A0A5K4FBP5_SCHMA Loading...

Non-specific protein-tyrosine kinase AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FBP5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 321 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	59.4	Low	81.5	Confident	118 Å²	118	117.9 Å²	117.9	58%	0.581	65%	0.647	S	S	*	*				0	74.9	0	-68.6	154.4	-176.5	0	0	109.2	L15 P18	M1-L15 HydrophobicContact CB-CB 4.34Å; M1-L15 HydrophobicContact CE-CB 3.75Å; M1-L15 HydrophobicContact CE-CD1 4.29Å; M1-L15 HydrophobicContact CE-CG 4.47Å; M1-L15 HydrophobicContact CG-CB 3.68Å; M1-L15 HydrophobicContact CG-CD1 4.43Å; M1-L15 HydrophobicContact SD-CB 3.38Å; M1-L15 WeakPolarHBondContact SD-CB 3.18Å; M1-P18 HydrophobicContact CE-CB 4.07Å
2	K	62.6	Low	82.3	Confident	213 Å²	213	111.8 Å²	111.8	93%	0.926	63%	0.632	S	S	*	*			trans	-91.1	-14.1	-167.2	-72.8	-175	176.8	-178.7	0	114.7
3	T	76.6	Confident	82.9	Confident	113 Å²	113	107.2 Å²	107.2	69%	0.693	62%	0.616	S	S	*	*	S	Bend	trans	-93.8	-11.8	-169.2	63	0	0	0	0	114.5	T5	T3-T5 WeakPolarHBondContact CB-OG1 3.38Å; T3-T5 PolarHBondContact O-N 3.08Å; T3-T5 PolarHBondContact O-OG1 2.86Å; T3-T5 PolarHBondContact OG1-OG1 2.92Å
4	Q	77.3	Confident	83.2	Confident	163 Å²	163	103.3 Å²	103.3	76%	0.762	60%	0.597	S	S	*	*			trans	45.4	22.1	-171.1	-67.2	-169.8	-12.4	0	0	114.1	C14	Q4-C14 PolarHBondContact O-SG 3.29Å
5	T	85	Confident	83.5	Confident	88 Å²	88	103.5 Å²	103.5	54%	0.54	60%	0.595	S	S	.	*			trans	-74.3	130.9	-178.6	-44.7	0	0	0	0	108.6	T3 V7	T3-T5 WeakPolarHBondContact CB-OG1 3.38Å; T3-T5 PolarHBondContact O-N 3.08Å; T3-T5 PolarHBondContact O-OG1 2.86Å; T3-T5 PolarHBondContact OG1-OG1 2.92Å; T5-V7 PolarHBondContact O-N 3.47Å
6	P	87.8	Confident	83.6	Confident	58 Å²	58	104.6 Å²	104.6	38%	0.377	60%	0.603	S	S	.	*			trans	-55.3	136.7	174.2	-27.4	35.5	0	0	0	111.7	T8 A13	P6-T8 WeakPolarHBondContact CB-O 3.36Å; P6-T8 PolarHBondContact O-N 3.44Å; P6-A13 CarbonylContact C-O 3.56Å; P6-A13 WeakPolarHBondContact CA-O 3.47Å
7	V	88.5	Confident	83.7	Confident	92 Å²	92	104.6 Å²	104.6	56%	0.558	61%	0.606	S	S	*	*	S	Bend	trans	-57.5	-37.8	175.1	176.4	0	0	0	0	110.3	T5 A13 L15	T5-V7 PolarHBondContact O-N 3.47Å; V7-A13 WeakPolarHBondContact CG2-O 3.4Å; V7-A13 PolarHBondContact N-O 3.2Å; V7-L15 HydrophobicContact CG2-CD1 4.39Å; V7-L15 HydrophobicContact CG2-CD2 3.91Å; V7-L15 HydrophobicContact CG2-CG 3.8Å
8	T	88.7	Confident	83.7	Confident	73 Å²	73	103.8 Å²	103.8	45%	0.448	61%	0.605	S	S	.	*	S	Bend	trans	-140.3	145.3	166.9	65.8	0	0	0	0	109.7	P6 K10 S11 G12	P6-T8 WeakPolarHBondContact CB-O 3.36Å; P6-T8 PolarHBondContact O-N 3.44Å; T8-K10 PolarHBondContact O-N 3.37Å; T8-S11 PolarHBondContact O-N 3.3Å; T8-S11 PolarHBondContact O-OG 3.04Å; T8-S11 VanDerWaalsContact OG1-CB 3.26Å; T8-S11 WeakPolarHBondContact OG1-CB 3.26Å; T8-S11 PolarHBondContact OG1-N 2.79Å; T8-S11 PolarHBondContact OG1-OG 3.2Å; T8-G12 PolarHBondContact O-N 3.37Å; T8-G12 VanDerWaalsContact O-N 3.15Å
9	A	87.7	Confident	83.7	Confident	105 Å²	105	107.1 Å²	107.1	87%	0.868	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-36.1	176.6	0	0	0	0	0	112.5
10	K	91.7	Very high	83.6	Confident	208 Å²	208	106.9 Å²	106.9	90%	0.904	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-36.6	179.6	-174.3	177.6	179.2	-179.6	0	113.4	T8	T8-K10 PolarHBondContact O-N 3.37Å
11	S	91.3	Very high	83.3	Confident	66 Å²	66	108.9 Å²	108.9	46%	0.462	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.4	-29.3	-176.7	64.8	0	0	0	0	113.1	T8 A13	T8-S11 PolarHBondContact O-N 3.3Å; T8-S11 PolarHBondContact O-OG 3.04Å; T8-S11 VanDerWaalsContact OG1-CB 3.26Å; T8-S11 WeakPolarHBondContact OG1-CB 3.26Å; T8-S11 PolarHBondContact OG1-N 2.79Å; T8-S11 PolarHBondContact OG1-OG 3.2Å; S11-A13 PolarHBondContact O-N 2.77Å; S11-A13 PolarHBondContact OG-N 3.16Å
12	G	91.1	Very high	84.5	Confident	45 Å²	45	105.7 Å²	105.7	46%	0.464	61%	0.608	S	S	.	*			trans	62.9	5	-168.6	0	0	0	0	0	113.6	T8 C14	T8-G12 PolarHBondContact O-N 3.37Å; T8-G12 VanDerWaalsContact O-N 3.15Å; G12-C14 PolarHBondContact O-N 3.15Å
13	A	89.3	Confident	85.7	Confident	51 Å²	51	103.4 Å²	103.4	42%	0.421	61%	0.606	S	S	.	*			trans	-74.6	121.2	-172.7	0	0	0	0	0	110.1	P6 V7 S11	P6-A13 CarbonylContact C-O 3.56Å; P6-A13 WeakPolarHBondContact CA-O 3.47Å; V7-A13 WeakPolarHBondContact CG2-O 3.4Å; V7-A13 PolarHBondContact N-O 3.2Å; S11-A13 PolarHBondContact O-N 2.77Å; S11-A13 PolarHBondContact OG-N 3.16Å
14	C	88.2	Confident	86.3	Confident	53 Å²	53	102.2 Å²	102.2	36%	0.358	59%	0.589	S	S	.	*			trans	-106.4	140.4	177.8	-61.5	0	0	0	0	110.3	Q4 G12 V16	Q4-C14 PolarHBondContact O-SG 3.29Å; G12-C14 PolarHBondContact O-N 3.15Å; C14-V16 PolarHBondContact O-N 3.18Å
15	L	86.6	Confident	87	Confident	107 Å²	107	97 Å²	97	56%	0.56	56%	0.564	S	S	*	*			trans	-75.1	123.9	174.9	-57.5	174.2	0	0	0	109.4	M1 V7	M1-L15 HydrophobicContact CB-CB 4.34Å; M1-L15 HydrophobicContact CE-CB 3.75Å; M1-L15 HydrophobicContact CE-CD1 4.29Å; M1-L15 HydrophobicContact CE-CG 4.47Å; M1-L15 HydrophobicContact CG-CB 3.68Å; M1-L15 HydrophobicContact CG-CD1 4.43Å; M1-L15 HydrophobicContact SD-CB 3.38Å; M1-L15 WeakPolarHBondContact SD-CB 3.18Å; V7-L15 HydrophobicContact CG2-CD1 4.39Å; V7-L15 HydrophobicContact CG2-CD2 3.91Å; V7-L15 HydrophobicContact CG2-CG 3.8Å
16	V	86.4	Confident	87.4	Confident	121 Å²	121	93 Å²	93	73%	0.733	54%	0.54	S	S	*	.			trans	-106.6	-68.6	-175.6	-174.7	0	0	0	0	111.1	C14	C14-V16 PolarHBondContact O-N 3.18Å
17	T	84.6	Confident	87.6	Confident	105 Å²	105	91.1 Å²	91.1	64%	0.644	53%	0.526	S	S	*	.	S	Bend	trans	-122.1	122.1	-174	-54.8	0	0	0	0	109.1	I19	T17-I19 PolarHBondContact O-N 3.22Å
18	P	84	Confident	87.8	Confident	90 Å²	90	87.3 Å²	87.3	58%	0.584	50%	0.503	S	S	*	.			trans	-64.7	129.3	171.3	27.7	-31.9	0	0	0	109.3	M1	M1-P18 HydrophobicContact CE-CB 4.07Å
19	I	82.6	Confident	88	Confident	165 Å²	165	93.7 Å²	93.7	85%	0.846	52%	0.519	S	S	*	.			trans	-88.8	110.4	170.5	-60.8	172	0	0	0	106.4	T17	T17-I19 PolarHBondContact O-N 3.22Å
20	S	81.8	Confident	88.4	Confident	104 Å²	104	92.9 Å²	92.9	73%	0.727	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-70.7	147.9	175.9	-59.7	0	0	0	0	110
21	R	78.5	Confident	88.6	Confident	149 Å²	149	83.3 Å²	83.3	56%	0.562	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-65.3	142.5	172.3	-65.5	178.6	-173.9	171	-5.9	108.9
22	P	84.7	Confident	88.8	Confident	50 Å²	50	85.9 Å²	85.9	33%	0.325	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-68.1	150.4	173.3	31	-34	0	0	0	110	W24 E25	P22-W24 HydrophobicContact CB-CD2 4.36Å; P22-W24 HydrophobicContact CB-CG 4.24Å; P22-W24 HydrophobicContact CB-CZ2 4.36Å; P22-W24 VanDerWaalsContact CB-NE1 3.28Å; P22-W24 HydrophobicContact CG-CD2 3.94Å; P22-W24 HydrophobicContact CG-CG 4.33Å; P22-W24 HydrophobicContact CG-CH2 4.24Å; P22-W24 HydrophobicContact CG-CZ2 3.49Å; P22-W24 VanDerWaalsContact CG-CZ2 3.49Å; P22-W24 PolarHBondContact O-N 3.23Å; P22-E25 HydrophobicContact CG-CB 3.91Å; P22-E25 WeakPolarHBondContact O-CB 3.39Å; P22-E25 PolarHBondContact O-N 2.67Å
23	D	86.8	Confident	89.1	Confident	165 Å²	165	86.4 Å²	86.4	88%	0.882	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.5	-174.9	-61.8	-26.5	0	0	0	113.8
24	W	90.2	Very high	89.3	Confident	88 Å²	88	87.7 Å²	87.7	33%	0.333	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-17.6	176.9	62.6	-106.2	0	0	0	113.7	P22 L26 T78 L81 G93 I94	P22-W24 HydrophobicContact CB-CD2 4.36Å; P22-W24 HydrophobicContact CB-CG 4.24Å; P22-W24 HydrophobicContact CB-CZ2 4.36Å; P22-W24 VanDerWaalsContact CB-NE1 3.28Å; P22-W24 HydrophobicContact CG-CD2 3.94Å; P22-W24 HydrophobicContact CG-CG 4.33Å; P22-W24 HydrophobicContact CG-CH2 4.24Å; P22-W24 HydrophobicContact CG-CZ2 3.49Å; P22-W24 VanDerWaalsContact CG-CZ2 3.49Å; P22-W24 PolarHBondContact O-N 3.23Å; W24-L26 PolarHBondContact O-N 3.05Å; W24-L26 VanDerWaalsContact O-N 3.16Å; W24-T78 HydrophobicContact CZ2-CG2 4.38Å; W24-L81 HydrophobicContact CB-CD1 3.71Å; W24-L81 HydrophobicContact CB-CD2 4.04Å; W24-L81 HydrophobicContact CB-CG 4.43Å; W24-L81 HydrophobicContact CD2-CD1 3.48Å; W24-L81 VanDerWaalsContact CD2-CD1 3.48Å; W24-L81 HydrophobicContact CE3-CD1 3.64Å; W24-L81 HydrophobicContact CG-CD1 3.52Å; W24-L81 HydrophobicContact CZ3-CD1 4.48Å; W24-G93 CarbonylContact O-C 3.53Å; W24-G93 WeakPolarHBondContact O-CA 3.42Å; W24-I94 HydrophobicContact CE3-CB 4.4Å; W24-I94 HydrophobicContact CE3-CG1 4.49Å; W24-I94 HydrophobicContact CZ3-CB 4.46Å; W24-I94 PolarHBondContact O-N 3.31Å
25	E	91.7	Very high	89.6	Confident	54 Å²	54	91 Å²	91	25%	0.252	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	93	179.7	-171.4	-175.4	149.3	0	0	109.7	P22 V96	P22-E25 HydrophobicContact CG-CB 3.91Å; P22-E25 WeakPolarHBondContact O-CB 3.39Å; P22-E25 PolarHBondContact O-N 2.67Å; E25-V96 HydrophobicContact CG-CG2 3.97Å
26	L	93.3	Very high	89.9	Confident	5 Å²	5	90 Å²	90	3%	0.026	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	156.2	-173.9	-47.7	-173.9	0	0	0	111.4	W24 V31 Y50 I94 A95 Q97 V104	W24-L26 PolarHBondContact O-N 3.05Å; W24-L26 VanDerWaalsContact O-N 3.16Å; L26-V31 HydrophobicContact CD1-CG2 4.36Å; L26-Y50 HydrophobicContact CB-CE2 4.42Å; L26-Y50 HydrophobicContact CD1-CD1 4.45Å; L26-Y50 HydrophobicContact CD1-CD2 4.27Å; L26-Y50 HydrophobicContact CD1-CE1 4.18Å; L26-Y50 HydrophobicContact CD1-CE2 4.01Å; L26-Y50 HydrophobicContact CD1-CG 4.5Å; L26-Y50 HydrophobicContact CD2-CE1 4.19Å; L26-Y50 HydrophobicContact CD2-CE2 4.24Å; L26-Y50 WeakPolarHBondContact CD2-OH 3.45Å; L26-Y50 HydrophobicContact CG-CE2 4.45Å; L26-I94 PolarHBondContact N-O 2.61Å; L26-A95 HydrophobicContact CB-CB 3.98Å; L26-A95 WeakPolarHBondContact O-CA 3.49Å; L26-Q97 PolarHBondContact O-NE2 2.86Å; L26-V104 HydrophobicContact CD1-CB 3.86Å; L26-V104 HydrophobicContact CD1-CG1 4.41Å; L26-V104 HydrophobicContact CD1-CG2 3.68Å
27	D	91.5	Very high	90	Very high	18 Å²	18	88 Å²	88	10%	0.096	44%	0.44	C	S	.	.			trans	-84.5	130.1	165	-160.6	-52.3	0	0	0	109.6	R29 D30 Q97	D27-R29 PolarHBondContact O-N 2.92Å; D27-R29 VanDerWaalsContact O-N 3.1Å; D27-R29 VanDerWaalsContact OD1-CB 3.3Å; D27-R29 WeakPolarHBondContact OD1-CB 3.46Å; D27-R29 WeakPolarHBondContact OD1-CG 3.3Å; D27-R29 IonicContact OD1-CZ 3.85Å; D27-R29 PolarHBondContact OD1-N 3.1Å; D27-R29 IonicContact OD1-NE 3.23Å; D27-R29 PolarHBondContact OD1-NE 2.95Å; D27-R29 IonicContact OD1-NH2 3.9Å; D27-R29 IonicContact OD2-CZ 3.35Å; D27-R29 IonicContact OD2-NE 3.53Å; D27-R29 PolarHBondContact OD2-NE 3.31Å; D27-R29 IonicContact OD2-NH2 2.67Å; D27-R29 PolarHBondContact OD2-NH2 2.94Å; D27-D30 WeakPolarHBondContact CB-OD2 3.4Å; D27-D30 PolarHBondContact O-N 2.95Å; D27-Q97 VanDerWaalsContact CA-NE2 3.35Å; D27-Q97 PolarHBondContact OD2-OE1 2.95Å
28	N	92.5	Very high	90	Very high	11 Å²	11	84 Å²	84	6%	0.059	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-57.1	-26.7	177.3	-67	76.3	0	0	0	112	D30 V31 A95 Q97 S98 P100	N28-D30 VanDerWaalsContact C-N 3.3Å; N28-D30 PolarHBondContact O-N 2.99Å; N28-V31 PolarHBondContact O-N 2.98Å; N28-A95 HydrophobicContact CB-CB 4.32Å; N28-A95 PolarHBondContact ND2-O 3.16Å; N28-Q97 PolarHBondContact OD1-N 3.35Å; N28-S98 WeakPolarHBondContact CB-OG 3.47Å; N28-S98 PolarHBondContact ND2-O 3.5Å; N28-S98 VanDerWaalsContact ND2-O 3.11Å; N28-S98 PolarHBondContact OD1-N 3.24Å; N28-P100 PolarHBondContact ND2-O 3.01Å
29	R	93.8	Very high	89.9	Confident	207 Å²	207	84.8 Å²	84.8	78%	0.781	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-71	-23.9	178.4	-62.8	174.2	-68.6	170	3.1	113.3	D27 V31	D27-R29 PolarHBondContact O-N 2.92Å; D27-R29 VanDerWaalsContact O-N 3.1Å; D27-R29 VanDerWaalsContact OD1-CB 3.3Å; D27-R29 WeakPolarHBondContact OD1-CB 3.46Å; D27-R29 WeakPolarHBondContact OD1-CG 3.3Å; D27-R29 IonicContact OD1-CZ 3.85Å; D27-R29 PolarHBondContact OD1-N 3.1Å; D27-R29 IonicContact OD1-NE 3.23Å; D27-R29 PolarHBondContact OD1-NE 2.95Å; D27-R29 IonicContact OD1-NH2 3.9Å; D27-R29 IonicContact OD2-CZ 3.35Å; D27-R29 IonicContact OD2-NE 3.53Å; D27-R29 PolarHBondContact OD2-NE 3.31Å; D27-R29 IonicContact OD2-NH2 2.67Å; D27-R29 PolarHBondContact OD2-NH2 2.94Å; R29-V31 VanDerWaalsContact C-N 3.33Å
30	D	95	Very high	89.3	Confident	88 Å²	88	78.3 Å²	78.3	47%	0.471	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-85.5	-11.2	-179.7	-60	-25.2	0	0	0	112	D27 N28 Y50	D27-D30 WeakPolarHBondContact CB-OD2 3.4Å; D27-D30 PolarHBondContact O-N 2.95Å; N28-D30 VanDerWaalsContact C-N 3.3Å; N28-D30 PolarHBondContact O-N 2.99Å; D30-Y50 HydrophobicContact CB-CD2 4.1Å; D30-Y50 HydrophobicContact CB-CE2 3.78Å; D30-Y50 WeakPolarHBondContact O-CD2 3.18Å
31	V	96.3	Very high	88.5	Confident	8 Å²	8	77.1 Å²	77.1	5%	0.048	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	106.1	-179.9	-175.3	0	0	0	0	109.5	L26 N28 R29 L33 Y50 V57 A95 M102 V104	L26-V31 HydrophobicContact CD1-CG2 4.36Å; N28-V31 PolarHBondContact O-N 2.98Å; R29-V31 VanDerWaalsContact C-N 3.33Å; V31-L33 HydrophobicContact CG1-CD2 4.48Å; V31-Y50 HydrophobicContact CG2-CD2 3.8Å; V31-Y50 HydrophobicContact CG2-CE2 4.45Å; V31-V57 HydrophobicContact CG1-CG1 4.09Å; V31-V57 HydrophobicContact CG1-CG2 3.79Å; V31-A95 HydrophobicContact CG2-CB 4.31Å; V31-M102 HydrophobicContact CB-SD 4.04Å; V31-M102 HydrophobicContact CG1-SD 3.87Å; V31-V104 HydrophobicContact CG1-CG2 4.01Å; V31-V104 HydrophobicContact CG2-CG2 3.81Å
32	Q	96.6	Very high	88.1	Confident	119 Å²	119	72.9 Å²	72.9	56%	0.556	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	111.9	176.3	-171.2	-179.8	9.5	0	0	110.3	L34 G48 V49	Q32-L34 HydrophobicContact CG-CD2 3.91Å; Q32-G48 CarbonylContact O-C 3.59Å; Q32-G48 WeakPolarHBondContact O-CA 3.28Å; Q32-V49 HydrophobicContact CB-CB 4.43Å; Q32-V49 PolarHBondContact N-O 2.92Å; Q32-V49 PolarHBondContact O-N 3.31Å
33	L	95.8	Very high	87.9	Confident	57 Å²	57	70.7 Å²	70.7	30%	0.298	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	127.7	169.5	-57.3	-177.6	0	0	0	109.7	V31 Y46 V57 T59 M102	V31-L33 HydrophobicContact CG1-CD2 4.48Å; L33-Y46 HydrophobicContact CB-CD1 4.36Å; L33-Y46 HydrophobicContact CB-CG 4.42Å; L33-Y46 HydrophobicContact CD1-CD2 4.23Å; L33-Y46 HydrophobicContact CD1-CE2 4.22Å; L33-Y46 HydrophobicContact CD1-CG 4.45Å; L33-Y46 HydrophobicContact CD2-CD2 4.2Å; L33-Y46 HydrophobicContact CD2-CG 4.16Å; L33-V57 HydrophobicContact CD2-CB 3.66Å; L33-V57 HydrophobicContact CD2-CG1 3.54Å; L33-V57 HydrophobicContact CD2-CG2 4.02Å; L33-T59 HydrophobicContact CD1-CG2 4.23Å; L33-M102 HydrophobicContact CD1-CE 3.93Å; L33-M102 HydrophobicContact CD2-SD 4.09Å; L33-M102 HydrophobicContact CG-CE 4.22Å; L33-M102 HydrophobicContact CG-SD 4.38Å
34	L	95.5	Very high	88	Confident	78 Å²	78	63 Å²	63	41%	0.408	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-83	178.1	-58.6	179.5	0	0	0	110.9	Q32 R47 V49	Q32-L34 HydrophobicContact CG-CD2 3.91Å; L34-R47 WeakPolarHBondContact CA-O 3.32Å; L34-R47 VanDerWaalsContact CB-O 3.32Å; L34-R47 WeakPolarHBondContact CB-O 3.21Å; L34-R47 PolarHBondContact N-O 3.16Å; L34-V49 HydrophobicContact CD1-CG2 3.75Å; L34-V49 HydrophobicContact CG-CG2 4.49Å
35	Q	93.7	Very high	88	Confident	121 Å²	121	60.4 Å²	60.4	57%	0.565	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.9	-172	-177.6	-177.5	13	0	0	110.4	I37 Y46 R47	Q35-I37 PolarHBondContact O-N 3.19Å; Q35-Y46 CarbonylContact O-C 3.56Å; Q35-Y46 WeakPolarHBondContact O-CA 3.49Å; Q35-R47 PolarHBondContact N-O 2.85Å; Q35-R47 PolarHBondContact O-N 2.77Å
36	K	93.2	Very high	88.1	Confident	86 Å²	86	60.3 Å²	60.3	37%	0.374	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	124.2	169.3	-176.4	174.1	170.5	171.1	0	109.6	G38 Q39 D44 Y46	K36-G38 VanDerWaalsContact CE-O 3.3Å; K36-G38 WeakPolarHBondContact CE-O 3.43Å; K36-Q39 VanDerWaalsContact NZ-OE1 3.09Å; K36-D44 HydrophobicContact CD-CB 4.15Å; K36-D44 WeakPolarHBondContact CE-OD1 3.44Å; K36-D44 HydrophobicContact CG-CB 4.42Å; K36-D44 IonicContact NZ-OD1 2.77Å; K36-D44 PolarHBondContact NZ-OD1 3.43Å; K36-D44 IonicContact NZ-OD2 3.67Å; K36-D44 PolarHBondContact NZ-OD2 2.95Å; K36-D44 VanDerWaalsContact NZ-OD2 3.08Å; K36-Y46 HydrophobicContact CB-CD1 3.88Å; K36-Y46 HydrophobicContact CB-CE1 3.72Å; K36-Y46 HydrophobicContact CG-CE1 4.32Å
37	I	88.1	Confident	88.1	Confident	79 Å²	79	63.4 Å²	63.4	41%	0.405	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-17.8	-177.2	59.3	144.7	0	0	0	113.3	Q35 V45 R47 W107	Q35-I37 PolarHBondContact O-N 3.19Å; I37-V45 HydrophobicContact CD1-CB 4.41Å; I37-V45 HydrophobicContact CD1-CG1 3.67Å; I37-V45 HydrophobicContact CG1-CB 4.1Å; I37-V45 HydrophobicContact CG1-CG1 3.79Å; I37-V45 VanDerWaalsContact CG1-O 3.31Å; I37-V45 WeakPolarHBondContact CG1-O 3.42Å; I37-V45 PolarHBondContact N-O 2.82Å; I37-R47 HydrophobicContact CG2-CB 4.08Å; I37-W107 HydrophobicContact CD1-CH2 3.89Å; I37-W107 HydrophobicContact CD1-CZ3 3.46Å; I37-W107 VanDerWaalsContact CD1-CZ3 3.46Å; I37-W107 HydrophobicContact CG1-CZ3 4.23Å; I37-W107 HydrophobicContact CG2-CH2 3.85Å; I37-W107 HydrophobicContact CG2-CZ3 4.18Å
38	G	83.9	Confident	88.3	Confident	21 Å²	21	62.5 Å²	62.5	22%	0.216	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	176.5	-178.9	0	0	0	0	0	112.3	K36 V45	K36-G38 VanDerWaalsContact CE-O 3.3Å; K36-G38 WeakPolarHBondContact CE-O 3.43Å; G38-V45 PolarHBondContact N-O 2.88Å; G38-V45 VanDerWaalsContact N-O 3.16Å; G38-V45 PolarHBondContact O-N 2.88Å
39	Q	83.2	Confident	88.5	Confident	108 Å²	108	63.8 Å²	63.8	51%	0.505	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	110.3	176.7	178.5	172.9	-24.2	0	0	108.9	K36	K36-Q39 VanDerWaalsContact NZ-OE1 3.09Å
40	G	70.2	Confident	88.6	Confident	28 Å²	28	55.5 Å²	55.5	29%	0.289	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-177.6	174.2	0	0	0	0	0	112.5	F42 G43	G40-F42 VanDerWaalsContact C-N 3.26Å; G40-F42 PolarHBondContact O-N 2.97Å; G40-G43 PolarHBondContact N-O 2.95Å; G40-G43 PolarHBondContact O-N 3.18Å
41	N	65.1	Low	88.6	Confident	80 Å²	80	56.9 Å²	56.9	43%	0.428	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-35.3	-179.2	-65.6	-27.8	0	0	0	113.3
42	F	70.1	Confident	88.5	Confident	59 Å²	59	60 Å²	60	26%	0.259	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-7	-172.2	-57.9	-72.6	0	0	0	113.6	G40 C60 R61 V62 F73	G40-F42 VanDerWaalsContact C-N 3.26Å; G40-F42 PolarHBondContact O-N 2.97Å; F42-C60 CarbonylContact O-C 3.57Å; F42-C60 WeakPolarHBondContact O-CA 3.2Å; F42-R61 PolarHBondContact O-N 3.21Å; F42-V62 HydrophobicContact CD1-CG2 4.34Å; F42-F73 HydrophobicContact CB-CE2 3.96Å; F42-F73 HydrophobicContact CB-CZ 3.67Å; F42-F73 HydrophobicContact CD1-CD2 4.28Å; F42-F73 AromaticContact CD1-CE2 3.39Å; F42-F73 HydrophobicContact CD1-CE2 3.39Å; F42-F73 HydrophobicContact CD1-CZ 4.03Å; F42-F73 AromaticContact CD2-CE2 3.62Å; F42-F73 HydrophobicContact CD2-CE2 3.62Å; F42-F73 AromaticContact CD2-CZ 3.87Å; F42-F73 HydrophobicContact CD2-CZ 3.87Å; F42-F73 HydrophobicContact CE1-CD2 4.32Å; F42-F73 AromaticContact CE1-CE2 3.68Å; F42-F73 HydrophobicContact CE1-CE2 3.68Å; F42-F73 AromaticContact CE2-CE2 3.89Å; F42-F73 HydrophobicContact CE2-CE2 3.89Å; F42-F73 AromaticContact CG-CE2 3.35Å; F42-F73 HydrophobicContact CG-CE2 3.35Å; F42-F73 AromaticContact CG-CZ 3.57Å; F42-F73 HydrophobicContact CG-CZ 3.57Å; F42-F73 AromaticContact CZ-CE2 3.92Å; F42-F73 HydrophobicContact CZ-CE2 3.92Å
43	G	78.9	Confident	88.4	Confident	4 Å²	4	58.1 Å²	58.1	4%	0.041	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.3	-166.1	-179.6	0	0	0	0	0	112.8	G40 T59	G40-G43 PolarHBondContact N-O 2.95Å; G40-G43 PolarHBondContact O-N 3.18Å; G43-T59 CarbonylContact C-O 3.42Å; G43-T59 VanDerWaalsContact CA-O 3.23Å; G43-T59 WeakPolarHBondContact CA-O 3.29Å
44	D	89.6	Confident	88.3	Confident	5 Å²	5	59.9 Å²	59.9	3%	0.027	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	150.7	-172.1	-69.6	-17.4	0	0	0	111.7	K36 Y46 T59 R61	K36-D44 HydrophobicContact CD-CB 4.15Å; K36-D44 WeakPolarHBondContact CE-OD1 3.44Å; K36-D44 HydrophobicContact CG-CB 4.42Å; K36-D44 IonicContact NZ-OD1 2.77Å; K36-D44 PolarHBondContact NZ-OD1 3.43Å; K36-D44 IonicContact NZ-OD2 3.67Å; K36-D44 PolarHBondContact NZ-OD2 2.95Å; K36-D44 VanDerWaalsContact NZ-OD2 3.08Å; D44-Y46 HydrophobicContact CB-CD2 4.09Å; D44-Y46 HydrophobicContact CB-CE2 3.31Å; D44-Y46 PolarHBondContact OD2-OH 3.03Å; D44-T59 WeakPolarHBondContact CA-OG1 3.35Å; D44-T59 PolarHBondContact N-OG1 3.43Å; D44-T59 PolarHBondContact O-N 2.97Å; D44-T59 PolarHBondContact O-OG1 3.05Å; D44-R61 IonicContact OD1-CZ 3.86Å; D44-R61 IonicContact OD1-NE 3.61Å; D44-R61 IonicContact OD1-NH2 3.01Å; D44-R61 PolarHBondContact OD1-NH2 3.11Å; D44-R61 VanDerWaalsContact OD1-NH2 3.1Å; D44-R61 IonicContact OD2-CZ 2.65Å; D44-R61 IonicContact OD2-NE 3.96Å; D44-R61 IonicContact OD2-NH2 3.37Å; D44-R61 PolarHBondContact OD2-NH2 3.01Å
45	V	90.2	Very high	88.3	Confident	32 Å²	32	56.4 Å²	56.4	19%	0.194	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.8	170	-171.2	0	0	0	0	108.4	I37 G38 V57 K58	I37-V45 HydrophobicContact CD1-CB 4.41Å; I37-V45 HydrophobicContact CD1-CG1 3.67Å; I37-V45 HydrophobicContact CG1-CB 4.1Å; I37-V45 HydrophobicContact CG1-CG1 3.79Å; I37-V45 VanDerWaalsContact CG1-O 3.31Å; I37-V45 WeakPolarHBondContact CG1-O 3.42Å; I37-V45 PolarHBondContact N-O 2.82Å; G38-V45 PolarHBondContact N-O 2.88Å; G38-V45 VanDerWaalsContact N-O 3.16Å; G38-V45 PolarHBondContact O-N 2.88Å; V45-V57 CarbonylContact C-O 3.51Å; V45-V57 WeakPolarHBondContact CA-O 3.2Å; V45-K58 HydrophobicContact CG2-CB 4.49Å; V45-K58 HydrophobicContact CG2-CG 4.4Å
46	Y	93.3	Very high	88.3	Confident	52 Å²	52	51 Å²	51	20%	0.204	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149	180	-62.3	-98.6	0	0	0	111	L33 Q35 K36 D44 A56 V57 T59	L33-Y46 HydrophobicContact CB-CD1 4.36Å; L33-Y46 HydrophobicContact CB-CG 4.42Å; L33-Y46 HydrophobicContact CD1-CD2 4.23Å; L33-Y46 HydrophobicContact CD1-CE2 4.22Å; L33-Y46 HydrophobicContact CD1-CG 4.45Å; L33-Y46 HydrophobicContact CD2-CD2 4.2Å; L33-Y46 HydrophobicContact CD2-CG 4.16Å; Q35-Y46 CarbonylContact O-C 3.56Å; Q35-Y46 WeakPolarHBondContact O-CA 3.49Å; K36-Y46 HydrophobicContact CB-CD1 3.88Å; K36-Y46 HydrophobicContact CB-CE1 3.72Å; K36-Y46 HydrophobicContact CG-CE1 4.32Å; D44-Y46 HydrophobicContact CB-CD2 4.09Å; D44-Y46 HydrophobicContact CB-CE2 3.31Å; D44-Y46 PolarHBondContact OD2-OH 3.03Å; Y46-A56 CarbonylContact O-C 3.44Å; Y46-A56 WeakPolarHBondContact O-CA 3.47Å; Y46-V57 PolarHBondContact N-O 3.44Å; Y46-V57 PolarHBondContact O-N 3.15Å; Y46-T59 HydrophobicContact CD2-CG2 3.79Å; Y46-T59 HydrophobicContact CE2-CG2 3.61Å
47	R	94	Very high	88.3	Confident	70 Å²	70	46.9 Å²	46.9	26%	0.264	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	136.4	150.8	-177.9	170.8	169.2	-109.9	8.5	107.5	L34 Q35 I37 E54 W107	L34-R47 WeakPolarHBondContact CA-O 3.32Å; L34-R47 VanDerWaalsContact CB-O 3.32Å; L34-R47 WeakPolarHBondContact CB-O 3.21Å; L34-R47 PolarHBondContact N-O 3.16Å; Q35-R47 PolarHBondContact N-O 2.85Å; Q35-R47 PolarHBondContact O-N 2.77Å; I37-R47 HydrophobicContact CG2-CB 4.08Å; R47-E54 IonicContact CZ-OE1 2.69Å; R47-E54 IonicContact CZ-OE2 3.88Å; R47-E54 IonicContact NE-OE1 3.79Å; R47-E54 IonicContact NE-OE2 3.96Å; R47-E54 PolarHBondContact NE-OE2 3.19Å; R47-E54 IonicContact NH2-OE1 3.53Å; R47-E54 PolarHBondContact NH2-OE1 3.11Å; R47-E54 IonicContact NH2-OE2 2.73Å; R47-E54 PolarHBondContact NH2-OE2 3.04Å; R47-W107 HydrophobicContact CB-CE3 4.02Å; R47-W107 HydrophobicContact CB-CH2 3.8Å; R47-W107 HydrophobicContact CB-CZ2 4.33Å; R47-W107 HydrophobicContact CB-CZ3 3.58Å; R47-W107 HydrophobicContact CG-CD2 4.08Å; R47-W107 HydrophobicContact CG-CE3 3.97Å; R47-W107 HydrophobicContact CG-CH2 4.11Å; R47-W107 HydrophobicContact CG-CZ2 4.16Å; R47-W107 HydrophobicContact CG-CZ3 3.98Å
48	G	95.5	Very high	88.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	-178.5	-179.6	0	0	0	0	0	112.5	Q32 E54 V55	Q32-G48 CarbonylContact O-C 3.59Å; Q32-G48 WeakPolarHBondContact O-CA 3.28Å; G48-E54 WeakPolarHBondContact O-CA 3.44Å; G48-V55 PolarHBondContact N-O 2.77Å; G48-V55 PolarHBondContact O-N 3.43Å
49	V	97.1	Very high	88.7	Confident	37 Å²	37	42.9 Å²	42.9	22%	0.224	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	134.6	172.5	174.7	0	0	0	0	108.8	Q32 L34 C53	Q32-V49 HydrophobicContact CB-CB 4.43Å; Q32-V49 PolarHBondContact N-O 2.92Å; Q32-V49 PolarHBondContact O-N 3.31Å; L34-V49 HydrophobicContact CD1-CG2 3.75Å; L34-V49 HydrophobicContact CG-CG2 4.49Å; V49-C53 VanDerWaalsContact CA-O 3.28Å; V49-C53 WeakPolarHBondContact CA-O 3.43Å
50	Y	96.3	Very high	88.6	Confident	33 Å²	33	37.8 Å²	37.8	13%	0.129	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	128.4	173	174.4	-104.5	0	0	0	108.7	L26 D30 V31 G52 C53 V92	L26-Y50 HydrophobicContact CB-CE2 4.42Å; L26-Y50 HydrophobicContact CD1-CD1 4.45Å; L26-Y50 HydrophobicContact CD1-CD2 4.27Å; L26-Y50 HydrophobicContact CD1-CE1 4.18Å; L26-Y50 HydrophobicContact CD1-CE2 4.01Å; L26-Y50 HydrophobicContact CD1-CG 4.5Å; L26-Y50 HydrophobicContact CD2-CE1 4.19Å; L26-Y50 HydrophobicContact CD2-CE2 4.24Å; L26-Y50 WeakPolarHBondContact CD2-OH 3.45Å; L26-Y50 HydrophobicContact CG-CE2 4.45Å; D30-Y50 HydrophobicContact CB-CD2 4.1Å; D30-Y50 HydrophobicContact CB-CE2 3.78Å; D30-Y50 WeakPolarHBondContact O-CD2 3.18Å; V31-Y50 HydrophobicContact CG2-CD2 3.8Å; V31-Y50 HydrophobicContact CG2-CE2 4.45Å; Y50-G52 PolarHBondContact O-N 2.81Å; Y50-G52 VanDerWaalsContact O-N 3.16Å; Y50-C53 PolarHBondContact N-O 3.47Å; Y50-C53 PolarHBondContact O-N 2.87Å; Y50-V92 HydrophobicContact CD1-CG1 3.78Å; Y50-V92 HydrophobicContact CE1-CG1 3.88Å
51	N	94	Very high	88.6	Confident	117 Å²	117	42.6 Å²	42.6	63%	0.626	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.2	39.1	-175.4	-70.8	-11.9	0	0	0	114.4	C53	N51-C53 PolarHBondContact O-N 2.96Å
52	G	93.8	Very high	88.6	Confident	73 Å²	73	41.1 Å²	41.1	75%	0.753	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.7	-2	-179.6	0	0	0	0	0	115.3	Y50	Y50-G52 PolarHBondContact O-N 2.81Å; Y50-G52 VanDerWaalsContact O-N 3.16Å
53	C	94.4	Very high	88.2	Confident	81 Å²	81	44.1 Å²	44.1	55%	0.547	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	144.2	177.9	-65.3	0	0	0	0	111.4	V49 Y50 N51	V49-C53 VanDerWaalsContact CA-O 3.28Å; V49-C53 WeakPolarHBondContact CA-O 3.43Å; Y50-C53 PolarHBondContact N-O 3.47Å; Y50-C53 PolarHBondContact O-N 2.87Å; N51-C53 PolarHBondContact O-N 2.96Å
54	E	94.9	Very high	87.3	Confident	94 Å²	94	45 Å²	45	44%	0.439	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	135.4	170.3	-65.6	-167.6	-170.1	0	0	111.2	R47 G48 W107	R47-E54 IonicContact CZ-OE1 2.69Å; R47-E54 IonicContact CZ-OE2 3.88Å; R47-E54 IonicContact NE-OE1 3.79Å; R47-E54 IonicContact NE-OE2 3.96Å; R47-E54 PolarHBondContact NE-OE2 3.19Å; R47-E54 IonicContact NH2-OE1 3.53Å; R47-E54 PolarHBondContact NH2-OE1 3.11Å; R47-E54 IonicContact NH2-OE2 2.73Å; R47-E54 PolarHBondContact NH2-OE2 3.04Å; G48-E54 WeakPolarHBondContact O-CA 3.44Å; E54-W107 HydrophobicContact CB-CB 4.21Å; E54-W107 HydrophobicContact CB-CG 4.26Å
55	V	95.4	Very high	85.9	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.024	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.7	-177.3	-67.9	0	0	0	0	111.2	G48 V57 V92 V104 M105	G48-V55 PolarHBondContact N-O 2.77Å; G48-V55 PolarHBondContact O-N 3.43Å; V55-V57 HydrophobicContact CG2-CG2 3.78Å; V55-V92 HydrophobicContact CG1-CG2 4.49Å; V55-V104 HydrophobicContact CB-CG1 3.68Å; V55-V104 HydrophobicContact CG1-CG1 3.75Å; V55-V104 HydrophobicContact CG2-CG1 3.8Å; V55-M105 WeakPolarHBondContact CA-O 3.41Å; V55-M105 WeakPolarHBondContact CB-O 3.48Å
56	A	93.5	Very high	84.7	Confident	7 Å²	7	51.5 Å²	51.5	6%	0.058	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	136.5	161.4	0	0	0	0	0	108.8	Y46 M105 W107	Y46-A56 CarbonylContact O-C 3.44Å; Y46-A56 WeakPolarHBondContact O-CA 3.47Å; A56-M105 HydrophobicContact CB-CG 3.7Å; A56-M105 HydrophobicContact CB-SD 4.41Å; A56-M105 PolarHBondContact N-O 3.11Å; A56-M105 PolarHBondContact O-N 3.14Å; A56-W107 HydrophobicContact CB-CE3 3.91Å; A56-W107 HydrophobicContact CB-CZ3 4.46Å
57	V	93.6	Very high	83.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	109.7	-176.8	-170.1	0	0	0	0	109.7	V31 L33 V45 Y46 V55 M102 I103 V104	V31-V57 HydrophobicContact CG1-CG1 4.09Å; V31-V57 HydrophobicContact CG1-CG2 3.79Å; L33-V57 HydrophobicContact CD2-CB 3.66Å; L33-V57 HydrophobicContact CD2-CG1 3.54Å; L33-V57 HydrophobicContact CD2-CG2 4.02Å; V45-V57 CarbonylContact C-O 3.51Å; V45-V57 WeakPolarHBondContact CA-O 3.2Å; Y46-V57 PolarHBondContact N-O 3.44Å; Y46-V57 PolarHBondContact O-N 3.15Å; V55-V57 HydrophobicContact CG2-CG2 3.78Å; V57-M102 HydrophobicContact CG1-CB 3.66Å; V57-M102 HydrophobicContact CG1-CG 4.06Å; V57-M102 HydrophobicContact CG1-SD 4.09Å; V57-I103 WeakPolarHBondContact CA-O 3.3Å; V57-V104 HydrophobicContact CG1-CG2 4.4Å
58	K	90.8	Very high	82.3	Confident	12 Å²	12	54.1 Å²	54.1	5%	0.052	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	114.7	172.6	-179.2	176.6	175.5	-178.5	0	109	V45 M102 I103 M105 D162	V45-K58 HydrophobicContact CG2-CB 4.49Å; V45-K58 HydrophobicContact CG2-CG 4.4Å; K58-M102 WeakPolarHBondContact O-CA 3.36Å; K58-I103 HydrophobicContact CB-CB 4.36Å; K58-I103 HydrophobicContact CD-CD1 4.39Å; K58-I103 PolarHBondContact N-O 2.84Å; K58-I103 PolarHBondContact O-N 2.85Å; K58-M105 HydrophobicContact CB-CE 4.14Å; K58-D162 IonicContact NZ-OD1 2.63Å; K58-D162 PolarHBondContact NZ-OD1 2.9Å; K58-D162 IonicContact NZ-OD2 2.78Å; K58-D162 PolarHBondContact NZ-OD2 3.45Å
59	T	89.7	Confident	80.9	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.031	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	143.2	174.5	61	0	0	0	0	110.6	L33 G43 D44 Y46 P100 I101 M102	L33-T59 HydrophobicContact CD1-CG2 4.23Å; G43-T59 CarbonylContact C-O 3.42Å; G43-T59 VanDerWaalsContact CA-O 3.23Å; G43-T59 WeakPolarHBondContact CA-O 3.29Å; D44-T59 WeakPolarHBondContact CA-OG1 3.35Å; D44-T59 PolarHBondContact N-OG1 3.43Å; D44-T59 PolarHBondContact O-N 2.97Å; D44-T59 PolarHBondContact O-OG1 3.05Å; Y46-T59 HydrophobicContact CD2-CG2 3.79Å; Y46-T59 HydrophobicContact CE2-CG2 3.61Å; T59-P100 HydrophobicContact CG2-CG 4.18Å; T59-I101 CarbonylContact C-O 3.45Å; T59-I101 WeakPolarHBondContact CA-O 3.11Å; T59-M102 HydrophobicContact CG2-CG 4.4Å
60	C	81.1	Confident	79.7	Confident	1 Å²	1	61 Å²	61	1%	0.007	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.1	169	-171.2	0	0	0	0	109.6	F42 M64 F73 I101	F42-C60 CarbonylContact O-C 3.57Å; F42-C60 WeakPolarHBondContact O-CA 3.2Å; C60-M64 HydrophobicContact CB-CE 4.01Å; C60-M64 VanDerWaalsContact SG-CE 3.52Å; C60-F73 HydrophobicContact CB-CE1 3.76Å; C60-F73 HydrophobicContact CB-CZ 4.22Å; C60-F73 WeakPolarHBondContact SG-CE1 3.44Å; C60-F73 VanDerWaalsContact SG-CZ 3.53Å; C60-I101 HydrophobicContact CB-CB 4.29Å; C60-I101 PolarHBondContact N-O 3.44Å
61	R	69.6	Low	78.6	Confident	128 Å²	128	67.4 Å²	67.4	48%	0.483	37%	0.371	S	S	.	.			trans	-88	-3.4	-179.5	-65.6	178.3	176.3	-168	-5.9	113.5	F42 D44 D63 Y99	F42-R61 PolarHBondContact O-N 3.21Å; D44-R61 IonicContact OD1-CZ 3.86Å; D44-R61 IonicContact OD1-NE 3.61Å; D44-R61 IonicContact OD1-NH2 3.01Å; D44-R61 PolarHBondContact OD1-NH2 3.11Å; D44-R61 VanDerWaalsContact OD1-NH2 3.1Å; D44-R61 IonicContact OD2-CZ 2.65Å; D44-R61 IonicContact OD2-NE 3.96Å; D44-R61 IonicContact OD2-NH2 3.37Å; D44-R61 PolarHBondContact OD2-NH2 3.01Å; R61-D63 PolarHBondContact O-N 3.46Å; R61-D63 VanDerWaalsContact O-N 3.17Å; R61-Y99 WeakPolarHBondContact CA-OH 3.41Å; R61-Y99 PolarHBondContact O-OH 3.32Å
62	V	64.8	Low	77.4	Confident	49 Å²	49	67 Å²	67	30%	0.297	36%	0.364	S	S	.	.			trans	-66.4	119.4	179.2	-176.7	0	0	0	0	107.6	F42 M64 L69	F42-V62 HydrophobicContact CD1-CG2 4.34Å; V62-M64 VanDerWaalsContact C-N 3.3Å; V62-M64 HydrophobicContact CB-CE 4.27Å; V62-M64 HydrophobicContact CB-CG 3.96Å; V62-M64 HydrophobicContact CB-SD 4.5Å; V62-M64 HydrophobicContact CG1-CG 3.7Å; V62-M64 WeakPolarHBondContact O-CE 3.37Å; V62-M64 WeakPolarHBondContact O-CG 3.34Å; V62-M64 PolarHBondContact O-N 3.14Å; V62-L69 HydrophobicContact CG1-CD2 4.05Å
63	D	61.6	Low	76.2	Confident	122 Å²	122	64.7 Å²	64.7	65%	0.652	33%	0.333	S	S	*	.			trans	-67.7	94.9	170.4	-173.2	8.2	0	0	0	108.3	R61 T65	R61-D63 PolarHBondContact O-N 3.46Å; R61-D63 VanDerWaalsContact O-N 3.17Å; D63-T65 VanDerWaalsContact C-N 3.25Å; D63-T65 PolarHBondContact O-N 3.47Å; D63-T65 WeakPolarHBondContact OD1-CG2 3.45Å
64	M	61.2	Low	75.6	Confident	22 Å²	22	61.5 Å²	61.5	11%	0.108	31%	0.311	C	S	.	.			trans	-93.6	49.9	-174	-70.5	176.1	-88.8	0	0	110.9	C60 V62 A66 R70 F73 I101	C60-M64 HydrophobicContact CB-CE 4.01Å; C60-M64 VanDerWaalsContact SG-CE 3.52Å; V62-M64 VanDerWaalsContact C-N 3.3Å; V62-M64 HydrophobicContact CB-CE 4.27Å; V62-M64 HydrophobicContact CB-CG 3.96Å; V62-M64 HydrophobicContact CB-SD 4.5Å; V62-M64 HydrophobicContact CG1-CG 3.7Å; V62-M64 WeakPolarHBondContact O-CE 3.37Å; V62-M64 WeakPolarHBondContact O-CG 3.34Å; V62-M64 PolarHBondContact O-N 3.14Å; M64-A66 PolarHBondContact O-N 3.1Å; M64-R70 HydrophobicContact CB-CB 3.95Å; M64-R70 HydrophobicContact CG-CB 4.39Å; M64-R70 VanDerWaalsContact SD-CA 3.52Å; M64-R70 HydrophobicContact SD-CB 3.93Å; M64-R70 HydrophobicContact SD-CG 4.13Å; M64-F73 HydrophobicContact CE-CD1 4.4Å; M64-F73 HydrophobicContact SD-CB 4.2Å; M64-F73 HydrophobicContact SD-CD1 4.25Å; M64-F73 HydrophobicContact SD-CG 4.36Å; M64-I101 HydrophobicContact CE-CB 4.27Å; M64-I101 HydrophobicContact CE-CD1 3.36Å; M64-I101 HydrophobicContact CE-CG1 3.92Å; M64-I101 HydrophobicContact SD-CD1 4.15Å
65	T	58.7	Low	75.2	Confident	125 Å²	125	61 Å²	61	77%	0.767	31%	0.308	S	S	*	.			trans	-55.6	-26.4	167.6	48.6	0	0	0	0	111.9	D63 S67	D63-T65 VanDerWaalsContact C-N 3.25Å; D63-T65 PolarHBondContact O-N 3.47Å; D63-T65 WeakPolarHBondContact OD1-CG2 3.45Å; T65-S67 PolarHBondContact O-N 2.99Å
66	A	65.2	Low	74.7	Confident	50 Å²	50	60.8 Å²	60.8	41%	0.413	31%	0.307	S	S	.	.	S	Bend	trans	-83.1	104.6	168.3	0	0	0	0	0	111.3	M64 D68 L69 R70	M64-A66 PolarHBondContact O-N 3.1Å; A66-D68 PolarHBondContact O-N 2.77Å; A66-D68 VanDerWaalsContact O-N 3.12Å; A66-L69 HydrophobicContact CB-CB 4.2Å; A66-L69 PolarHBondContact O-N 3.41Å; A66-R70 PolarHBondContact O-N 3.23Å
67	S	68.5	Low	74.5	Confident	88 Å²	88	60.5 Å²	60.5	62%	0.615	31%	0.305	S	S	*	.	H	α-helix	trans	-51.8	-33.4	176.8	55.2	0	0	0	0	113.6	T65 R70 R71	T65-S67 PolarHBondContact O-N 2.99Å; S67-R70 WeakPolarHBondContact O-CB 3.43Å; S67-R70 PolarHBondContact O-N 2.73Å; S67-R71 PolarHBondContact O-N 3.15Å
68	D	69	Low	74.3	Confident	88 Å²	88	62.7 Å²	62.7	47%	0.471	32%	0.318	S	S	.	.	H	α-helix	trans	-68.2	-38.4	177.5	-75	-34	0	0	0	113.3	A66 R71 K72	A66-D68 PolarHBondContact O-N 2.77Å; A66-D68 VanDerWaalsContact O-N 3.12Å; D68-R71 PolarHBondContact O-N 3Å; D68-R71 IonicContact OD1-CZ 2.95Å; D68-R71 IonicContact OD1-NE 2.82Å; D68-R71 IonicContact OD1-NH2 3.71Å; D68-R71 PolarHBondContact OD1-NH2 3.26Å; D68-K72 WeakPolarHBondContact O-CG 3.48Å; D68-K72 PolarHBondContact O-N 2.97Å
69	L	65.7	Low	74.3	Confident	93 Å²	93	63.1 Å²	63.1	49%	0.487	32%	0.322	S	S	.	.	H	α-helix	trans	-68.5	-40.7	176.7	-169.9	64.6	0	0	0	110.1	V62 A66 R71 K72 F73	V62-L69 HydrophobicContact CG1-CD2 4.05Å; A66-L69 HydrophobicContact CB-CB 4.2Å; A66-L69 PolarHBondContact O-N 3.41Å; L69-R71 PolarHBondContact O-N 3.42Å; L69-K72 PolarHBondContact O-N 3.09Å; L69-F73 VanDerWaalsContact O-CB 3.26Å; L69-F73 WeakPolarHBondContact O-CB 3.4Å; L69-F73 PolarHBondContact O-N 3.42Å
70	R	71.2	Confident	74.4	Confident	88 Å²	88	63 Å²	63	33%	0.332	32%	0.321	S	S	.	.	H	α-helix	trans	-56.1	-49.9	173.3	-175.6	171.5	158.9	171	-11.9	112.4	M64 A66 S67 F73 L74 V96 I101	M64-R70 HydrophobicContact CB-CB 3.95Å; M64-R70 HydrophobicContact CG-CB 4.39Å; M64-R70 VanDerWaalsContact SD-CA 3.52Å; M64-R70 HydrophobicContact SD-CB 3.93Å; M64-R70 HydrophobicContact SD-CG 4.13Å; A66-R70 PolarHBondContact O-N 3.23Å; S67-R70 WeakPolarHBondContact O-CB 3.43Å; S67-R70 PolarHBondContact O-N 2.73Å; R70-F73 PolarHBondContact O-N 3.18Å; R70-L74 HydrophobicContact CG-CD1 3.91Å; R70-L74 WeakPolarHBondContact O-CB 3.45Å; R70-L74 WeakPolarHBondContact O-CG 3.49Å; R70-L74 PolarHBondContact O-N 3Å; R70-V96 VanDerWaalsContact CZ-O 3.24Å; R70-V96 PolarHBondContact NH1-O 3.02Å; R70-V96 PolarHBondContact NH2-O 3.2Å; R70-I101 HydrophobicContact CG-CD1 3.83Å
71	R	73.6	Confident	75	Confident	168 Å²	168	64.4 Å²	64.4	63%	0.634	33%	0.328	S	S	*	.	H	α-helix	trans	-61.9	-46	179.7	179.8	170.9	52.1	125.9	-3.3	111.6	S67 D68 L69 F73 L74 Q75	S67-R71 PolarHBondContact O-N 3.15Å; D68-R71 PolarHBondContact O-N 3Å; D68-R71 IonicContact OD1-CZ 2.95Å; D68-R71 IonicContact OD1-NE 2.82Å; D68-R71 IonicContact OD1-NH2 3.71Å; D68-R71 PolarHBondContact OD1-NH2 3.26Å; L69-R71 PolarHBondContact O-N 3.42Å; R71-F73 VanDerWaalsContact C-N 3.3Å; R71-F73 PolarHBondContact O-N 2.91Å; R71-L74 PolarHBondContact O-N 3.18Å; R71-Q75 WeakPolarHBondContact O-CB 3.46Å; R71-Q75 PolarHBondContact O-N 3.3Å
72	K	68.3	Low	76.1	Confident	109 Å²	109	64.3 Å²	64.3	47%	0.474	34%	0.337	S	S	.	.	H	α-helix	trans	-64.3	-33.9	177.5	-74.2	180	-179.6	-178.1	0	113.1	D68 L69 R167	D68-K72 WeakPolarHBondContact O-CG 3.48Å; D68-K72 PolarHBondContact O-N 2.97Å; L69-K72 PolarHBondContact O-N 3.09Å; K72-R167 PolarHBondContact O-NH2 3.43Å
73	F	69.3	Low	77.6	Confident	24 Å²	24	62.5 Å²	62.5	11%	0.105	33%	0.325	C	S	.	.	H	α-helix	trans	-72.5	-43.4	178.5	-175.2	-99.8	0	0	0	111.8	F42 C60 M64 L69 R70 R71	F42-F73 HydrophobicContact CB-CE2 3.96Å; F42-F73 HydrophobicContact CB-CZ 3.67Å; F42-F73 HydrophobicContact CD1-CD2 4.28Å; F42-F73 AromaticContact CD1-CE2 3.39Å; F42-F73 HydrophobicContact CD1-CE2 3.39Å; F42-F73 HydrophobicContact CD1-CZ 4.03Å; F42-F73 AromaticContact CD2-CE2 3.62Å; F42-F73 HydrophobicContact CD2-CE2 3.62Å; F42-F73 AromaticContact CD2-CZ 3.87Å; F42-F73 HydrophobicContact CD2-CZ 3.87Å; F42-F73 HydrophobicContact CE1-CD2 4.32Å; F42-F73 AromaticContact CE1-CE2 3.68Å; F42-F73 HydrophobicContact CE1-CE2 3.68Å; F42-F73 AromaticContact CE2-CE2 3.89Å; F42-F73 HydrophobicContact CE2-CE2 3.89Å; F42-F73 AromaticContact CG-CE2 3.35Å; F42-F73 HydrophobicContact CG-CE2 3.35Å; F42-F73 AromaticContact CG-CZ 3.57Å; F42-F73 HydrophobicContact CG-CZ 3.57Å; F42-F73 AromaticContact CZ-CE2 3.92Å; F42-F73 HydrophobicContact CZ-CE2 3.92Å; C60-F73 HydrophobicContact CB-CE1 3.76Å; C60-F73 HydrophobicContact CB-CZ 4.22Å; C60-F73 WeakPolarHBondContact SG-CE1 3.44Å; C60-F73 VanDerWaalsContact SG-CZ 3.53Å; M64-F73 HydrophobicContact CE-CD1 4.4Å; M64-F73 HydrophobicContact SD-CB 4.2Å; M64-F73 HydrophobicContact SD-CD1 4.25Å; M64-F73 HydrophobicContact SD-CG 4.36Å; L69-F73 VanDerWaalsContact O-CB 3.26Å; L69-F73 WeakPolarHBondContact O-CB 3.4Å; L69-F73 PolarHBondContact O-N 3.42Å; R70-F73 PolarHBondContact O-N 3.18Å; R71-F73 VanDerWaalsContact C-N 3.3Å; R71-F73 PolarHBondContact O-N 2.91Å
74	L	82.2	Confident	79.2	Confident	15 Å²	15	62.8 Å²	62.8	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-81.1	-16.4	-178.5	-66.9	178.9	0	0	0	113.8	R70 R71 G76 E77 T78 I94 V96 I101	R70-L74 HydrophobicContact CG-CD1 3.91Å; R70-L74 WeakPolarHBondContact O-CB 3.45Å; R70-L74 WeakPolarHBondContact O-CG 3.49Å; R70-L74 PolarHBondContact O-N 3Å; R71-L74 PolarHBondContact O-N 3.18Å; L74-G76 VanDerWaalsContact C-N 3.33Å; L74-G76 PolarHBondContact O-N 2.93Å; L74-E77 PolarHBondContact O-N 3.47Å; L74-E77 VanDerWaalsContact O-N 3.09Å; L74-T78 WeakPolarHBondContact O-CB 3.46Å; L74-T78 PolarHBondContact O-N 3.01Å; L74-T78 PolarHBondContact O-OG1 3.27Å; L74-T78 VanDerWaalsContact O-OG1 3.1Å; L74-I94 HydrophobicContact CD2-CG2 4.08Å; L74-V96 HydrophobicContact CD1-CG1 3.75Å; L74-I101 HydrophobicContact CD1-CD1 4.21Å; L74-I101 HydrophobicContact CD2-CG2 4.04Å
75	Q	85.9	Confident	80.9	Confident	82 Å²	82	63.6 Å²	63.6	38%	0.383	33%	0.331	S	S	.	.	H	α-helix	trans	-49.5	-50.4	-175.7	-173.8	177.5	6.8	0	0	113.1	R71 T78 T79	R71-Q75 WeakPolarHBondContact O-CB 3.46Å; R71-Q75 PolarHBondContact O-N 3.3Å; Q75-T78 PolarHBondContact O-N 3.44Å; Q75-T79 PolarHBondContact O-N 2.91Å; Q75-T79 PolarHBondContact O-OG1 2.73Å
76	G	86	Confident	82.6	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.5	-38.6	-178.5	0	0	0	0	0	113.3	L74 T79 A80 F163 S166	L74-G76 VanDerWaalsContact C-N 3.33Å; L74-G76 PolarHBondContact O-N 2.93Å; G76-T79 PolarHBondContact O-N 3.48Å; G76-A80 WeakPolarHBondContact O-CB 3.36Å; G76-A80 PolarHBondContact O-N 2.63Å; G76-F163 CarbonylContact C-O 3.46Å; G76-F163 VanDerWaalsContact CA-O 3.3Å; G76-F163 WeakPolarHBondContact CA-O 3.48Å; G76-S166 WeakPolarHBondContact CA-OG 3.45Å
77	E	88.9	Confident	84.1	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-71.5	-38.4	176.8	-59.8	-70.8	176.4	0	0	111.4	L74 T79 A80 L81 L91 I94 I103 F163 G164	L74-E77 PolarHBondContact O-N 3.47Å; L74-E77 VanDerWaalsContact O-N 3.09Å; E77-T79 VanDerWaalsContact C-N 3.33Å; E77-T79 PolarHBondContact O-N 3.2Å; E77-A80 PolarHBondContact O-N 3.01Å; E77-A80 VanDerWaalsContact O-N 3.14Å; E77-L81 PolarHBondContact O-N 2.92Å; E77-L81 VanDerWaalsContact O-N 3.11Å; E77-L91 HydrophobicContact CB-CD1 4.3Å; E77-L91 WeakPolarHBondContact O-CD1 3.33Å; E77-L91 WeakPolarHBondContact OE2-CD1 3.45Å; E77-I94 HydrophobicContact CB-CD1 3.96Å; E77-I103 HydrophobicContact CB-CD1 4.42Å; E77-I103 HydrophobicContact CG-CD1 3.64Å; E77-I103 HydrophobicContact CG-CG1 4.24Å; E77-F163 PolarHBondContact OE1-N 2.95Å; E77-G164 PolarHBondContact OE1-N 3.4Å
78	T	89.9	Confident	85.4	Confident	46 Å²	46	55.1 Å²	55.1	28%	0.282	27%	0.27	S	S	.	.	H	α-helix	trans	-63	-40.4	174.3	-59.5	0	0	0	0	111.3	W24 L74 Q75 A80 L81	W24-T78 HydrophobicContact CZ2-CG2 4.38Å; L74-T78 WeakPolarHBondContact O-CB 3.46Å; L74-T78 PolarHBondContact O-N 3.01Å; L74-T78 PolarHBondContact O-OG1 3.27Å; L74-T78 VanDerWaalsContact O-OG1 3.1Å; Q75-T78 PolarHBondContact O-N 3.44Å; T78-A80 VanDerWaalsContact C-N 3.34Å; T78-L81 HydrophobicContact CG2-CD1 4.43Å; T78-L81 WeakPolarHBondContact O-CB 3.32Å; T78-L81 PolarHBondContact O-N 2.88Å
79	T	90.3	Very high	86.6	Confident	21 Å²	21	51 Å²	51	13%	0.129	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-44.8	171.5	-68.2	0	0	0	0	110.9	Q75 G76 E77 L81 N82 F83 E168	Q75-T79 PolarHBondContact O-N 2.91Å; Q75-T79 PolarHBondContact O-OG1 2.73Å; G76-T79 PolarHBondContact O-N 3.48Å; E77-T79 VanDerWaalsContact C-N 3.33Å; E77-T79 PolarHBondContact O-N 3.2Å; T79-L81 PolarHBondContact O-N 2.91Å; T79-N82 PolarHBondContact O-N 2.88Å; T79-F83 HydrophobicContact CG2-CE1 3.91Å; T79-F83 HydrophobicContact CG2-CZ 3.69Å; T79-E168 HydrophobicContact CG2-CB 4.1Å; T79-E168 WeakPolarHBondContact CG2-OE2 2.76Å
80	A	92.5	Very high	88	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-66.6	-17.4	-177.3	0	0	0	0	0	114.6	G76 E77 T78 N82 F83 L91 F163	G76-A80 WeakPolarHBondContact O-CB 3.36Å; G76-A80 PolarHBondContact O-N 2.63Å; E77-A80 PolarHBondContact O-N 3.01Å; E77-A80 VanDerWaalsContact O-N 3.14Å; T78-A80 VanDerWaalsContact C-N 3.34Å; A80-N82 PolarHBondContact O-N 3.26Å; A80-F83 VanDerWaalsContact CA-CD2 3.49Å; A80-F83 HydrophobicContact CB-CD2 3.71Å; A80-F83 HydrophobicContact CB-CE2 3.83Å; A80-F83 HydrophobicContact CB-CG 4.45Å; A80-F83 WeakPolarHBondContact O-CB 3.47Å; A80-F83 PolarHBondContact O-N 3Å; A80-L91 HydrophobicContact CB-CD1 3.67Å; A80-L91 HydrophobicContact CB-CG 4.36Å; A80-F163 HydrophobicContact CB-CB 3.69Å; A80-F163 HydrophobicContact CB-CD1 4.26Å; A80-F163 HydrophobicContact CB-CD2 3.68Å; A80-F163 HydrophobicContact CB-CE2 4.44Å; A80-F163 HydrophobicContact CB-CG 3.59Å
81	L	93.1	Very high	89.1	Confident	31 Å²	31	48.6 Å²	48.6	16%	0.162	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.3	169	-69.2	166.2	0	0	0	112.9	W24 E77 T78 T79 F83 L91 I94	W24-L81 HydrophobicContact CB-CD1 3.71Å; W24-L81 HydrophobicContact CB-CD2 4.04Å; W24-L81 HydrophobicContact CB-CG 4.43Å; W24-L81 HydrophobicContact CD2-CD1 3.48Å; W24-L81 VanDerWaalsContact CD2-CD1 3.48Å; W24-L81 HydrophobicContact CE3-CD1 3.64Å; W24-L81 HydrophobicContact CG-CD1 3.52Å; W24-L81 HydrophobicContact CZ3-CD1 4.48Å; E77-L81 PolarHBondContact O-N 2.92Å; E77-L81 VanDerWaalsContact O-N 3.11Å; T78-L81 HydrophobicContact CG2-CD1 4.43Å; T78-L81 WeakPolarHBondContact O-CB 3.32Å; T78-L81 PolarHBondContact O-N 2.88Å; T79-L81 PolarHBondContact O-N 2.91Å; L81-F83 VanDerWaalsContact C-N 3.3Å; L81-L91 HydrophobicContact CD2-CB 3.72Å; L81-L91 HydrophobicContact CD2-CD1 4.35Å; L81-L91 HydrophobicContact CG-CB 4.46Å; L81-L91 HydrophobicContact CG-CD1 4.37Å; L81-I94 HydrophobicContact CD1-CD1 4.04Å; L81-I94 HydrophobicContact CD1-CG1 4.22Å; L81-I94 HydrophobicContact CD2-CG1 4.39Å
82	N	93	Very high	90	Very high	126 Å²	126	43.4 Å²	43.4	67%	0.674	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	4	177.9	-60.3	-55.6	0	0	0	112.9	T79 A80	T79-N82 PolarHBondContact O-N 2.88Å; A80-N82 PolarHBondContact O-N 3.26Å
83	F	95.2	Very high	91.3	Very high	11 Å²	11	38.2 Å²	38.2	5%	0.048	20%	0.201	C	C	.	.			trans	-86.6	134.8	-179.6	-61.8	-14.7	0	0	0	112.1	T79 A80 L81 I88 Y134 L135 C140 F163	T79-F83 HydrophobicContact CG2-CE1 3.91Å; T79-F83 HydrophobicContact CG2-CZ 3.69Å; A80-F83 VanDerWaalsContact CA-CD2 3.49Å; A80-F83 HydrophobicContact CB-CD2 3.71Å; A80-F83 HydrophobicContact CB-CE2 3.83Å; A80-F83 HydrophobicContact CB-CG 4.45Å; A80-F83 WeakPolarHBondContact O-CB 3.47Å; A80-F83 PolarHBondContact O-N 3Å; L81-F83 VanDerWaalsContact C-N 3.3Å; F83-I88 HydrophobicContact CB-CG2 3.99Å; F83-I88 HydrophobicContact CD2-CG2 4.16Å; F83-Y134 VanDerWaalsContact CA-OH 3.29Å; F83-Y134 WeakPolarHBondContact CA-OH 3.4Å; F83-Y134 HydrophobicContact CB-CE1 4.01Å; F83-Y134 HydrophobicContact CD1-CE1 4.11Å; F83-Y134 HydrophobicContact CG-CE1 4.01Å; F83-L135 HydrophobicContact CD2-CD2 3.85Å; F83-L135 HydrophobicContact CE2-CD2 3.46Å; F83-L135 VanDerWaalsContact CE2-CD2 3.46Å; F83-L135 HydrophobicContact CZ-CD2 3.86Å; F83-C140 HydrophobicContact CZ-CB 4.09Å; F83-F163 HydrophobicContact CD2-CD1 4.35Å; F83-F163 HydrophobicContact CD2-CE1 4.05Å; F83-F163 HydrophobicContact CD2-CZ 4.24Å; F83-F163 AromaticContact CE2-CD1 3.84Å; F83-F163 HydrophobicContact CE2-CD1 3.84Å; F83-F163 AromaticContact CE2-CE1 3.81Å; F83-F163 HydrophobicContact CE2-CE1 3.81Å; F83-F163 HydrophobicContact CE2-CG 4.49Å; F83-F163 HydrophobicContact CE2-CZ 4.45Å
84	N	95.1	Very high	92.4	Very high	128 Å²	128	37.1 Å²	37.1	68%	0.684	20%	0.196	S	C	*	.			trans	-144.4	96.8	176.9	-175	27.2	0	0	0	109.4	Y134	N84-Y134 PolarHBondContact N-OH 2.74Å
85	H	97	Very high	92.9	Very high	40 Å²	40	36.4 Å²	36.4	19%	0.185	19%	0.193	C	C	.	.			trans	-154.6	141.1	-179.6	-175.1	-91.7	0	0	0	109.6	N87 I88 Y134	H85-N87 PolarHBondContact CE1-OD1 3Å; H85-N87 PolarHBondContact ND1-N 3.26Å; H85-N87 VanDerWaalsContact ND1-N 3.11Å; H85-N87 PolarHBondContact O-N 2.94Å; H85-N87 VanDerWaalsContact O-N 3.15Å; H85-I88 HydrophobicContact CB-CB 4.08Å; H85-I88 HydrophobicContact CB-CG1 3.78Å; H85-I88 PolarHBondContact O-N 2.87Å; H85-I88 VanDerWaalsContact O-O 3.09Å; H85-Y134 HydrophobicContact CB-CD1 3.94Å; H85-Y134 HydrophobicContact CB-CD2 3.73Å; H85-Y134 HydrophobicContact CB-CE1 4.1Å; H85-Y134 HydrophobicContact CB-CE2 3.84Å; H85-Y134 HydrophobicContact CB-CG 3.76Å; H85-Y134 AromaticContact CD2-CD2 3.54Å; H85-Y134 AromaticContact CD2-CG 3.73Å; H85-Y134 AromaticContact CG-CD2 3.82Å; H85-Y134 AromaticContact CG-CG 3.73Å
86	P	95.6	Very high	93	Very high	73 Å²	73	32.9 Å²	32.9	47%	0.474	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-32.7	-177.1	20.8	-34.2	0	0	0	113.8	K159	P86-K159 WeakPolarHBondContact O-CD 3.43Å; P86-K159 WeakPolarHBondContact O-CE 3.43Å; P86-K159 WeakPolarHBondContact O-CG 3.41Å
87	N	96.8	Very high	92.8	Very high	7 Å²	7	36 Å²	36	4%	0.037	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	18.4	179	-51.1	109.7	0	0	0	114.4	H85 D127 N130 L158 K159 I160	H85-N87 PolarHBondContact CE1-OD1 3Å; H85-N87 PolarHBondContact ND1-N 3.26Å; H85-N87 VanDerWaalsContact ND1-N 3.11Å; H85-N87 PolarHBondContact O-N 2.94Å; H85-N87 VanDerWaalsContact O-N 3.15Å; N87-D127 WeakPolarHBondContact CB-O 2.99Å; N87-D127 VanDerWaalsContact CG-O 3.24Å; N87-D127 WeakPolarHBondContact ND2-CA 3.48Å; N87-D127 WeakPolarHBondContact ND2-CB 3.22Å; N87-D127 VanDerWaalsContact ND2-CG 3.31Å; N87-D127 PolarHBondContact ND2-OD1 2.79Å; N87-N130 WeakPolarHBondContact OD1-CB 3.49Å; N87-L158 WeakPolarHBondContact CB-O 3.48Å; N87-L158 PolarHBondContact ND2-O 3.35Å; N87-K159 CarbonylContact O-C 3.55Å; N87-K159 WeakPolarHBondContact O-CA 3.45Å; N87-I160 PolarHBondContact O-N 2.92Å
88	I	96.1	Very high	92.6	Very high	4 Å²	4	39 Å²	39	2%	0.021	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-122.5	132.2	172.4	-60.3	-61.9	0	0	0	108.1	F83 H85 K90 Y134 L135 I160 F163	F83-I88 HydrophobicContact CB-CG2 3.99Å; F83-I88 HydrophobicContact CD2-CG2 4.16Å; H85-I88 HydrophobicContact CB-CB 4.08Å; H85-I88 HydrophobicContact CB-CG1 3.78Å; H85-I88 PolarHBondContact O-N 2.87Å; H85-I88 VanDerWaalsContact O-O 3.09Å; I88-K90 PolarHBondContact O-N 3.48Å; I88-Y134 HydrophobicContact CG1-CD1 3.86Å; I88-Y134 HydrophobicContact CG1-CE1 4.25Å; I88-L135 HydrophobicContact CD1-CD1 4.09Å; I88-L135 HydrophobicContact CD1-CD2 4.19Å; I88-L135 HydrophobicContact CD1-CG 4Å; I88-I160 HydrophobicContact CD1-CB 3.92Å; I88-I160 HydrophobicContact CD1-CD1 4.14Å; I88-I160 HydrophobicContact CD1-CG1 4.38Å; I88-F163 HydrophobicContact CD1-CZ 4.21Å; I88-F163 HydrophobicContact CG2-CE2 3.92Å; I88-F163 HydrophobicContact CG2-CZ 3.62Å
89	V	93.9	Very high	92.3	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.012	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-64.8	124.8	176.2	173.4	0	0	0	0	109.5	L91 M105 E106 F108 L151 K159 I160 A161	V89-L91 PolarHBondContact O-N 3.11Å; V89-M105 HydrophobicContact CG1-CB 4.03Å; V89-M105 HydrophobicContact CG1-CG 4.18Å; V89-M105 HydrophobicContact CG1-SD 4.05Å; V89-E106 WeakPolarHBondContact CA-OE1 3.48Å; V89-E106 HydrophobicContact CG1-CG 3.95Å; V89-F108 HydrophobicContact CG1-CE2 4.46Å; V89-F108 HydrophobicContact CG2-CE2 4.07Å; V89-L151 HydrophobicContact CG2-CB 4.35Å; V89-L151 HydrophobicContact CG2-CD1 3.86Å; V89-L151 HydrophobicContact CG2-CG 4.25Å; V89-K159 HydrophobicContact CG2-CB 3.65Å; V89-I160 WeakPolarHBondContact CG2-O 3.17Å; V89-I160 PolarHBondContact N-O 2.91Å; V89-A161 HydrophobicContact CB-CB 4.15Å; V89-A161 HydrophobicContact CG2-CB 3.69Å
90	K	94.2	Very high	92.2	Very high	120 Å²	120	44.2 Å²	44.2	52%	0.522	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-76.5	118.4	178.6	-173.4	175.3	-179.4	178.7	0	110.6	I88 M105 E106	I88-K90 PolarHBondContact O-N 3.48Å; K90-M105 WeakPolarHBondContact O-CA 3.21Å; K90-E106 HydrophobicContact CB-CG 4.2Å; K90-E106 WeakPolarHBondContact CB-OE1 3.3Å; K90-E106 PolarHBondContact N-OE1 3.43Å; K90-E106 PolarHBondContact O-N 3.5Å
91	L	93.9	Very high	92	Very high	11 Å²	11	44.6 Å²	44.6	6%	0.058	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	134.5	166.5	-61.5	-171.9	0	0	0	109.9	E77 A80 L81 V89 I103 M105	E77-L91 HydrophobicContact CB-CD1 4.3Å; E77-L91 WeakPolarHBondContact O-CD1 3.33Å; E77-L91 WeakPolarHBondContact OE2-CD1 3.45Å; A80-L91 HydrophobicContact CB-CD1 3.67Å; A80-L91 HydrophobicContact CB-CG 4.36Å; L81-L91 HydrophobicContact CD2-CB 3.72Å; L81-L91 HydrophobicContact CD2-CD1 4.35Å; L81-L91 HydrophobicContact CG-CB 4.46Å; L81-L91 HydrophobicContact CG-CD1 4.37Å; V89-L91 PolarHBondContact O-N 3.11Å; L91-I103 HydrophobicContact CD1-CG2 4.42Å; L91-I103 HydrophobicContact CD2-CG2 3.82Å; L91-M105 HydrophobicContact CD2-CB 3.72Å; L91-M105 HydrophobicContact CD2-CE 4.11Å
92	V	94	Very high	91.9	Very high	59 Å²	59	43.8 Å²	43.8	36%	0.358	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-42.2	174.6	176.4	0	0	0	0	109.9	Y50 V55 V104	Y50-V92 HydrophobicContact CD1-CG1 3.78Å; Y50-V92 HydrophobicContact CE1-CG1 3.88Å; V55-V92 HydrophobicContact CG1-CG2 4.49Å; V92-V104 HydrophobicContact CB-CB 4.37Å; V92-V104 HydrophobicContact CB-CG1 4.04Å; V92-V104 HydrophobicContact CG1-CG1 4.38Å; V92-V104 PolarHBondContact N-O 2.85Å
93	G	94.5	Very high	91.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.2	179.8	-178.2	0	0	0	0	0	112	W24 V104	W24-G93 CarbonylContact O-C 3.53Å; W24-G93 WeakPolarHBondContact O-CA 3.42Å; G93-V104 PolarHBondContact N-O 2.9Å; G93-V104 PolarHBondContact O-N 3.47Å
94	I	93.3	Very high	91.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	121	179.9	-44.8	178.5	0	0	0	108.7	W24 L26 L74 E77 L81 V96 I101 M102 I103	W24-I94 HydrophobicContact CE3-CB 4.4Å; W24-I94 HydrophobicContact CE3-CG1 4.49Å; W24-I94 HydrophobicContact CZ3-CB 4.46Å; W24-I94 PolarHBondContact O-N 3.31Å; L26-I94 PolarHBondContact N-O 2.61Å; L74-I94 HydrophobicContact CD2-CG2 4.08Å; E77-I94 HydrophobicContact CB-CD1 3.96Å; L81-I94 HydrophobicContact CD1-CD1 4.04Å; L81-I94 HydrophobicContact CD1-CG1 4.22Å; L81-I94 HydrophobicContact CD2-CG1 4.39Å; I94-V96 HydrophobicContact CB-CG1 4.04Å; I94-V96 HydrophobicContact CG2-CG1 3.32Å; I94-I101 HydrophobicContact CG2-CG2 4.15Å; I94-M102 CarbonylContact C-O 3.51Å; I94-M102 WeakPolarHBondContact CA-O 3.48Å; I94-M102 WeakPolarHBondContact CG2-O 3.33Å; I94-I103 HydrophobicContact CG2-CG1 4.16Å
95	A	92.1	Very high	91.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	109.7	173.7	0	0	0	0	0	109.9	L26 N28 V31 I101 M102	L26-A95 HydrophobicContact CB-CB 3.98Å; L26-A95 WeakPolarHBondContact O-CA 3.49Å; N28-A95 HydrophobicContact CB-CB 4.32Å; N28-A95 PolarHBondContact ND2-O 3.16Å; V31-A95 HydrophobicContact CG2-CB 4.31Å; A95-I101 WeakPolarHBondContact O-CA 3.44Å; A95-M102 HydrophobicContact CB-CB 4.03Å; A95-M102 PolarHBondContact N-O 2.88Å; A95-M102 PolarHBondContact O-N 3.5Å
96	V	87	Confident	91.6	Very high	8 Å²	8	32.3 Å²	32.3	5%	0.048	17%	0.166	C	C	.	.			trans	-126.8	5.2	-169.9	-54.2	0	0	0	0	113.1	E25 R70 L74 I94 I101	E25-V96 HydrophobicContact CG-CG2 3.97Å; R70-V96 VanDerWaalsContact CZ-O 3.24Å; R70-V96 PolarHBondContact NH1-O 3.02Å; R70-V96 PolarHBondContact NH2-O 3.2Å; L74-V96 HydrophobicContact CD1-CG1 3.75Å; I94-V96 HydrophobicContact CB-CG1 4.04Å; I94-V96 HydrophobicContact CG2-CG1 3.32Å; V96-I101 HydrophobicContact CG1-CG2 3.94Å
97	Q	83.2	Confident	91.2	Very high	67 Å²	67	31.6 Å²	31.6	31%	0.313	15%	0.154	S	C	.	.	S	Bend	trans	-76	-32.4	-173.8	-62.3	-177.5	40.4	0	0	112	L26 D27 N28	L26-Q97 PolarHBondContact O-NE2 2.86Å; D27-Q97 VanDerWaalsContact CA-NE2 3.35Å; D27-Q97 PolarHBondContact OD2-OE1 2.95Å; N28-Q97 PolarHBondContact OD1-N 3.35Å
98	S	84.6	Confident	90.3	Very high	63 Å²	63	32.3 Å²	32.3	44%	0.441	16%	0.157	S	C	.	.	S	Bend	trans	-135.1	168.7	174.4	65.1	0	0	0	0	111.6	N28 P100	N28-S98 WeakPolarHBondContact CB-OG 3.47Å; N28-S98 PolarHBondContact ND2-O 3.5Å; N28-S98 VanDerWaalsContact ND2-O 3.11Å; N28-S98 PolarHBondContact OD1-N 3.24Å; S98-P100 CarbonylContact O-C 3.49Å
99	Y	83	Confident	88.9	Confident	144 Å²	144	34.7 Å²	34.7	57%	0.565	17%	0.174	S	C	*	.	S	Bend	trans	-83.4	141.8	173.3	178.9	-89.7	0	0	0	110.6	R61	R61-Y99 WeakPolarHBondContact CA-OH 3.41Å; R61-Y99 PolarHBondContact O-OH 3.32Å
100	P	87.5	Confident	87.2	Confident	34 Å²	34	40.5 Å²	40.5	22%	0.221	21%	0.209	C	C	.	.	S	Bend	cis	-75.8	152.4	-3.9	32.8	-35.2	0	0	0	112.1	N28 T59 S98 M102	N28-P100 PolarHBondContact ND2-O 3.01Å; T59-P100 HydrophobicContact CG2-CG 4.18Å; S98-P100 CarbonylContact O-C 3.49Å; P100-M102 HydrophobicContact CG-CE 3.88Å; P100-M102 WeakPolarHBondContact O-CG 3.48Å; P100-M102 PolarHBondContact O-N 2.98Å
101	I	88.6	Confident	85.3	Confident	9 Å²	9	42.3 Å²	42.3	5%	0.046	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	135.2	168	-63.5	-169.3	0	0	0	108.5	T59 C60 M64 R70 L74 I94 A95 V96	T59-I101 CarbonylContact C-O 3.45Å; T59-I101 WeakPolarHBondContact CA-O 3.11Å; C60-I101 HydrophobicContact CB-CB 4.29Å; C60-I101 PolarHBondContact N-O 3.44Å; M64-I101 HydrophobicContact CE-CB 4.27Å; M64-I101 HydrophobicContact CE-CD1 3.36Å; M64-I101 HydrophobicContact CE-CG1 3.92Å; M64-I101 HydrophobicContact SD-CD1 4.15Å; R70-I101 HydrophobicContact CG-CD1 3.83Å; L74-I101 HydrophobicContact CD1-CD1 4.21Å; L74-I101 HydrophobicContact CD2-CG2 4.04Å; I94-I101 HydrophobicContact CG2-CG2 4.15Å; A95-I101 WeakPolarHBondContact O-CA 3.44Å; V96-I101 HydrophobicContact CG1-CG2 3.94Å
102	M	92.2	Very high	83.4	Confident	14 Å²	14	45.6 Å²	45.6	7%	0.069	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124.5	-177.8	-55.2	-175.7	-172.9	0	0	110.6	V31 L33 V57 K58 T59 I94 A95 P100	V31-M102 HydrophobicContact CB-SD 4.04Å; V31-M102 HydrophobicContact CG1-SD 3.87Å; L33-M102 HydrophobicContact CD1-CE 3.93Å; L33-M102 HydrophobicContact CD2-SD 4.09Å; L33-M102 HydrophobicContact CG-CE 4.22Å; L33-M102 HydrophobicContact CG-SD 4.38Å; V57-M102 HydrophobicContact CG1-CB 3.66Å; V57-M102 HydrophobicContact CG1-CG 4.06Å; V57-M102 HydrophobicContact CG1-SD 4.09Å; K58-M102 WeakPolarHBondContact O-CA 3.36Å; T59-M102 HydrophobicContact CG2-CG 4.4Å; I94-M102 CarbonylContact C-O 3.51Å; I94-M102 WeakPolarHBondContact CA-O 3.48Å; I94-M102 WeakPolarHBondContact CG2-O 3.33Å; A95-M102 HydrophobicContact CB-CB 4.03Å; A95-M102 PolarHBondContact N-O 2.88Å; A95-M102 PolarHBondContact O-N 3.5Å; P100-M102 HydrophobicContact CG-CE 3.88Å; P100-M102 WeakPolarHBondContact O-CG 3.48Å; P100-M102 PolarHBondContact O-N 2.98Å
103	I	92.2	Very high	81.5	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	117	168.2	-59.4	150.8	0	0	0	106.6	V57 K58 E77 L91 I94 M105	V57-I103 WeakPolarHBondContact CA-O 3.3Å; K58-I103 HydrophobicContact CB-CB 4.36Å; K58-I103 HydrophobicContact CD-CD1 4.39Å; K58-I103 PolarHBondContact N-O 2.84Å; K58-I103 PolarHBondContact O-N 2.85Å; E77-I103 HydrophobicContact CB-CD1 4.42Å; E77-I103 HydrophobicContact CG-CD1 3.64Å; E77-I103 HydrophobicContact CG-CG1 4.24Å; L91-I103 HydrophobicContact CD1-CG2 4.42Å; L91-I103 HydrophobicContact CD2-CG2 3.82Å; I94-I103 HydrophobicContact CG2-CG1 4.16Å; I103-M105 HydrophobicContact CB-CE 4.45Å; I103-M105 HydrophobicContact CG2-CE 3.82Å
104	V	94.4	Very high	79.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	128	-176.4	-173.7	0	0	0	0	108.7	L26 V31 V55 V57 V92 G93	L26-V104 HydrophobicContact CD1-CB 3.86Å; L26-V104 HydrophobicContact CD1-CG1 4.41Å; L26-V104 HydrophobicContact CD1-CG2 3.68Å; V31-V104 HydrophobicContact CG1-CG2 4.01Å; V31-V104 HydrophobicContact CG2-CG2 3.81Å; V55-V104 HydrophobicContact CB-CG1 3.68Å; V55-V104 HydrophobicContact CG1-CG1 3.75Å; V55-V104 HydrophobicContact CG2-CG1 3.8Å; V57-V104 HydrophobicContact CG1-CG2 4.4Å; V92-V104 HydrophobicContact CB-CB 4.37Å; V92-V104 HydrophobicContact CB-CG1 4.04Å; V92-V104 HydrophobicContact CG1-CG1 4.38Å; V92-V104 PolarHBondContact N-O 2.85Å; G93-V104 PolarHBondContact N-O 2.9Å; G93-V104 PolarHBondContact O-N 3.47Å
105	M	93.9	Very high	78.9	Confident	18 Å²	18	56.5 Å²	56.5	9%	0.089	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	167	-176.5	67.9	-166.2	68.9	0	0	111.4	V55 A56 K58 V89 K90 L91 I103	V55-M105 WeakPolarHBondContact CA-O 3.41Å; V55-M105 WeakPolarHBondContact CB-O 3.48Å; A56-M105 HydrophobicContact CB-CG 3.7Å; A56-M105 HydrophobicContact CB-SD 4.41Å; A56-M105 PolarHBondContact N-O 3.11Å; A56-M105 PolarHBondContact O-N 3.14Å; K58-M105 HydrophobicContact CB-CE 4.14Å; V89-M105 HydrophobicContact CG1-CB 4.03Å; V89-M105 HydrophobicContact CG1-CG 4.18Å; V89-M105 HydrophobicContact CG1-SD 4.05Å; K90-M105 WeakPolarHBondContact O-CA 3.21Å; L91-M105 HydrophobicContact CD2-CB 3.72Å; L91-M105 HydrophobicContact CD2-CE 4.11Å; I103-M105 HydrophobicContact CB-CE 4.45Å; I103-M105 HydrophobicContact CG2-CE 3.82Å
106	E	91.9	Very high	78.4	Confident	44 Å²	44	59.8 Å²	59.8	21%	0.206	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	140.2	174.8	58.9	177.4	150.9	0	0	111.9	V89 K90 F108 K159	V89-E106 WeakPolarHBondContact CA-OE1 3.48Å; V89-E106 HydrophobicContact CG1-CG 3.95Å; K90-E106 HydrophobicContact CB-CG 4.2Å; K90-E106 WeakPolarHBondContact CB-OE1 3.3Å; K90-E106 PolarHBondContact N-OE1 3.43Å; K90-E106 PolarHBondContact O-N 3.5Å; E106-F108 HydrophobicContact CB-CZ 4.44Å; E106-F108 HydrophobicContact CG-CE1 4.29Å; E106-F108 HydrophobicContact CG-CE2 3.71Å; E106-F108 HydrophobicContact CG-CZ 3.47Å; E106-F108 VanDerWaalsContact CG-CZ 3.47Å; E106-F108 WeakPolarHBondContact OE2-CE1 3.25Å; E106-F108 WeakPolarHBondContact OE2-CZ 3.37Å; E106-K159 VanDerWaalsContact CD-NZ 3.28Å; E106-K159 IonicContact OE1-NZ 3.65Å; E106-K159 PolarHBondContact OE1-NZ 3.34Å; E106-K159 IonicContact OE2-NZ 3.76Å; E106-K159 PolarHBondContact OE2-NZ 3.04Å
107	W	87.4	Confident	78.5	Confident	59 Å²	59	63.5 Å²	63.5	22%	0.223	35%	0.345	C	S	.	.			trans	-89.6	145.2	178.2	173.5	-105.7	0	0	0	111.3	I37 R47 E54 A56	I37-W107 HydrophobicContact CD1-CH2 3.89Å; I37-W107 HydrophobicContact CD1-CZ3 3.46Å; I37-W107 VanDerWaalsContact CD1-CZ3 3.46Å; I37-W107 HydrophobicContact CG1-CZ3 4.23Å; I37-W107 HydrophobicContact CG2-CH2 3.85Å; I37-W107 HydrophobicContact CG2-CZ3 4.18Å; R47-W107 HydrophobicContact CB-CE3 4.02Å; R47-W107 HydrophobicContact CB-CH2 3.8Å; R47-W107 HydrophobicContact CB-CZ2 4.33Å; R47-W107 HydrophobicContact CB-CZ3 3.58Å; R47-W107 HydrophobicContact CG-CD2 4.08Å; R47-W107 HydrophobicContact CG-CE3 3.97Å; R47-W107 HydrophobicContact CG-CH2 4.11Å; R47-W107 HydrophobicContact CG-CZ2 4.16Å; R47-W107 HydrophobicContact CG-CZ3 3.98Å; E54-W107 HydrophobicContact CB-CB 4.21Å; E54-W107 HydrophobicContact CB-CG 4.26Å; A56-W107 HydrophobicContact CB-CE3 3.91Å; A56-W107 HydrophobicContact CB-CZ3 4.46Å
108	F	79.2	Confident	78.9	Confident	21 Å²	21	62.7 Å²	62.7	9%	0.092	34%	0.344	C	S	.	.			trans	-132.6	142.1	170.5	-55.4	-70.5	0	0	0	111	V89 E106 V110 L151 S153 K159	V89-F108 HydrophobicContact CG1-CE2 4.46Å; V89-F108 HydrophobicContact CG2-CE2 4.07Å; E106-F108 HydrophobicContact CB-CZ 4.44Å; E106-F108 HydrophobicContact CG-CE1 4.29Å; E106-F108 HydrophobicContact CG-CE2 3.71Å; E106-F108 HydrophobicContact CG-CZ 3.47Å; E106-F108 VanDerWaalsContact CG-CZ 3.47Å; E106-F108 WeakPolarHBondContact OE2-CE1 3.25Å; E106-F108 WeakPolarHBondContact OE2-CZ 3.37Å; F108-V110 PolarHBondContact O-N 3.13Å; F108-L151 HydrophobicContact CD2-CB 3.97Å; F108-L151 HydrophobicContact CD2-CD1 3.73Å; F108-L151 HydrophobicContact CD2-CG 4.5Å; F108-L151 HydrophobicContact CE2-CB 4.24Å; F108-L151 HydrophobicContact CE2-CD1 3.95Å; F108-S153 VanDerWaalsContact CD1-CA 3.49Å; F108-S153 VanDerWaalsContact CD1-CB 3.44Å; F108-K159 HydrophobicContact CE1-CD 4.34Å; F108-K159 HydrophobicContact CE2-CD 4.41Å; F108-K159 HydrophobicContact CZ-CD 3.64Å; F108-K159 HydrophobicContact CZ-CG 4.46Å
109	S	65.9	Low	79.2	Confident	55 Å²	55	62.3 Å²	62.3	39%	0.385	34%	0.336	S	S	.	.			trans	-79.8	112.6	171.4	-162.8	0	0	0	0	109.2	K111 D154	S109-K111 VanDerWaalsContact C-N 3.35Å; S109-K111 PolarHBondContact O-N 3.23Å; S109-D154 VanDerWaalsContact CB-OD1 3.22Å; S109-D154 WeakPolarHBondContact CB-OD1 3.31Å; S109-D154 PolarHBondContact N-OD1 3.11Å; S109-D154 VanDerWaalsContact N-OD1 3.1Å
110	V	59.3	Low	79.6	Confident	124 Å²	124	58.1 Å²	58.1	75%	0.752	32%	0.321	S	S	*	.			trans	-68.9	94	175.8	-176.2	0	0	0	0	108.9	F108	F108-V110 PolarHBondContact O-N 3.13Å
111	K	54.3	Low	79.9	Confident	157 Å²	157	56.6 Å²	56.6	68%	0.683	31%	0.311	S	S	*	.			trans	-77.9	132.4	172.7	-70	-177.7	-176.2	168.1	0	110.3	S109	S109-K111 VanDerWaalsContact C-N 3.35Å; S109-K111 PolarHBondContact O-N 3.23Å
112	S	52.5	Low	80.2	Confident	81 Å²	81	56.3 Å²	56.3	57%	0.566	31%	0.31	S	S	*	.			trans	-78.3	134	-161.6	61	0	0	0	0	115.6	N114	S112-N114 VanDerWaalsContact C-N 3.3Å; S112-N114 PolarHBondContact O-N 3.26Å
113	K	54.8	Low	80.3	Confident	106 Å²	106	58.7 Å²	58.7	46%	0.461	32%	0.32	S	S	.	.				56.3	2	121.4	-55.2	-174.4	-173.3	-179.4	0	121.7	S312	K113-S312 PolarHBondContact NZ-OG 3.48Å
114	N	61	Low	80.5	Confident	101 Å²	101	59.6 Å²	59.6	54%	0.54	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-79.6	148.5	175.4	-68.3	-13.1	0	0	0	110.9	S112 L116	S112-N114 VanDerWaalsContact C-N 3.3Å; S112-N114 PolarHBondContact O-N 3.26Å; N114-L116 PolarHBondContact O-N 2.81Å
115	A	71.8	Confident	80.6	Confident	81 Å²	81	59.6 Å²	59.6	67%	0.669	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-53.7	116.9	170.8	0	0	0	0	0	108.6
116	L	82.9	Confident	80.8	Confident	69 Å²	69	60.1 Å²	60.1	36%	0.361	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-83	139.9	179.1	-64.7	178.3	0	0	0	109.1	N114 K120 L121 M124	N114-L116 PolarHBondContact O-N 2.81Å; L116-K120 HydrophobicContact CB-CB 4.22Å; L116-K120 HydrophobicContact CB-CG 4.4Å; L116-K120 HydrophobicContact CD1-CG 4.13Å; L116-K120 HydrophobicContact CD2-CG 4.3Å; L116-L121 HydrophobicContact CB-CD2 3.92Å; L116-L121 HydrophobicContact CB-CG 4.37Å; L116-L121 HydrophobicContact CD1-CD2 4.19Å; L116-M124 HydrophobicContact CD1-SD 3.65Å
117	P	88.8	Confident	81	Confident	85 Å²	85	58.3 Å²	58.3	55%	0.552	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-60.8	149.2	172.5	26.7	-33.5	0	0	0	109.8	M119 K120 L121	P117-M119 PolarHBondContact O-N 3.37Å; P117-K120 HydrophobicContact CG-CB 4.04Å; P117-K120 WeakPolarHBondContact O-CA 3.49Å; P117-K120 WeakPolarHBondContact O-CB 3.36Å; P117-K120 PolarHBondContact O-N 3.06Å; P117-L121 PolarHBondContact O-N 3.38Å
118	V	91.3	Very high	81.5	Confident	50 Å²	50	55.5 Å²	55.5	30%	0.303	31%	0.309	S	S	.	.	H	α-helix	trans	-50.8	-37.6	-180	173.4	0	0	0	0	111.9	K120 L121 L122 F213 L243 P245	V118-K120 VanDerWaalsContact C-N 3.27Å; V118-K120 PolarHBondContact O-N 3.07Å; V118-L121 WeakPolarHBondContact O-CB 3.46Å; V118-L121 PolarHBondContact O-N 3.07Å; V118-L121 VanDerWaalsContact O-N 3.12Å; V118-L122 HydrophobicContact CG1-CD1 4.1Å; V118-L122 HydrophobicContact CG1-CG 4.24Å; V118-L122 WeakPolarHBondContact O-CG 3.41Å; V118-L122 PolarHBondContact O-N 2.83Å; V118-F213 HydrophobicContact CG1-CE1 4.31Å; V118-L243 HydrophobicContact CG2-CB 4.41Å; V118-P245 HydrophobicContact CG1-CG 4.41Å
119	M	91.5	Very high	82.5	Confident	55 Å²	55	54.5 Å²	54.5	27%	0.271	30%	0.304	S	S	.	.	H	α-helix	trans	-56	-38.6	175.1	-70	-53.1	-55.7	0	0	113.6	P117 L122 Q123 I275 P276	P117-M119 PolarHBondContact O-N 3.37Å; M119-L122 HydrophobicContact SD-CD1 4.28Å; M119-Q123 PolarHBondContact O-N 3.36Å; M119-I275 HydrophobicContact CE-CB 4.47Å; M119-I275 HydrophobicContact CE-CG2 3.38Å; M119-P276 HydrophobicContact CE-CB 4.41Å; M119-P276 WeakPolarHBondContact CE-O 3.42Å; M119-P276 HydrophobicContact SD-CB 4.23Å; M119-P276 HydrophobicContact SD-CG 4.22Å
120	K	90.9	Very high	84	Confident	56 Å²	56	53.5 Å²	53.5	24%	0.243	30%	0.295	C	S	.	.	H	α-helix	trans	-73.9	-36.8	177.7	-171.3	65.4	-178.4	175.8	0	111.5	L116 P117 V118 L122 Q123 M124 G156	L116-K120 HydrophobicContact CB-CB 4.22Å; L116-K120 HydrophobicContact CB-CG 4.4Å; L116-K120 HydrophobicContact CD1-CG 4.13Å; L116-K120 HydrophobicContact CD2-CG 4.3Å; P117-K120 HydrophobicContact CG-CB 4.04Å; P117-K120 WeakPolarHBondContact O-CA 3.49Å; P117-K120 WeakPolarHBondContact O-CB 3.36Å; P117-K120 PolarHBondContact O-N 3.06Å; V118-K120 VanDerWaalsContact C-N 3.27Å; V118-K120 PolarHBondContact O-N 3.07Å; K120-L122 VanDerWaalsContact C-N 3.34Å; K120-Q123 PolarHBondContact O-N 2.68Å; K120-M124 HydrophobicContact CG-SD 4.42Å; K120-M124 VanDerWaalsContact O-CG 3.28Å; K120-M124 WeakPolarHBondContact O-CG 3.45Å; K120-M124 PolarHBondContact O-N 2.85Å; K120-G156 WeakPolarHBondContact CE-O 3.37Å; K120-G156 PolarHBondContact NZ-O 3.16Å
121	L	92.8	Very high	85.9	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-43.8	173.5	-58.1	-179.6	0	0	0	111.1	L116 P117 V118 M124 S125 I212 F213 F215	L116-L121 HydrophobicContact CB-CD2 3.92Å; L116-L121 HydrophobicContact CB-CG 4.37Å; L116-L121 HydrophobicContact CD1-CD2 4.19Å; P117-L121 PolarHBondContact O-N 3.38Å; V118-L121 WeakPolarHBondContact O-CB 3.46Å; V118-L121 PolarHBondContact O-N 3.07Å; V118-L121 VanDerWaalsContact O-N 3.12Å; L121-M124 PolarHBondContact O-N 3.44Å; L121-S125 PolarHBondContact O-N 3.01Å; L121-S125 PolarHBondContact O-OG 2.85Å; L121-S125 VanDerWaalsContact O-OG 3.07Å; L121-I212 HydrophobicContact CB-CG2 3.89Å; L121-I212 HydrophobicContact CD2-CG2 3.9Å; L121-I212 HydrophobicContact CG-CG2 4.46Å; L121-F213 HydrophobicContact CB-CE1 4.14Å; L121-F213 HydrophobicContact CB-CE2 4.1Å; L121-F213 HydrophobicContact CB-CZ 3.89Å; L121-F213 HydrophobicContact CD1-CD1 4.07Å; L121-F213 HydrophobicContact CD1-CE1 4.23Å; L121-F213 HydrophobicContact CD1-CG 4.49Å; L121-F215 HydrophobicContact CD1-CE1 4.02Å; L121-F215 HydrophobicContact CD1-CZ 4.15Å; L121-F215 HydrophobicContact CD2-CD1 4.45Å; L121-F215 HydrophobicContact CD2-CE1 4.12Å
122	L	95.5	Very high	88	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-43.4	173.9	-69.9	173.6	0	0	0	112.3	V118 M119 K120 M124 S125 L126 F213 P245 W247 L248	V118-L122 HydrophobicContact CG1-CD1 4.1Å; V118-L122 HydrophobicContact CG1-CG 4.24Å; V118-L122 WeakPolarHBondContact O-CG 3.41Å; V118-L122 PolarHBondContact O-N 2.83Å; M119-L122 HydrophobicContact SD-CD1 4.28Å; K120-L122 VanDerWaalsContact C-N 3.34Å; L122-M124 PolarHBondContact O-N 3.21Å; L122-S125 WeakPolarHBondContact O-CB 3.36Å; L122-S125 PolarHBondContact O-N 3.12Å; L122-L126 PolarHBondContact O-N 2.97Å; L122-F213 HydrophobicContact CD2-CZ 3.89Å; L122-F213 HydrophobicContact CG-CZ 4.28Å; L122-P245 HydrophobicContact CD2-CG 4.33Å; L122-W247 HydrophobicContact CD1-CZ2 4.4Å; L122-W247 HydrophobicContact CD2-CH2 3.67Å; L122-W247 HydrophobicContact CD2-CZ2 3.61Å; L122-L248 HydrophobicContact CD2-CD2 3.69Å
123	Q	95	Very high	90.2	Very high	63 Å²	63	39 Å²	39	29%	0.294	21%	0.213	S	C	.	.	H	α-helix	trans	-60.6	-44.9	174.9	-174.1	64.1	59.8	0	0	111.5	M119 K120 S125 L126 D127 I275	M119-Q123 PolarHBondContact O-N 3.36Å; K120-Q123 PolarHBondContact O-N 2.68Å; Q123-S125 VanDerWaalsContact C-N 3.3Å; Q123-S125 PolarHBondContact O-N 2.9Å; Q123-L126 PolarHBondContact O-N 3.19Å; Q123-D127 PolarHBondContact NE2-OD1 2.91Å; Q123-D127 WeakPolarHBondContact O-CB 3.39Å; Q123-D127 PolarHBondContact O-N 3.04Å; Q123-I275 HydrophobicContact CB-CD1 4.27Å
124	M	94.8	Very high	92.2	Very high	21 Å²	21	35.1 Å²	35.1	10%	0.103	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-38.4	176.6	-69.8	168.8	59.4	0	0	112	L116 K120 L121 L122 A128 I152 L158 I212	L116-M124 HydrophobicContact CD1-SD 3.65Å; K120-M124 HydrophobicContact CG-SD 4.42Å; K120-M124 VanDerWaalsContact O-CG 3.28Å; K120-M124 WeakPolarHBondContact O-CG 3.45Å; K120-M124 PolarHBondContact O-N 2.85Å; L121-M124 PolarHBondContact O-N 3.44Å; L122-M124 PolarHBondContact O-N 3.21Å; M124-A128 WeakPolarHBondContact O-CB 3.12Å; M124-A128 PolarHBondContact O-N 3.36Å; M124-I152 HydrophobicContact CE-CD1 3.64Å; M124-I152 HydrophobicContact CE-CG1 4.41Å; M124-I152 HydrophobicContact CG-CD1 4.37Å; M124-I152 HydrophobicContact SD-CD1 4.33Å; M124-L158 HydrophobicContact CB-CB 4.33Å; M124-L158 HydrophobicContact CB-CD1 4Å; M124-L158 HydrophobicContact CE-CD1 4.2Å; M124-L158 HydrophobicContact CG-CB 4.35Å; M124-I212 HydrophobicContact CB-CD1 4.35Å; M124-I212 HydrophobicContact CB-CG2 4.4Å
125	S	97.1	Very high	94	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-44.6	173.3	-59.9	0	0	0	0	112.2	L121 L122 Q123 A129 Y205 L209	L121-S125 PolarHBondContact O-N 3.01Å; L121-S125 PolarHBondContact O-OG 2.85Å; L121-S125 VanDerWaalsContact O-OG 3.07Å; L122-S125 WeakPolarHBondContact O-CB 3.36Å; L122-S125 PolarHBondContact O-N 3.12Å; Q123-S125 VanDerWaalsContact C-N 3.3Å; Q123-S125 PolarHBondContact O-N 2.9Å; S125-A129 PolarHBondContact O-N 3.35Å; S125-Y205 PolarHBondContact O-OH 3.19Å; S125-L209 VanDerWaalsContact CB-CD2 3.46Å; S125-L209 VanDerWaalsContact OG-CD2 3.24Å; S125-L209 WeakPolarHBondContact OG-CD2 3.47Å
126	L	97.9	Very high	95.2	Very high	28 Å²	28	28.3 Å²	28.3	15%	0.147	15%	0.147	C	C	.	.	H	α-helix	trans	-65.1	-45.9	177.4	-179	59.2	0	0	0	111.8	L122 Q123 A128 A129 N130 S270 I273 I275	L122-L126 PolarHBondContact O-N 2.97Å; Q123-L126 PolarHBondContact O-N 3.19Å; L126-A128 VanDerWaalsContact C-N 3.33Å; L126-A128 PolarHBondContact O-N 3.25Å; L126-A129 WeakPolarHBondContact O-CB 3.26Å; L126-A129 PolarHBondContact O-N 2.85Å; L126-A129 VanDerWaalsContact O-N 3.1Å; L126-N130 PolarHBondContact O-N 2.7Å; L126-N130 PolarHBondContact O-ND2 2.83Å; L126-S270 WeakPolarHBondContact CD1-O 3.32Å; L126-I273 HydrophobicContact CB-CG2 3.82Å; L126-I273 HydrophobicContact CD1-CB 4.14Å; L126-I273 HydrophobicContact CD1-CG2 4.28Å; L126-I275 HydrophobicContact CB-CD1 4.13Å; L126-I275 HydrophobicContact CD2-CD1 3.44Å; L126-I275 VanDerWaalsContact CD2-CD1 3.44Å; L126-I275 HydrophobicContact CD2-CG1 4.16Å; L126-I275 HydrophobicContact CG-CD1 4.43Å
127	D	97.4	Very high	95.8	Very high	6 Å²	6	29 Å²	29	3%	0.032	16%	0.162	C	C	.	.	H	α-helix	trans	-55	-48.5	177	-74.7	-5.7	0	0	0	111.1	N87 Q123 A129 N130 G131 Q157 L158	N87-D127 WeakPolarHBondContact CB-O 2.99Å; N87-D127 VanDerWaalsContact CG-O 3.24Å; N87-D127 WeakPolarHBondContact ND2-CA 3.48Å; N87-D127 WeakPolarHBondContact ND2-CB 3.22Å; N87-D127 VanDerWaalsContact ND2-CG 3.31Å; N87-D127 PolarHBondContact ND2-OD1 2.79Å; Q123-D127 PolarHBondContact NE2-OD1 2.91Å; Q123-D127 WeakPolarHBondContact O-CB 3.39Å; Q123-D127 PolarHBondContact O-N 3.04Å; D127-A129 PolarHBondContact O-N 3.2Å; D127-N130 PolarHBondContact O-N 2.9Å; D127-G131 PolarHBondContact O-N 3.16Å; D127-Q157 WeakPolarHBondContact OD2-CA 3.47Å; D127-L158 HydrophobicContact CB-CB 3.78Å; D127-L158 PolarHBondContact OD2-N 2.81Å
128	A	98.1	Very high	96.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-41.1	175.4	0	0	0	0	0	112.3	M124 L126 G131 M132 L158 Y205 L208	M124-A128 WeakPolarHBondContact O-CB 3.12Å; M124-A128 PolarHBondContact O-N 3.36Å; L126-A128 VanDerWaalsContact C-N 3.33Å; L126-A128 PolarHBondContact O-N 3.25Å; A128-G131 PolarHBondContact O-N 2.8Å; A128-M132 WeakPolarHBondContact O-CG 3.18Å; A128-M132 PolarHBondContact O-N 3.1Å; A128-L158 HydrophobicContact CB-CD1 4.44Å; A128-L158 HydrophobicContact CB-CD2 3.76Å; A128-Y205 HydrophobicContact CB-CD2 4.42Å; A128-Y205 HydrophobicContact CB-CE2 3.84Å; A128-L208 HydrophobicContact CB-CD2 3.72Å
129	A	98.6	Very high	96.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-41.4	177	0	0	0	0	0	111.8	S125 L126 D127 M132 M133 Y205 I269 I273	S125-A129 PolarHBondContact O-N 3.35Å; L126-A129 WeakPolarHBondContact O-CB 3.26Å; L126-A129 PolarHBondContact O-N 2.85Å; L126-A129 VanDerWaalsContact O-N 3.1Å; D127-A129 PolarHBondContact O-N 3.2Å; A129-M132 PolarHBondContact O-N 3.39Å; A129-M133 VanDerWaalsContact O-CB 3.3Å; A129-M133 WeakPolarHBondContact O-CB 3.38Å; A129-M133 PolarHBondContact O-N 2.84Å; A129-Y205 HydrophobicContact CB-CE2 4Å; A129-I269 HydrophobicContact CB-CG2 3.73Å; A129-I273 HydrophobicContact CB-CD1 4.04Å
130	N	98.4	Very high	96.5	Very high	34 Å²	34	27.9 Å²	27.9	18%	0.182	14%	0.144	C	C	.	.	H	α-helix	trans	-65	-43.6	177.4	-72	-21.5	0	0	0	111.8	N87 L126 D127 M133 Y134 S270	N87-N130 WeakPolarHBondContact OD1-CB 3.49Å; L126-N130 PolarHBondContact O-N 2.7Å; L126-N130 PolarHBondContact O-ND2 2.83Å; D127-N130 PolarHBondContact O-N 2.9Å; N130-M133 PolarHBondContact O-N 2.79Å; N130-Y134 PolarHBondContact O-N 2.78Å; N130-S270 WeakPolarHBondContact OD1-CB 3.33Å; N130-S270 PolarHBondContact OD1-OG 2.88Å
131	G	98.3	Very high	96.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.5	-47.5	173.5	0	0	0	0	0	111.9	D127 A128 Y134 L135	D127-G131 PolarHBondContact O-N 3.16Å; A128-G131 PolarHBondContact O-N 2.8Å; G131-Y134 WeakPolarHBondContact O-CB 3.45Å; G131-Y134 PolarHBondContact O-N 3.17Å; G131-L135 WeakPolarHBondContact O-CG 3.49Å; G131-L135 PolarHBondContact O-N 2.78Å; G131-L135 VanDerWaalsContact O-N 3.13Å
132	M	98.6	Very high	96.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-69.7	-32.6	178.3	-71.2	-54.7	-52.7	0	0	113.7	A128 A129 Y134 L135 E136 H142 L145 I160 I198 D201 F266	A128-M132 WeakPolarHBondContact O-CG 3.18Å; A128-M132 PolarHBondContact O-N 3.1Å; A129-M132 PolarHBondContact O-N 3.39Å; M132-Y134 VanDerWaalsContact C-N 3.29Å; M132-Y134 PolarHBondContact O-N 2.81Å; M132-L135 HydrophobicContact CE-CD1 4.21Å; M132-L135 PolarHBondContact O-N 2.91Å; M132-L135 HydrophobicContact SD-CD1 3.79Å; M132-E136 WeakPolarHBondContact O-CB 3.45Å; M132-E136 PolarHBondContact O-N 2.91Å; M132-H142 HydrophobicContact CE-CB 4.04Å; M132-H142 HydrophobicContact SD-CB 4.25Å; M132-L145 HydrophobicContact CE-CD2 4.43Å; M132-L145 HydrophobicContact CG-CD1 4.36Å; M132-L145 HydrophobicContact CG-CD2 3.74Å; M132-L145 HydrophobicContact SD-CD1 3.94Å; M132-L145 HydrophobicContact SD-CD2 3.8Å; M132-L145 HydrophobicContact SD-CG 4.36Å; M132-I160 HydrophobicContact CB-CD1 4.46Å; M132-I160 HydrophobicContact CG-CD1 3.59Å; M132-I160 HydrophobicContact SD-CD1 3.61Å; M132-I198 HydrophobicContact CE-CD1 4.1Å; M132-D201 HydrophobicContact CE-CB 3.55Å; M132-F266 HydrophobicContact CB-CB 4.35Å; M132-F266 HydrophobicContact CB-CD1 3.34Å; M132-F266 HydrophobicContact CB-CD2 3.73Å; M132-F266 HydrophobicContact CB-CE1 3.32Å; M132-F266 HydrophobicContact CB-CE2 3.71Å; M132-F266 HydrophobicContact CB-CG 3.54Å; M132-F266 HydrophobicContact CB-CZ 3.5Å; M132-F266 VanDerWaalsContact CB-CZ 3.5Å; M132-F266 HydrophobicContact CE-CD2 4.44Å; M132-F266 HydrophobicContact CE-CE2 3.61Å; M132-F266 HydrophobicContact CE-CZ 3.71Å; M132-F266 HydrophobicContact CG-CD1 4.2Å; M132-F266 HydrophobicContact CG-CE1 3.69Å; M132-F266 HydrophobicContact CG-CE2 4.28Å; M132-F266 HydrophobicContact CG-CZ 3.72Å
133	M	98.3	Very high	96.8	Very high	59 Å²	59	25.6 Å²	25.6	29%	0.291	13%	0.133	S	C	.	.	H	α-helix	trans	-61.6	-40.3	171.9	179.8	179.8	63.2	0	0	111.1	A129 N130 E136 A137 F266	A129-M133 VanDerWaalsContact O-CB 3.3Å; A129-M133 WeakPolarHBondContact O-CB 3.38Å; A129-M133 PolarHBondContact O-N 2.84Å; N130-M133 PolarHBondContact O-N 2.79Å; M133-E136 PolarHBondContact O-N 2.84Å; M133-A137 PolarHBondContact O-N 3.39Å; M133-F266 HydrophobicContact CB-CB 3.87Å
134	Y	98.3	Very high	96.7	Very high	23 Å²	23	22.8 Å²	22.8	9%	0.09	12%	0.12	C	C	.	.	H	α-helix	trans	-63.2	-40.3	174.2	168.3	-87.8	0	0	0	112.5	F83 N84 H85 I88 N130 G131 M132 R138	F83-Y134 VanDerWaalsContact CA-OH 3.29Å; F83-Y134 WeakPolarHBondContact CA-OH 3.4Å; F83-Y134 HydrophobicContact CB-CE1 4.01Å; F83-Y134 HydrophobicContact CD1-CE1 4.11Å; F83-Y134 HydrophobicContact CG-CE1 4.01Å; N84-Y134 PolarHBondContact N-OH 2.74Å; H85-Y134 HydrophobicContact CB-CD1 3.94Å; H85-Y134 HydrophobicContact CB-CD2 3.73Å; H85-Y134 HydrophobicContact CB-CE1 4.1Å; H85-Y134 HydrophobicContact CB-CE2 3.84Å; H85-Y134 HydrophobicContact CB-CG 3.76Å; H85-Y134 AromaticContact CD2-CD2 3.54Å; H85-Y134 AromaticContact CD2-CG 3.73Å; H85-Y134 AromaticContact CG-CD2 3.82Å; H85-Y134 AromaticContact CG-CG 3.73Å; I88-Y134 HydrophobicContact CG1-CD1 3.86Å; I88-Y134 HydrophobicContact CG1-CE1 4.25Å; N130-Y134 PolarHBondContact O-N 2.78Å; G131-Y134 WeakPolarHBondContact O-CB 3.45Å; G131-Y134 PolarHBondContact O-N 3.17Å; M132-Y134 VanDerWaalsContact C-N 3.29Å; M132-Y134 PolarHBondContact O-N 2.81Å; Y134-R138 VanDerWaalsContact CZ-NE 3.32Å; Y134-R138 PolarHBondContact O-N 2.8Å; Y134-R138 PolarHBondContact OH-NE 3.44Å; Y134-R138 PolarHBondContact OH-NH2 3.1Å
135	L	97.4	Very high	96.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-69.1	-41.2	175.6	-63.5	178.3	0	0	0	112	F83 I88 G131 M132 A137 R138 N139 C140 H142 F163	F83-L135 HydrophobicContact CD2-CD2 3.85Å; F83-L135 HydrophobicContact CE2-CD2 3.46Å; F83-L135 VanDerWaalsContact CE2-CD2 3.46Å; F83-L135 HydrophobicContact CZ-CD2 3.86Å; I88-L135 HydrophobicContact CD1-CD1 4.09Å; I88-L135 HydrophobicContact CD1-CD2 4.19Å; I88-L135 HydrophobicContact CD1-CG 4Å; G131-L135 WeakPolarHBondContact O-CG 3.49Å; G131-L135 PolarHBondContact O-N 2.78Å; G131-L135 VanDerWaalsContact O-N 3.13Å; M132-L135 HydrophobicContact CE-CD1 4.21Å; M132-L135 PolarHBondContact O-N 2.91Å; M132-L135 HydrophobicContact SD-CD1 3.79Å; L135-A137 VanDerWaalsContact C-N 3.33Å; L135-A137 PolarHBondContact O-N 3.22Å; L135-R138 CarbonylContact O-C 3.58Å; L135-R138 WeakPolarHBondContact O-CA 3.22Å; L135-R138 PolarHBondContact O-N 3.44Å; L135-N139 PolarHBondContact O-N 3.05Å; L135-C140 HydrophobicContact CB-CB 4.11Å; L135-C140 HydrophobicContact CD2-CB 4.15Å; L135-C140 PolarHBondContact O-N 2.81Å; L135-H142 HydrophobicContact CD1-CB 4.43Å; L135-F163 HydrophobicContact CD1-CE1 3.84Å; L135-F163 HydrophobicContact CD2-CE1 3.97Å
136	E	97.2	Very high	96.8	Very high	40 Å²	40	21.8 Å²	21.8	19%	0.187	12%	0.115	C	C	.	.	H	α-helix	trans	-55.7	-46.9	174.1	177.3	171	-121.8	0	0	110.9	M132 M133 R138 N139 I198 F266	M132-E136 WeakPolarHBondContact O-CB 3.45Å; M132-E136 PolarHBondContact O-N 2.91Å; M133-E136 PolarHBondContact O-N 2.84Å; E136-R138 PolarHBondContact O-N 3.2Å; E136-R138 VanDerWaalsContact O-N 3.15Å; E136-N139 PolarHBondContact O-N 3.47Å; E136-I198 HydrophobicContact CB-CD1 4.02Å; E136-I198 HydrophobicContact CB-CG1 3.82Å; E136-I198 HydrophobicContact CG-CG1 3.9Å; E136-F266 HydrophobicContact CB-CD2 4.27Å; E136-F266 PolarHBondContact OE2-N 2.96Å
137	A	96.6	Very high	96.5	Very high	82 Å²	82	21.7 Å²	21.7	68%	0.678	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.1	177.4	0	0	0	0	0	114	M133 L135	M133-A137 PolarHBondContact O-N 3.39Å; L135-A137 VanDerWaalsContact C-N 3.33Å; L135-A137 PolarHBondContact O-N 3.22Å
138	R	95.3	Very high	96.2	Very high	98 Å²	98	24.3 Å²	24.3	37%	0.37	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	7.2	175.9	-75.6	175.3	155.7	63.8	-1.9	113.2	Y134 L135 E136 C140 E168	Y134-R138 VanDerWaalsContact CZ-NE 3.32Å; Y134-R138 PolarHBondContact O-N 2.8Å; Y134-R138 PolarHBondContact OH-NE 3.44Å; Y134-R138 PolarHBondContact OH-NH2 3.1Å; L135-R138 CarbonylContact O-C 3.58Å; L135-R138 WeakPolarHBondContact O-CA 3.22Å; L135-R138 PolarHBondContact O-N 3.44Å; E136-R138 PolarHBondContact O-N 3.2Å; E136-R138 VanDerWaalsContact O-N 3.15Å; R138-C140 HydrophobicContact CB-CB 4.48Å; R138-C140 PolarHBondContact O-N 3Å; R138-E168 WeakPolarHBondContact O-CG 3.41Å
139	N	94.5	Very high	95.9	Very high	70 Å²	70	25 Å²	25	37%	0.374	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	33.1	-172.7	-54	-48.4	0	0	0	112.5	L135 E136 E168 E169 H170	L135-N139 PolarHBondContact O-N 3.05Å; E136-N139 PolarHBondContact O-N 3.47Å; N139-E168 CarbonylContact O-C 3.54Å; N139-E168 WeakPolarHBondContact O-CA 3.47Å; N139-E169 CarbonylContact O-C 3.45Å; N139-E169 PolarHBondContact O-N 3.03Å; N139-E169 VanDerWaalsContact O-O 3.14Å; N139-H170 PolarHBondContact OD1-CE1 2.69Å; N139-H170 PolarHBondContact OD1-ND1 3.41Å
140	C	95.4	Very high	95.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	116.5	177.8	-175.1	0	0	0	0	109.8	F83 L135 R138 R167	F83-C140 HydrophobicContact CZ-CB 4.09Å; L135-C140 HydrophobicContact CB-CB 4.11Å; L135-C140 HydrophobicContact CD2-CB 4.15Å; L135-C140 PolarHBondContact O-N 2.81Å; R138-C140 HydrophobicContact CB-CB 4.48Å; R138-C140 PolarHBondContact O-N 3Å; C140-R167 WeakPolarHBondContact CA-O 3.38Å
141	I	96.1	Very high	95.2	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	120.8	171.7	-48.7	167.4	0	0	0	107.6	R143 S166 R167 E169 Y196 D201	I141-R143 HydrophobicContact CB-CG 4.2Å; I141-R143 HydrophobicContact CG2-CG 3.52Å; I141-S166 CarbonylContact O-C 3.57Å; I141-S166 WeakPolarHBondContact O-CA 3.23Å; I141-S166 WeakPolarHBondContact O-CB 3.36Å; I141-R167 PolarHBondContact N-O 3.13Å; I141-R167 PolarHBondContact O-N 3.3Å; I141-E169 WeakPolarHBondContact CD1-O 3.34Å; I141-E169 WeakPolarHBondContact CG1-O 3.42Å; I141-Y196 WeakPolarHBondContact CD1-O 3.24Å; I141-D201 WeakPolarHBondContact CA-OD2 3.09Å; I141-D201 VanDerWaalsContact CG2-OD2 3.31Å; I141-D201 WeakPolarHBondContact CG2-OD2 3.4Å
142	H	95.4	Very high	94.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.			trans	-73.6	-45.1	-177.7	-169.9	-76.7	0	0	0	112.2	M132 L135 D144 L145 I160 A161 D162 F163 D201	M132-H142 HydrophobicContact CE-CB 4.04Å; M132-H142 HydrophobicContact SD-CB 4.25Å; L135-H142 HydrophobicContact CD1-CB 4.43Å; H142-D144 PolarHBondContact CE1-O 2.72Å; H142-D144 PolarHBondContact ND1-N 2.81Å; H142-D144 PolarHBondContact O-N 2.79Å; H142-L145 PolarHBondContact ND1-N 2.72Å; H142-L145 VanDerWaalsContact ND1-N 3.14Å; H142-I160 VanDerWaalsContact NE2-CG2 3.33Å; H142-I160 WeakPolarHBondContact NE2-CG2 3.45Å; H142-A161 PolarHBondContact NE2-O 2.76Å; H142-A161 VanDerWaalsContact NE2-O 3.13Å; H142-D162 PolarHBondContact CE1-O 3.24Å; H142-F163 AromaticContact CD2-CE1 3.73Å; H142-D201 PolarHBondContact N-OD2 3.2Å
143	R	94.4	Very high	94	Very high	11 Å²	11	30.2 Å²	30.2	4%	0.042	16%	0.161	C	C	.	.	S	Bend	trans	67.6	-16.3	178	-55.8	-178.4	49.6	-133.1	-2.1	117.1	I141 M165 Y196 D201	I141-R143 HydrophobicContact CB-CG 4.2Å; I141-R143 HydrophobicContact CG2-CG 3.52Å; R143-M165 HydrophobicContact CB-CB 4.28Å; R143-M165 WeakPolarHBondContact CD-O 3.38Å; R143-M165 PolarHBondContact NH1-O 2.93Å; R143-Y196 HydrophobicContact CB-CD1 4.09Å; R143-Y196 HydrophobicContact CB-CE1 4.27Å; R143-Y196 HydrophobicContact CG-CD1 3.72Å; R143-Y196 HydrophobicContact CG-CE1 4.37Å; R143-Y196 HydrophobicContact CG-CG 4.04Å; R143-D201 WeakPolarHBondContact CA-OD1 3.48Å; R143-D201 PolarHBondContact N-OD1 3.24Å
144	D	93.3	Very high	93	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.021	17%	0.171	C	C	.	.			trans	-130.4	38.8	176.7	-159.7	8.8	0	0	0	113.2	H142 A146 R148 N149 M165 R319	H142-D144 PolarHBondContact CE1-O 2.72Å; H142-D144 PolarHBondContact ND1-N 2.81Å; H142-D144 PolarHBondContact O-N 2.79Å; D144-A146 PolarHBondContact O-N 3.38Å; D144-R148 IonicContact OD1-CZ 2.69Å; D144-R148 IonicContact OD1-NE 3.69Å; D144-R148 IonicContact OD1-NH2 3.59Å; D144-R148 PolarHBondContact OD1-NH2 3.39Å; D144-N149 PolarHBondContact O-ND2 3.39Å; D144-N149 PolarHBondContact OD2-ND2 3.41Å; D144-N149 VanDerWaalsContact OD2-ND2 3.13Å; D144-M165 HydrophobicContact CB-CB 4.33Å; D144-M165 HydrophobicContact CB-CG 4.46Å; D144-M165 HydrophobicContact CB-SD 3.97Å; D144-R319 IonicContact OD1-NH2 2.69Å; D144-R319 PolarHBondContact OD1-NH2 3.19Å; D144-R319 IonicContact OD2-CZ 3.47Å; D144-R319 IonicContact OD2-NH2 3.55Å; D144-R319 PolarHBondContact OD2-NH2 3.04Å
145	L	97.1	Very high	92.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.			trans	-71.4	118.9	179.1	-177.9	68.2	0	0	0	110	M132 H142 I160 Y205 L208	M132-L145 HydrophobicContact CE-CD2 4.43Å; M132-L145 HydrophobicContact CG-CD1 4.36Å; M132-L145 HydrophobicContact CG-CD2 3.74Å; M132-L145 HydrophobicContact SD-CD1 3.94Å; M132-L145 HydrophobicContact SD-CD2 3.8Å; M132-L145 HydrophobicContact SD-CG 4.36Å; H142-L145 PolarHBondContact ND1-N 2.72Å; H142-L145 VanDerWaalsContact ND1-N 3.14Å; L145-I160 HydrophobicContact CD1-CD1 4.19Å; L145-I160 HydrophobicContact CD1-CG1 4.39Å; L145-I160 HydrophobicContact CD1-CG2 4.1Å; L145-Y205 HydrophobicContact CD2-CD2 4.32Å; L145-L208 HydrophobicContact CD1-CD2 4.02Å; L145-L208 HydrophobicContact CD2-CD2 4.36Å; L145-L208 HydrophobicContact CG-CD2 4.14Å
146	A	95.5	Very high	91.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-162.8	162.8	179.7	0	0	0	0	0	109.9	D144 R148 N149 C150 W185	D144-A146 PolarHBondContact O-N 3.38Å; A146-R148 HydrophobicContact CB-CG 3.95Å; A146-R148 PolarHBondContact O-N 3.38Å; A146-R148 VanDerWaalsContact O-N 3.16Å; A146-N149 CarbonylContact O-C 3.53Å; A146-N149 PolarHBondContact O-N 2.86Å; A146-C150 PolarHBondContact O-N 3.27Å; A146-C150 PolarHBondContact O-SG 3.17Å; A146-C150 VanDerWaalsContact O-SG 3.38Å; A146-W185 HydrophobicContact CB-CD2 4.2Å; A146-W185 HydrophobicContact CB-CG 4.08Å; A146-W185 HydrophobicContact CB-CZ2 4.48Å
147	A	93.2	Very high	91.1	Very high	27 Å²	27	37.8 Å²	37.8	22%	0.223	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-60.8	-29.9	-179.4	0	0	0	0	0	113.1	N149 C150 L208 E211	A147-N149 PolarHBondContact O-N 3.37Å; A147-C150 PolarHBondContact O-N 3.14Å; A147-L208 HydrophobicContact CB-CD1 3.86Å; A147-E211 HydrophobicContact CB-CB 3.78Å; A147-E211 HydrophobicContact CB-CG 4.29Å; A147-E211 WeakPolarHBondContact CB-OE1 3.48Å; A147-E211 PolarHBondContact N-OE2 2.95Å
148	R	90.1	Very high	91	Very high	61 Å²	61	34 Å²	34	23%	0.23	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-63.8	-24.7	174.4	61.5	169.7	177.6	-75.2	-10.1	113.9	D144 A146 W185	D144-R148 IonicContact OD1-CZ 2.69Å; D144-R148 IonicContact OD1-NE 3.69Å; D144-R148 IonicContact OD1-NH2 3.59Å; D144-R148 PolarHBondContact OD1-NH2 3.39Å; A146-R148 HydrophobicContact CB-CG 3.95Å; A146-R148 PolarHBondContact O-N 3.38Å; A146-R148 VanDerWaalsContact O-N 3.16Å; R148-W185 VanDerWaalsContact NH1-CH2 3.27Å
149	N	91.7	Very high	90.9	Very high	14 Å²	14	30.6 Å²	30.6	8%	0.075	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-104.7	20.2	-179.2	-67.4	-11.6	0	0	0	110.5	D144 A146 A147 A161 D162	D144-N149 PolarHBondContact O-ND2 3.39Å; D144-N149 PolarHBondContact OD2-ND2 3.41Å; D144-N149 VanDerWaalsContact OD2-ND2 3.13Å; A146-N149 CarbonylContact O-C 3.53Å; A146-N149 PolarHBondContact O-N 2.86Å; A147-N149 PolarHBondContact O-N 3.37Å; N149-A161 WeakPolarHBondContact O-CA 3.33Å; N149-A161 PolarHBondContact O-N 3.37Å; N149-D162 HydrophobicContact CB-CB 4.12Å
150	C	92.3	Very high	91	Very high	16 Å²	16	27.3 Å²	27.3	11%	0.108	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.8	170.3	-62.4	0	0	0	0	108.5	A146 A147 L158 K159	A146-C150 PolarHBondContact O-N 3.27Å; A146-C150 PolarHBondContact O-SG 3.17Å; A146-C150 VanDerWaalsContact O-SG 3.38Å; A147-C150 PolarHBondContact O-N 3.14Å; C150-L158 HydrophobicContact CB-CD1 4.02Å; C150-L158 HydrophobicContact CB-CD2 4.02Å; C150-L158 HydrophobicContact CB-CG 3.97Å; C150-K159 CarbonylContact C-O 3.34Å; C150-K159 WeakPolarHBondContact CA-O 3.46Å
151	L	89.5	Confident	90.8	Very high	53 Å²	53	27.7 Å²	27.7	28%	0.277	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	149.1	174	-57.9	-176.8	0	0	0	109.3	V89 F108 L158 K159 A161	V89-L151 HydrophobicContact CG2-CB 4.35Å; V89-L151 HydrophobicContact CG2-CD1 3.86Å; V89-L151 HydrophobicContact CG2-CG 4.25Å; F108-L151 HydrophobicContact CD2-CB 3.97Å; F108-L151 HydrophobicContact CD2-CD1 3.73Å; F108-L151 HydrophobicContact CD2-CG 4.5Å; F108-L151 HydrophobicContact CE2-CB 4.24Å; F108-L151 HydrophobicContact CE2-CD1 3.95Å; L151-L158 CarbonylContact O-C 3.53Å; L151-L158 WeakPolarHBondContact O-CA 3.38Å; L151-K159 PolarHBondContact N-O 3.12Å; L151-K159 PolarHBondContact O-N 3.27Å; L151-A161 HydrophobicContact CD1-CB 4.27Å; L151-A161 HydrophobicContact CG-CB 4.12Å
152	I	87.6	Confident	90.3	Very high	64 Å²	64	29.1 Å²	29.1	33%	0.328	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.2	172.2	-51.6	-57.2	0	0	0	106.9	M124 Q157 L158	M124-I152 HydrophobicContact CE-CD1 3.64Å; M124-I152 HydrophobicContact CE-CG1 4.41Å; M124-I152 HydrophobicContact CG-CD1 4.37Å; M124-I152 HydrophobicContact SD-CD1 4.33Å; I152-Q157 WeakPolarHBondContact CA-O 3.34Å; I152-L158 HydrophobicContact CD1-CB 3.75Å; I152-L158 HydrophobicContact CD1-CD1 4.1Å; I152-L158 HydrophobicContact CD1-CG 3.93Å
153	S	83.8	Confident	90	Very high	10 Å²	10	29.2 Å²	29.2	7%	0.07	16%	0.156	C	C	.	.			trans	-76.6	168.8	177.5	52.3	0	0	0	0	111.7	F108 D155 G156 Q157	F108-S153 VanDerWaalsContact CD1-CA 3.49Å; F108-S153 VanDerWaalsContact CD1-CB 3.44Å; S153-D155 PolarHBondContact O-N 2.73Å; S153-D155 PolarHBondContact OG-OD1 2.81Å; S153-G156 VanDerWaalsContact O-CA 3.24Å; S153-G156 WeakPolarHBondContact O-CA 3.2Å; S153-G156 PolarHBondContact O-N 2.99Å; S153-Q157 PolarHBondContact N-O 2.76Å; S153-Q157 WeakPolarHBondContact OG-CB 3.41Å; S153-Q157 PolarHBondContact OG-N 2.91Å; S153-Q157 PolarHBondContact OG-O 3.11Å
154	D	78.4	Confident	89.3	Confident	95 Å²	95	29 Å²	29	51%	0.508	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-26.1	-171.9	-73.4	-11.1	0	0	0	113.9	S109	S109-D154 VanDerWaalsContact CB-OD1 3.22Å; S109-D154 WeakPolarHBondContact CB-OD1 3.31Å; S109-D154 PolarHBondContact N-OD1 3.11Å; S109-D154 VanDerWaalsContact N-OD1 3.1Å
155	D	80.9	Confident	88.7	Confident	107 Å²	107	30 Å²	30	57%	0.572	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-2	171.2	68.7	-5.1	0	0	0	112.6	S153 Q157	S153-D155 PolarHBondContact O-N 2.73Å; S153-D155 PolarHBondContact OG-OD1 2.81Å; D155-Q157 WeakPolarHBondContact OD1-CG 3.37Å; D155-Q157 PolarHBondContact OD1-N 2.94Å
156	G	82.4	Confident	88	Confident	11 Å²	11	30.1 Å²	30.1	11%	0.113	16%	0.162	C	C	.	.			trans	83.5	12.5	177.8	0	0	0	0	0	114.5	K120 S153	K120-G156 WeakPolarHBondContact CE-O 3.37Å; K120-G156 PolarHBondContact NZ-O 3.16Å; S153-G156 VanDerWaalsContact O-CA 3.24Å; S153-G156 WeakPolarHBondContact O-CA 3.2Å; S153-G156 PolarHBondContact O-N 2.99Å
157	Q	89.6	Confident	87.5	Confident	69 Å²	69	31.1 Å²	31.1	32%	0.322	17%	0.166	S	C	.	.			trans	-73.5	138.6	173.3	-64.7	-178.6	-5	0	0	110.8	D127 I152 S153 D155	D127-Q157 WeakPolarHBondContact OD2-CA 3.47Å; I152-Q157 WeakPolarHBondContact CA-O 3.34Å; S153-Q157 PolarHBondContact N-O 2.76Å; S153-Q157 WeakPolarHBondContact OG-CB 3.41Å; S153-Q157 PolarHBondContact OG-N 2.91Å; S153-Q157 PolarHBondContact OG-O 3.11Å; D155-Q157 WeakPolarHBondContact OD1-CG 3.37Å; D155-Q157 PolarHBondContact OD1-N 2.94Å
158	L	93.6	Very high	87.1	Confident	3 Å²	3	35 Å²	35	2%	0.016	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	132.5	170.4	-176.4	157.5	0	0	0	110	N87 M124 D127 A128 C150 L151 I152 I160 I212	N87-L158 WeakPolarHBondContact CB-O 3.48Å; N87-L158 PolarHBondContact ND2-O 3.35Å; M124-L158 HydrophobicContact CB-CB 4.33Å; M124-L158 HydrophobicContact CB-CD1 4Å; M124-L158 HydrophobicContact CE-CD1 4.2Å; M124-L158 HydrophobicContact CG-CB 4.35Å; D127-L158 HydrophobicContact CB-CB 3.78Å; D127-L158 PolarHBondContact OD2-N 2.81Å; A128-L158 HydrophobicContact CB-CD1 4.44Å; A128-L158 HydrophobicContact CB-CD2 3.76Å; C150-L158 HydrophobicContact CB-CD1 4.02Å; C150-L158 HydrophobicContact CB-CD2 4.02Å; C150-L158 HydrophobicContact CB-CG 3.97Å; L151-L158 CarbonylContact O-C 3.53Å; L151-L158 WeakPolarHBondContact O-CA 3.38Å; I152-L158 HydrophobicContact CD1-CB 3.75Å; I152-L158 HydrophobicContact CD1-CD1 4.1Å; I152-L158 HydrophobicContact CD1-CG 3.93Å; L158-I160 HydrophobicContact CD2-CG1 4.37Å; L158-I212 HydrophobicContact CD1-CD1 4.4Å
159	K	95	Very high	86.9	Confident	26 Å²	26	36 Å²	36	11%	0.113	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.8	173.4	-53.7	-157.3	-171	-177.8	0	111.5	P86 N87 V89 E106 F108 C150 L151	P86-K159 WeakPolarHBondContact O-CD 3.43Å; P86-K159 WeakPolarHBondContact O-CE 3.43Å; P86-K159 WeakPolarHBondContact O-CG 3.41Å; N87-K159 CarbonylContact O-C 3.55Å; N87-K159 WeakPolarHBondContact O-CA 3.45Å; V89-K159 HydrophobicContact CG2-CB 3.65Å; E106-K159 VanDerWaalsContact CD-NZ 3.28Å; E106-K159 IonicContact OE1-NZ 3.65Å; E106-K159 PolarHBondContact OE1-NZ 3.34Å; E106-K159 IonicContact OE2-NZ 3.76Å; E106-K159 PolarHBondContact OE2-NZ 3.04Å; F108-K159 HydrophobicContact CE1-CD 4.34Å; F108-K159 HydrophobicContact CE2-CD 4.41Å; F108-K159 HydrophobicContact CZ-CD 3.64Å; F108-K159 HydrophobicContact CZ-CG 4.46Å; C150-K159 CarbonylContact C-O 3.34Å; C150-K159 WeakPolarHBondContact CA-O 3.46Å; L151-K159 PolarHBondContact N-O 3.12Å; L151-K159 PolarHBondContact O-N 3.27Å
160	I	95.2	Very high	86.7	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	135	177.1	-54.8	174.4	0	0	0	109.4	N87 I88 V89 M132 H142 L145 L158 F163	N87-I160 PolarHBondContact O-N 2.92Å; I88-I160 HydrophobicContact CD1-CB 3.92Å; I88-I160 HydrophobicContact CD1-CD1 4.14Å; I88-I160 HydrophobicContact CD1-CG1 4.38Å; V89-I160 WeakPolarHBondContact CG2-O 3.17Å; V89-I160 PolarHBondContact N-O 2.91Å; M132-I160 HydrophobicContact CB-CD1 4.46Å; M132-I160 HydrophobicContact CG-CD1 3.59Å; M132-I160 HydrophobicContact SD-CD1 3.61Å; H142-I160 VanDerWaalsContact NE2-CG2 3.33Å; H142-I160 WeakPolarHBondContact NE2-CG2 3.45Å; L145-I160 HydrophobicContact CD1-CD1 4.19Å; L145-I160 HydrophobicContact CD1-CG1 4.39Å; L145-I160 HydrophobicContact CD1-CG2 4.1Å; L158-I160 HydrophobicContact CD2-CG1 4.37Å; I160-F163 HydrophobicContact CG2-CZ 4.3Å
161	A	91.5	Very high	86.6	Confident	8 Å²	8	44.5 Å²	44.5	7%	0.066	23%	0.226	C	C	.	.			trans	-131.3	177.2	-176.7	0	0	0	0	0	111.1	V89 H142 N149 L151	V89-A161 HydrophobicContact CB-CB 4.15Å; V89-A161 HydrophobicContact CG2-CB 3.69Å; H142-A161 PolarHBondContact NE2-O 2.76Å; H142-A161 VanDerWaalsContact NE2-O 3.13Å; N149-A161 WeakPolarHBondContact O-CA 3.33Å; N149-A161 PolarHBondContact O-N 3.37Å; L151-A161 HydrophobicContact CD1-CB 4.27Å; L151-A161 HydrophobicContact CG-CB 4.12Å
162	D	86.5	Confident	86.5	Confident	33 Å²	33	43.4 Å²	43.4	18%	0.176	22%	0.218	C	C	.	.			trans	62.9	77.7	176.4	-155.6	-19.7	0	0	0	114.6	K58 H142 N149	K58-D162 IonicContact NZ-OD1 2.63Å; K58-D162 PolarHBondContact NZ-OD1 2.9Å; K58-D162 IonicContact NZ-OD2 2.78Å; K58-D162 PolarHBondContact NZ-OD2 3.45Å; H142-D162 PolarHBondContact CE1-O 3.24Å; N149-D162 HydrophobicContact CB-CB 4.12Å
163	F	87.7	Confident	86.5	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.009	23%	0.229	C	C	.	.			trans	-91.5	6.1	-179.3	-66.3	-82.5	0	0	0	113	G76 E77 A80 F83 I88 L135 H142 I160 M165 S166	G76-F163 CarbonylContact C-O 3.46Å; G76-F163 VanDerWaalsContact CA-O 3.3Å; G76-F163 WeakPolarHBondContact CA-O 3.48Å; E77-F163 PolarHBondContact OE1-N 2.95Å; A80-F163 HydrophobicContact CB-CB 3.69Å; A80-F163 HydrophobicContact CB-CD1 4.26Å; A80-F163 HydrophobicContact CB-CD2 3.68Å; A80-F163 HydrophobicContact CB-CE2 4.44Å; A80-F163 HydrophobicContact CB-CG 3.59Å; F83-F163 HydrophobicContact CD2-CD1 4.35Å; F83-F163 HydrophobicContact CD2-CE1 4.05Å; F83-F163 HydrophobicContact CD2-CZ 4.24Å; F83-F163 AromaticContact CE2-CD1 3.84Å; F83-F163 HydrophobicContact CE2-CD1 3.84Å; F83-F163 AromaticContact CE2-CE1 3.81Å; F83-F163 HydrophobicContact CE2-CE1 3.81Å; F83-F163 HydrophobicContact CE2-CG 4.49Å; F83-F163 HydrophobicContact CE2-CZ 4.45Å; I88-F163 HydrophobicContact CD1-CZ 4.21Å; I88-F163 HydrophobicContact CG2-CE2 3.92Å; I88-F163 HydrophobicContact CG2-CZ 3.62Å; L135-F163 HydrophobicContact CD1-CE1 3.84Å; L135-F163 HydrophobicContact CD2-CE1 3.97Å; H142-F163 AromaticContact CD2-CE1 3.73Å; I160-F163 HydrophobicContact CG2-CZ 4.3Å; F163-M165 PolarHBondContact O-N 3.49Å; F163-M165 VanDerWaalsContact O-N 3.07Å; F163-S166 VanDerWaalsContact O-CB 3.25Å; F163-S166 WeakPolarHBondContact O-CB 3.35Å; F163-S166 PolarHBondContact O-N 2.87Å; F163-S166 PolarHBondContact O-OG 2.88Å
164	G	81.2	Confident	86.5	Confident	7 Å²	7	47 Å²	47	7%	0.072	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-27	-176.5	0	0	0	0	0	114.4	E77	E77-G164 PolarHBondContact OE1-N 3.4Å
165	M	79.6	Confident	86.4	Confident	25 Å²	25	47.4 Å²	47.4	12%	0.123	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-9.8	174.5	-66	-166.6	63.6	0	0	114.2	R143 D144 F163	R143-M165 HydrophobicContact CB-CB 4.28Å; R143-M165 WeakPolarHBondContact CD-O 3.38Å; R143-M165 PolarHBondContact NH1-O 2.93Å; D144-M165 HydrophobicContact CB-CB 4.33Å; D144-M165 HydrophobicContact CB-CG 4.46Å; D144-M165 HydrophobicContact CB-SD 3.97Å; F163-M165 PolarHBondContact O-N 3.49Å; F163-M165 VanDerWaalsContact O-N 3.07Å
166	S	82.2	Confident	85.9	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.007	24%	0.239	C	C	.	.			trans	-71.2	153.6	-171.4	74.5	0	0	0	0	113.2	G76 I141 F163	G76-S166 WeakPolarHBondContact CA-OG 3.45Å; I141-S166 CarbonylContact O-C 3.57Å; I141-S166 WeakPolarHBondContact O-CA 3.23Å; I141-S166 WeakPolarHBondContact O-CB 3.36Å; F163-S166 VanDerWaalsContact O-CB 3.25Å; F163-S166 WeakPolarHBondContact O-CB 3.35Å; F163-S166 PolarHBondContact O-N 2.87Å; F163-S166 PolarHBondContact O-OG 2.88Å
167	R	86.1	Confident	85.1	Confident	22 Å²	22	52.1 Å²	52.1	8%	0.083	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	132.1	-179.8	-63	-68.2	-177.4	-94.1	11.2	110	K72 C140 I141 E169 Y172	K72-R167 PolarHBondContact O-NH2 3.43Å; C140-R167 WeakPolarHBondContact CA-O 3.38Å; I141-R167 PolarHBondContact N-O 3.13Å; I141-R167 PolarHBondContact O-N 3.3Å; R167-E169 VanDerWaalsContact C-N 3.33Å; R167-E169 PolarHBondContact O-N 3.28Å; R167-Y172 HydrophobicContact CB-CD2 4.01Å; R167-Y172 HydrophobicContact CB-CG 4.08Å; R167-Y172 HydrophobicContact CG-CD1 4.07Å; R167-Y172 HydrophobicContact CG-CD2 3.55Å; R167-Y172 HydrophobicContact CG-CE1 4.19Å; R167-Y172 HydrophobicContact CG-CE2 3.69Å; R167-Y172 HydrophobicContact CG-CG 3.73Å
168	E	85	Confident	83.7	Confident	108 Å²	108	59.6 Å²	59.6	51%	0.505	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	71.2	176.2	-166.3	177.3	-173.5	0	0	110.3	T79 R138 N139	T79-E168 HydrophobicContact CG2-CB 4.1Å; T79-E168 WeakPolarHBondContact CG2-OE2 2.76Å; R138-E168 WeakPolarHBondContact O-CG 3.41Å; N139-E168 CarbonylContact O-C 3.54Å; N139-E168 WeakPolarHBondContact O-CA 3.47Å
169	E	85.5	Confident	82.3	Confident	82 Å²	82	61.3 Å²	61.3	38%	0.383	30%	0.304	S	S	.	.	S	Bend	trans	-148.2	150	-177.8	-64.3	176.7	-175.9	0	0	108.8	N139 I141 R167 I171 Y172	N139-E169 CarbonylContact O-C 3.45Å; N139-E169 PolarHBondContact O-N 3.03Å; N139-E169 VanDerWaalsContact O-O 3.14Å; I141-E169 WeakPolarHBondContact CD1-O 3.34Å; I141-E169 WeakPolarHBondContact CG1-O 3.42Å; R167-E169 VanDerWaalsContact C-N 3.33Å; R167-E169 PolarHBondContact O-N 3.28Å; E169-I171 VanDerWaalsContact C-N 3.34Å; E169-Y172 WeakPolarHBondContact OE2-CD2 3.47Å
170	H	86.8	Confident	81.1	Confident	136 Å²	136	66 Å²	66	63%	0.63	33%	0.327	S	S	*	.	S	Bend	trans	-67.6	-36.1	175.5	-72.9	-74.9	0	0	0	113	N139	N139-H170 PolarHBondContact OD1-CE1 2.69Å; N139-H170 PolarHBondContact OD1-ND1 3.41Å
171	I	90.2	Very high	80.7	Confident	72 Å²	72	67.4 Å²	67.4	37%	0.369	33%	0.333	S	S	.	.	S	Bend	trans	-136.1	123.6	-179.3	-63.3	157.8	0	0	0	106.4	E169 E173 R195 Y196 T197	E169-I171 VanDerWaalsContact C-N 3.34Å; I171-E173 HydrophobicContact CG2-CG 4.28Å; I171-R195 HydrophobicContact CG2-CG 3.62Å; I171-Y196 WeakPolarHBondContact CA-O 3.47Å; I171-T197 HydrophobicContact CG1-CG2 4.07Å
172	Y	87.9	Confident	80.7	Confident	30 Å²	30	67.1 Å²	67.1	12%	0.118	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	124.8	174.7	177.2	-105.1	0	0	0	110.5	R167 E169 L174 Y196	R167-Y172 HydrophobicContact CB-CD2 4.01Å; R167-Y172 HydrophobicContact CB-CG 4.08Å; R167-Y172 HydrophobicContact CG-CD1 4.07Å; R167-Y172 HydrophobicContact CG-CD2 3.55Å; R167-Y172 HydrophobicContact CG-CE1 4.19Å; R167-Y172 HydrophobicContact CG-CE2 3.69Å; R167-Y172 HydrophobicContact CG-CG 3.73Å; E169-Y172 WeakPolarHBondContact OE2-CD2 3.47Å; Y172-L174 HydrophobicContact CE1-CD2 4.13Å; Y172-L174 HydrophobicContact CE1-CG 4.5Å; Y172-Y196 HydrophobicContact CD1-CD2 4.45Å; Y172-Y196 PolarHBondContact N-O 3.12Å; Y172-Y196 PolarHBondContact O-N 3.28Å
173	E	87.3	Confident	81.1	Confident	117 Å²	117	67 Å²	67	55%	0.547	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127.7	177.1	-65.3	-174.7	176.3	0	0	110.4	I171 S175 R195	I171-E173 HydrophobicContact CG2-CG 4.28Å; E173-S175 PolarHBondContact O-N 2.81Å; E173-R195 HydrophobicContact CG-CB 4.19Å; E173-R195 HydrophobicContact CG-CG 4.04Å; E173-R195 IonicContact OE1-NH1 3.96Å; E173-R195 PolarHBondContact OE1-NH1 3.32Å
174	L	83.5	Confident	81.5	Confident	32 Å²	32	68 Å²	68	17%	0.168	33%	0.334	C	S	.	.			trans	-62.1	120.4	175.9	-83.7	174.3	0	0	0	110.7	Y172 D176 I181 G194 Y196	Y172-L174 HydrophobicContact CE1-CD2 4.13Å; Y172-L174 HydrophobicContact CE1-CG 4.5Å; L174-D176 VanDerWaalsContact C-N 3.27Å; L174-D176 PolarHBondContact O-N 3.29Å; L174-I181 HydrophobicContact CD1-CD1 3.82Å; L174-I181 HydrophobicContact CD1-CG1 4.28Å; L174-G194 PolarHBondContact N-O 2.93Å; L174-Y196 HydrophobicContact CD1-CE2 3.67Å; L174-Y196 HydrophobicContact CG-CD2 4.42Å; L174-Y196 HydrophobicContact CG-CE2 3.89Å
175	S	76.8	Confident	82.3	Confident	105 Å²	105	68.2 Å²	68.2	73%	0.734	33%	0.333	S	S	*	.	S	Bend	trans	-68.3	-27.8	172.8	62.1	0	0	0	0	113	E173	E173-S175 PolarHBondContact O-N 2.81Å
176	D	70.5	Confident	83.1	Confident	86 Å²	86	67.1 Å²	67.1	46%	0.46	33%	0.328	S	S	.	.			trans	-135	118	174.5	-173.8	-1	0	0	0	109.4	L174 R178	L174-D176 VanDerWaalsContact C-N 3.27Å; L174-D176 PolarHBondContact O-N 3.29Å; D176-R178 PolarHBondContact O-N 3.28Å; D176-R178 VanDerWaalsContact OD1-CB 3.25Å; D176-R178 WeakPolarHBondContact OD1-CB 3.31Å; D176-R178 WeakPolarHBondContact OD1-CG 3.45Å; D176-R178 PolarHBondContact OD1-N 3.24Å
177	K	65.6	Low	83.9	Confident	130 Å²	130	67.1 Å²	67.1	57%	0.565	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.5	178.3	-64.7	-173.2	179	-173.5	0	112.9	G179 T193	K177-G179 VanDerWaalsContact C-N 3.3Å; K177-T193 WeakPolarHBondContact CE-O 3.41Å; K177-T193 PolarHBondContact NZ-O 3.44Å
178	R	59.9	Low	84.3	Confident	226 Å²	226	66.5 Å²	66.5	85%	0.853	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.1	176.6	-60.7	177.2	177.4	-171.9	-0.1	113.8	D176	D176-R178 PolarHBondContact O-N 3.28Å; D176-R178 VanDerWaalsContact OD1-CB 3.25Å; D176-R178 WeakPolarHBondContact OD1-CB 3.31Å; D176-R178 WeakPolarHBondContact OD1-CG 3.45Å; D176-R178 PolarHBondContact OD1-N 3.24Å
179	G	63.3	Low	84.8	Confident	39 Å²	39	62.3 Å²	62.3	40%	0.402	31%	0.307	S	S	.	.	S	Bend	trans	-59	152.7	174.9	0	0	0	0	0	112.1	K177 I181	K177-G179 VanDerWaalsContact C-N 3.3Å; G179-I181 PolarHBondContact O-N 2.94Å
180	Q	71.8	Confident	85.3	Confident	126 Å²	126	58.4 Å²	58.4	59%	0.589	29%	0.289	S	S	*	.			trans	-66.4	106.7	176.1	-69.5	-178.8	-8.9	0	0	110.5	R319	Q180-R319 PolarHBondContact O-NH1 2.87Å; Q180-R319 VanDerWaalsContact O-NH1 3.15Å
181	I	86	Confident	85.5	Confident	28 Å²	28	52.7 Å²	52.7	14%	0.144	26%	0.263	C	S	.	.			trans	-100.4	133.1	178.4	-62.6	168.9	0	0	0	109.5	L174 G179 I183 T186 L191 Y196	L174-I181 HydrophobicContact CD1-CD1 3.82Å; L174-I181 HydrophobicContact CD1-CG1 4.28Å; G179-I181 PolarHBondContact O-N 2.94Å; I181-I183 VanDerWaalsContact C-N 3.26Å; I181-I183 HydrophobicContact CB-CD1 3.95Å; I181-I183 HydrophobicContact CG2-CD1 3.88Å; I181-I183 PolarHBondContact O-N 3.26Å; I181-T186 HydrophobicContact CG2-CG2 3.9Å; I181-T186 VanDerWaalsContact CG2-OG1 3.32Å; I181-T186 WeakPolarHBondContact CG2-OG1 3.24Å; I181-L191 HydrophobicContact CG2-CD2 3.78Å; I181-Y196 WeakPolarHBondContact CG2-OH 3.4Å
182	P	91.9	Very high	85.6	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.013	27%	0.269	C	S	.	.			trans	-72.3	76.5	172.1	26.7	-29.6	0	0	0	111.4	K184 W185 T186 R319	P182-K184 VanDerWaalsContact C-N 3.27Å; P182-K184 PolarHBondContact O-N 3.49Å; P182-K184 VanDerWaalsContact O-N 3.1Å; P182-W185 HydrophobicContact CB-CB 4.37Å; P182-W185 HydrophobicContact CB-CE3 4.08Å; P182-W185 PolarHBondContact O-N 3.07Å; P182-T186 VanDerWaalsContact C-OG1 3.31Å; P182-T186 PolarHBondContact O-N 2.64Å; P182-T186 VanDerWaalsContact O-N 3.09Å; P182-T186 PolarHBondContact O-OG1 3.08Å; P182-R319 VanDerWaalsContact CB-CZ 3.49Å
183	I	94.4	Very high	85.7	Confident	30 Å²	30	57.6 Å²	57.6	15%	0.154	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-48.5	-47.1	-169.8	-57.1	-61.6	0	0	0	112.7	I181 W185 T186 L191 N225 R229	I181-I183 VanDerWaalsContact C-N 3.26Å; I181-I183 HydrophobicContact CB-CD1 3.95Å; I181-I183 HydrophobicContact CG2-CD1 3.88Å; I181-I183 PolarHBondContact O-N 3.26Å; I183-W185 PolarHBondContact O-N 3.06Å; I183-W185 VanDerWaalsContact O-N 3.14Å; I183-T186 PolarHBondContact O-N 3.1Å; I183-T186 VanDerWaalsContact O-N 3.12Å; I183-L191 HydrophobicContact CD1-CD2 3.44Å; I183-L191 VanDerWaalsContact CD1-CD2 3.44Å; I183-L191 HydrophobicContact CG2-CD1 4.12Å; I183-L191 HydrophobicContact CG2-CD2 4.49Å; I183-N225 HydrophobicContact CB-CB 3.99Å; I183-N225 HydrophobicContact CG1-CB 3.9Å; I183-N225 HydrophobicContact CG2-CB 4.14Å; I183-N225 WeakPolarHBondContact CG2-O 3.39Å; I183-R229 HydrophobicContact CG2-CB 4.39Å
184	K	96.9	Very high	85.9	Confident	23 Å²	23	52.2 Å²	52.2	10%	0.1	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-64.8	-15	-178.7	-69.2	169.9	174.2	-150.9	0	115.6	P182 P219 Y220 W223 T228	P182-K184 VanDerWaalsContact C-N 3.27Å; P182-K184 PolarHBondContact O-N 3.49Å; P182-K184 VanDerWaalsContact O-N 3.1Å; K184-P219 HydrophobicContact CB-CG 4.13Å; K184-P219 WeakPolarHBondContact CD-O 3.44Å; K184-Y220 HydrophobicContact CB-CD2 4.11Å; K184-Y220 HydrophobicContact CG-CD2 4.14Å; K184-Y220 PolarHBondContact NZ-O 3.47Å; K184-W223 WeakPolarHBondContact CE-O 3.44Å; K184-W223 PolarHBondContact NZ-O 2.96Å; K184-T228 HydrophobicContact CG-CG2 3.94Å
185	W	97.6	Very high	86.4	Confident	13 Å²	13	55.9 Å²	55.9	5%	0.049	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-112.8	-6.4	176.5	-68	-99.5	0	0	0	112.8	A146 R148 P182 I183 S204 V207 E211 P219	A146-W185 HydrophobicContact CB-CD2 4.2Å; A146-W185 HydrophobicContact CB-CG 4.08Å; A146-W185 HydrophobicContact CB-CZ2 4.48Å; R148-W185 VanDerWaalsContact NH1-CH2 3.27Å; P182-W185 HydrophobicContact CB-CB 4.37Å; P182-W185 HydrophobicContact CB-CE3 4.08Å; P182-W185 PolarHBondContact O-N 3.07Å; I183-W185 PolarHBondContact O-N 3.06Å; I183-W185 VanDerWaalsContact O-N 3.14Å; W185-S204 WeakPolarHBondContact O-CA 3.42Å; W185-S204 WeakPolarHBondContact O-CB 3.46Å; W185-S204 PolarHBondContact O-OG 3.15Å; W185-V207 VanDerWaalsContact CD1-CG1 3.41Å; W185-V207 HydrophobicContact CD2-CG1 4.46Å; W185-V207 HydrophobicContact CG-CB 4.43Å; W185-V207 HydrophobicContact CG-CG1 4.02Å; W185-E211 WeakPolarHBondContact CZ2-OE1 3.2Å; W185-E211 VanDerWaalsContact NE1-CD 3.32Å; W185-E211 PolarHBondContact NE1-OE2 3.1Å; W185-P219 HydrophobicContact CD2-CG 4.37Å; W185-P219 HydrophobicContact CH2-CG 3.82Å; W185-P219 HydrophobicContact CZ2-CG 3.47Å; W185-P219 VanDerWaalsContact CZ2-CG 3.47Å; W185-P219 HydrophobicContact CZ3-CG 4.42Å
186	T	96.3	Very high	87.3	Confident	2 Å²	2	51 Å²	51	1%	0.012	24%	0.237	C	C	.	.	S	Bend	trans	-93.6	134.8	-170.5	-56.4	0	0	0	0	110.5	I181 P182 I183 A190 L191 Y196	I181-T186 HydrophobicContact CG2-CG2 3.9Å; I181-T186 VanDerWaalsContact CG2-OG1 3.32Å; I181-T186 WeakPolarHBondContact CG2-OG1 3.24Å; P182-T186 VanDerWaalsContact C-OG1 3.31Å; P182-T186 PolarHBondContact O-N 2.64Å; P182-T186 VanDerWaalsContact O-N 3.09Å; P182-T186 PolarHBondContact O-OG1 3.08Å; I183-T186 PolarHBondContact O-N 3.1Å; I183-T186 VanDerWaalsContact O-N 3.12Å; T186-A190 HydrophobicContact CG2-CB 3.75Å; T186-L191 HydrophobicContact CG2-CD2 3.6Å; T186-L191 HydrophobicContact CG2-CG 3.82Å; T186-Y196 HydrophobicContact CG2-CE1 4.05Å
187	A	97.5	Very high	88.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.224	C	C	.	.			trans	-63.3	145.2	177.6	0	0	0	0	0	112.2	E189 A190 L191 C200 W203	A187-E189 VanDerWaalsContact C-N 3.29Å; A187-E189 VanDerWaalsContact CB-CD 3.48Å; A187-E189 WeakPolarHBondContact CB-OE1 3.21Å; A187-E189 WeakPolarHBondContact CB-OE2 2.93Å; A187-E189 PolarHBondContact O-N 2.69Å; A187-A190 WeakPolarHBondContact O-CB 3.37Å; A187-A190 PolarHBondContact O-N 3.14Å; A187-L191 PolarHBondContact O-N 3.38Å; A187-L191 VanDerWaalsContact O-N 3.09Å; A187-C200 HydrophobicContact CB-CB 4.06Å; A187-W203 HydrophobicContact CB-CB 3.68Å; A187-W203 HydrophobicContact CB-CD2 4.04Å; A187-W203 HydrophobicContact CB-CE3 4.41Å; A187-W203 HydrophobicContact CB-CG 3.71Å
188	P	96.1	Very high	90.1	Very high	9 Å²	9	43.7 Å²	43.7	6%	0.058	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-33.9	-173.7	22.8	-33.5	0	0	0	113.3	L191 R192 W203 I232	P188-L191 PolarHBondContact O-N 3.21Å; P188-R192 WeakPolarHBondContact O-CB 3.28Å; P188-R192 VanDerWaalsContact O-CG 3.32Å; P188-R192 WeakPolarHBondContact O-CG 3.44Å; P188-R192 PolarHBondContact O-N 3.47Å; P188-R192 PolarHBondContact O-NE 3.32Å; P188-W203 VanDerWaalsContact CD-CZ3 3.46Å; P188-W203 HydrophobicContact CG-CE3 4.47Å; P188-W203 HydrophobicContact CG-CH2 3.93Å; P188-W203 HydrophobicContact CG-CZ3 3.89Å; P188-I232 HydrophobicContact CB-CG2 4.11Å; P188-I232 HydrophobicContact CG-CG2 4.28Å
189	E	95.5	Very high	92	Very high	21 Å²	21	34.5 Å²	34.5	10%	0.098	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-36.6	175.3	72.9	-74.4	179	0	0	112.9	A187 R192 T193 C200 P260 R263	A187-E189 VanDerWaalsContact C-N 3.29Å; A187-E189 VanDerWaalsContact CB-CD 3.48Å; A187-E189 WeakPolarHBondContact CB-OE1 3.21Å; A187-E189 WeakPolarHBondContact CB-OE2 2.93Å; A187-E189 PolarHBondContact O-N 2.69Å; E189-R192 PolarHBondContact O-N 2.89Å; E189-T193 WeakPolarHBondContact O-CB 3.49Å; E189-T193 PolarHBondContact O-N 2.93Å; E189-T193 PolarHBondContact O-OG1 3.16Å; E189-C200 PolarHBondContact OE1-SG 2.65Å; E189-P260 HydrophobicContact CG-CG 3.86Å; E189-R263 IonicContact OE1-CZ 2.94Å; E189-R263 IonicContact OE1-NH1 2.72Å; E189-R263 PolarHBondContact OE1-NH1 3.03Å; E189-R263 IonicContact OE1-NH2 2.64Å; E189-R263 PolarHBondContact OE1-NH2 3.49Å; E189-R263 IonicContact OE2-CZ 2.92Å; E189-R263 IonicContact OE2-NH1 2.72Å; E189-R263 IonicContact OE2-NH2 3.49Å; E189-R263 PolarHBondContact OE2-NH2 3.26Å
190	A	94.5	Very high	93.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-70.9	-35.5	176	0	0	0	0	0	111.3	T186 A187 G194 R195 Y196	T186-A190 HydrophobicContact CG2-CB 3.75Å; A187-A190 WeakPolarHBondContact O-CB 3.37Å; A187-A190 PolarHBondContact O-N 3.14Å; A190-G194 WeakPolarHBondContact O-CA 3.46Å; A190-G194 PolarHBondContact O-N 3.13Å; A190-R195 WeakPolarHBondContact CA-O 3.2Å; A190-R195 WeakPolarHBondContact CB-O 3.36Å; A190-Y196 HydrophobicContact CB-CD1 4.09Å; A190-Y196 HydrophobicContact CB-CD2 4.38Å; A190-Y196 HydrophobicContact CB-CE1 3.93Å; A190-Y196 HydrophobicContact CB-CE2 4.18Å; A190-Y196 HydrophobicContact CB-CG 4.31Å
191	L	92.6	Very high	94.9	Very high	16 Å²	16	26.8 Å²	26.8	8%	0.084	13%	0.125	C	C	.	.	H	α-helix	trans	-66.1	-38.2	172.6	-65.6	-179.2	0	0	0	113.2	I181 I183 T186 A187 P188 R229	I181-L191 HydrophobicContact CG2-CD2 3.78Å; I183-L191 HydrophobicContact CD1-CD2 3.44Å; I183-L191 VanDerWaalsContact CD1-CD2 3.44Å; I183-L191 HydrophobicContact CG2-CD1 4.12Å; I183-L191 HydrophobicContact CG2-CD2 4.49Å; T186-L191 HydrophobicContact CG2-CD2 3.6Å; T186-L191 HydrophobicContact CG2-CG 3.82Å; A187-L191 PolarHBondContact O-N 3.38Å; A187-L191 VanDerWaalsContact O-N 3.09Å; P188-L191 PolarHBondContact O-N 3.21Å; L191-R229 HydrophobicContact CD1-CG 4.27Å; L191-R229 PolarHBondContact O-NH1 2.79Å; L191-R229 PolarHBondContact O-NH2 3.26Å
192	R	91.3	Very high	95.5	Very high	133 Å²	133	25.5 Å²	25.5	50%	0.502	12%	0.118	S	C	.	.	H	α-helix	trans	-73.3	-50.8	179	-74.3	179.4	-70.6	133	-8.1	112.1	P188 E189	P188-R192 WeakPolarHBondContact O-CB 3.28Å; P188-R192 VanDerWaalsContact O-CG 3.32Å; P188-R192 WeakPolarHBondContact O-CG 3.44Å; P188-R192 PolarHBondContact O-N 3.47Å; P188-R192 PolarHBondContact O-NE 3.32Å; E189-R192 PolarHBondContact O-N 2.89Å
193	T	91.3	Very high	95.8	Very high	72 Å²	72	25.4 Å²	25.4	44%	0.442	12%	0.118	S	C	.	.	H	α-helix	trans	-100.5	-24	-166.9	64.4	0	0	0	0	113.2	K177 E189 R195	K177-T193 WeakPolarHBondContact CE-O 3.41Å; K177-T193 PolarHBondContact NZ-O 3.44Å; E189-T193 WeakPolarHBondContact O-CB 3.49Å; E189-T193 PolarHBondContact O-N 2.93Å; E189-T193 PolarHBondContact O-OG1 3.16Å; T193-R195 WeakPolarHBondContact OG1-CB 3.3Å; T193-R195 PolarHBondContact OG1-N 3.37Å; T193-R195 VanDerWaalsContact OG1-N 3.12Å
194	G	91.4	Very high	96	Very high	3 Å²	3	24.2 Å²	24.2	3%	0.031	11%	0.112	C	C	.	.			trans	78.7	6.5	-167.2	0	0	0	0	0	113.5	L174 A190 Y196	L174-G194 PolarHBondContact N-O 2.93Å; A190-G194 WeakPolarHBondContact O-CA 3.46Å; A190-G194 PolarHBondContact O-N 3.13Å; G194-Y196 WeakPolarHBondContact O-CD2 3.15Å
195	R	93.7	Very high	96.1	Very high	109 Å²	109	23.1 Å²	23.1	41%	0.411	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121	-179.5	-174.8	175	162.8	139.9	-12.4	110.7	I171 E173 A190 T193	I171-R195 HydrophobicContact CG2-CG 3.62Å; E173-R195 HydrophobicContact CG-CB 4.19Å; E173-R195 HydrophobicContact CG-CG 4.04Å; E173-R195 IonicContact OE1-NH1 3.96Å; E173-R195 PolarHBondContact OE1-NH1 3.32Å; A190-R195 WeakPolarHBondContact CA-O 3.2Å; A190-R195 WeakPolarHBondContact CB-O 3.36Å; T193-R195 WeakPolarHBondContact OG1-CB 3.3Å; T193-R195 PolarHBondContact OG1-N 3.37Å; T193-R195 VanDerWaalsContact OG1-N 3.12Å
196	Y	95.6	Very high	96.2	Very high	3 Å²	3	22.5 Å²	22.5	1%	0.012	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	143.4	177.4	-69.9	-101.8	0	0	0	110	I141 R143 I171 Y172 L174 I181 T186 A190 G194 C200	I141-Y196 WeakPolarHBondContact CD1-O 3.24Å; R143-Y196 HydrophobicContact CB-CD1 4.09Å; R143-Y196 HydrophobicContact CB-CE1 4.27Å; R143-Y196 HydrophobicContact CG-CD1 3.72Å; R143-Y196 HydrophobicContact CG-CE1 4.37Å; R143-Y196 HydrophobicContact CG-CG 4.04Å; I171-Y196 WeakPolarHBondContact CA-O 3.47Å; Y172-Y196 HydrophobicContact CD1-CD2 4.45Å; Y172-Y196 PolarHBondContact N-O 3.12Å; Y172-Y196 PolarHBondContact O-N 3.28Å; L174-Y196 HydrophobicContact CD1-CE2 3.67Å; L174-Y196 HydrophobicContact CG-CD2 4.42Å; L174-Y196 HydrophobicContact CG-CE2 3.89Å; I181-Y196 WeakPolarHBondContact CG2-OH 3.4Å; T186-Y196 HydrophobicContact CG2-CE1 4.05Å; A190-Y196 HydrophobicContact CB-CD1 4.09Å; A190-Y196 HydrophobicContact CB-CD2 4.38Å; A190-Y196 HydrophobicContact CB-CE1 3.93Å; A190-Y196 HydrophobicContact CB-CE2 4.18Å; A190-Y196 HydrophobicContact CB-CG 4.31Å; G194-Y196 WeakPolarHBondContact O-CD2 3.15Å; Y196-C200 HydrophobicContact CD1-CB 4.35Å
197	T	97.2	Very high	96.3	Very high	30 Å²	30	22.4 Å²	22.4	18%	0.184	10%	0.104	C	C	.	.			trans	-141.3	172.4	170.5	65.7	0	0	0	0	108	I171 K199 C200	I171-T197 HydrophobicContact CG1-CG2 4.07Å; T197-K199 PolarHBondContact O-N 3.29Å; T197-K199 VanDerWaalsContact O-N 3.12Å; T197-K199 PolarHBondContact OG1-N 3.13Å; T197-C200 PolarHBondContact N-SG 2.79Å; T197-C200 VanDerWaalsContact N-SG 3.37Å; T197-C200 VanDerWaalsContact O-CB 3.24Å; T197-C200 WeakPolarHBondContact O-CB 3.5Å; T197-C200 PolarHBondContact O-N 2.88Å
198	I	97.7	Very high	96.3	Very high	32 Å²	32	22.4 Å²	22.4	16%	0.164	10%	0.104	C	C	.	.	H	α-helix	trans	-57.6	-26.3	172.7	-163.2	64.4	0	0	0	112.7	M132 E136 C200 D201 V202 F266	M132-I198 HydrophobicContact CE-CD1 4.1Å; E136-I198 HydrophobicContact CB-CD1 4.02Å; E136-I198 HydrophobicContact CB-CG1 3.82Å; E136-I198 HydrophobicContact CG-CG1 3.9Å; I198-C200 PolarHBondContact O-N 3.13Å; I198-D201 HydrophobicContact CD1-CB 4.34Å; I198-D201 WeakPolarHBondContact O-CB 3.38Å; I198-D201 PolarHBondContact O-N 2.77Å; I198-V202 PolarHBondContact O-N 3.14Å; I198-F266 HydrophobicContact CD1-CD2 4.12Å; I198-F266 HydrophobicContact CD1-CE2 3.84Å; I198-F266 HydrophobicContact CG1-CD2 3.97Å; I198-F266 HydrophobicContact CG1-CE2 3.9Å
199	K	98.4	Very high	96.4	Very high	34 Å²	34	22 Å²	22	15%	0.148	10%	0.102	C	C	.	.	H	α-helix	trans	-68.7	-22.4	175.2	-62.4	-60.5	-173.3	174.3	0	113	T197 V202 W203 P260 R263 P264	T197-K199 PolarHBondContact O-N 3.29Å; T197-K199 VanDerWaalsContact O-N 3.12Å; T197-K199 PolarHBondContact OG1-N 3.13Å; K199-V202 HydrophobicContact CD-CG2 4.48Å; K199-W203 PolarHBondContact O-N 3.21Å; K199-P260 HydrophobicContact CB-CB 3.94Å; K199-P260 WeakPolarHBondContact CD-O 3.24Å; K199-P260 HydrophobicContact CG-CB 4.49Å; K199-R263 HydrophobicContact CD-CB 4.37Å; K199-R263 PolarHBondContact NZ-O 2.77Å; K199-R263 WeakPolarHBondContact O-CD 3.42Å; K199-R263 PolarHBondContact O-NH1 2.91Å; K199-P264 PolarHBondContact NZ-O 2.88Å; K199-P264 VanDerWaalsContact NZ-O 3.11Å
200	C	98.2	Very high	96.5	Very high	3 Å²	3	22 Å²	22	2%	0.02	10%	0.101	C	C	.	.	H	α-helix	trans	-71.8	-37.7	169.7	-53.5	0	0	0	0	110.6	A187 E189 Y196 T197 I198 V202 W203 S204	A187-C200 HydrophobicContact CB-CB 4.06Å; E189-C200 PolarHBondContact OE1-SG 2.65Å; Y196-C200 HydrophobicContact CD1-CB 4.35Å; T197-C200 PolarHBondContact N-SG 2.79Å; T197-C200 VanDerWaalsContact N-SG 3.37Å; T197-C200 VanDerWaalsContact O-CB 3.24Å; T197-C200 WeakPolarHBondContact O-CB 3.5Å; T197-C200 PolarHBondContact O-N 2.88Å; I198-C200 PolarHBondContact O-N 3.13Å; C200-V202 VanDerWaalsContact C-N 3.31Å; C200-V202 PolarHBondContact O-N 3.44Å; C200-W203 VanDerWaalsContact O-CB 3.31Å; C200-W203 WeakPolarHBondContact O-CB 3.4Å; C200-W203 PolarHBondContact O-N 3.36Å; C200-S204 PolarHBondContact O-N 3.04Å; C200-S204 VanDerWaalsContact O-N 3.14Å; C200-S204 PolarHBondContact O-OG 2.78Å
201	D	98.5	Very high	96.6	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-68.9	-30.7	174.2	-65.6	-33.3	0	0	0	112.1	M132 I141 H142 R143 I198 W203 S204 Y205 F266	M132-D201 HydrophobicContact CE-CB 3.55Å; I141-D201 WeakPolarHBondContact CA-OD2 3.09Å; I141-D201 VanDerWaalsContact CG2-OD2 3.31Å; I141-D201 WeakPolarHBondContact CG2-OD2 3.4Å; H142-D201 PolarHBondContact N-OD2 3.2Å; R143-D201 WeakPolarHBondContact CA-OD1 3.48Å; R143-D201 PolarHBondContact N-OD1 3.24Å; I198-D201 HydrophobicContact CD1-CB 4.34Å; I198-D201 WeakPolarHBondContact O-CB 3.38Å; I198-D201 PolarHBondContact O-N 2.77Å; D201-W203 VanDerWaalsContact C-N 3.29Å; D201-W203 PolarHBondContact O-N 3.48Å; D201-S204 CarbonylContact O-C 3.6Å; D201-S204 WeakPolarHBondContact O-CB 3.44Å; D201-S204 PolarHBondContact O-N 3.06Å; D201-Y205 WeakPolarHBondContact O-CB 3.41Å; D201-Y205 PolarHBondContact O-N 3.22Å; D201-F266 HydrophobicContact CB-CE2 4.05Å; D201-F266 HydrophobicContact CB-CZ 4.06Å
202	V	98.8	Very high	96.7	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.1	-40.5	171.2	173	0	0	0	0	111.1	I198 K199 C200 Y205 G206 C255 R263 P264 F266 I269	I198-V202 PolarHBondContact O-N 3.14Å; K199-V202 HydrophobicContact CD-CG2 4.48Å; C200-V202 VanDerWaalsContact C-N 3.31Å; C200-V202 PolarHBondContact O-N 3.44Å; V202-Y205 WeakPolarHBondContact O-CB 3.48Å; V202-Y205 PolarHBondContact O-N 2.84Å; V202-G206 PolarHBondContact O-N 3.35Å; V202-G206 VanDerWaalsContact O-N 3.13Å; V202-C255 HydrophobicContact CG1-CB 3.99Å; V202-C255 WeakPolarHBondContact O-CB 3.43Å; V202-R263 HydrophobicContact CG1-CB 3.87Å; V202-P264 HydrophobicContact CG1-CG 4.3Å; V202-P264 WeakPolarHBondContact CG2-O 3.5Å; V202-F266 HydrophobicContact CB-CZ 4.38Å; V202-F266 HydrophobicContact CG2-CD2 3.99Å; V202-F266 HydrophobicContact CG2-CE1 4.29Å; V202-F266 HydrophobicContact CG2-CE2 3.61Å; V202-F266 HydrophobicContact CG2-CG 4.49Å; V202-F266 HydrophobicContact CG2-CZ 3.79Å; V202-I269 HydrophobicContact CG1-CD1 3.99Å; V202-I269 HydrophobicContact CG2-CD1 4.45Å
203	W	98.7	Very high	96.9	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.1	-48.3	172.9	176.4	-74.6	0	0	0	111.5	A187 P188 K199 C200 D201 Y205 G206 V207 I232 R237 C255 W256	A187-W203 HydrophobicContact CB-CB 3.68Å; A187-W203 HydrophobicContact CB-CD2 4.04Å; A187-W203 HydrophobicContact CB-CE3 4.41Å; A187-W203 HydrophobicContact CB-CG 3.71Å; P188-W203 VanDerWaalsContact CD-CZ3 3.46Å; P188-W203 HydrophobicContact CG-CE3 4.47Å; P188-W203 HydrophobicContact CG-CH2 3.93Å; P188-W203 HydrophobicContact CG-CZ3 3.89Å; K199-W203 PolarHBondContact O-N 3.21Å; C200-W203 VanDerWaalsContact O-CB 3.31Å; C200-W203 WeakPolarHBondContact O-CB 3.4Å; C200-W203 PolarHBondContact O-N 3.36Å; D201-W203 VanDerWaalsContact C-N 3.29Å; D201-W203 PolarHBondContact O-N 3.48Å; W203-Y205 PolarHBondContact O-N 2.69Å; W203-G206 PolarHBondContact O-N 3.07Å; W203-V207 PolarHBondContact O-N 3.18Å; W203-I232 HydrophobicContact CH2-CG2 3.62Å; W203-I232 HydrophobicContact CZ2-CD1 4.25Å; W203-I232 HydrophobicContact CZ2-CG1 4.45Å; W203-I232 HydrophobicContact CZ2-CG2 3.56Å; W203-R237 VanDerWaalsContact CH2-CZ 3.43Å; W203-C255 WeakPolarHBondContact CA-O 3.5Å; W203-W256 AromaticContact CD2-CD1 3.58Å; W203-W256 HydrophobicContact CD2-CG 4.38Å; W203-W256 AromaticContact CE2-CD1 3.83Å; W203-W256 HydrophobicContact CE3-CB 4.05Å; W203-W256 AromaticContact CE3-CD1 3.88Å; W203-W256 HydrophobicContact CE3-CG 4.34Å; W203-W256 AromaticContact CG-CD1 3.86Å; W203-W256 HydrophobicContact CH2-CB 4.23Å; W203-W256 HydrophobicContact CZ3-CB 3.87Å; W203-W256 HydrophobicContact CZ3-CG 4.45Å; W203-W256 WeakPolarHBondContact CZ3-O 3.43Å; W203-W256 PolarHBondContact O-NE1 2.99Å
204	S	98.7	Very high	97	Very high	5 Å²	5	13.6 Å²	13.6	4%	0.035	6%	0.064	C	C	.	.	H	α-helix	trans	-59.3	-35.7	177.1	-54	0	0	0	0	111.8	W185 C200 D201 V207 L208	W185-S204 WeakPolarHBondContact O-CA 3.42Å; W185-S204 WeakPolarHBondContact O-CB 3.46Å; W185-S204 PolarHBondContact O-OG 3.15Å; C200-S204 PolarHBondContact O-N 3.04Å; C200-S204 VanDerWaalsContact O-N 3.14Å; C200-S204 PolarHBondContact O-OG 2.78Å; D201-S204 CarbonylContact O-C 3.6Å; D201-S204 WeakPolarHBondContact O-CB 3.44Å; D201-S204 PolarHBondContact O-N 3.06Å; S204-V207 WeakPolarHBondContact O-CB 3.31Å; S204-V207 PolarHBondContact O-N 3.23Å; S204-V207 VanDerWaalsContact O-N 3.13Å; S204-L208 PolarHBondContact O-N 2.66Å
205	Y	98.8	Very high	97	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.1	-39.5	174.2	179	-92.6	0	0	0	112.3	S125 A128 A129 L145 D201 V202 W203 V207 L208 L209 F266 I269 I273	S125-Y205 PolarHBondContact O-OH 3.19Å; A128-Y205 HydrophobicContact CB-CD2 4.42Å; A128-Y205 HydrophobicContact CB-CE2 3.84Å; A129-Y205 HydrophobicContact CB-CE2 4Å; L145-Y205 HydrophobicContact CD2-CD2 4.32Å; D201-Y205 WeakPolarHBondContact O-CB 3.41Å; D201-Y205 PolarHBondContact O-N 3.22Å; V202-Y205 WeakPolarHBondContact O-CB 3.48Å; V202-Y205 PolarHBondContact O-N 2.84Å; W203-Y205 PolarHBondContact O-N 2.69Å; Y205-V207 VanDerWaalsContact C-N 3.27Å; Y205-V207 PolarHBondContact O-N 2.88Å; Y205-L208 HydrophobicContact CD2-CD2 4.34Å; Y205-L208 WeakPolarHBondContact O-CB 3.45Å; Y205-L208 PolarHBondContact O-N 3.16Å; Y205-L208 VanDerWaalsContact O-N 3.13Å; Y205-L209 HydrophobicContact CD1-CD1 4.18Å; Y205-L209 HydrophobicContact CD1-CG 4.15Å; Y205-L209 HydrophobicContact CE1-CD1 3.63Å; Y205-L209 HydrophobicContact CE1-CD2 3.89Å; Y205-L209 HydrophobicContact CE1-CG 3.64Å; Y205-L209 PolarHBondContact O-N 3.3Å; Y205-L209 WeakPolarHBondContact OH-CD2 3.49Å; Y205-F266 HydrophobicContact CD1-CE1 4.45Å; Y205-F266 AromaticContact CD2-CE1 3.92Å; Y205-F266 HydrophobicContact CD2-CE1 3.92Å; Y205-F266 AromaticContact CG-CE1 3.76Å; Y205-F266 HydrophobicContact CG-CE1 3.76Å; Y205-I269 HydrophobicContact CD1-CD1 4.02Å; Y205-I269 HydrophobicContact CD1-CG2 4.13Å; Y205-I269 HydrophobicContact CE1-CD1 4.32Å; Y205-I269 HydrophobicContact CE1-CG2 3.36Å; Y205-I273 WeakPolarHBondContact OH-CD1 3.4Å
206	G	98.6	Very high	96.8	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-58.3	-40.1	171.5	0	0	0	0	0	112.3	V202 W203 L209 W210 M252 W256	V202-G206 PolarHBondContact O-N 3.35Å; V202-G206 VanDerWaalsContact O-N 3.13Å; W203-G206 PolarHBondContact O-N 3.07Å; G206-L209 WeakPolarHBondContact O-CB 3.45Å; G206-L209 PolarHBondContact O-N 2.68Å; G206-W210 PolarHBondContact O-N 2.94Å; G206-M252 WeakPolarHBondContact O-CG 3.36Å; G206-W256 VanDerWaalsContact O-CZ2 3.25Å; G206-W256 WeakPolarHBondContact O-CZ2 3.4Å
207	V	98.6	Very high	96.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-68.2	-39	174.7	-174	0	0	0	0	111.2	W185 W203 S204 Y205 L209 W210 E211 P219 L238 W256	W185-V207 VanDerWaalsContact CD1-CG1 3.41Å; W185-V207 HydrophobicContact CD2-CG1 4.46Å; W185-V207 HydrophobicContact CG-CB 4.43Å; W185-V207 HydrophobicContact CG-CG1 4.02Å; W203-V207 PolarHBondContact O-N 3.18Å; S204-V207 WeakPolarHBondContact O-CB 3.31Å; S204-V207 PolarHBondContact O-N 3.23Å; S204-V207 VanDerWaalsContact O-N 3.13Å; Y205-V207 VanDerWaalsContact C-N 3.27Å; Y205-V207 PolarHBondContact O-N 2.88Å; V207-L209 PolarHBondContact O-N 3.42Å; V207-W210 WeakPolarHBondContact O-CB 3.48Å; V207-W210 PolarHBondContact O-N 3.12Å; V207-E211 WeakPolarHBondContact O-CG 3.37Å; V207-E211 PolarHBondContact O-N 2.89Å; V207-P219 HydrophobicContact CG1-CB 3.8Å; V207-P219 HydrophobicContact CG1-CG 3.82Å; V207-L238 HydrophobicContact CG1-CD1 4.47Å; V207-W256 HydrophobicContact CG2-CZ2 4.03Å
208	L	98.2	Very high	96.5	Very high	1 Å²	1	16 Å²	16	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-60.9	-41.3	174	174.3	62.3	0	0	0	112.2	A128 L145 A147 S204 Y205 W210 E211 I212	A128-L208 HydrophobicContact CB-CD2 3.72Å; L145-L208 HydrophobicContact CD1-CD2 4.02Å; L145-L208 HydrophobicContact CD2-CD2 4.36Å; L145-L208 HydrophobicContact CG-CD2 4.14Å; A147-L208 HydrophobicContact CB-CD1 3.86Å; S204-L208 PolarHBondContact O-N 2.66Å; Y205-L208 HydrophobicContact CD2-CD2 4.34Å; Y205-L208 WeakPolarHBondContact O-CB 3.45Å; Y205-L208 PolarHBondContact O-N 3.16Å; Y205-L208 VanDerWaalsContact O-N 3.13Å; L208-W210 VanDerWaalsContact C-N 3.3Å; L208-W210 PolarHBondContact O-N 2.87Å; L208-E211 PolarHBondContact O-N 3.05Å; L208-I212 HydrophobicContact CD1-CD1 4.13Å; L208-I212 HydrophobicContact CD1-CG1 4.15Å; L208-I212 HydrophobicContact CG-CD1 3.97Å; L208-I212 HydrophobicContact CG-CG1 4.44Å; L208-I212 VanDerWaalsContact O-CG1 3.3Å; L208-I212 WeakPolarHBondContact O-CG1 3.32Å; L208-I212 PolarHBondContact O-N 3.27Å
209	L	98.1	Very high	96.4	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-57.1	-45.8	173.2	-72.3	-179.4	0	0	0	111.2	S125 Y205 G206 V207 E211 I212 F213 M244 L248 M252	S125-L209 VanDerWaalsContact CB-CD2 3.46Å; S125-L209 VanDerWaalsContact OG-CD2 3.24Å; S125-L209 WeakPolarHBondContact OG-CD2 3.47Å; Y205-L209 HydrophobicContact CD1-CD1 4.18Å; Y205-L209 HydrophobicContact CD1-CG 4.15Å; Y205-L209 HydrophobicContact CE1-CD1 3.63Å; Y205-L209 HydrophobicContact CE1-CD2 3.89Å; Y205-L209 HydrophobicContact CE1-CG 3.64Å; Y205-L209 PolarHBondContact O-N 3.3Å; Y205-L209 WeakPolarHBondContact OH-CD2 3.49Å; G206-L209 WeakPolarHBondContact O-CB 3.45Å; G206-L209 PolarHBondContact O-N 2.68Å; V207-L209 PolarHBondContact O-N 3.42Å; L209-E211 VanDerWaalsContact C-N 3.35Å; L209-E211 PolarHBondContact O-N 3.05Å; L209-I212 PolarHBondContact O-N 3.42Å; L209-F213 WeakPolarHBondContact O-CD2 3.25Å; L209-F213 PolarHBondContact O-N 2.79Å; L209-F213 VanDerWaalsContact O-N 3.1Å; L209-M244 HydrophobicContact CB-CE 4.21Å; L209-L248 HydrophobicContact CD1-CD1 3.99Å; L209-L248 HydrophobicContact CD2-CD1 4.22Å; L209-M252 HydrophobicContact CB-CG 4.21Å; L209-M252 HydrophobicContact CB-SD 4.46Å; L209-M252 HydrophobicContact CD1-CB 3.86Å; L209-M252 HydrophobicContact CD1-CG 4.17Å
210	W	98	Very high	96.4	Very high	21 Å²	21	13.3 Å²	13.3	8%	0.08	7%	0.073	C	C	.	.	H	α-helix	trans	-60.7	-44.1	176.2	-172.6	94.8	0	0	0	111.7	G206 V207 L208 I212 F213 T214 D217 P219 L238 P239 P241 M252 W256	G206-W210 PolarHBondContact O-N 2.94Å; V207-W210 WeakPolarHBondContact O-CB 3.48Å; V207-W210 PolarHBondContact O-N 3.12Å; L208-W210 VanDerWaalsContact C-N 3.3Å; L208-W210 PolarHBondContact O-N 2.87Å; W210-I212 PolarHBondContact O-N 3.14Å; W210-F213 PolarHBondContact O-N 3.21Å; W210-T214 HydrophobicContact CD2-CG2 3.91Å; W210-T214 HydrophobicContact CE3-CG2 4.1Å; W210-T214 HydrophobicContact CH2-CG2 3.88Å; W210-T214 HydrophobicContact CZ2-CG2 3.69Å; W210-T214 HydrophobicContact CZ3-CG2 4.08Å; W210-T214 WeakPolarHBondContact CZ3-OG1 3.42Å; W210-T214 WeakPolarHBondContact O-CB 3.11Å; W210-T214 WeakPolarHBondContact O-CG2 3.39Å; W210-T214 PolarHBondContact O-N 3.43Å; W210-T214 PolarHBondContact O-OG1 3.49Å; W210-D217 HydrophobicContact CH2-CB 3.79Å; W210-D217 HydrophobicContact CZ3-CB 3.83Å; W210-P219 HydrophobicContact CE3-CB 4.26Å; W210-P219 HydrophobicContact CZ3-CB 4.26Å; W210-L238 HydrophobicContact CB-CD1 4.16Å; W210-L238 HydrophobicContact CD2-CD1 3.87Å; W210-L238 HydrophobicContact CE3-CD1 4.32Å; W210-L238 HydrophobicContact CG-CB 4.22Å; W210-L238 HydrophobicContact CG-CD1 3.77Å; W210-L238 HydrophobicContact CZ2-CD2 4.4Å; W210-P239 VanDerWaalsContact CD1-O 3.31Å; W210-P239 PolarHBondContact NE1-O 3.34Å; W210-P241 HydrophobicContact CG-CG 4.49Å; W210-M252 HydrophobicContact CB-SD 4.1Å; W210-W256 HydrophobicContact CB-CH2 4.49Å
211	E	96.5	Very high	96.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.7	-43.3	176.1	-70.5	-176.5	100	0	0	112.1	A147 W185 V207 L208 L209 F213 T214 F215 G216 R317	A147-E211 HydrophobicContact CB-CB 3.78Å; A147-E211 HydrophobicContact CB-CG 4.29Å; A147-E211 WeakPolarHBondContact CB-OE1 3.48Å; A147-E211 PolarHBondContact N-OE2 2.95Å; W185-E211 WeakPolarHBondContact CZ2-OE1 3.2Å; W185-E211 VanDerWaalsContact NE1-CD 3.32Å; W185-E211 PolarHBondContact NE1-OE2 3.1Å; V207-E211 WeakPolarHBondContact O-CG 3.37Å; V207-E211 PolarHBondContact O-N 2.89Å; L208-E211 PolarHBondContact O-N 3.05Å; L209-E211 VanDerWaalsContact C-N 3.35Å; L209-E211 PolarHBondContact O-N 3.05Å; E211-F213 VanDerWaalsContact C-N 3.34Å; E211-F213 PolarHBondContact O-N 2.98Å; E211-T214 WeakPolarHBondContact CA-OG1 3.25Å; E211-T214 CarbonylContact O-C 3.52Å; E211-T214 PolarHBondContact O-N 2.88Å; E211-T214 PolarHBondContact O-OG1 3.05Å; E211-F215 PolarHBondContact O-N 2.89Å; E211-F215 VanDerWaalsContact O-N 3.14Å; E211-G216 PolarHBondContact O-N 3.44Å; E211-R317 IonicContact OE1-CZ 3.41Å; E211-R317 IonicContact OE1-NH1 2.64Å; E211-R317 PolarHBondContact OE1-NH1 3.38Å; E211-R317 IonicContact OE1-NH2 3.82Å
212	I	94.6	Very high	96	Very high	10 Å²	10	26.5 Å²	26.5	5%	0.051	13%	0.133	C	C	.	.	H	α-helix	trans	-58.7	-47.8	178.4	-71.3	166.8	0	0	0	110.1	L121 M124 L158 L208 L209 W210 T214 F215	L121-I212 HydrophobicContact CB-CG2 3.89Å; L121-I212 HydrophobicContact CD2-CG2 3.9Å; L121-I212 HydrophobicContact CG-CG2 4.46Å; M124-I212 HydrophobicContact CB-CD1 4.35Å; M124-I212 HydrophobicContact CB-CG2 4.4Å; L158-I212 HydrophobicContact CD1-CD1 4.4Å; L208-I212 HydrophobicContact CD1-CD1 4.13Å; L208-I212 HydrophobicContact CD1-CG1 4.15Å; L208-I212 HydrophobicContact CG-CD1 3.97Å; L208-I212 HydrophobicContact CG-CG1 4.44Å; L208-I212 VanDerWaalsContact O-CG1 3.3Å; L208-I212 WeakPolarHBondContact O-CG1 3.32Å; L208-I212 PolarHBondContact O-N 3.27Å; L209-I212 PolarHBondContact O-N 3.42Å; W210-I212 PolarHBondContact O-N 3.14Å; I212-T214 VanDerWaalsContact C-N 3.31Å; I212-T214 PolarHBondContact O-N 3.31Å; I212-F215 PolarHBondContact O-N 3.22Å
213	F	94.9	Very high	95.9	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.018	14%	0.144	C	C	.	.	H	α-helix	trans	-80.1	-8.4	-176.4	-81.7	-95.9	0	0	0	114.8	V118 L121 L122 L209 W210 E211 P241 L243 M244 L248	V118-F213 HydrophobicContact CG1-CE1 4.31Å; L121-F213 HydrophobicContact CB-CE1 4.14Å; L121-F213 HydrophobicContact CB-CE2 4.1Å; L121-F213 HydrophobicContact CB-CZ 3.89Å; L121-F213 HydrophobicContact CD1-CD1 4.07Å; L121-F213 HydrophobicContact CD1-CE1 4.23Å; L121-F213 HydrophobicContact CD1-CG 4.49Å; L122-F213 HydrophobicContact CD2-CZ 3.89Å; L122-F213 HydrophobicContact CG-CZ 4.28Å; L209-F213 WeakPolarHBondContact O-CD2 3.25Å; L209-F213 PolarHBondContact O-N 2.79Å; L209-F213 VanDerWaalsContact O-N 3.1Å; W210-F213 PolarHBondContact O-N 3.21Å; E211-F213 VanDerWaalsContact C-N 3.34Å; E211-F213 PolarHBondContact O-N 2.98Å; F213-P241 HydrophobicContact CB-CB 4.03Å; F213-P241 HydrophobicContact CB-CG 3.79Å; F213-L243 HydrophobicContact CD1-CB 4.26Å; F213-M244 HydrophobicContact CB-CB 4.46Å; F213-M244 HydrophobicContact CB-CE 3.86Å; F213-M244 HydrophobicContact CD1-CB 3.78Å; F213-M244 HydrophobicContact CD1-CG 4.31Å; F213-M244 HydrophobicContact CD2-CE 3.66Å; F213-M244 HydrophobicContact CE1-CB 4.22Å; F213-M244 HydrophobicContact CE1-CG 4.46Å; F213-M244 HydrophobicContact CE2-CE 4.39Å; F213-M244 HydrophobicContact CG-CB 4.1Å; F213-M244 HydrophobicContact CG-CE 3.76Å; F213-M244 HydrophobicContact CG-CG 4.39Å; F213-L248 HydrophobicContact CD2-CD2 4.24Å; F213-L248 HydrophobicContact CE1-CD2 4.44Å; F213-L248 HydrophobicContact CE2-CD2 3.32Å; F213-L248 HydrophobicContact CZ-CD2 3.44Å; F213-L248 VanDerWaalsContact CZ-CD2 3.44Å
214	T	93.4	Very high	95.7	Very high	31 Å²	31	31.9 Å²	31.9	19%	0.19	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	10.7	169.9	55.7	0	0	0	0	112.9	W210 E211 I212 G216 D217 P241	W210-T214 HydrophobicContact CD2-CG2 3.91Å; W210-T214 HydrophobicContact CE3-CG2 4.1Å; W210-T214 HydrophobicContact CH2-CG2 3.88Å; W210-T214 HydrophobicContact CZ2-CG2 3.69Å; W210-T214 HydrophobicContact CZ3-CG2 4.08Å; W210-T214 WeakPolarHBondContact CZ3-OG1 3.42Å; W210-T214 WeakPolarHBondContact O-CB 3.11Å; W210-T214 WeakPolarHBondContact O-CG2 3.39Å; W210-T214 PolarHBondContact O-N 3.43Å; W210-T214 PolarHBondContact O-OG1 3.49Å; E211-T214 WeakPolarHBondContact CA-OG1 3.25Å; E211-T214 CarbonylContact O-C 3.52Å; E211-T214 PolarHBondContact O-N 2.88Å; E211-T214 PolarHBondContact O-OG1 3.05Å; I212-T214 VanDerWaalsContact C-N 3.31Å; I212-T214 PolarHBondContact O-N 3.31Å; T214-G216 PolarHBondContact O-N 3.32Å; T214-D217 HydrophobicContact CG2-CB 4.47Å; T214-D217 PolarHBondContact O-N 2.87Å; T214-D217 WeakPolarHBondContact OG1-CB 3.39Å; T214-D217 PolarHBondContact OG1-N 3.19Å; T214-P241 HydrophobicContact CG2-CB 4.04Å; T214-P241 HydrophobicContact CG2-CG 3.42Å; T214-P241 VanDerWaalsContact CG2-CG 3.42Å
215	F	91	Very high	95.5	Very high	88 Å²	88	32.9 Å²	32.9	39%	0.386	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	36.9	-178.6	-50.2	-79.9	0	0	0	113.3	L121 E211 I212 L243	L121-F215 HydrophobicContact CD1-CE1 4.02Å; L121-F215 HydrophobicContact CD1-CZ 4.15Å; L121-F215 HydrophobicContact CD2-CD1 4.45Å; L121-F215 HydrophobicContact CD2-CE1 4.12Å; E211-F215 PolarHBondContact O-N 2.89Å; E211-F215 VanDerWaalsContact O-N 3.14Å; I212-F215 PolarHBondContact O-N 3.22Å; F215-L243 HydrophobicContact CE2-CD1 3.7Å; F215-L243 HydrophobicContact CZ-CD1 3.66Å
216	G	90.2	Very high	95.3	Very high	24 Å²	24	38.1 Å²	38.1	25%	0.247	19%	0.19	C	C	.	.	S	Bend	trans	86.8	26.5	175	0	0	0	0	0	114.8	E211 T214 R317	E211-G216 PolarHBondContact O-N 3.44Å; T214-G216 PolarHBondContact O-N 3.32Å; G216-R317 PolarHBondContact O-NH1 3.48Å
217	D	92.3	Very high	95.2	Very high	58 Å²	58	42.8 Å²	42.8	31%	0.31	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-61.3	166.5	173.9	-162.8	11	0	0	0	111.5	W210 T214 P219 R221 R317	W210-D217 HydrophobicContact CH2-CB 3.79Å; W210-D217 HydrophobicContact CZ3-CB 3.83Å; T214-D217 HydrophobicContact CG2-CB 4.47Å; T214-D217 PolarHBondContact O-N 2.87Å; T214-D217 WeakPolarHBondContact OG1-CB 3.39Å; T214-D217 PolarHBondContact OG1-N 3.19Å; D217-P219 WeakPolarHBondContact O-CD 3.39Å; D217-R221 IonicContact OD1-CZ 3.18Å; D217-R221 IonicContact OD1-NE 2.94Å; D217-R221 PolarHBondContact OD1-NE 2.92Å; D217-R221 IonicContact OD1-NH2 2.63Å; D217-R221 PolarHBondContact OD1-NH2 3.42Å; D217-R317 PolarHBondContact O-NH1 3.26Å
218	V	93.6	Very high	95.1	Very high	25 Å²	25	42.8 Å²	42.8	15%	0.152	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-86.5	117.1	179	176.9	0	0	0	0	108.7	Y220 R221 R317	V218-Y220 PolarHBondContact O-N 3.17Å; V218-R221 HydrophobicContact CB-CB 4.23Å; V218-R221 HydrophobicContact CG1-CB 4.42Å; V218-R221 VanDerWaalsContact CG2-NH2 3.28Å; V218-R221 WeakPolarHBondContact O-CB 3.3Å; V218-R221 PolarHBondContact O-N 3.24Å; V218-R317 HydrophobicContact CG2-CG 3.87Å
219	P	96.9	Very high	94.9	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	140.5	174.6	25.9	-33.9	0	0	0	109.7	K184 W185 V207 W210 D217 R221 L238	K184-P219 HydrophobicContact CB-CG 4.13Å; K184-P219 WeakPolarHBondContact CD-O 3.44Å; W185-P219 HydrophobicContact CD2-CG 4.37Å; W185-P219 HydrophobicContact CH2-CG 3.82Å; W185-P219 HydrophobicContact CZ2-CG 3.47Å; W185-P219 VanDerWaalsContact CZ2-CG 3.47Å; W185-P219 HydrophobicContact CZ3-CG 4.42Å; V207-P219 HydrophobicContact CG1-CB 3.8Å; V207-P219 HydrophobicContact CG1-CG 3.82Å; W210-P219 HydrophobicContact CE3-CB 4.26Å; W210-P219 HydrophobicContact CZ3-CB 4.26Å; D217-P219 WeakPolarHBondContact O-CD 3.39Å; P219-R221 PolarHBondContact O-N 2.76Å; P219-R221 VanDerWaalsContact O-N 3.16Å; P219-L238 HydrophobicContact CB-CD1 3.77Å; P219-L238 HydrophobicContact CB-CD2 4.45Å
220	Y	96.9	Very high	94.8	Very high	10 Å²	10	49.8 Å²	49.8	4%	0.039	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	39.3	-180	-46.7	-76.7	0	0	0	112.4	K184 V218 N222 W223 T228 I232 Y236 L238	K184-Y220 HydrophobicContact CB-CD2 4.11Å; K184-Y220 HydrophobicContact CG-CD2 4.14Å; K184-Y220 PolarHBondContact NZ-O 3.47Å; V218-Y220 PolarHBondContact O-N 3.17Å; Y220-N222 PolarHBondContact O-N 3.41Å; Y220-W223 AromaticContact CD1-CE3 3.74Å; Y220-W223 HydrophobicContact CD1-CE3 3.74Å; Y220-W223 AromaticContact CD1-CZ3 3.6Å; Y220-W223 HydrophobicContact CD1-CZ3 3.6Å; Y220-W223 HydrophobicContact CE1-CZ3 4.26Å; Y220-W223 HydrophobicContact CG-CE3 4.27Å; Y220-W223 PolarHBondContact O-N 2.87Å; Y220-T228 HydrophobicContact CD1-CG2 4.23Å; Y220-T228 HydrophobicContact CD2-CG2 3.55Å; Y220-T228 HydrophobicContact CE2-CG2 4.07Å; Y220-T228 HydrophobicContact CG-CG2 3.63Å; Y220-I232 HydrophobicContact CE1-CG1 4.34Å; Y220-I232 HydrophobicContact CE2-CD1 4.05Å; Y220-Y236 HydrophobicContact CD1-CD1 4.39Å; Y220-Y236 HydrophobicContact CD1-CE1 4.1Å; Y220-Y236 AromaticContact CE1-CD1 3.96Å; Y220-Y236 HydrophobicContact CE1-CD1 3.96Å; Y220-Y236 AromaticContact CE1-CE1 3.91Å; Y220-Y236 HydrophobicContact CE1-CE1 3.91Å; Y220-L238 HydrophobicContact CD1-CD2 3.59Å; Y220-L238 HydrophobicContact CD1-CG 4.12Å; Y220-L238 HydrophobicContact CD2-CD2 4.24Å; Y220-L238 HydrophobicContact CD2-CG 4.5Å; Y220-L238 HydrophobicContact CE1-CD1 4.47Å; Y220-L238 HydrophobicContact CE1-CD2 3.62Å; Y220-L238 HydrophobicContact CE1-CG 3.61Å; Y220-L238 HydrophobicContact CE2-CD1 3.98Å; Y220-L238 HydrophobicContact CE2-CD2 4.24Å; Y220-L238 HydrophobicContact CE2-CG 4.02Å; Y220-L238 HydrophobicContact CG-CD2 3.94Å
221	R	94.6	Very high	94.7	Very high	137 Å²	137	51.7 Å²	51.7	52%	0.517	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-35.4	-175	174.9	173.8	-69.8	-73.4	7.7	114	D217 V218 P219 W223	D217-R221 IonicContact OD1-CZ 3.18Å; D217-R221 IonicContact OD1-NE 2.94Å; D217-R221 PolarHBondContact OD1-NE 2.92Å; D217-R221 IonicContact OD1-NH2 2.63Å; D217-R221 PolarHBondContact OD1-NH2 3.42Å; V218-R221 HydrophobicContact CB-CB 4.23Å; V218-R221 HydrophobicContact CG1-CB 4.42Å; V218-R221 VanDerWaalsContact CG2-NH2 3.28Å; V218-R221 WeakPolarHBondContact O-CB 3.3Å; V218-R221 PolarHBondContact O-N 3.24Å; P219-R221 PolarHBondContact O-N 2.76Å; P219-R221 VanDerWaalsContact O-N 3.16Å; R221-W223 VanDerWaalsContact C-N 3.3Å; R221-W223 PolarHBondContact O-N 2.69Å
222	N	94.5	Very high	94.6	Very high	143 Å²	143	51.7 Å²	51.7	77%	0.765	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	0.8	-173.1	-60	-24.4	0	0	0	114.1	Y220	Y220-N222 PolarHBondContact O-N 3.41Å
223	W	95.7	Very high	94.5	Very high	63 Å²	63	55.8 Å²	55.8	24%	0.239	27%	0.274	C	S	.	.	S	Bend	trans	-124.2	143.4	-176.7	-62.5	-33.3	0	0	0	111.8	K184 Y220 R221 Q227 M231 Y236	K184-W223 WeakPolarHBondContact CE-O 3.44Å; K184-W223 PolarHBondContact NZ-O 2.96Å; Y220-W223 AromaticContact CD1-CE3 3.74Å; Y220-W223 HydrophobicContact CD1-CE3 3.74Å; Y220-W223 AromaticContact CD1-CZ3 3.6Å; Y220-W223 HydrophobicContact CD1-CZ3 3.6Å; Y220-W223 HydrophobicContact CE1-CZ3 4.26Å; Y220-W223 HydrophobicContact CG-CE3 4.27Å; Y220-W223 PolarHBondContact O-N 2.87Å; R221-W223 VanDerWaalsContact C-N 3.3Å; R221-W223 PolarHBondContact O-N 2.69Å; W223-Q227 HydrophobicContact CB-CB 3.78Å; W223-Q227 HydrophobicContact CG-CB 4.2Å; W223-M231 HydrophobicContact CD2-CG 3.91Å; W223-M231 HydrophobicContact CE3-CB 3.89Å; W223-M231 HydrophobicContact CE3-CG 3.79Å; W223-M231 HydrophobicContact CH2-CB 3.96Å; W223-M231 HydrophobicContact CH2-CE 3.64Å; W223-M231 HydrophobicContact CH2-CG 3.76Å; W223-M231 HydrophobicContact CH2-SD 4.43Å; W223-M231 HydrophobicContact CZ2-CE 3.78Å; W223-M231 HydrophobicContact CZ2-CG 3.89Å; W223-M231 HydrophobicContact CZ2-SD 4.33Å; W223-M231 HydrophobicContact CZ3-CB 3.56Å; W223-M231 HydrophobicContact CZ3-CE 4.42Å; W223-M231 HydrophobicContact CZ3-CG 3.7Å; W223-Y236 AromaticContact CH2-CD1 3.44Å; W223-Y236 HydrophobicContact CH2-CD1 3.44Å; W223-Y236 VanDerWaalsContact CH2-CD1 3.44Å; W223-Y236 AromaticContact CH2-CD2 3.94Å; W223-Y236 HydrophobicContact CH2-CD2 3.94Å; W223-Y236 AromaticContact CH2-CE1 3.29Å; W223-Y236 HydrophobicContact CH2-CE1 3.29Å; W223-Y236 AromaticContact CH2-CE2 3.8Å; W223-Y236 HydrophobicContact CH2-CE2 3.8Å; W223-Y236 AromaticContact CH2-CG 3.77Å; W223-Y236 HydrophobicContact CH2-CG 3.77Å; W223-Y236 AromaticContact CH2-CZ 3.48Å; W223-Y236 VanDerWaalsContact CH2-CZ 3.48Å; W223-Y236 AromaticContact CZ3-CD1 3.39Å; W223-Y236 HydrophobicContact CZ3-CD1 3.39Å; W223-Y236 AromaticContact CZ3-CE1 3.36Å; W223-Y236 HydrophobicContact CZ3-CE1 3.36Å; W223-Y236 HydrophobicContact CZ3-CG 4.1Å
224	S	96.1	Very high	94.5	Very high	50 Å²	50	59.8 Å²	59.8	35%	0.35	30%	0.302	S	S	.	.			trans	-63.2	171.3	165.1	72.9	0	0	0	0	110.7	Q226 Q227 T228	S224-Q226 VanDerWaalsContact C-N 3.34Å; S224-Q226 PolarHBondContact O-N 3.43Å; S224-Q227 PolarHBondContact O-N 3.35Å; S224-Q227 WeakPolarHBondContact OG-CG 3.45Å; S224-Q227 PolarHBondContact OG-N 3.33Å; S224-Q227 PolarHBondContact OG-OE1 2.82Å; S224-T228 WeakPolarHBondContact O-CB 3.47Å; S224-T228 PolarHBondContact O-N 3.05Å; S224-T228 PolarHBondContact O-OG1 3.47Å
225	N	93.7	Very high	94.6	Very high	25 Å²	25	60.3 Å²	60.3	13%	0.134	31%	0.314	C	S	.	.	H	α-helix	trans	-62.6	-42.2	176.6	-69	-34.7	0	0	0	112.1	I183 T228 R229 E320 D321	I183-N225 HydrophobicContact CB-CB 3.99Å; I183-N225 HydrophobicContact CG1-CB 3.9Å; I183-N225 HydrophobicContact CG2-CB 4.14Å; I183-N225 WeakPolarHBondContact CG2-O 3.39Å; N225-T228 PolarHBondContact O-N 3.5Å; N225-R229 PolarHBondContact O-N 3.03Å; N225-E320 PolarHBondContact ND2-O 3.01Å; N225-D321 WeakPolarHBondContact CB-OXT 3.23Å; N225-D321 PolarHBondContact ND2-OXT 3.44Å
226	Q	93.9	Very high	94.9	Very high	110 Å²	110	60.2 Å²	60.2	51%	0.514	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-48.3	176.8	-174.8	58.8	53.1	0	0	111.4	S224 T228 R229 D230	S224-Q226 VanDerWaalsContact C-N 3.34Å; S224-Q226 PolarHBondContact O-N 3.43Å; Q226-T228 VanDerWaalsContact C-N 3.3Å; Q226-T228 PolarHBondContact O-N 3.27Å; Q226-R229 WeakPolarHBondContact O-CB 3.44Å; Q226-R229 PolarHBondContact O-N 3.33Å; Q226-R229 VanDerWaalsContact O-N 3.16Å; Q226-D230 PolarHBondContact NE2-OD1 3.42Å; Q226-D230 PolarHBondContact O-N 3.07Å
227	Q	96.8	Very high	95.2	Very high	98 Å²	98	61.1 Å²	61.1	46%	0.458	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-40.5	176.5	-72.7	173.1	-33.1	0	0	111.7	W223 S224 R229 D230 M231	W223-Q227 HydrophobicContact CB-CB 3.78Å; W223-Q227 HydrophobicContact CG-CB 4.2Å; S224-Q227 PolarHBondContact O-N 3.35Å; S224-Q227 WeakPolarHBondContact OG-CG 3.45Å; S224-Q227 PolarHBondContact OG-N 3.33Å; S224-Q227 PolarHBondContact OG-OE1 2.82Å; Q227-R229 VanDerWaalsContact C-N 3.3Å; Q227-R229 PolarHBondContact O-N 3.4Å; Q227-D230 PolarHBondContact O-N 3.13Å; Q227-M231 WeakPolarHBondContact O-CB 3.5Å; Q227-M231 VanDerWaalsContact O-CG 3.23Å; Q227-M231 WeakPolarHBondContact O-CG 3.43Å; Q227-M231 PolarHBondContact O-N 3.2Å
228	T	96.2	Very high	95.4	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-44.1	176.8	-60.1	0	0	0	0	110.8	K184 Y220 S224 N225 Q226 M231 I232	K184-T228 HydrophobicContact CG-CG2 3.94Å; Y220-T228 HydrophobicContact CD1-CG2 4.23Å; Y220-T228 HydrophobicContact CD2-CG2 3.55Å; Y220-T228 HydrophobicContact CE2-CG2 4.07Å; Y220-T228 HydrophobicContact CG-CG2 3.63Å; S224-T228 WeakPolarHBondContact O-CB 3.47Å; S224-T228 PolarHBondContact O-N 3.05Å; S224-T228 PolarHBondContact O-OG1 3.47Å; N225-T228 PolarHBondContact O-N 3.5Å; Q226-T228 VanDerWaalsContact C-N 3.3Å; Q226-T228 PolarHBondContact O-N 3.27Å; T228-M231 PolarHBondContact O-N 3Å; T228-I232 HydrophobicContact CG2-CD1 3.7Å; T228-I232 HydrophobicContact CG2-CG1 4.32Å; T228-I232 WeakPolarHBondContact O-CB 3.38Å; T228-I232 VanDerWaalsContact O-CG1 3.29Å; T228-I232 WeakPolarHBondContact O-CG1 3.25Å; T228-I232 PolarHBondContact O-N 3.3Å
229	R	94.3	Very high	95.6	Very high	70 Å²	70	61.4 Å²	61.4	26%	0.264	31%	0.313	S	S	.	.	H	α-helix	trans	-58.9	-50.9	176.6	178.7	-177.9	179.3	150.3	2.3	111	I183 L191 N225 Q226 Q227 M231 I232 E233	I183-R229 HydrophobicContact CG2-CB 4.39Å; L191-R229 HydrophobicContact CD1-CG 4.27Å; L191-R229 PolarHBondContact O-NH1 2.79Å; L191-R229 PolarHBondContact O-NH2 3.26Å; N225-R229 PolarHBondContact O-N 3.03Å; Q226-R229 WeakPolarHBondContact O-CB 3.44Å; Q226-R229 PolarHBondContact O-N 3.33Å; Q226-R229 VanDerWaalsContact O-N 3.16Å; Q227-R229 VanDerWaalsContact C-N 3.3Å; Q227-R229 PolarHBondContact O-N 3.4Å; R229-M231 VanDerWaalsContact C-N 3.31Å; R229-M231 PolarHBondContact O-N 3.47Å; R229-I232 PolarHBondContact O-N 3.35Å; R229-E233 HydrophobicContact CG-CG 4.5Å; R229-E233 IonicContact CZ-OE1 3.75Å; R229-E233 IonicContact NE-OE1 3.03Å; R229-E233 PolarHBondContact NE-OE1 3.09Å; R229-E233 IonicContact NH2-OE1 3.55Å; R229-E233 WeakPolarHBondContact O-CB 3.38Å; R229-E233 WeakPolarHBondContact O-CG 3.46Å; R229-E233 PolarHBondContact O-N 3.27Å
230	D	95.6	Very high	95.5	Very high	78 Å²	78	61.9 Å²	61.9	42%	0.417	32%	0.316	S	S	.	.	H	α-helix	trans	-60.8	-42.4	-178.6	-57.4	-21	0	0	0	111	Q226 Q227 E233 S234	Q226-D230 PolarHBondContact NE2-OD1 3.42Å; Q226-D230 PolarHBondContact O-N 3.07Å; Q227-D230 PolarHBondContact O-N 3.13Å; D230-E233 PolarHBondContact O-N 3.12Å; D230-S234 PolarHBondContact O-N 3.14Å
231	M	96	Very high	95.5	Very high	61 Å²	61	62.2 Å²	62.2	30%	0.3	32%	0.32	S	S	.	.	H	α-helix	trans	-64.8	-44.8	177.1	-69.5	-55.9	-61.1	0	0	112.1	W223 Q227 T228 R229 E233 S234 G235 Y236	W223-M231 HydrophobicContact CD2-CG 3.91Å; W223-M231 HydrophobicContact CE3-CB 3.89Å; W223-M231 HydrophobicContact CE3-CG 3.79Å; W223-M231 HydrophobicContact CH2-CB 3.96Å; W223-M231 HydrophobicContact CH2-CE 3.64Å; W223-M231 HydrophobicContact CH2-CG 3.76Å; W223-M231 HydrophobicContact CH2-SD 4.43Å; W223-M231 HydrophobicContact CZ2-CE 3.78Å; W223-M231 HydrophobicContact CZ2-CG 3.89Å; W223-M231 HydrophobicContact CZ2-SD 4.33Å; W223-M231 HydrophobicContact CZ3-CB 3.56Å; W223-M231 HydrophobicContact CZ3-CE 4.42Å; W223-M231 HydrophobicContact CZ3-CG 3.7Å; Q227-M231 WeakPolarHBondContact O-CB 3.5Å; Q227-M231 VanDerWaalsContact O-CG 3.23Å; Q227-M231 WeakPolarHBondContact O-CG 3.43Å; Q227-M231 PolarHBondContact O-N 3.2Å; T228-M231 PolarHBondContact O-N 3Å; R229-M231 VanDerWaalsContact C-N 3.31Å; R229-M231 PolarHBondContact O-N 3.47Å; M231-E233 VanDerWaalsContact C-N 3.33Å; M231-E233 PolarHBondContact O-N 3.44Å; M231-S234 PolarHBondContact O-N 3.27Å; M231-S234 PolarHBondContact O-OG 3.1Å; M231-G235 PolarHBondContact O-N 3.04Å; M231-Y236 HydrophobicContact CE-CD2 4.07Å; M231-Y236 HydrophobicContact CE-CG 4.04Å; M231-Y236 VanDerWaalsContact O-CB 3.22Å; M231-Y236 WeakPolarHBondContact O-CB 3.49Å; M231-Y236 PolarHBondContact O-N 2.71Å
232	I	95.4	Very high	95.4	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-43.6	175.7	-71.7	170.1	0	0	0	110.8	P188 W203 Y220 T228 R229 S234 G235 R237	P188-I232 HydrophobicContact CB-CG2 4.11Å; P188-I232 HydrophobicContact CG-CG2 4.28Å; W203-I232 HydrophobicContact CH2-CG2 3.62Å; W203-I232 HydrophobicContact CZ2-CD1 4.25Å; W203-I232 HydrophobicContact CZ2-CG1 4.45Å; W203-I232 HydrophobicContact CZ2-CG2 3.56Å; Y220-I232 HydrophobicContact CE1-CG1 4.34Å; Y220-I232 HydrophobicContact CE2-CD1 4.05Å; T228-I232 HydrophobicContact CG2-CD1 3.7Å; T228-I232 HydrophobicContact CG2-CG1 4.32Å; T228-I232 WeakPolarHBondContact O-CB 3.38Å; T228-I232 VanDerWaalsContact O-CG1 3.29Å; T228-I232 WeakPolarHBondContact O-CG1 3.25Å; T228-I232 PolarHBondContact O-N 3.3Å; R229-I232 PolarHBondContact O-N 3.35Å; I232-S234 VanDerWaalsContact C-N 3.29Å; I232-S234 PolarHBondContact O-N 3.13Å; I232-G235 PolarHBondContact O-N 3.06Å; I232-R237 PolarHBondContact O-NH1 2.87Å
233	E	92.9	Very high	95.2	Very high	96 Å²	96	60.9 Å²	60.9	45%	0.449	32%	0.322	S	S	.	.	H	α-helix	trans	-64.1	-32.3	177.7	-74.3	-177.1	-172.5	0	0	111.9	R229 D230 M231 G235	R229-E233 HydrophobicContact CG-CG 4.5Å; R229-E233 IonicContact CZ-OE1 3.75Å; R229-E233 IonicContact NE-OE1 3.03Å; R229-E233 PolarHBondContact NE-OE1 3.09Å; R229-E233 IonicContact NH2-OE1 3.55Å; R229-E233 WeakPolarHBondContact O-CB 3.38Å; R229-E233 WeakPolarHBondContact O-CG 3.46Å; R229-E233 PolarHBondContact O-N 3.27Å; D230-E233 PolarHBondContact O-N 3.12Å; M231-E233 VanDerWaalsContact C-N 3.33Å; M231-E233 PolarHBondContact O-N 3.44Å; E233-G235 PolarHBondContact O-N 2.91Å
234	S	95	Very high	95.2	Very high	88 Å²	88	58.2 Å²	58.2	62%	0.615	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-3.2	172.3	77.1	0	0	0	0	115.1	D230 M231 I232	D230-S234 PolarHBondContact O-N 3.14Å; M231-S234 PolarHBondContact O-N 3.27Å; M231-S234 PolarHBondContact O-OG 3.1Å; I232-S234 VanDerWaalsContact C-N 3.29Å; I232-S234 PolarHBondContact O-N 3.13Å
235	G	95.2	Very high	95.2	Very high	42 Å²	42	57.3 Å²	57.3	43%	0.433	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.4	0.6	-178.6	0	0	0	0	0	114.8	M231 I232 E233	M231-G235 PolarHBondContact O-N 3.04Å; I232-G235 PolarHBondContact O-N 3.06Å; E233-G235 PolarHBondContact O-N 2.91Å
236	Y	96.6	Very high	95.3	Very high	85 Å²	85	61.6 Å²	61.6	33%	0.333	33%	0.333	S	S	.	.			trans	-65	142	175.6	-177.3	-86	0	0	0	111.2	Y220 W223 M231	Y220-Y236 HydrophobicContact CD1-CD1 4.39Å; Y220-Y236 HydrophobicContact CD1-CE1 4.1Å; Y220-Y236 AromaticContact CE1-CD1 3.96Å; Y220-Y236 HydrophobicContact CE1-CD1 3.96Å; Y220-Y236 AromaticContact CE1-CE1 3.91Å; Y220-Y236 HydrophobicContact CE1-CE1 3.91Å; W223-Y236 AromaticContact CH2-CD1 3.44Å; W223-Y236 HydrophobicContact CH2-CD1 3.44Å; W223-Y236 VanDerWaalsContact CH2-CD1 3.44Å; W223-Y236 AromaticContact CH2-CD2 3.94Å; W223-Y236 HydrophobicContact CH2-CD2 3.94Å; W223-Y236 AromaticContact CH2-CE1 3.29Å; W223-Y236 HydrophobicContact CH2-CE1 3.29Å; W223-Y236 AromaticContact CH2-CE2 3.8Å; W223-Y236 HydrophobicContact CH2-CE2 3.8Å; W223-Y236 AromaticContact CH2-CG 3.77Å; W223-Y236 HydrophobicContact CH2-CG 3.77Å; W223-Y236 AromaticContact CH2-CZ 3.48Å; W223-Y236 VanDerWaalsContact CH2-CZ 3.48Å; W223-Y236 AromaticContact CZ3-CD1 3.39Å; W223-Y236 HydrophobicContact CZ3-CD1 3.39Å; W223-Y236 AromaticContact CZ3-CE1 3.36Å; W223-Y236 HydrophobicContact CZ3-CE1 3.36Å; W223-Y236 HydrophobicContact CZ3-CG 4.1Å; M231-Y236 HydrophobicContact CE-CD2 4.07Å; M231-Y236 HydrophobicContact CE-CG 4.04Å; M231-Y236 VanDerWaalsContact O-CB 3.22Å; M231-Y236 WeakPolarHBondContact O-CB 3.49Å; M231-Y236 PolarHBondContact O-N 2.71Å
237	R	97.3	Very high	95.3	Very high	43 Å²	43	60 Å²	60	16%	0.162	32%	0.322	C	S	.	.			trans	-134.8	155.1	174.8	-61.3	-61.7	-178.1	-91.6	-1.1	110	W203 I232 W256 D258	W203-R237 VanDerWaalsContact CH2-CZ 3.43Å; I232-R237 PolarHBondContact O-NH1 2.87Å; R237-W256 HydrophobicContact CB-CE3 3.9Å; R237-W256 HydrophobicContact CB-CZ3 4.21Å; R237-W256 HydrophobicContact CG-CB 4.48Å; R237-W256 HydrophobicContact CG-CE3 4.24Å; R237-W256 PolarHBondContact NE-O 2.96Å; R237-W256 VanDerWaalsContact NE-O 3.16Å; R237-W256 PolarHBondContact NH2-O 2.77Å; R237-W256 VanDerWaalsContact NH2-O 3.12Å; R237-D258 IonicContact CZ-OD1 3.1Å; R237-D258 IonicContact NH2-OD1 3.08Å; R237-D258 PolarHBondContact NH2-OD1 3.1Å
238	L	97.2	Very high	95.3	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.042	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-60.9	136.1	178	-68.2	164.2	0	0	0	110.4	V207 W210 P219 Y220 W256	V207-L238 HydrophobicContact CG1-CD1 4.47Å; W210-L238 HydrophobicContact CB-CD1 4.16Å; W210-L238 HydrophobicContact CD2-CD1 3.87Å; W210-L238 HydrophobicContact CE3-CD1 4.32Å; W210-L238 HydrophobicContact CG-CB 4.22Å; W210-L238 HydrophobicContact CG-CD1 3.77Å; W210-L238 HydrophobicContact CZ2-CD2 4.4Å; P219-L238 HydrophobicContact CB-CD1 3.77Å; P219-L238 HydrophobicContact CB-CD2 4.45Å; Y220-L238 HydrophobicContact CD1-CD2 3.59Å; Y220-L238 HydrophobicContact CD1-CG 4.12Å; Y220-L238 HydrophobicContact CD2-CD2 4.24Å; Y220-L238 HydrophobicContact CD2-CG 4.5Å; Y220-L238 HydrophobicContact CE1-CD1 4.47Å; Y220-L238 HydrophobicContact CE1-CD2 3.62Å; Y220-L238 HydrophobicContact CE1-CG 3.61Å; Y220-L238 HydrophobicContact CE2-CD1 3.98Å; Y220-L238 HydrophobicContact CE2-CD2 4.24Å; Y220-L238 HydrophobicContact CE2-CG 4.02Å; Y220-L238 HydrophobicContact CG-CD2 3.94Å; L238-W256 HydrophobicContact CB-CH2 3.77Å; L238-W256 HydrophobicContact CB-CZ3 4.12Å; L238-W256 HydrophobicContact CD1-CH2 4.1Å; L238-W256 HydrophobicContact CD1-CZ2 4.24Å; L238-W256 HydrophobicContact CG-CH2 4.37Å
239	P	96.5	Very high	95.4	Very high	82 Å²	82	59 Å²	59	53%	0.532	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-66.9	136.1	170.5	29.4	-33.7	0	0	0	109	W210	W210-P239 VanDerWaalsContact CD1-O 3.31Å; W210-P239 PolarHBondContact NE1-O 3.34Å
240	A	95.9	Very high	95.5	Very high	9 Å²	9	58.7 Å²	58.7	7%	0.074	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-71.3	139.9	179.1	0	0	0	0	0	111.4	M244 R249 M252	A240-M244 HydrophobicContact CB-SD 3.84Å; A240-R249 HydrophobicContact CB-CB 3.94Å; A240-R249 HydrophobicContact CB-CG 3.55Å; A240-R249 VanDerWaalsContact O-CZ 3.32Å; A240-R249 PolarHBondContact O-NH1 3.07Å; A240-R249 PolarHBondContact O-NH2 3.07Å; A240-M252 HydrophobicContact CB-CE 3.54Å
241	P	95.3	Very high	95.6	Very high	18 Å²	18	55 Å²	55	12%	0.117	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-63.7	153.7	-178.3	-22.5	36.1	0	0	0	112.9	W210 F213 T214 L243 M244 R249	W210-P241 HydrophobicContact CG-CG 4.49Å; F213-P241 HydrophobicContact CB-CB 4.03Å; F213-P241 HydrophobicContact CB-CG 3.79Å; T214-P241 HydrophobicContact CG2-CB 4.04Å; T214-P241 HydrophobicContact CG2-CG 3.42Å; T214-P241 VanDerWaalsContact CG2-CG 3.42Å; P241-L243 VanDerWaalsContact C-N 3.27Å; P241-L243 PolarHBondContact O-N 3.29Å; P241-M244 VanDerWaalsContact O-CB 3.3Å; P241-M244 WeakPolarHBondContact O-CB 3.48Å; P241-M244 PolarHBondContact O-N 3.4Å; P241-R249 PolarHBondContact O-NH2 3.09Å
242	D	92.4	Very high	95.7	Very high	165 Å²	165	52.1 Å²	52.1	88%	0.882	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.4	-175.4	-64.1	-23.6	0	0	0	113.2	M244	D242-M244 PolarHBondContact O-N 3.16Å
243	L	91.9	Very high	95.8	Very high	86 Å²	86	55.8 Å²	55.8	45%	0.45	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-11.9	179.1	-64.7	178.3	0	0	0	113.7	V118 F213 F215 P241 P245	V118-L243 HydrophobicContact CG2-CB 4.41Å; F213-L243 HydrophobicContact CD1-CB 4.26Å; F215-L243 HydrophobicContact CE2-CD1 3.7Å; F215-L243 HydrophobicContact CZ-CD1 3.66Å; P241-L243 VanDerWaalsContact C-N 3.27Å; P241-L243 PolarHBondContact O-N 3.29Å; L243-P245 WeakPolarHBondContact O-CD 3.27Å
244	M	95.5	Very high	96.1	Very high	7 Å²	7	55.5 Å²	55.5	3%	0.034	30%	0.304	C	S	.	.	S	Bend	trans	-78.9	120.8	-175.6	-174.7	177.6	-77.3	0	0	110.9	L209 F213 A240 P241 D242 L248 R249 M252	L209-M244 HydrophobicContact CB-CE 4.21Å; F213-M244 HydrophobicContact CB-CB 4.46Å; F213-M244 HydrophobicContact CB-CE 3.86Å; F213-M244 HydrophobicContact CD1-CB 3.78Å; F213-M244 HydrophobicContact CD1-CG 4.31Å; F213-M244 HydrophobicContact CD2-CE 3.66Å; F213-M244 HydrophobicContact CE1-CB 4.22Å; F213-M244 HydrophobicContact CE1-CG 4.46Å; F213-M244 HydrophobicContact CE2-CE 4.39Å; F213-M244 HydrophobicContact CG-CB 4.1Å; F213-M244 HydrophobicContact CG-CE 3.76Å; F213-M244 HydrophobicContact CG-CG 4.39Å; A240-M244 HydrophobicContact CB-SD 3.84Å; P241-M244 VanDerWaalsContact O-CB 3.3Å; P241-M244 WeakPolarHBondContact O-CB 3.48Å; P241-M244 PolarHBondContact O-N 3.4Å; D242-M244 PolarHBondContact O-N 3.16Å; M244-L248 HydrophobicContact CG-CB 4.02Å; M244-L248 HydrophobicContact CG-CD2 4.13Å; M244-L248 HydrophobicContact CG-CG 4.1Å; M244-L248 HydrophobicContact SD-CG 4.34Å; M244-R249 HydrophobicContact CG-CB 4.35Å; M244-R249 HydrophobicContact SD-CB 4.04Å; M244-M252 HydrophobicContact CE-SD 3.8Å; M244-M252 HydrophobicContact SD-CB 4.44Å; M244-M252 HydrophobicContact SD-CE 4.33Å; M244-M252 HydrophobicContact SD-SD 3.94Å
245	P	95.6	Very high	96.2	Very high	32 Å²	32	51.3 Å²	51.3	21%	0.208	28%	0.275	C	S	.	.			trans	-55.2	145.1	174.9	-26.1	35.5	0	0	0	112.2	V118 L122 L243 W247 L248 R249	V118-P245 HydrophobicContact CG1-CG 4.41Å; L122-P245 HydrophobicContact CD2-CG 4.33Å; L243-P245 WeakPolarHBondContact O-CD 3.27Å; P245-W247 VanDerWaalsContact C-N 3.27Å; P245-W247 HydrophobicContact CB-CD2 4.44Å; P245-W247 HydrophobicContact CB-CG 4.35Å; P245-W247 HydrophobicContact CB-CZ2 4.39Å; P245-W247 VanDerWaalsContact CB-NE1 3.34Å; P245-W247 HydrophobicContact CG-CZ2 4.44Å; P245-W247 PolarHBondContact O-N 3.12Å; P245-L248 PolarHBondContact O-N 3.49Å; P245-R249 PolarHBondContact O-N 3.5Å
246	V	95.3	Very high	96.4	Very high	114 Å²	114	49.5 Å²	49.5	69%	0.691	26%	0.255	S	S	*	.	H	α-helix	trans	-54.2	-42.3	-176.8	174.6	0	0	0	0	112.3	L248 R249 T250	V246-L248 VanDerWaalsContact C-N 3.33Å; V246-L248 PolarHBondContact O-N 3.23Å; V246-R249 WeakPolarHBondContact O-CB 3.27Å; V246-R249 PolarHBondContact O-N 3.03Å; V246-T250 PolarHBondContact O-N 3.24Å; V246-T250 PolarHBondContact O-OG1 3.39Å
247	W	95	Very high	96.5	Very high	76 Å²	76	49 Å²	49	29%	0.288	26%	0.255	S	S	.	.	H	α-helix	trans	-63.8	-37.6	178.7	63.2	-101.2	0	0	0	112.3	L122 P245 T250 L251 I273 Q274	L122-W247 HydrophobicContact CD1-CZ2 4.4Å; L122-W247 HydrophobicContact CD2-CH2 3.67Å; L122-W247 HydrophobicContact CD2-CZ2 3.61Å; P245-W247 VanDerWaalsContact C-N 3.27Å; P245-W247 HydrophobicContact CB-CD2 4.44Å; P245-W247 HydrophobicContact CB-CG 4.35Å; P245-W247 HydrophobicContact CB-CZ2 4.39Å; P245-W247 VanDerWaalsContact CB-NE1 3.34Å; P245-W247 HydrophobicContact CG-CZ2 4.44Å; P245-W247 PolarHBondContact O-N 3.12Å; W247-T250 WeakPolarHBondContact O-CB 3.45Å; W247-T250 PolarHBondContact O-N 2.77Å; W247-L251 PolarHBondContact O-N 3.41Å; W247-I273 HydrophobicContact CH2-CB 4.46Å; W247-I273 HydrophobicContact CH2-CG2 4.17Å; W247-I273 HydrophobicContact CZ3-CB 4.45Å; W247-I273 HydrophobicContact CZ3-CG1 4.32Å; W247-Q274 HydrophobicContact CH2-CB 4.4Å; W247-Q274 HydrophobicContact CZ2-CB 4.14Å; W247-Q274 WeakPolarHBondContact CZ2-O 3.22Å
248	L	97.1	Very high	96.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-74.2	-35.1	179.2	-174.6	60.3	0	0	0	111.2	L122 L209 F213 M244 P245 V246 T250 L251 M252 I273	L122-L248 HydrophobicContact CD2-CD2 3.69Å; L209-L248 HydrophobicContact CD1-CD1 3.99Å; L209-L248 HydrophobicContact CD2-CD1 4.22Å; F213-L248 HydrophobicContact CD2-CD2 4.24Å; F213-L248 HydrophobicContact CE1-CD2 4.44Å; F213-L248 HydrophobicContact CE2-CD2 3.32Å; F213-L248 HydrophobicContact CZ-CD2 3.44Å; F213-L248 VanDerWaalsContact CZ-CD2 3.44Å; M244-L248 HydrophobicContact CG-CB 4.02Å; M244-L248 HydrophobicContact CG-CD2 4.13Å; M244-L248 HydrophobicContact CG-CG 4.1Å; M244-L248 HydrophobicContact SD-CG 4.34Å; P245-L248 PolarHBondContact O-N 3.49Å; V246-L248 VanDerWaalsContact C-N 3.33Å; V246-L248 PolarHBondContact O-N 3.23Å; L248-T250 VanDerWaalsContact C-N 3.3Å; L248-T250 PolarHBondContact O-N 3Å; L248-L251 HydrophobicContact CD1-CB 4.49Å; L248-L251 HydrophobicContact CD1-CD2 4.11Å; L248-L251 PolarHBondContact O-N 3.43Å; L248-M252 WeakPolarHBondContact O-CB 3.32Å; L248-M252 PolarHBondContact O-N 3.09Å; L248-I273 HydrophobicContact CD1-CG1 4.36Å
249	R	96.8	Very high	96.3	Very high	77 Å²	77	56.1 Å²	56.1	29%	0.291	29%	0.294	S	S	.	.	H	α-helix	trans	-57.3	-44.6	169.3	169.1	-178.6	-47.7	-108.2	-4.4	111.2	A240 P241 M244 P245 V246 M252 N253	A240-R249 HydrophobicContact CB-CB 3.94Å; A240-R249 HydrophobicContact CB-CG 3.55Å; A240-R249 VanDerWaalsContact O-CZ 3.32Å; A240-R249 PolarHBondContact O-NH1 3.07Å; A240-R249 PolarHBondContact O-NH2 3.07Å; P241-R249 PolarHBondContact O-NH2 3.09Å; M244-R249 HydrophobicContact CG-CB 4.35Å; M244-R249 HydrophobicContact SD-CB 4.04Å; P245-R249 PolarHBondContact O-N 3.5Å; V246-R249 WeakPolarHBondContact O-CB 3.27Å; V246-R249 PolarHBondContact O-N 3.03Å; R249-M252 PolarHBondContact O-N 2.87Å; R249-N253 PolarHBondContact O-N 3.09Å; R249-N253 PolarHBondContact O-ND2 3.19Å
250	T	97	Very high	96.4	Very high	65 Å²	65	53.3 Å²	53.3	40%	0.399	28%	0.276	S	S	.	.	H	α-helix	trans	-61.6	-46.2	175.8	-60	0	0	0	0	111.4	V246 W247 L248 M252 N253 H254	V246-T250 PolarHBondContact O-N 3.24Å; V246-T250 PolarHBondContact O-OG1 3.39Å; W247-T250 WeakPolarHBondContact O-CB 3.45Å; W247-T250 PolarHBondContact O-N 2.77Å; L248-T250 VanDerWaalsContact C-N 3.3Å; L248-T250 PolarHBondContact O-N 3Å; T250-M252 PolarHBondContact O-N 3.02Å; T250-N253 PolarHBondContact O-N 3.46Å; T250-H254 VanDerWaalsContact CG2-CE1 3.49Å; T250-H254 WeakPolarHBondContact CG2-CE1 3.5Å; T250-H254 PolarHBondContact O-N 2.82Å; T250-H254 PolarHBondContact O-ND1 3.48Å
251	L	97.8	Very high	96.4	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-44.2	175.8	179.5	56.6	0	0	0	112.6	W247 L248 N253 H254 C255 P264 I269 E272 I273	W247-L251 PolarHBondContact O-N 3.41Å; L248-L251 HydrophobicContact CD1-CB 4.49Å; L248-L251 HydrophobicContact CD1-CD2 4.11Å; L248-L251 PolarHBondContact O-N 3.43Å; L251-N253 VanDerWaalsContact C-N 3.33Å; L251-N253 PolarHBondContact O-N 3.31Å; L251-H254 WeakPolarHBondContact O-CB 3.32Å; L251-H254 PolarHBondContact O-N 3.35Å; L251-C255 PolarHBondContact O-N 3.5Å; L251-C255 VanDerWaalsContact O-N 3.1Å; L251-C255 PolarHBondContact O-SG 3.45Å; L251-P264 HydrophobicContact CD1-CG 4.23Å; L251-I269 HydrophobicContact CD1-CG1 4.09Å; L251-I269 HydrophobicContact CD2-CG2 4.2Å; L251-E272 HydrophobicContact CD2-CB 4.13Å; L251-I273 HydrophobicContact CD2-CG1 3.93Å
252	M	98.3	Very high	96.6	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.3	-44.6	175.2	-174.1	-168.3	69.6	0	0	111.3	G206 L209 W210 A240 M244 L248 R249 T250 H254 C255 W256	G206-M252 WeakPolarHBondContact O-CG 3.36Å; L209-M252 HydrophobicContact CB-CG 4.21Å; L209-M252 HydrophobicContact CB-SD 4.46Å; L209-M252 HydrophobicContact CD1-CB 3.86Å; L209-M252 HydrophobicContact CD1-CG 4.17Å; W210-M252 HydrophobicContact CB-SD 4.1Å; A240-M252 HydrophobicContact CB-CE 3.54Å; M244-M252 HydrophobicContact CE-SD 3.8Å; M244-M252 HydrophobicContact SD-CB 4.44Å; M244-M252 HydrophobicContact SD-CE 4.33Å; M244-M252 HydrophobicContact SD-SD 3.94Å; L248-M252 WeakPolarHBondContact O-CB 3.32Å; L248-M252 PolarHBondContact O-N 3.09Å; R249-M252 PolarHBondContact O-N 2.87Å; T250-M252 PolarHBondContact O-N 3.02Å; M252-H254 PolarHBondContact O-N 3.05Å; M252-C255 VanDerWaalsContact O-CB 3.27Å; M252-C255 WeakPolarHBondContact O-CB 3.3Å; M252-C255 PolarHBondContact O-N 3.3Å; M252-C255 VanDerWaalsContact O-N 3.13Å; M252-W256 HydrophobicContact CE-CE3 4.42Å; M252-W256 HydrophobicContact CE-CH2 3.59Å; M252-W256 HydrophobicContact CE-CZ3 3.44Å; M252-W256 VanDerWaalsContact CE-CZ3 3.44Å; M252-W256 HydrophobicContact CG-CH2 3.74Å; M252-W256 HydrophobicContact CG-CZ2 4.02Å; M252-W256 HydrophobicContact CG-CZ3 4.03Å; M252-W256 HydrophobicContact SD-CH2 3.5Å; M252-W256 WeakPolarHBondContact SD-CH2 3.14Å; M252-W256 HydrophobicContact SD-CZ2 4.19Å; M252-W256 HydrophobicContact SD-CZ3 3.98Å
253	N	97.7	Very high	96.9	Very high	77 Å²	77	56 Å²	56	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-64.3	-38.2	176.7	-72.5	-19.3	0	0	0	112.4	R249 T250 L251 C255 W256	R249-N253 PolarHBondContact O-N 3.09Å; R249-N253 PolarHBondContact O-ND2 3.19Å; T250-N253 PolarHBondContact O-N 3.46Å; L251-N253 VanDerWaalsContact C-N 3.33Å; L251-N253 PolarHBondContact O-N 3.31Å; N253-C255 PolarHBondContact O-N 3.02Å; N253-W256 PolarHBondContact O-N 3.47Å
254	H	98	Very high	97.2	Very high	91 Å²	91	52.4 Å²	52.4	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-30.3	173.6	-66.6	151.5	0	0	0	112.8	T250 L251 M252 W256 H257 P264	T250-H254 VanDerWaalsContact CG2-CE1 3.49Å; T250-H254 WeakPolarHBondContact CG2-CE1 3.5Å; T250-H254 PolarHBondContact O-N 2.82Å; T250-H254 PolarHBondContact O-ND1 3.48Å; L251-H254 WeakPolarHBondContact O-CB 3.32Å; L251-H254 PolarHBondContact O-N 3.35Å; M252-H254 PolarHBondContact O-N 3.05Å; H254-W256 PolarHBondContact O-N 2.92Å; H254-H257 PolarHBondContact O-N 3.16Å; H254-P264 HydrophobicContact CB-CG 4.47Å; H254-P264 WeakPolarHBondContact O-CD 3.35Å
255	C	98.6	Very high	97.3	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-23	173.9	-62.4	0	0	0	0	112.7	V202 W203 L251 M252 N253 R263	V202-C255 HydrophobicContact CG1-CB 3.99Å; V202-C255 WeakPolarHBondContact O-CB 3.43Å; W203-C255 WeakPolarHBondContact CA-O 3.5Å; L251-C255 PolarHBondContact O-N 3.5Å; L251-C255 VanDerWaalsContact O-N 3.1Å; L251-C255 PolarHBondContact O-SG 3.45Å; M252-C255 VanDerWaalsContact O-CB 3.27Å; M252-C255 WeakPolarHBondContact O-CB 3.3Å; M252-C255 PolarHBondContact O-N 3.3Å; M252-C255 VanDerWaalsContact O-N 3.13Å; N253-C255 PolarHBondContact O-N 3.02Å; C255-R263 VanDerWaalsContact O-CD 3.27Å; C255-R263 WeakPolarHBondContact O-CD 3.5Å
256	W	98.4	Very high	97.5	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.015	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	22.7	-179.6	-57.5	-36.4	0	0	0	114.5	W203 G206 V207 W210 R237 L238 M252 N253 H254 D258	W203-W256 AromaticContact CD2-CD1 3.58Å; W203-W256 HydrophobicContact CD2-CG 4.38Å; W203-W256 AromaticContact CE2-CD1 3.83Å; W203-W256 HydrophobicContact CE3-CB 4.05Å; W203-W256 AromaticContact CE3-CD1 3.88Å; W203-W256 HydrophobicContact CE3-CG 4.34Å; W203-W256 AromaticContact CG-CD1 3.86Å; W203-W256 HydrophobicContact CH2-CB 4.23Å; W203-W256 HydrophobicContact CZ3-CB 3.87Å; W203-W256 HydrophobicContact CZ3-CG 4.45Å; W203-W256 WeakPolarHBondContact CZ3-O 3.43Å; W203-W256 PolarHBondContact O-NE1 2.99Å; G206-W256 VanDerWaalsContact O-CZ2 3.25Å; G206-W256 WeakPolarHBondContact O-CZ2 3.4Å; V207-W256 HydrophobicContact CG2-CZ2 4.03Å; W210-W256 HydrophobicContact CB-CH2 4.49Å; R237-W256 HydrophobicContact CB-CE3 3.9Å; R237-W256 HydrophobicContact CB-CZ3 4.21Å; R237-W256 HydrophobicContact CG-CB 4.48Å; R237-W256 HydrophobicContact CG-CE3 4.24Å; R237-W256 PolarHBondContact NE-O 2.96Å; R237-W256 VanDerWaalsContact NE-O 3.16Å; R237-W256 PolarHBondContact NH2-O 2.77Å; R237-W256 VanDerWaalsContact NH2-O 3.12Å; L238-W256 HydrophobicContact CB-CH2 3.77Å; L238-W256 HydrophobicContact CB-CZ3 4.12Å; L238-W256 HydrophobicContact CD1-CH2 4.1Å; L238-W256 HydrophobicContact CD1-CZ2 4.24Å; L238-W256 HydrophobicContact CG-CH2 4.37Å; M252-W256 HydrophobicContact CE-CE3 4.42Å; M252-W256 HydrophobicContact CE-CH2 3.59Å; M252-W256 HydrophobicContact CE-CZ3 3.44Å; M252-W256 VanDerWaalsContact CE-CZ3 3.44Å; M252-W256 HydrophobicContact CG-CH2 3.74Å; M252-W256 HydrophobicContact CG-CZ2 4.02Å; M252-W256 HydrophobicContact CG-CZ3 4.03Å; M252-W256 HydrophobicContact SD-CH2 3.5Å; M252-W256 WeakPolarHBondContact SD-CH2 3.14Å; M252-W256 HydrophobicContact SD-CZ2 4.19Å; M252-W256 HydrophobicContact SD-CZ3 3.98Å; N253-W256 PolarHBondContact O-N 3.47Å; H254-W256 PolarHBondContact O-N 2.92Å; W256-D258 PolarHBondContact O-N 3.25Å
257	H	97.9	Very high	97.6	Very high	73 Å²	73	49.4 Å²	49.4	34%	0.338	25%	0.252	S	S	.	.			trans	-58	137.3	171	-166.2	-64.8	0	0	0	110.4	H254 E259 N262 R263	H254-H257 PolarHBondContact O-N 3.16Å; H257-E259 PolarHBondContact ND1-N 2.98Å; H257-E259 PolarHBondContact ND1-O 2.93Å; H257-N262 HydrophobicContact CB-CB 4.32Å; H257-N262 PolarHBondContact CE1-ND2 2.64Å; H257-N262 WeakPolarHBondContact ND1-CB 3.45Å; H257-N262 PolarHBondContact NE2-ND2 2.94Å; H257-N262 VanDerWaalsContact NE2-ND2 3.19Å; H257-R263 HydrophobicContact CB-CG 4Å; H257-R263 PolarHBondContact O-NE 3.43Å; H257-R263 PolarHBondContact O-NH2 3.49Å
258	D	95.6	Very high	97.7	Very high	101 Å²	101	50.8 Å²	50.8	54%	0.54	26%	0.26	S	S	.	.	S	Bend	trans	-60.7	-52.1	-177.3	-70.2	-43.6	0	0	0	111.9	R237 W256 P260 R263	R237-D258 IonicContact CZ-OD1 3.1Å; R237-D258 IonicContact NH2-OD1 3.08Å; R237-D258 PolarHBondContact NH2-OD1 3.1Å; W256-D258 PolarHBondContact O-N 3.25Å; D258-P260 VanDerWaalsContact O-CD 3.25Å; D258-P260 WeakPolarHBondContact O-CD 3.36Å; D258-R263 PolarHBondContact O-NH2 3.01Å
259	E	96.7	Very high	97.7	Very high	100 Å²	100	50.8 Å²	50.8	47%	0.467	26%	0.26	S	S	.	.	S	Bend	trans	-69.5	114.1	171.9	-176.9	50.9	-122.2	0	0	110.9	H257 M261 N262	H257-E259 PolarHBondContact ND1-N 2.98Å; H257-E259 PolarHBondContact ND1-O 2.93Å; E259-M261 HydrophobicContact CG-CB 4.37Å; E259-M261 PolarHBondContact O-N 2.79Å; E259-N262 HydrophobicContact CB-CB 4.42Å; E259-N262 PolarHBondContact O-N 2.87Å
260	P	97.6	Very high	97.8	Very high	24 Å²	24	47.8 Å²	47.8	16%	0.156	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-58.5	-31.9	-175.8	-26.9	36.1	0	0	0	114	E189 K199 D258 N262 R263	E189-P260 HydrophobicContact CG-CG 3.86Å; K199-P260 HydrophobicContact CB-CB 3.94Å; K199-P260 WeakPolarHBondContact CD-O 3.24Å; K199-P260 HydrophobicContact CG-CB 4.49Å; D258-P260 VanDerWaalsContact O-CD 3.25Å; D258-P260 WeakPolarHBondContact O-CD 3.36Å; P260-N262 PolarHBondContact O-N 2.82Å; P260-R263 WeakPolarHBondContact O-CB 3.45Å; P260-R263 PolarHBondContact O-N 3.05Å
261	M	96.9	Very high	97.7	Very high	145 Å²	145	50.7 Å²	50.7	71%	0.714	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-68.2	-23.4	-179.9	-65	-57.6	-70.1	0	0	113.3	E259	E259-M261 HydrophobicContact CG-CB 4.37Å; E259-M261 PolarHBondContact O-N 2.79Å
262	N	98	Very high	97.6	Very high	100 Å²	100	54 Å²	54	54%	0.535	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-84.9	-10.1	177.5	-69.6	-5.5	0	0	0	113	H257 E259 P260	H257-N262 HydrophobicContact CB-CB 4.32Å; H257-N262 PolarHBondContact CE1-ND2 2.64Å; H257-N262 WeakPolarHBondContact ND1-CB 3.45Å; H257-N262 PolarHBondContact NE2-ND2 2.94Å; H257-N262 VanDerWaalsContact NE2-ND2 3.19Å; E259-N262 HydrophobicContact CB-CB 4.42Å; E259-N262 PolarHBondContact O-N 2.87Å; P260-N262 PolarHBondContact O-N 2.82Å
263	R	98.6	Very high	97.4	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.015	28%	0.282	C	S	.	.	S	Bend	trans	-68.7	143.6	171.9	-58.6	175.3	-167.9	154.1	10.3	109.4	E189 K199 V202 C255 H257 D258 P260	E189-R263 IonicContact OE1-CZ 2.94Å; E189-R263 IonicContact OE1-NH1 2.72Å; E189-R263 PolarHBondContact OE1-NH1 3.03Å; E189-R263 IonicContact OE1-NH2 2.64Å; E189-R263 PolarHBondContact OE1-NH2 3.49Å; E189-R263 IonicContact OE2-CZ 2.92Å; E189-R263 IonicContact OE2-NH1 2.72Å; E189-R263 IonicContact OE2-NH2 3.49Å; E189-R263 PolarHBondContact OE2-NH2 3.26Å; K199-R263 HydrophobicContact CD-CB 4.37Å; K199-R263 PolarHBondContact NZ-O 2.77Å; K199-R263 WeakPolarHBondContact O-CD 3.42Å; K199-R263 PolarHBondContact O-NH1 2.91Å; V202-R263 HydrophobicContact CG1-CB 3.87Å; C255-R263 VanDerWaalsContact O-CD 3.27Å; C255-R263 WeakPolarHBondContact O-CD 3.5Å; H257-R263 HydrophobicContact CB-CG 4Å; H257-R263 PolarHBondContact O-NE 3.43Å; H257-R263 PolarHBondContact O-NH2 3.49Å; D258-R263 PolarHBondContact O-NH2 3.01Å; P260-R263 WeakPolarHBondContact O-CB 3.45Å; P260-R263 PolarHBondContact O-N 3.05Å
264	P	98.5	Very high	96.9	Very high	10 Å²	10	56.7 Å²	56.7	7%	0.065	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-62.4	160.3	179.1	27.6	-34.9	0	0	0	111.8	K199 V202 L251 H254 K268 I269	K199-P264 PolarHBondContact NZ-O 2.88Å; K199-P264 VanDerWaalsContact NZ-O 3.11Å; V202-P264 HydrophobicContact CG1-CG 4.3Å; V202-P264 WeakPolarHBondContact CG2-O 3.5Å; L251-P264 HydrophobicContact CD1-CG 4.23Å; H254-P264 HydrophobicContact CB-CG 4.47Å; H254-P264 WeakPolarHBondContact O-CD 3.35Å; P264-K268 HydrophobicContact CB-CB 4.19Å; P264-K268 HydrophobicContact CB-CD 4Å; P264-K268 HydrophobicContact CB-CG 4.16Å; P264-I269 HydrophobicContact CB-CG1 3.93Å; P264-I269 HydrophobicContact CG-CD1 3.96Å; P264-I269 HydrophobicContact CG-CG1 3.66Å
265	S	98.5	Very high	96.3	Very high	39 Å²	39	55 Å²	55	27%	0.273	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-78.3	162.4	164.3	57.9	0	0	0	0	110	S267 K268 I269	S265-S267 PolarHBondContact O-N 3.29Å; S265-K268 PolarHBondContact O-N 2.94Å; S265-K268 VanDerWaalsContact O-N 3.11Å; S265-K268 WeakPolarHBondContact OG-CB 3.29Å; S265-K268 PolarHBondContact OG-N 2.99Å; S265-K268 VanDerWaalsContact OG-N 3.16Å; S265-I269 WeakPolarHBondContact O-CG1 3.35Å; S265-I269 PolarHBondContact O-N 3.16Å
266	F	98.6	Very high	95.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.1	-30.7	175.3	-77.8	-68.1	0	0	0	112.2	M132 M133 E136 I198 D201 V202 Y205 I269 S270	M132-F266 HydrophobicContact CB-CB 4.35Å; M132-F266 HydrophobicContact CB-CD1 3.34Å; M132-F266 HydrophobicContact CB-CD2 3.73Å; M132-F266 HydrophobicContact CB-CE1 3.32Å; M132-F266 HydrophobicContact CB-CE2 3.71Å; M132-F266 HydrophobicContact CB-CG 3.54Å; M132-F266 HydrophobicContact CB-CZ 3.5Å; M132-F266 VanDerWaalsContact CB-CZ 3.5Å; M132-F266 HydrophobicContact CE-CD2 4.44Å; M132-F266 HydrophobicContact CE-CE2 3.61Å; M132-F266 HydrophobicContact CE-CZ 3.71Å; M132-F266 HydrophobicContact CG-CD1 4.2Å; M132-F266 HydrophobicContact CG-CE1 3.69Å; M132-F266 HydrophobicContact CG-CE2 4.28Å; M132-F266 HydrophobicContact CG-CZ 3.72Å; M133-F266 HydrophobicContact CB-CB 3.87Å; E136-F266 HydrophobicContact CB-CD2 4.27Å; E136-F266 PolarHBondContact OE2-N 2.96Å; I198-F266 HydrophobicContact CD1-CD2 4.12Å; I198-F266 HydrophobicContact CD1-CE2 3.84Å; I198-F266 HydrophobicContact CG1-CD2 3.97Å; I198-F266 HydrophobicContact CG1-CE2 3.9Å; D201-F266 HydrophobicContact CB-CE2 4.05Å; D201-F266 HydrophobicContact CB-CZ 4.06Å; V202-F266 HydrophobicContact CB-CZ 4.38Å; V202-F266 HydrophobicContact CG2-CD2 3.99Å; V202-F266 HydrophobicContact CG2-CE1 4.29Å; V202-F266 HydrophobicContact CG2-CE2 3.61Å; V202-F266 HydrophobicContact CG2-CG 4.49Å; V202-F266 HydrophobicContact CG2-CZ 3.79Å; Y205-F266 HydrophobicContact CD1-CE1 4.45Å; Y205-F266 AromaticContact CD2-CE1 3.92Å; Y205-F266 HydrophobicContact CD2-CE1 3.92Å; Y205-F266 AromaticContact CG-CE1 3.76Å; Y205-F266 HydrophobicContact CG-CE1 3.76Å; F266-I269 HydrophobicContact CD1-CD1 3.82Å; F266-I269 HydrophobicContact CE1-CD1 4.12Å; F266-I269 PolarHBondContact O-N 2.92Å; F266-S270 WeakPolarHBondContact O-CB 3.43Å; F266-S270 PolarHBondContact O-N 3.03Å
267	S	97.3	Very high	93.5	Very high	50 Å²	50	62.6 Å²	62.6	35%	0.35	33%	0.326	S	S	.	.	H	α-helix	trans	-59.8	-44.5	169	178.6	0	0	0	0	112.7	S265 S270 N271	S265-S267 PolarHBondContact O-N 3.29Å; S267-S270 PolarHBondContact O-N 3.47Å; S267-N271 WeakPolarHBondContact O-CB 3.47Å; S267-N271 VanDerWaalsContact O-CG 3.27Å; S267-N271 PolarHBondContact O-N 2.63Å; S267-N271 VanDerWaalsContact O-N 3.11Å; S267-N271 PolarHBondContact O-ND2 3.45Å; S267-N271 VanDerWaalsContact O-ND2 3.14Å
268	K	97.6	Very high	91.5	Very high	105 Å²	105	65.3 Å²	65.3	46%	0.457	35%	0.347	S	S	.	.	H	α-helix	trans	-64.9	-44	175.9	-178.9	170.8	176.6	178	0	111.6	P264 S265 N271 E272	P264-K268 HydrophobicContact CB-CB 4.19Å; P264-K268 HydrophobicContact CB-CD 4Å; P264-K268 HydrophobicContact CB-CG 4.16Å; S265-K268 PolarHBondContact O-N 2.94Å; S265-K268 VanDerWaalsContact O-N 3.11Å; S265-K268 WeakPolarHBondContact OG-CB 3.29Å; S265-K268 PolarHBondContact OG-N 2.99Å; S265-K268 VanDerWaalsContact OG-N 3.16Å; K268-N271 PolarHBondContact O-N 2.75Å; K268-E272 WeakPolarHBondContact CE-OE1 3.39Å; K268-E272 WeakPolarHBondContact CG-OE1 3.45Å; K268-E272 IonicContact NZ-OE1 2.77Å; K268-E272 WeakPolarHBondContact O-CG 3.38Å; K268-E272 PolarHBondContact O-N 3.48Å
269	I	98.4	Very high	89.2	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-57.4	-51.8	176.3	-67.6	166.3	0	0	0	110.7	A129 V202 Y205 L251 P264 S265 F266 N271 E272 I273	A129-I269 HydrophobicContact CB-CG2 3.73Å; V202-I269 HydrophobicContact CG1-CD1 3.99Å; V202-I269 HydrophobicContact CG2-CD1 4.45Å; Y205-I269 HydrophobicContact CD1-CD1 4.02Å; Y205-I269 HydrophobicContact CD1-CG2 4.13Å; Y205-I269 HydrophobicContact CE1-CD1 4.32Å; Y205-I269 HydrophobicContact CE1-CG2 3.36Å; L251-I269 HydrophobicContact CD1-CG1 4.09Å; L251-I269 HydrophobicContact CD2-CG2 4.2Å; P264-I269 HydrophobicContact CB-CG1 3.93Å; P264-I269 HydrophobicContact CG-CD1 3.96Å; P264-I269 HydrophobicContact CG-CG1 3.66Å; S265-I269 WeakPolarHBondContact O-CG1 3.35Å; S265-I269 PolarHBondContact O-N 3.16Å; F266-I269 HydrophobicContact CD1-CD1 3.82Å; F266-I269 HydrophobicContact CE1-CD1 4.12Å; F266-I269 PolarHBondContact O-N 2.92Å; I269-N271 VanDerWaalsContact C-N 3.32Å; I269-N271 PolarHBondContact O-N 2.84Å; I269-E272 PolarHBondContact O-N 3.47Å; I269-I273 HydrophobicContact CG2-CD1 3.97Å; I269-I273 WeakPolarHBondContact O-CG1 3.41Å; I269-I273 PolarHBondContact O-N 3.2Å
270	S	97.3	Very high	86.7	Confident	15 Å²	15	67.3 Å²	67.3	11%	0.105	37%	0.368	C	S	.	.	H	α-helix	trans	-57.4	-44.7	-179.6	171.5	0	0	0	0	111.6	L126 N130 F266 S267 E272 I273	L126-S270 WeakPolarHBondContact CD1-O 3.32Å; N130-S270 WeakPolarHBondContact OD1-CB 3.33Å; N130-S270 PolarHBondContact OD1-OG 2.88Å; F266-S270 WeakPolarHBondContact O-CB 3.43Å; F266-S270 PolarHBondContact O-N 3.03Å; S267-S270 PolarHBondContact O-N 3.47Å; S270-E272 PolarHBondContact O-N 3.06Å; S270-I273 PolarHBondContact O-N 3.02Å
271	N	95.7	Very high	83.9	Confident	126 Å²	126	73.2 Å²	73.2	67%	0.674	39%	0.391	S	S	*	.	H	α-helix	trans	-69	-28.4	179.2	-70.4	-28.9	0	0	0	114.1	S267 K268 I269	S267-N271 WeakPolarHBondContact O-CB 3.47Å; S267-N271 VanDerWaalsContact O-CG 3.27Å; S267-N271 PolarHBondContact O-N 2.63Å; S267-N271 VanDerWaalsContact O-N 3.11Å; S267-N271 PolarHBondContact O-ND2 3.45Å; S267-N271 VanDerWaalsContact O-ND2 3.14Å; K268-N271 PolarHBondContact O-N 2.75Å; I269-N271 VanDerWaalsContact C-N 3.32Å; I269-N271 PolarHBondContact O-N 2.84Å
272	E	94.9	Very high	81	Confident	70 Å²	70	72 Å²	72	33%	0.327	39%	0.392	S	S	.	.	H	α-helix	trans	-83	-18.8	179.6	-77.3	-175.1	-159.2	0	0	113.5	L251 K268 I269 S270 Q274	L251-E272 HydrophobicContact CD2-CB 4.13Å; K268-E272 WeakPolarHBondContact CE-OE1 3.39Å; K268-E272 WeakPolarHBondContact CG-OE1 3.45Å; K268-E272 IonicContact NZ-OE1 2.77Å; K268-E272 WeakPolarHBondContact O-CG 3.38Å; K268-E272 PolarHBondContact O-N 3.48Å; I269-E272 PolarHBondContact O-N 3.47Å; S270-E272 PolarHBondContact O-N 3.06Å; E272-Q274 PolarHBondContact O-N 3.44Å; E272-Q274 VanDerWaalsContact O-N 3.14Å
273	I	94.1	Very high	78.4	Confident	12 Å²	12	71.9 Å²	71.9	6%	0.062	40%	0.397	C	S	.	.			trans	-73.2	109.3	178.7	-68.9	166.4	0	0	0	110	L126 A129 Y205 W247 L248 L251 I269 S270	L126-I273 HydrophobicContact CB-CG2 3.82Å; L126-I273 HydrophobicContact CD1-CB 4.14Å; L126-I273 HydrophobicContact CD1-CG2 4.28Å; A129-I273 HydrophobicContact CB-CD1 4.04Å; Y205-I273 WeakPolarHBondContact OH-CD1 3.4Å; W247-I273 HydrophobicContact CH2-CB 4.46Å; W247-I273 HydrophobicContact CH2-CG2 4.17Å; W247-I273 HydrophobicContact CZ3-CB 4.45Å; W247-I273 HydrophobicContact CZ3-CG1 4.32Å; L248-I273 HydrophobicContact CD1-CG1 4.36Å; L251-I273 HydrophobicContact CD2-CG1 3.93Å; I269-I273 HydrophobicContact CG2-CD1 3.97Å; I269-I273 WeakPolarHBondContact O-CG1 3.41Å; I269-I273 PolarHBondContact O-N 3.2Å; S270-I273 PolarHBondContact O-N 3.02Å
274	Q	87.1	Confident	75.4	Confident	122 Å²	122	79.3 Å²	79.3	57%	0.57	44%	0.437	S	S	*	.			trans	-89.9	126.8	177.8	-62.7	175.9	9.3	0	0	109.9	W247 E272 P276	W247-Q274 HydrophobicContact CH2-CB 4.4Å; W247-Q274 HydrophobicContact CZ2-CB 4.14Å; W247-Q274 WeakPolarHBondContact CZ2-O 3.22Å; E272-Q274 PolarHBondContact O-N 3.44Å; E272-Q274 VanDerWaalsContact O-N 3.14Å; Q274-P276 WeakPolarHBondContact O-CD 3.48Å
275	I	85.5	Confident	72.4	Confident	54 Å²	54	85.9 Å²	85.9	28%	0.277	47%	0.471	S	S	.	.			trans	-108.4	100.3	169.3	-58.5	-169.9	0	0	0	106.8	M119 Q123 L126 N277	M119-I275 HydrophobicContact CE-CB 4.47Å; M119-I275 HydrophobicContact CE-CG2 3.38Å; Q123-I275 HydrophobicContact CB-CD1 4.27Å; L126-I275 HydrophobicContact CB-CD1 4.13Å; L126-I275 HydrophobicContact CD2-CD1 3.44Å; L126-I275 VanDerWaalsContact CD2-CD1 3.44Å; L126-I275 HydrophobicContact CD2-CG1 4.16Å; L126-I275 HydrophobicContact CG-CD1 4.43Å; I275-N277 PolarHBondContact O-N 2.68Å
276	P	74.9	Confident	69.1	Low	36 Å²	36	91.6 Å²	91.6	23%	0.234	50%	0.498	C	S	.	.			trans	-55.2	129.5	176.1	-26.4	34.9	0	0	0	110.5	M119 Q274 V278 F281	M119-P276 HydrophobicContact CE-CB 4.41Å; M119-P276 WeakPolarHBondContact CE-O 3.42Å; M119-P276 HydrophobicContact SD-CB 4.23Å; M119-P276 HydrophobicContact SD-CG 4.22Å; Q274-P276 WeakPolarHBondContact O-CD 3.48Å; P276-V278 PolarHBondContact O-N 3.23Å; P276-F281 HydrophobicContact CB-CD2 3.96Å; P276-F281 HydrophobicContact CB-CE2 3.64Å; P276-F281 HydrophobicContact CG-CE2 3.8Å
277	N	63.6	Low	66.2	Low	128 Å²	128	103 Å²	103	68%	0.684	54%	0.541	S	S	*	.			trans	-59.1	138.6	171.2	-81	-32.8	0	0	0	108.6	I275 N279 S280	I275-N277 PolarHBondContact O-N 2.68Å; N277-N279 PolarHBondContact O-N 3.47Å; N277-S280 PolarHBondContact O-N 3.26Å; N277-S280 PolarHBondContact O-OG 2.93Å
278	V	56.2	Low	63.1	Low	130 Å²	130	105.9 Å²	105.9	79%	0.788	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-54.8	-21.2	-179.2	-176.9	0	0	0	0	112	P276	P276-V278 PolarHBondContact O-N 3.23Å
279	N	46.4	Very low	60.3	Low	165 Å²	165	109.2 Å²	109.2	88%	0.882	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-82.2	-3.9	177.7	-61.5	-15.5	0	0	0	115.2	N277	N277-N279 PolarHBondContact O-N 3.47Å
280	S	46.1	Very low	57.4	Low	79 Å²	79	115.8 Å²	115.8	55%	0.552	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-106.6	4.7	-176.7	64.6	0	0	0	0	115.2	N277	N277-S280 PolarHBondContact O-N 3.26Å; N277-S280 PolarHBondContact O-OG 2.93Å
281	F	37.9	Very low	54.4	Low	147 Å²	147	122.1 Å²	122.1	65%	0.645	65%	0.65	S	S	*	*			trans	-100.9	92.9	174.4	-99.1	-90.9	0	0	0	111.5	P276	P276-F281 HydrophobicContact CB-CD2 3.96Å; P276-F281 HydrophobicContact CB-CE2 3.64Å; P276-F281 HydrophobicContact CG-CE2 3.8Å
282	T	36.5	Very low	51.6	Low	119 Å²	119	120.5 Å²	120.5	73%	0.73	65%	0.654	S	S	*	*			trans	-95.3	112.4	150.3	51.1	0	0	0	0	107.4	N284	T282-N284 PolarHBondContact O-N 3.43Å; T282-N284 VanDerWaalsContact O-N 3.09Å
283	P	41.9	Very low	48.8	Very low	99 Å²	99	125.7 Å²	125.7	64%	0.643	68%	0.678	S	S	*	*			trans	-66	113.7	171.6	-6.4	20.9	0	0	0	107.7	L285	P283-L285 HydrophobicContact CB-CD1 3.95Å; P283-L285 PolarHBondContact O-N 3.4Å
284	N	35.9	Very low	45.9	Very low	159 Å²	159	131.4 Å²	131.4	85%	0.85	71%	0.709	S	S	*	*			trans	-70.4	76.2	163.6	-93.7	-30.1	0	0	0	108.6	T282 N286	T282-N284 PolarHBondContact O-N 3.43Å; T282-N284 VanDerWaalsContact O-N 3.09Å; N284-N286 PolarHBondContact O-N 2.91Å
285	L	36.1	Very low	43.4	Very low	149 Å²	149	134.8 Å²	134.8	78%	0.78	72%	0.721	S	S	*	*			trans	-91.2	80.3	158.3	-96.7	91	0	0	0	107.4	P283	P283-L285 HydrophobicContact CB-CD1 3.95Å; P283-L285 PolarHBondContact O-N 3.4Å
286	N	29.8	Very low	40.8	Very low	159 Å²	159	142 Å²	142	85%	0.85	75%	0.751	S	S	*	*			trans	-168	77	160.7	-92	-25.2	0	0	0	109	N284	N284-N286 PolarHBondContact O-N 2.91Å
287	R	36.9	Very low	39	Very low	239 Å²	239	146 Å²	146	90%	0.902	78%	0.78	S	S	*	*	S	Bend	trans	-153.2	125	154	-106	174.7	-170.9	-172.5	1.4	108.6
288	S	33.3	Very low	37.6	Very low	111 Å²	111	144.7 Å²	144.7	78%	0.776	79%	0.786	S	S	*	*			trans	69.1	82.4	164.6	37.7	0	0	0	0	118.3
289	I	37.3	Very low	36.5	Very low	175 Å²	175	145.6 Å²	145.6	90%	0.897	79%	0.785	S	S	*	*			trans	-130.7	95.6	135.9	-58.5	-179.4	0	0	0	106.9
290	D	38.1	Very low	35.7	Very low	138 Å²	138	144.4 Å²	144.4	74%	0.738	78%	0.779	S	S	*	*			trans	-79.2	135.1	163.5	-89.2	-39.2	0	0	0	109.6
291	N	35.3	Very low	34.9	Very low	147 Å²	147	148 Å²	148	79%	0.786	79%	0.792	S	S	*	*			trans	62.4	96.6	147.2	-61.8	-36	0	0	0	120.5
292	A	35.9	Very low	34.5	Very low	92 Å²	92	148.8 Å²	148.8	76%	0.76	80%	0.802	S	S	*	*				168.6	101.4	119.7	0	0	0	0	0	109.2
293	Q	35.3	Very low	34	Very low	179 Å²	179	148.1 Å²	148.1	84%	0.836	80%	0.802	S	S	*	*				40.4	113.7	104.8	-74.9	-174.3	-0.8	0	0	113
294	L	33.5	Very low	33.4	Very low	133 Å²	133	149.4 Å²	149.4	70%	0.696	81%	0.808	S	S	*	*				-171.6	146	55	-95.3	121.2	0	0	0	112
295	K	34.4	Very low	33.1	Very low	192 Å²	192	147.6 Å²	147.6	84%	0.835	80%	0.803	S	S	*	*			trans	85	110.7	142	-76.5	175.1	178.5	-177.3	0	121.9
296	K	32.1	Very low	32.7	Very low	206 Å²	206	145.6 Å²	145.6	90%	0.896	80%	0.799	S	S	*	*			trans	-60.4	135.4	162.7	-72.4	170.3	167.6	177.8	0	114
297	S	36.6	Very low	32.5	Very low	121 Å²	121	146.4 Å²	146.4	85%	0.846	80%	0.802	S	S	*	*			trans	161.2	124	139.1	57.1	0	0	0	0	105.8
298	A	34.1	Very low	31.9	Very low	99 Å²	99	141.6 Å²	141.6	82%	0.818	79%	0.79	S	S	*	*			cis	-150.4	165.4	30	0	0	0	0	0	110.5
299	I	34	Very low	31.5	Very low	150 Å²	150	143.8 Å²	143.8	77%	0.769	79%	0.792	S	S	*	*			trans	-77.8	151.1	-176.9	-70.5	157.6	0	0	0	109.7
300	D	28.7	Very low	30.8	Very low	140 Å²	140	139.7 Å²	139.7	75%	0.749	78%	0.779	S	S	*	*	S	Bend	trans	82	118.5	170.3	-58.6	-25.3	0	0	0	119
301	N	29.4	Very low	30.2	Very low	153 Å²	153	138 Å²	138	82%	0.818	77%	0.773	S	S	*	*			trans	105.2	75.7	170.5	-56.8	-35.3	0	0	0	116.5
302	L	28.5	Very low	29.7	Very low	165 Å²	165	133.8 Å²	133.8	86%	0.864	76%	0.756	S	S	*	*			trans	-131.7	88.4	150.3	-95.8	103.4	0	0	0	110.8	T304	L302-T304 PolarHBondContact O-N 3.31Å
303	S	27.3	Very low	29.4	Very low	105 Å²	105	134.8 Å²	134.8	73%	0.734	75%	0.752	S	S	*	*			trans	-55.6	108	146.6	53.5	0	0	0	0	108.4	T305	S303-T305 VanDerWaalsContact C-N 3.33Å; S303-T305 PolarHBondContact O-N 3.02Å
304	T	29.5	Very low	29.2	Very low	126 Å²	126	134.3 Å²	134.3	77%	0.773	75%	0.747	S	S	*	*			trans	-73.2	90.4	168.4	50.3	0	0	0	0	108.4	L302 P306	L302-T304 PolarHBondContact O-N 3.31Å; T304-P306 WeakPolarHBondContact O-CD 3.43Å
305	T	28.9	Very low	29.2	Very low	121 Å²	121	132.8 Å²	132.8	74%	0.742	74%	0.74	S	S	*	*			trans	-69.4	119.2	166.6	28.2	0	0	0	0	109	S303	S303-T305 VanDerWaalsContact C-N 3.33Å; S303-T305 PolarHBondContact O-N 3.02Å
306	P	28.4	Very low	28.9	Very low	106 Å²	106	134.3 Å²	134.3	69%	0.688	74%	0.74	S	S	*	*			trans	-70.3	132.5	167.1	-7	23.9	0	0	0	108.1	T304 H308	T304-P306 WeakPolarHBondContact O-CD 3.43Å; P306-H308 PolarHBondContact O-N 2.92Å
307	L	25.2	Very low	29.2	Very low	176 Å²	176	127.3 Å²	127.3	92%	0.921	71%	0.708	S	S	*	*			trans	-50.6	104.6	170.4	-83	152.4	0	0	0	109.7
308	H	24.8	Very low	28.9	Very low	138 Å²	138	125.8 Å²	125.8	64%	0.639	69%	0.694	S	S	*	*			trans	-93.2	103.2	-176.5	-140.5	-81.9	0	0	0	108.3	P306	P306-H308 PolarHBondContact O-N 2.92Å
309	L	23.2	Very low	29.2	Very low	158 Å²	158	123.6 Å²	123.6	83%	0.827	66%	0.664	S	S	*	*			trans	-106.6	101.4	169.8	-95.4	148.7	0	0	0	108.5
310	S	24.1	Very low	29.2	Very low	89 Å²	89	123.4 Å²	123.4	62%	0.622	66%	0.66	S	S	*	*			trans	-87.3	117.4	176.1	56.5	0	0	0	0	110.4
311	V	25.9	Very low	29.4	Very low	101 Å²	101	125.8 Å²	125.8	61%	0.612	67%	0.673	S	S	*	*			trans	-109.5	132.8	167.8	-179.1	0	0	0	0	109.7	V313	V311-V313 PolarHBondContact O-N 3.43Å
312	S	24.7	Very low	29.4	Very low	60 Å²	60	124.5 Å²	124.5	42%	0.42	67%	0.666	S	S	.	*			trans	-80	115.7	-178.2	-174.5	0	0	0	0	110.6	K113 K314	K113-S312 PolarHBondContact NZ-OG 3.48Å; S312-K314 PolarHBondContact O-N 3.16Å; S312-K314 PolarHBondContact OG-N 2.97Å
313	V	28.8	Very low	29.5	Very low	113 Å²	113	122.3 Å²	122.3	69%	0.685	66%	0.655	S	S	*	*			trans	-70.2	74.4	151.5	-172.9	0	0	0	0	107.2	V311	V311-V313 PolarHBondContact O-N 3.43Å
314	K	31.2	Very low	29.6	Very low	168 Å²	168	123.3 Å²	123.3	73%	0.73	65%	0.651	S	S	*	*			trans	-105.2	115.7	151.3	-90.1	-173.4	177.5	-178.1	0	104.6	S312 R316	S312-K314 PolarHBondContact O-N 3.16Å; S312-K314 PolarHBondContact OG-N 2.97Å; K314-R316 PolarHBondContact O-N 3.37Å
315	D	32.6	Very low	29.6	Very low	102 Å²	102	123.1 Å²	123.1	55%	0.545	64%	0.644	S	S	.	*			trans	-39	99.5	166	-159.3	-5.5	0	0	0	111.3
316	R	29.1	Very low	29.7	Very low	223 Å²	223	123.3 Å²	123.3	84%	0.842	64%	0.638	S	S	*	*			trans	-140.6	24.5	164.7	-76.1	-163.8	-178.8	-172.8	0.8	110	K314 T318	K314-R316 PolarHBondContact O-N 3.37Å; R316-T318 PolarHBondContact O-N 2.94Å
317	R	37.8	Very low	29.7	Very low	59 Å²	59	124.4 Å²	124.4	22%	0.223	63%	0.634	C	S	.	*			trans	-93.5	57.6	171.7	-64.1	-174.1	-69.7	173.9	4.1	107.4	E211 G216 D217 V218 R319	E211-R317 IonicContact OE1-CZ 3.41Å; E211-R317 IonicContact OE1-NH1 2.64Å; E211-R317 PolarHBondContact OE1-NH1 3.38Å; E211-R317 IonicContact OE1-NH2 3.82Å; G216-R317 PolarHBondContact O-NH1 3.48Å; D217-R317 PolarHBondContact O-NH1 3.26Å; V218-R317 HydrophobicContact CG2-CG 3.87Å; R317-R319 PolarHBondContact O-N 3.32Å
318	T	31.2	Very low	30.1	Very low	89 Å²	89	120.7 Å²	120.7	55%	0.546	61%	0.614	S	S	.	*			trans	-55.2	128.1	159.3	34.5	0	0	0	0	106.3	R316 E320	R316-T318 PolarHBondContact O-N 2.94Å; T318-E320 PolarHBondContact O-N 3.2Å; T318-E320 PolarHBondContact OG1-OE1 3.37Å
319	R	40.3	Very low	30.5	Very low	53 Å²	53	119.4 Å²	119.4	20%	0.2	61%	0.612	C	S	.	*			trans	-66.9	73.7	162.9	-63.3	177.6	-174.4	164	5	105.9	D144 Q180 P182 R317	D144-R319 IonicContact OD1-NH2 2.69Å; D144-R319 PolarHBondContact OD1-NH2 3.19Å; D144-R319 IonicContact OD2-CZ 3.47Å; D144-R319 IonicContact OD2-NH2 3.55Å; D144-R319 PolarHBondContact OD2-NH2 3.04Å; Q180-R319 PolarHBondContact O-NH1 2.87Å; Q180-R319 VanDerWaalsContact O-NH1 3.15Å; P182-R319 VanDerWaalsContact CB-CZ 3.49Å; R317-R319 PolarHBondContact O-N 3.32Å
320	E	33.4	Very low	31.1	Very low	146 Å²	146	116.2 Å²	116.2	68%	0.682	59%	0.594	S	S	*	*			trans	-68	140.8	168.4	-76	170.8	-164.9	0	0	107.5	N225 T318	N225-E320 PolarHBondContact ND2-O 3.01Å; T318-E320 PolarHBondContact O-N 3.2Å; T318-E320 PolarHBondContact OG1-OE1 3.37Å
321	D	33.9	Very low	31.7	Very low	191 Å²	191	118.6 Å²	118.6	100%	1.021	59%	0.591	S	S	*	*			trans	-44.9	0	-166	-63.4	-51.3	0	0	0	115.1	N225	N225-D321 WeakPolarHBondContact CB-OXT 3.23Å; N225-D321 PolarHBondContact ND2-OXT 3.44Å

Retrieved 321 of 321 residues in 180.9 ms (Link to these results)

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