92.8	Very high	37 Å²	37	59.3 Å²	59.3	38%	0.381	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	53.2	-121.6	172.8	0	0	0	0	0	113.9	Y54 Q55	G52-Y54 PolarHBondContact O-N 3.33Å; G52-Y54 VanDerWaalsContact O-N 3.09Å; G52-Q55 VanDerWaalsContact O-CB 3.24Å; G52-Q55 WeakPolarHBondContact O-CB 2.99Å; G52-Q55 WeakPolarHBondContact O-CG 3.33Å; G52-Q55 PolarHBondContact O-N 3.28Å
53	S	90.5	Very high	92.6	Very high	86 Å²	86	57 Å²	57	60%	0.601	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-64.9	-12.8	-178.1	71.9	0	0	0	0	114.9	Y51 Q55 R57	Y51-S53 PolarHBondContact O-N 2.98Å; S53-Q55 VanDerWaalsContact C-N 3.32Å; S53-R57 VanDerWaalsContact O-CZ 3.26Å; S53-R57 PolarHBondContact O-NE 3.43Å; S53-R57 PolarHBondContact O-NH2 3.44Å
54	Y	89.9	Confident	92.5	Very high	126 Å²	126	62.2 Å²	62.2	49%	0.494	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-84	-6.8	174.8	-65.9	-71.4	0	0	0	113.7	Y51 G52 R57 K87	Y51-Y54 WeakPolarHBondContact O-CB 3.44Å; Y51-Y54 PolarHBondContact O-N 3.24Å; Y51-Y54 VanDerWaalsContact O-N 3.08Å; G52-Y54 PolarHBondContact O-N 3.33Å; G52-Y54 VanDerWaalsContact O-N 3.09Å; Y54-R57 WeakPolarHBondContact O-CB 3.22Å; Y54-R57 PolarHBondContact O-N 2.86Å; Y54-K87 PolarHBondContact O-NZ 2.73Å
55	Q	91.4	Very high	92.4	Very high	121 Å²	121	57.5 Å²	57.5	57%	0.565	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	138.7	176.5	-74.9	177	-5.1	0	0	111.8	N50 G52 S53 R57	N50-Q55 WeakPolarHBondContact O-CG 3.19Å; N50-Q55 WeakPolarHBondContact OD1-CA 3.22Å; G52-Q55 VanDerWaalsContact O-CB 3.24Å; G52-Q55 WeakPolarHBondContact O-CB 2.99Å; G52-Q55 WeakPolarHBondContact O-CG 3.33Å; G52-Q55 PolarHBondContact O-N 3.28Å; S53-Q55 VanDerWaalsContact C-N 3.32Å; Q55-R57 PolarHBondContact O-N 2.94Å
56	G	90.8	Very high	92.4	Very high	32 Å²	32	61.2 Å²	61.2	33%	0.33	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	13.5	177.2	0	0	0	0	0	114.4	G65	G56-G65 WeakPolarHBondContact O-CA 3.3Å; G56-G65 PolarHBondContact O-N 3.03Å
57	R	94	Very high	92.3	Very high	91 Å²	91	62.2 Å²	62.2	34%	0.343	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-83.2	144.2	177	-67.2	-166.4	-173.3	-173.9	5.9	112.5	S53 Y54 Q55 V59 G62 G63 K87	S53-R57 VanDerWaalsContact O-CZ 3.26Å; S53-R57 PolarHBondContact O-NE 3.43Å; S53-R57 PolarHBondContact O-NH2 3.44Å; Y54-R57 WeakPolarHBondContact O-CB 3.22Å; Y54-R57 PolarHBondContact O-N 2.86Å; Q55-R57 PolarHBondContact O-N 2.94Å; R57-V59 PolarHBondContact O-N 2.75Å; R57-G62 WeakPolarHBondContact CD-O 3.47Å; R57-G63 CarbonylContact C-O 3.54Å; R57-G63 WeakPolarHBondContact CA-O 3.07Å; R57-K87 PolarHBondContact O-NZ 3.19Å
58	C	94.1	Very high	92.4	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.007	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-52.6	127.1	176.1	-176.9	0	0	0	0	111.6	R21 C23 I60 C61 G62 G63	R21-C58 CarbonylContact O-C 3.42Å; R21-C58 WeakPolarHBondContact O-CA 3.5Å; C23-C58 HydrophobicContact CB-CB 3.87Å; C23-C58 PolarHBondContact N-SG 2.9Å; C58-I60 VanDerWaalsContact C-N 3.26Å; C58-I60 PolarHBondContact O-N 2.77Å; C58-C61 PolarHBondContact SG-SG 3.34Å; C58-G62 WeakPolarHBondContact O-CA 3.45Å; C58-G62 PolarHBondContact O-N 3.34Å; C58-G63 WeakPolarHBondContact CB-O 3.45Å; C58-G63 PolarHBondContact N-O 3.19Å
59	V	93.3	Very high	92.5	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.006	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-29.7	-178.3	-176.1	0	0	0	0	112.3	R21 L22 V31 I45 R57 A69 P86 K87 I88	R21-V59 WeakPolarHBondContact O-CG2 3.46Å; R21-V59 PolarHBondContact O-N 3.33Å; L22-V59 HydrophobicContact CD2-CB 4.48Å; V31-V59 HydrophobicContact CG1-CB 4.2Å; V31-V59 HydrophobicContact CG1-CG1 3.49Å; V31-V59 VanDerWaalsContact CG1-CG1 3.49Å; I45-V59 HydrophobicContact CG2-CG2 4.11Å; R57-V59 PolarHBondContact O-N 2.75Å; V59-A69 HydrophobicContact CG2-CB 4.39Å; V59-P86 HydrophobicContact CG1-CG 4.09Å; V59-P86 VanDerWaalsContact CG1-O 3.31Å; V59-P86 WeakPolarHBondContact CG1-O 3.37Å; V59-K87 HydrophobicContact CG1-CB 4.14Å; V59-I88 PolarHBondContact O-N 3.01Å
60	I	91.2	Very high	92.6	Very high	12 Å²	12	57.4 Å²	57.4	6%	0.062	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-45.8	-176.8	-57	176.1	0	0	0	112.1	M1 L22 C26 K29 V31 C58 I88	M1-I60 HydrophobicContact CB-CG2 4.26Å; L22-I60 HydrophobicContact CD2-CD1 3.77Å; L22-I60 HydrophobicContact CD2-CG1 3.84Å; C26-I60 HydrophobicContact CB-CD1 4.27Å; K29-I60 HydrophobicContact CB-CD1 4.15Å; V31-I60 HydrophobicContact CG1-CG1 4.14Å; C58-I60 VanDerWaalsContact C-N 3.26Å; C58-I60 PolarHBondContact O-N 2.77Å; I60-I88 HydrophobicContact CG2-CD1 4.19Å
61	C	89	Confident	92.7	Very high	38 Å²	38	55.9 Å²	55.9	26%	0.257	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-5.8	-167.7	76.4	0	0	0	0	115.1	C23 C58 G63 K95	C23-C61 PolarHBondContact SG-SG 3.41Å; C58-C61 PolarHBondContact SG-SG 3.34Å; C61-G63 VanDerWaalsContact C-N 3.25Å; C61-G63 PolarHBondContact O-N 3.37Å; C61-K95 PolarHBondContact O-NZ 3.46Å
62	G	89.2	Confident	92.8	Very high	38 Å²	38	47.4 Å²	47.4	39%	0.392	28%	0.282	S	S	.	.			trans	72.8	5	-178.3	0	0	0	0	0	116	R57 C58	R57-G62 WeakPolarHBondContact CD-O 3.47Å; C58-G62 WeakPolarHBondContact O-CA 3.45Å; C58-G62 PolarHBondContact O-N 3.34Å
63	G	90.7	Very high	93	Very high	21 Å²	21	53.3 Å²	53.3	22%	0.216	29%	0.293	C	S	.	.	S	Bend	trans	-73	178.6	174.3	0	0	0	0	0	113.7	R57 C58 C61 G65	R57-G63 CarbonylContact C-O 3.54Å; R57-G63 WeakPolarHBondContact CA-O 3.07Å; C58-G63 WeakPolarHBondContact CB-O 3.45Å; C58-G63 PolarHBondContact N-O 3.19Å; C61-G63 VanDerWaalsContact C-N 3.25Å; C61-G63 PolarHBondContact O-N 3.37Å; G63-G65 PolarHBondContact O-N 3.04Å
64	P	94.3	Very high	93.2	Very high	109 Å²	109	55.6 Å²	55.6	71%	0.708	29%	0.294	S	S	*	.	B	Isolated β-bridge	trans	-64.2	125.1	175.1	27.5	-33.5	0	0	0	110.4	C23	C23-P64 VanDerWaalsContact CA-O 3.3Å; C23-P64 WeakPolarHBondContact CA-O 2.78Å; C23-P64 WeakPolarHBondContact CB-O 3.06Å
65	G	93.7	Very high	93.4	Very high	18 Å²	18	49.8 Å²	49.8	19%	0.186	27%	0.272	C	S	.	.			trans	-87.2	133.8	-179.1	0	0	0	0	0	111.9	L22 G56 G63	L22-G65 CarbonylContact O-C 3.55Å; L22-G65 WeakPolarHBondContact O-CA 3.2Å; G56-G65 WeakPolarHBondContact O-CA 3.3Å; G56-G65 PolarHBondContact O-N 3.03Å; G63-G65 PolarHBondContact O-N 3.04Å
66	V	94.3	Very high	93.5	Very high	82 Å²	82	45.6 Å²	45.6	50%	0.497	26%	0.255	S	S	.	.			trans	-113	-54.4	-177.2	-175.6	0	0	0	0	109.9	R21 L22 E24	R21-V66 PolarHBondContact NH2-O 3.35Å; L22-V66 PolarHBondContact O-N 3.35Å; E24-V66 HydrophobicContact CG-CG2 3.84Å
67	S	94.8	Very high	93.8	Very high	25 Å²	25	48.7 Å²	48.7	18%	0.175	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	159.5	-177.7	55.3	0	0	0	0	112.5	R21 L22 D27	R21-S67 CarbonylContact C-O 3.51Å; R21-S67 WeakPolarHBondContact CA-O 3.21Å; L22-S67 PolarHBondContact N-O 3.08Å; L22-S67 PolarHBondContact O-N 3.09Å; D27-S67 VanDerWaalsContact CG-OG 3.26Å; D27-S67 WeakPolarHBondContact OD1-CB 3.47Å; D27-S67 PolarHBondContact OD1-OG 3.04Å
68	D	94.8	Very high	93.8	Very high	55 Å²	55	49.2 Å²	49.2	29%	0.294	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	142.1	175.2	-63.7	-28.6	0	0	0	111.2	I19 R21 L42 Y70	I19-D68 HydrophobicContact CG2-CB 4.16Å; R21-D68 WeakPolarHBondContact CD-OD1 3.34Å; R21-D68 IonicContact CZ-OD1 2.75Å; R21-D68 IonicContact NE-OD1 3.36Å; R21-D68 IonicContact NH1-OD1 3.95Å; R21-D68 PolarHBondContact NH1-OD1 2.8Å; L42-D68 HydrophobicContact CD2-CB 4.19Å; D68-Y70 HydrophobicContact CB-CE2 4.08Å; D68-Y70 WeakPolarHBondContact O-CD2 3.41Å
69	A	94.9	Very high	93.8	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-86.1	140.4	-178.5	0	0	0	0	0	111.2	G20 L22 V31 V43 V59	G20-A69 VanDerWaalsContact O-CB 3.31Å; G20-A69 WeakPolarHBondContact O-CB 3.36Å; G20-A69 PolarHBondContact O-N 3.44Å; L22-A69 HydrophobicContact CD1-CB 4.05Å; L22-A69 HydrophobicContact CD2-CB 4.22Å; L22-A69 HydrophobicContact CG-CB 3.74Å; V31-A69 HydrophobicContact CG2-CB 4.15Å; V43-A69 HydrophobicContact CB-CB 3.82Å; V43-A69 WeakPolarHBondContact CB-O 3.46Å; V43-A69 HydrophobicContact CG1-CB 4.31Å; V43-A69 HydrophobicContact CG2-CB 3.91Å; V43-A69 WeakPolarHBondContact CG2-O 3.47Å; V43-A69 PolarHBondContact N-O 2.92Å; V59-A69 HydrophobicContact CG2-CB 4.39Å
70	Y	95.4	Very high	93.7	Very high	90 Å²	90	58.2 Å²	58.2	35%	0.353	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	149.5	178.9	-71.4	-93.2	0	0	0	112.1	C30 P39 T41 L42 D68	C30-Y70 WeakPolarHBondContact CA-O 3.36Å; P39-Y70 HydrophobicContact CB-CD1 4.1Å; P39-Y70 HydrophobicContact CB-CD2 4.45Å; P39-Y70 HydrophobicContact CB-CG 3.8Å; T41-Y70 CarbonylContact O-C 3.51Å; T41-Y70 WeakPolarHBondContact O-CA 3.31Å; L42-Y70 HydrophobicContact CB-CE1 4.49Å; L42-Y70 HydrophobicContact CD2-CD1 4.22Å; L42-Y70 HydrophobicContact CD2-CE1 3.6Å; L42-Y70 HydrophobicContact CD2-CE2 4.12Å; L42-Y70 HydrophobicContact CG-CD1 4.14Å; L42-Y70 HydrophobicContact CG-CE1 3.53Å; D68-Y70 HydrophobicContact CB-CE2 4.08Å; D68-Y70 WeakPolarHBondContact O-CD2 3.41Å
71	Y	95.3	Very high	93.8	Very high	7 Å²	7	59.2 Å²	59.2	3%	0.027	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	136.8	160.9	-60	-78.1	0	0	0	109.2	I32 C40 T41 V43 D81 P86	I32-Y71 HydrophobicContact CD1-CD1 3.93Å; I32-Y71 HydrophobicContact CD1-CE1 3.71Å; I32-Y71 HydrophobicContact CG1-CD1 4.07Å; I32-Y71 HydrophobicContact CG1-CE1 3.92Å; C40-Y71 PolarHBondContact N-O 3.29Å; T41-Y71 HydrophobicContact CG2-CD2 4.43Å; T41-Y71 PolarHBondContact N-O 3.27Å; T41-Y71 PolarHBondContact O-N 3.07Å; V43-Y71 HydrophobicContact CB-CD2 4.43Å; V43-Y71 HydrophobicContact CB-CE2 4Å; V43-Y71 HydrophobicContact CG1-CE2 4.28Å; V43-Y71 HydrophobicContact CG2-CD1 4.28Å; V43-Y71 HydrophobicContact CG2-CD2 3.58Å; V43-Y71 HydrophobicContact CG2-CE1 4.21Å; V43-Y71 HydrophobicContact CG2-CE2 3.52Å; V43-Y71 HydrophobicContact CG2-CG 4Å; Y71-D81 HydrophobicContact CD1-CB 4.15Å; Y71-D81 HydrophobicContact CD2-CB 3.62Å; Y71-D81 HydrophobicContact CE1-CB 4.32Å; Y71-D81 HydrophobicContact CE2-CB 3.79Å; Y71-D81 HydrophobicContact CG-CB 3.78Å; Y71-P86 HydrophobicContact CE1-CB 4.36Å; Y71-P86 HydrophobicContact CE1-CG 4.33Å; Y71-P86 WeakPolarHBondContact OH-CD 3.46Å; Y71-P86 VanDerWaalsContact OH-CG 3.26Å; Y71-P86 WeakPolarHBondContact OH-CG 3.42Å
72	C	95.1	Very high	93.9	Very high	5 Å²	5	66 Å²	66	3%	0.034	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	155.9	172.1	71.4	0	0	0	0	110.8	C30 C33 S35 R38 Q74 C75 T76	C30-C72 HydrophobicContact CB-CB 3.87Å; C30-C72 PolarHBondContact SG-N 3.2Å; C33-C72 PolarHBondContact SG-SG 3.11Å; S35-C72 WeakPolarHBondContact OG-CB 3.38Å; S35-C72 PolarHBondContact OG-SG 3.14Å; S35-C72 VanDerWaalsContact OG-SG 3.38Å; R38-C72 CarbonylContact O-C 3.56Å; R38-C72 WeakPolarHBondContact O-CA 3.31Å; C72-Q74 PolarHBondContact O-N 3.46Å; C72-Q74 VanDerWaalsContact O-N 3.12Å; C72-C75 WeakPolarHBondContact O-CB 3.32Å; C72-C75 PolarHBondContact O-N 3.33Å; C72-T76 PolarHBondContact O-N 3.33Å; C72-T76 VanDerWaalsContact O-N 3.09Å; C72-T76 PolarHBondContact O-OG1 3.15Å
73	R	95.4	Very high	94	Very high	161 Å²	161	67.8 Å²	67.8	61%	0.608	35%	0.346	S	S	*	.	H	α-helix	trans	-54.2	-35.3	-179.1	-171.8	158.3	179.5	170.4	-1.1	113.5	R38 C40 T76 C77	R38-R73 HydrophobicContact CB-CB 4.27Å; R38-R73 PolarHBondContact O-N 2.76Å; C40-R73 HydrophobicContact CB-CB 3.93Å; C40-R73 HydrophobicContact CB-CG 4.43Å; R73-T76 PolarHBondContact O-N 3.44Å; R73-C77 WeakPolarHBondContact O-CB 3.27Å; R73-C77 PolarHBondContact O-N 3.28Å; R73-C77 PolarHBondContact O-SG 3.49Å
74	Q	95	Very high	94.1	Very high	134 Å²	134	67.1 Å²	67.1	63%	0.626	34%	0.339	S	S	*	.	H	α-helix	trans	-65.8	-40.4	176.8	-173	-178.8	9.7	0	0	112.1	C72 C77 L78	C72-Q74 PolarHBondContact O-N 3.46Å; C72-Q74 VanDerWaalsContact O-N 3.12Å; Q74-C77 PolarHBondContact O-N 2.86Å; Q74-L78 HydrophobicContact CG-CD1 4.25Å; Q74-L78 VanDerWaalsContact O-CG 3.3Å; Q74-L78 WeakPolarHBondContact O-CG 3.43Å; Q74-L78 PolarHBondContact O-N 2.83Å; Q74-L78 VanDerWaalsContact O-N 3.11Å
75	C	94.5	Very high	94.1	Very high	4 Å²	4	61.9 Å²	61.9	3%	0.027	31%	0.305	C	S	.	.	H	α-helix	trans	-67.3	-40.1	176.8	-72.1	0	0	0	0	111.3	C30 C72 L78 E79 K80	C30-C75 VanDerWaalsContact SG-SG 3.66Å; C72-C75 WeakPolarHBondContact O-CB 3.32Å; C72-C75 PolarHBondContact O-N 3.33Å; C75-L78 CarbonylContact O-C 3.45Å; C75-L78 PolarHBondContact O-N 2.91Å; C75-E79 PolarHBondContact O-N 3.22Å; C75-K80 HydrophobicContact CB-CB 4.37Å; C75-K80 PolarHBondContact O-N 2.8Å
76	T	94.7	Very high	94.1	Very high	34 Å²	34	61.1 Å²	61.1	21%	0.209	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-43.8	174.2	-50.1	0	0	0	0	111.9	T41 C72 R73 L78 E79	T41-T76 WeakPolarHBondContact OG1-CG2 3.35Å; T41-T76 PolarHBondContact OG1-OG1 2.71Å; C72-T76 PolarHBondContact O-N 3.33Å; C72-T76 VanDerWaalsContact O-N 3.09Å; C72-T76 PolarHBondContact O-OG1 3.15Å; R73-T76 PolarHBondContact O-N 3.44Å; T76-L78 PolarHBondContact O-N 2.95Å; T76-E79 WeakPolarHBondContact O-CA 3.43Å; T76-E79 PolarHBondContact O-N 3.46Å
77	C	95.2	Very high	94	Very high	96 Å²	96	57.8 Å²	57.8	65%	0.649	28%	0.276	S	S	*	.	H	α-helix	trans	-65.5	-28.2	177.3	-71	0	0	0	0	113.2	R73 Q74	R73-C77 WeakPolarHBondContact O-CB 3.27Å; R73-C77 PolarHBondContact O-N 3.28Å; R73-C77 PolarHBondContact O-SG 3.49Å; Q74-C77 PolarHBondContact O-N 2.86Å
78	L	95.5	Very high	93.9	Very high	103 Å²	103	57.6 Å²	57.6	54%	0.539	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	8.7	173.7	-65.5	173.9	0	0	0	112.5	Q74 C75 T76 K80	Q74-L78 HydrophobicContact CG-CD1 4.25Å; Q74-L78 VanDerWaalsContact O-CG 3.3Å; Q74-L78 WeakPolarHBondContact O-CG 3.43Å; Q74-L78 PolarHBondContact O-N 2.83Å; Q74-L78 VanDerWaalsContact O-N 3.11Å; C75-L78 CarbonylContact O-C 3.45Å; C75-L78 PolarHBondContact O-N 2.91Å; T76-L78 PolarHBondContact O-N 2.95Å; L78-K80 HydrophobicContact CB-CD 4.46Å; L78-K80 HydrophobicContact CB-CG 3.99Å; L78-K80 PolarHBondContact O-N 3.47Å
79	E	93.9	Very high	93.7	Very high	106 Å²	106	59.1 Å²	59.1	50%	0.495	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	19.1	-178.2	-54.1	-163.9	133.6	0	0	115.2	C75 T76 D81 R82	C75-E79 PolarHBondContact O-N 3.22Å; T76-E79 WeakPolarHBondContact O-CA 3.43Å; T76-E79 PolarHBondContact O-N 3.46Å; E79-D81 PolarHBondContact O-N 3.39Å; E79-R82 WeakPolarHBondContact O-CB 3.44Å; E79-R82 PolarHBondContact O-N 3.5Å; E79-R82 VanDerWaalsContact O-N 3.07Å; E79-R82 IonicContact OE1-CZ 3.63Å; E79-R82 IonicContact OE1-NH1 3.22Å; E79-R82 PolarHBondContact OE1-NH1 2.92Å; E79-R82 IonicContact OE1-NH2 2.74Å; E79-R82 IonicContact OE2-NH1 2.8Å
80	K	91.9	Very high	93.3	Very high	84 Å²	84	61.4 Å²	61.4	37%	0.365	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-70.7	-15.7	-179.5	-61.5	-168.3	176.4	-170	0	113.1	I32 C75 L78 R82	I32-K80 HydrophobicContact CD1-CB 3.54Å; I32-K80 WeakPolarHBondContact CD1-O 3.34Å; I32-K80 HydrophobicContact CG2-CD 4.01Å; C75-K80 HydrophobicContact CB-CB 4.37Å; C75-K80 PolarHBondContact O-N 2.8Å; L78-K80 HydrophobicContact CB-CD 4.46Å; L78-K80 HydrophobicContact CB-CG 3.99Å; L78-K80 PolarHBondContact O-N 3.47Å; K80-R82 PolarHBondContact O-N 3.26Å
81	D	91.9	Very high	92.7	Very high	33 Å²	33	63.1 Å²	63.1	18%	0.176	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-70.1	-12.4	171.9	60.8	-37.9	0	0	0	112.9	Y71 E79	Y71-D81 HydrophobicContact CD1-CB 4.15Å; Y71-D81 HydrophobicContact CD2-CB 3.62Å; Y71-D81 HydrophobicContact CE1-CB 4.32Å; Y71-D81 HydrophobicContact CE2-CB 3.79Å; Y71-D81 HydrophobicContact CG-CB 3.78Å; E79-D81 PolarHBondContact O-N 3.39Å
82	R	91.4	Very high	92.2	Very high	181 Å²	181	63.2 Å²	63.2	68%	0.683	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-98.1	-4.7	-179.9	-58.4	-173.9	-179	162.4	5.9	114.9	E79 K80 G84	E79-R82 WeakPolarHBondContact O-CB 3.44Å; E79-R82 PolarHBondContact O-N 3.5Å; E79-R82 VanDerWaalsContact O-N 3.07Å; E79-R82 IonicContact OE1-CZ 3.63Å; E79-R82 IonicContact OE1-NH1 3.22Å; E79-R82 PolarHBondContact OE1-NH1 2.92Å; E79-R82 IonicContact OE1-NH2 2.74Å; E79-R82 IonicContact OE2-NH1 2.8Å; K80-R82 PolarHBondContact O-N 3.26Å; R82-G84 PolarHBondContact O-N 3.31Å; R82-G84 VanDerWaalsContact O-N 3.13Å
83	D	91	Very high	91.7	Very high	76 Å²	76	65.8 Å²	65.8	41%	0.406	33%	0.332	S	S	.	.	S	Bend	trans	-67	-12.1	-178.6	-69.1	-17.3	0	0	0	114.3	R12	R12-D83 IonicContact CZ-OD2 3.76Å; R12-D83 VanDerWaalsContact NH1-CG 3.32Å; R12-D83 IonicContact NH1-OD2 3.74Å; R12-D83 PolarHBondContact NH1-OD2 3.09Å; R12-D83 IonicContact NH2-OD2 3.41Å; R12-D83 PolarHBondContact NH2-OD2 3.12Å
84	G	93.1	Very high	91.1	Very high	6 Å²	6	59.9 Å²	59.9	6%	0.062	32%	0.317	C	S	.	.	S	Bend	trans	112.1	-165.5	-178	0	0	0	0	0	114.3	R82 P86	R82-G84 PolarHBondContact O-N 3.31Å; R82-G84 VanDerWaalsContact O-N 3.13Å; G84-P86 WeakPolarHBondContact O-CD 3.24Å
85	C	94.4	Very high	90.6	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.311	C	S	.	.			trans	-59.3	116.9	-173.7	179.9	0	0	0	0	112	C11 R12 K13 C46 K87	C11-C85 HydrophobicContact CB-CB 4.17Å; R12-C85 PolarHBondContact N-O 2.82Å; K13-C85 VanDerWaalsContact O-CB 3.27Å; K13-C85 WeakPolarHBondContact O-CB 3.35Å; K13-C85 PolarHBondContact O-N 3.07Å; C46-C85 HydrophobicContact CB-CB 3.89Å; C46-C85 PolarHBondContact N-SG 3.3Å; C85-K87 VanDerWaalsContact C-N 3.26Å; C85-K87 PolarHBondContact O-N 2.58Å
86	P	93.5	Very high	90.1	Very high	1 Å²	1	61 Å²	61	1%	0.006	32%	0.324	C	S	.	.			trans	-88.4	17	-176	39.1	-40.4	0	0	0	113.1	F10 V31 V43 R44 V59 Y71 G84	F10-P86 WeakPolarHBondContact CD1-O 3.38Å; V31-P86 HydrophobicContact CB-CB 4.31Å; V31-P86 HydrophobicContact CG1-CB 3.85Å; V31-P86 HydrophobicContact CG1-CG 4.1Å; V43-P86 HydrophobicContact CG1-CG 3.41Å; V43-P86 VanDerWaalsContact CG1-CG 3.41Å; R44-P86 WeakPolarHBondContact O-CD 3.46Å; V59-P86 HydrophobicContact CG1-CG 4.09Å; V59-P86 VanDerWaalsContact CG1-O 3.31Å; V59-P86 WeakPolarHBondContact CG1-O 3.37Å; Y71-P86 HydrophobicContact CE1-CB 4.36Å; Y71-P86 HydrophobicContact CE1-CG 4.33Å; Y71-P86 WeakPolarHBondContact OH-CD 3.46Å; Y71-P86 VanDerWaalsContact OH-CG 3.26Å; Y71-P86 WeakPolarHBondContact OH-CG 3.42Å; G84-P86 WeakPolarHBondContact O-CD 3.24Å
87	K	92.9	Very high	89.7	Confident	13 Å²	13	63.7 Å²	63.7	6%	0.057	34%	0.337	C	S	.	.			trans	-72.5	131.5	177.9	-170.7	128	168.5	-170.1	0	110.5	C11 I45 C49 Y54 R57 V59 C85	C11-K87 WeakPolarHBondContact CB-O 3.35Å; C11-K87 PolarHBondContact N-O 2.75Å; I45-K87 HydrophobicContact CG2-CB 4.31Å; I45-K87 HydrophobicContact CG2-CD 4.41Å; C49-K87 HydrophobicContact CB-CB 4.21Å; C49-K87 HydrophobicContact CB-CD 3.99Å; C49-K87 HydrophobicContact CB-CG 4.26Å; C49-K87 PolarHBondContact O-NZ 3.26Å; Y54-K87 PolarHBondContact O-NZ 2.73Å; R57-K87 PolarHBondContact O-NZ 3.19Å; V59-K87 HydrophobicContact CG1-CB 4.14Å; C85-K87 VanDerWaalsContact C-N 3.26Å; C85-K87 PolarHBondContact O-N 2.58Å
88	I	92	Very high	89.3	Confident	20 Å²	20	63.1 Å²	63.1	10%	0.103	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-79.3	123.8	176.5	-59.5	-174.6	0	0	0	108.5	A2 L8 I9 F10 V59 I60 N90	A2-I88 HydrophobicContact CB-CD1 3.96Å; L8-I88 HydrophobicContact CB-CD1 4.28Å; L8-I88 HydrophobicContact CB-CG2 4.22Å; L8-I88 HydrophobicContact CD1-CD1 3.99Å; L8-I88 HydrophobicContact CD2-CG2 3.92Å; I9-I88 WeakPolarHBondContact O-CA 3.25Å; F10-I88 HydrophobicContact CD1-CG1 4.1Å; F10-I88 HydrophobicContact CE1-CD1 4.38Å; F10-I88 HydrophobicContact CE1-CG1 4.05Å; V59-I88 PolarHBondContact O-N 3.01Å; I60-I88 HydrophobicContact CG2-CD1 4.19Å; I88-N90 WeakPolarHBondContact CG2-O 3.44Å
89	V	90.2	Very high	88.8	Confident	88 Å²	88	64.3 Å²	64.3	53%	0.533	33%	0.328	S	S	.	.			trans	-93.1	-33.1	-174.7	-84.8	0	0	0	0	113	I9 C11	I9-V89 HydrophobicContact CB-CG2 4.14Å; I9-V89 HydrophobicContact CG2-CG2 3.97Å; I9-V89 VanDerWaalsContact O-CG2 3.24Å; I9-V89 WeakPolarHBondContact O-CG2 3.36Å; I9-V89 PolarHBondContact O-N 3.2Å; C11-V89 HydrophobicContact CB-CG1 4.08Å
90	N	87.8	Confident	88.4	Confident	47 Å²	47	66.3 Å²	66.3	25%	0.251	33%	0.332	S	S	.	.	S	Bend	trans	-93.9	151.7	179.4	66.1	-37.3	0	0	0	112.2	D7 I9 I88	D7-N90 PolarHBondContact O-ND2 2.77Å; I9-N90 PolarHBondContact N-OD1 2.72Å; I88-N90 WeakPolarHBondContact CG2-O 3.44Å
91	L	82.4	Confident	88.2	Confident	127 Å²	127	67.9 Å²	67.9	67%	0.665	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-82.1	117.8	161.7	-97.1	99.5	0	0	0	108.4	K95 T96	L91-K95 HydrophobicContact CD2-CD 4.18Å; L91-T96 HydrophobicContact CB-CG2 4.49Å
92	G	83.5	Confident	87.8	Confident	9 Å²	9	73.8 Å²	73.8	9%	0.093	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-66.1	154	178.2	0	0	0	0	0	113.9	D7 A94 K95 T96	D7-G92 WeakPolarHBondContact OD2-CA 3.27Å; G92-A94 VanDerWaalsContact C-N 3.26Å; G92-A94 PolarHBondContact O-N 3.16Å; G92-K95 PolarHBondContact O-N 3.33Å; G92-T96 PolarHBondContact O-N 3.45Å
93	S	84.5	Confident	87.4	Confident	59 Å²	59	72.4 Å²	72.4	41%	0.413	36%	0.359	S	S	.	.	H	α-helix	trans	-56.9	-39.5	-173.6	-46.2	0	0	0	0	112	D7 K95 T96 D97	D7-S93 PolarHBondContact OD2-N 3.49Å; D7-S93 PolarHBondContact OD2-OG 3.21Å; S93-K95 PolarHBondContact O-N 3.32Å; S93-K95 VanDerWaalsContact O-N 3.1Å; S93-T96 WeakPolarHBondContact CA-OG1 3.39Å; S93-T96 PolarHBondContact O-N 3.12Å; S93-T96 VanDerWaalsContact O-N 3.12Å; S93-T96 PolarHBondContact O-OG1 3.03Å; S93-D97 WeakPolarHBondContact O-CB 3.38Å; S93-D97 PolarHBondContact O-N 3.38Å
94	A	84.4	Confident	86.9	Confident	37 Å²	37	76.6 Å²	76.6	31%	0.306	37%	0.374	S	S	.	.	H	α-helix	trans	-58.2	-31.9	-179.9	0	0	0	0	0	113.1	H5 G92 L98	H5-A94 WeakPolarHBondContact CE1-CB 3.35Å; G92-A94 VanDerWaalsContact C-N 3.26Å; G92-A94 PolarHBondContact O-N 3.16Å; A94-L98 WeakPolarHBondContact O-CB 3.43Å; A94-L98 PolarHBondContact O-N 3.1Å
95	K	83.6	Confident	86	Confident	113 Å²	113	83.7 Å²	83.7	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-84.1	-33.7	-179.6	-157.6	175.5	-177	-173.1	0	111.6	C61 L91 G92 S93 F99	C61-K95 PolarHBondContact O-NZ 3.46Å; L91-K95 HydrophobicContact CD2-CD 4.18Å; G92-K95 PolarHBondContact O-N 3.33Å; S93-K95 PolarHBondContact O-N 3.32Å; S93-K95 VanDerWaalsContact O-N 3.1Å; K95-F99 PolarHBondContact O-N 2.8Å
96	T	85.1	Confident	84.8	Confident	49 Å²	49	86.4 Å²	86.4	30%	0.301	43%	0.428	S	S	.	.	H	α-helix	trans	-70.1	-43.2	175.9	51.4	0	0	0	0	111.1	L91 G92 S93 L98 F99 Y100	L91-T96 HydrophobicContact CB-CG2 4.49Å; G92-T96 PolarHBondContact O-N 3.45Å; S93-T96 WeakPolarHBondContact CA-OG1 3.39Å; S93-T96 PolarHBondContact O-N 3.12Å; S93-T96 VanDerWaalsContact O-N 3.12Å; S93-T96 PolarHBondContact O-OG1 3.03Å; T96-L98 PolarHBondContact O-N 3.04Å; T96-F99 WeakPolarHBondContact O-CB 3.32Å; T96-F99 PolarHBondContact O-N 3.24Å; T96-F99 VanDerWaalsContact O-N 3.16Å; T96-Y100 WeakPolarHBondContact O-CD2 3.42Å; T96-Y100 PolarHBondContact O-N 2.84Å; T96-Y100 VanDerWaalsContact O-N 3.11Å
97	D	86.2	Confident	83.2	Confident	90 Å²	90	94.3 Å²	94.3	48%	0.481	46%	0.463	S	S	.	.	H	α-helix	trans	-63.9	-45.1	-179.1	-64.4	-15.3	0	0	0	110.6	S93 F99 Y100 E101	S93-D97 WeakPolarHBondContact O-CB 3.38Å; S93-D97 PolarHBondContact O-N 3.38Å; D97-F99 PolarHBondContact O-N 3.41Å; D97-Y100 PolarHBondContact O-N 3.44Å; D97-E101 WeakPolarHBondContact O-CG 3.46Å; D97-E101 PolarHBondContact O-N 3.04Å
98	L	86	Confident	81.6	Confident	84 Å²	84	102.9 Å²	102.9	44%	0.44	50%	0.5	S	S	.	.	H	α-helix	trans	-62.4	-29.3	177.7	-138.6	132.2	0	0	0	112.9	A94 T96 R102	A94-L98 WeakPolarHBondContact O-CB 3.43Å; A94-L98 PolarHBondContact O-N 3.1Å; T96-L98 PolarHBondContact O-N 3.04Å; L98-R102 VanDerWaalsContact O-CG 3.27Å; L98-R102 WeakPolarHBondContact O-CG 3.19Å; L98-R102 PolarHBondContact O-N 2.86Å
99	F	85.5	Confident	80.1	Confident	128 Å²	128	111.3 Å²	111.3	56%	0.561	54%	0.536	S	S	*	.	H	α-helix	trans	-70.6	-46.3	173.3	172.7	-96.4	0	0	0	111.2	K95 T96 D97 R102 K103	K95-F99 PolarHBondContact O-N 2.8Å; T96-F99 WeakPolarHBondContact O-CB 3.32Å; T96-F99 PolarHBondContact O-N 3.24Å; T96-F99 VanDerWaalsContact O-N 3.16Å; D97-F99 PolarHBondContact O-N 3.41Å; F99-R102 PolarHBondContact O-N 3.36Å; F99-K103 PolarHBondContact O-N 3.07Å
100	Y	85.7	Confident	78.5	Confident	147 Å²	147	122.1 Å²	122.1	58%	0.576	57%	0.567	S	S	*	*	H	α-helix	trans	-69.7	-36.1	179.9	-75.1	-67.1	0	0	0	112.9	T96 D97 K103 K104	T96-Y100 WeakPolarHBondContact O-CD2 3.42Å; T96-Y100 PolarHBondContact O-N 2.84Å; T96-Y100 VanDerWaalsContact O-N 3.11Å; D97-Y100 PolarHBondContact O-N 3.44Å; Y100-K103 PolarHBondContact O-N 3.42Å; Y100-K104 WeakPolarHBondContact O-CB 3.09Å; Y100-K104 PolarHBondContact O-N 2.82Å
101	E	86.5	Confident	78	Confident	118 Å²	118	125.9 Å²	125.9	55%	0.551	58%	0.583	S	S	*	*	H	α-helix	trans	-60.4	-47	172.6	-74.4	-175.2	157.2	0	0	111.5	D97 K103 K104 Y105	D97-E101 WeakPolarHBondContact O-CG 3.46Å; D97-E101 PolarHBondContact O-N 3.04Å; E101-K103 VanDerWaalsContact C-N 3.29Å; E101-K103 PolarHBondContact O-N 3.21Å; E101-K104 PolarHBondContact O-N 3.27Å; E101-Y105 WeakPolarHBondContact O-CD2 3.19Å; E101-Y105 PolarHBondContact O-N 2.85Å; E101-Y105 VanDerWaalsContact O-N 3.09Å
102	R	84	Confident	77.8	Confident	156 Å²	156	125.8 Å²	125.8	59%	0.589	58%	0.578	S	S	*	*	H	α-helix	trans	-61.7	-37.2	176.7	-74.6	176.8	-175	-164.6	2	112.6	L98 F99 G106	L98-R102 VanDerWaalsContact O-CG 3.27Å; L98-R102 WeakPolarHBondContact O-CG 3.19Å; L98-R102 PolarHBondContact O-N 2.86Å; F99-R102 PolarHBondContact O-N 3.36Å; R102-G106 PolarHBondContact O-N 3.27Å
103	K	83	Confident	77.5	Confident	152 Å²	152	132.3 Å²	132.3	66%	0.661	61%	0.605	S	S	*	*	H	α-helix	trans	-67.7	-41.9	176	-168.5	178.7	-178.4	-177.9	0	111.5	F99 Y100 E101 G106	F99-K103 PolarHBondContact O-N 3.07Å; Y100-K103 PolarHBondContact O-N 3.42Å; E101-K103 VanDerWaalsContact C-N 3.29Å; E101-K103 PolarHBondContact O-N 3.21Å; K103-G106 PolarHBondContact O-N 2.88Å
104	K	80.9	Confident	77.1	Confident	165 Å²	165	136.6 Å²	136.6	72%	0.717	62%	0.617	S	S	*	*	H	α-helix	trans	-63.3	-42.5	-179.4	-171.6	179	-179.5	-176.6	0	112.2	Y100 E101	Y100-K104 WeakPolarHBondContact O-CB 3.09Å; Y100-K104 PolarHBondContact O-N 2.82Å; E101-K104 PolarHBondContact O-N 3.27Å
105	Y	73	Confident	76.6	Confident	154 Å²	154	142.8 Å²	142.8	60%	0.604	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	4.3	-176.6	-63	-68.8	0	0	0	114.3	E101 F107	E101-Y105 WeakPolarHBondContact O-CD2 3.19Å; E101-Y105 PolarHBondContact O-N 2.85Å; E101-Y105 VanDerWaalsContact O-N 3.09Å; Y105-F107 PolarHBondContact O-N 3.07Å
106	G	69.4	Low	76.2	Confident	57 Å²	57	144.8 Å²	144.8	59%	0.588	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.2	20.6	171.2	0	0	0	0	0	115.2	R102 K103 K108	R102-G106 PolarHBondContact O-N 3.27Å; K103-G106 PolarHBondContact O-N 2.88Å; G106-K108 PolarHBondContact O-N 3.11Å
107	F	60.5	Low	75.5	Confident	167 Å²	167	151.6 Å²	151.6	73%	0.732	67%	0.67	S	S	*	*			trans	-62.7	99.9	179.5	-85.1	-83.4	0	0	0	109.5	Y105 K109	Y105-F107 PolarHBondContact O-N 3.07Å; F107-K109 PolarHBondContact O-N 3.47Å
108	K	59.7	Low	74.7	Confident	193 Å²	193	156.4 Å²	156.4	84%	0.839	69%	0.685	S	S	*	*			trans	-55.8	131.6	162.6	-85.2	-178.8	175.9	176.9	0	107.1	G106 R110	G106-K108 PolarHBondContact O-N 3.11Å; K108-R110 PolarHBondContact O-N 3.09Å
109	K	60.1	Low	73.8	Confident	198 Å²	198	162.4 Å²	162.4	86%	0.861	71%	0.705	S	S	*	*			trans	-52.1	117.7	165.7	-110.8	-178.8	173.2	-176	0	106.6	F107	F107-K109 PolarHBondContact O-N 3.47Å
110	R	56.8	Low	72.7	Confident	314 Å²	314	165.5 Å²	165.5	100%	1.185	72%	0.719	S	S	*	*			trans	-63.8	0	170.4	-152.1	-179.2	-167.4	179.8	3.4	109.2	K108	K108-R110 PolarHBondContact O-N 3.09Å

Retrieved 110 of 110 residues in 19.9 ms (Link to these results)

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