A0A087XS71_POEFO Loading...

Muscleblind-like splicing regulator 3

AlphaFold DB , UniProt , Accession A0A087XS71, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 343 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41	Very low	50.8	Low	238 Å²	238	125.8 Å²	125.8	100%	1.172	70%	0.702	S	S	*	*				0	123.2	0	-63.8	169.1	-176.2	0	0	107.2	V3	M1-V3 PolarHBondContact O-N 2.99Å
2	A	35.1	Very low	53.9	Low	98 Å²	98	129 Å²	129	81%	0.81	70%	0.703	S	S	*	*			trans	-78.4	117.6	-177	0	0	0	0	0	110.5	S4	A2-S4 PolarHBondContact O-N 3.38Å; A2-S4 VanDerWaalsContact O-N 3.13Å
3	V	40.6	Very low	56.6	Low	117 Å²	117	123.1 Å²	123.1	71%	0.709	66%	0.664	S	S	*	*			trans	-81.7	89.9	173.3	-175.2	0	0	0	0	107.9	M1 M5	M1-V3 PolarHBondContact O-N 2.99Å; V3-M5 VanDerWaalsContact C-N 3.28Å; V3-M5 HydrophobicContact CG1-CE 4.13Å; V3-M5 HydrophobicContact CG1-CG 3.96Å; V3-M5 PolarHBondContact O-N 3.17Å
4	S	37	Very low	59.1	Low	102 Å²	102	115.4 Å²	115.4	71%	0.713	62%	0.622	S	S	*	*			trans	-65	88.9	171.3	-66.4	0	0	0	0	109.8	A2 T6	A2-S4 PolarHBondContact O-N 3.38Å; A2-S4 VanDerWaalsContact O-N 3.13Å; S4-T6 PolarHBondContact O-N 3.43Å
5	M	40.9	Very low	61.3	Low	125 Å²	125	110.9 Å²	110.9	62%	0.616	60%	0.601	S	S	*	*			trans	-71.8	79	172.6	-62.9	-167.3	-170.4	0	0	109.1	V3 M7 L97	V3-M5 VanDerWaalsContact C-N 3.28Å; V3-M5 HydrophobicContact CG1-CE 4.13Å; V3-M5 HydrophobicContact CG1-CG 3.96Å; V3-M5 PolarHBondContact O-N 3.17Å; M5-M7 PolarHBondContact O-N 3.24Å; M5-M7 VanDerWaalsContact O-N 3.17Å; M5-L97 HydrophobicContact CE-CD2 4.18Å
6	T	40.3	Very low	63.3	Low	111 Å²	111	104.5 Å²	104.5	68%	0.681	57%	0.566	S	S	*	*			trans	-56	120.8	173	48.5	0	0	0	0	109	S4 G8	S4-T6 PolarHBondContact O-N 3.43Å; T6-G8 PolarHBondContact O-N 3.01Å
7	M	48.2	Very low	65	Low	187 Å²	187	103.6 Å²	103.6	92%	0.921	56%	0.557	S	S	*	*	S	Bend	trans	-68.9	26.5	170.1	-65.9	-72.8	112.9	0	0	112.6	M5	M5-M7 PolarHBondContact O-N 3.24Å; M5-M7 VanDerWaalsContact O-N 3.17Å
8	G	53.7	Low	66.7	Low	45 Å²	45	98.2 Å²	98.2	46%	0.464	53%	0.528	S	S	.	.	S	Bend	trans	-93.8	140.2	170.5	0	0	0	0	0	109.5	T6 D10	T6-G8 PolarHBondContact O-N 3.01Å; G8-D10 PolarHBondContact O-N 2.99Å
9	R	68.2	Low	68.1	Low	224 Å²	224	93.1 Å²	93.1	85%	0.845	50%	0.501	S	S	*	.			trans	-52.2	125.2	177.1	-74.1	160.3	-101.1	-172	-7.8	110.4	T11	R9-T11 PolarHBondContact O-N 3.23Å
10	D	71.4	Confident	69.3	Low	63 Å²	63	97.7 Å²	97.7	34%	0.337	51%	0.511	S	S	.	.			trans	-55.4	100.4	177.7	-75.5	-77.8	0	0	0	111.7	G8 K12 W13 Q90	G8-D10 PolarHBondContact O-N 2.99Å; D10-K12 VanDerWaalsContact C-N 3.3Å; D10-W13 PolarHBondContact O-NE1 2.74Å; D10-Q90 PolarHBondContact OD2-NE2 3.3Å
11	T	82.8	Confident	70.5	Confident	74 Å²	74	97.3 Å²	97.3	45%	0.454	51%	0.507	S	S	.	.			trans	-79.9	-12.1	178.4	50.9	0	0	0	0	113	R9 W13 L14 T15	R9-T11 PolarHBondContact O-N 3.23Å; T11-W13 PolarHBondContact O-N 2.94Å; T11-L14 WeakPolarHBondContact O-CA 3.31Å; T11-L14 WeakPolarHBondContact O-CB 3.42Å; T11-L14 PolarHBondContact O-N 3.22Å; T11-T15 PolarHBondContact O-N 2.69Å
12	K	87.7	Confident	73	Confident	164 Å²	164	90.4 Å²	90.4	71%	0.713	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-58.2	-46.1	-176.1	-72.3	179.9	177.2	174.4	0	112.8	D10 L14 T15	D10-K12 VanDerWaalsContact C-N 3.3Å; K12-L14 PolarHBondContact O-N 3.03Å; K12-T15 PolarHBondContact O-N 3.08Å; K12-T15 VanDerWaalsContact O-N 3.15Å; K12-T15 PolarHBondContact O-OG1 2.75Å
13	W	88.5	Confident	75.6	Confident	52 Å²	52	91.3 Å²	91.3	20%	0.197	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-71.3	-15.7	178.6	72.4	-93.7	0	0	0	113.4	D10 T11 T15 F54 L57 L79 N82 G83 N86	D10-W13 PolarHBondContact O-NE1 2.74Å; T11-W13 PolarHBondContact O-N 2.94Å; W13-T15 VanDerWaalsContact C-N 3.32Å; W13-F54 AromaticContact CH2-CD2 3.88Å; W13-F54 HydrophobicContact CH2-CD2 3.88Å; W13-F54 AromaticContact CH2-CE2 3.95Å; W13-F54 HydrophobicContact CH2-CE2 3.95Å; W13-F54 AromaticContact CZ2-CD2 3.92Å; W13-F54 HydrophobicContact CZ2-CD2 3.92Å; W13-F54 AromaticContact CZ2-CE2 3.81Å; W13-F54 HydrophobicContact CZ2-CE2 3.81Å; W13-L57 HydrophobicContact CH2-CD1 4.4Å; W13-L57 HydrophobicContact CZ3-CD1 4.13Å; W13-L79 WeakPolarHBondContact CZ3-O 3.11Å; W13-L79 WeakPolarHBondContact O-CD2 3.41Å; W13-N82 HydrophobicContact CB-CB 4.45Å; W13-G83 VanDerWaalsContact CD2-CA 3.46Å; W13-N86 HydrophobicContact CB-CB 3.93Å; W13-N86 HydrophobicContact CG-CB 4.26Å
14	L	91.9	Very high	78.1	Confident	15 Å²	15	94 Å²	94	8%	0.079	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-84.9	0	173.1	-70.2	167.9	0	0	0	113.3	T11 K12 I51 A52 F54 L57	T11-L14 WeakPolarHBondContact O-CA 3.31Å; T11-L14 WeakPolarHBondContact O-CB 3.42Å; T11-L14 PolarHBondContact O-N 3.22Å; K12-L14 PolarHBondContact O-N 3.03Å; L14-I51 HydrophobicContact CB-CG2 4.27Å; L14-A52 PolarHBondContact O-N 3.31Å; L14-F54 HydrophobicContact CD1-CB 4.15Å; L14-F54 HydrophobicContact CD1-CD2 4.24Å; L14-F54 HydrophobicContact CD2-CB 4.45Å; L14-F54 HydrophobicContact CD2-CD2 4.3Å; L14-L57 HydrophobicContact CD2-CD1 3.45Å; L14-L57 VanDerWaalsContact CD2-CD1 3.45Å
15	T	91.8	Very high	80.6	Confident	49 Å²	49	92.5 Å²	92.5	30%	0.301	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	136.7	176.8	64.5	0	0	0	0	112.1	T11 K12 W13 V50 I51	T11-T15 PolarHBondContact O-N 2.69Å; K12-T15 PolarHBondContact O-N 3.08Å; K12-T15 VanDerWaalsContact O-N 3.15Å; K12-T15 PolarHBondContact O-OG1 2.75Å; W13-T15 VanDerWaalsContact C-N 3.32Å; T15-V50 WeakPolarHBondContact CA-O 3.49Å; T15-I51 HydrophobicContact CG2-CG1 4.21Å
16	L	93.1	Very high	83.1	Confident	8 Å²	8	91 Å²	91	4%	0.042	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.7	168.7	-73.6	175.5	0	0	0	110	A37 R49 V50 L69 P71 L75 L79	L16-A37 HydrophobicContact CB-CB 4.19Å; L16-A37 HydrophobicContact CD1-CB 4.38Å; L16-R49 CarbonylContact O-C 3.48Å; L16-R49 WeakPolarHBondContact O-CA 3.44Å; L16-R49 WeakPolarHBondContact O-CB 3.22Å; L16-V50 HydrophobicContact CB-CG1 4.32Å; L16-V50 PolarHBondContact N-O 3.4Å; L16-V50 PolarHBondContact O-N 3.44Å; L16-L69 HydrophobicContact CD1-CD2 4.11Å; L16-P71 HydrophobicContact CD1-CB 4.09Å; L16-L75 HydrophobicContact CD1-CB 3.94Å; L16-L75 HydrophobicContact CD1-CD1 4.24Å; L16-L75 HydrophobicContact CD1-CG 4.49Å; L16-L75 HydrophobicContact CD2-CD2 4.3Å; L16-L79 HydrophobicContact CD1-CD1 3.7Å; L16-L79 HydrophobicContact CD1-CG 4.29Å; L16-L79 HydrophobicContact CD2-CD1 4.21Å; L16-L79 HydrophobicContact CD2-CD2 3.92Å; L16-L79 HydrophobicContact CD2-CG 3.87Å; L16-L79 HydrophobicContact CG-CD1 3.88Å; L16-L79 HydrophobicContact CG-CD2 4Å; L16-L79 HydrophobicContact CG-CG 4.05Å
17	E	93.7	Very high	85.6	Confident	89 Å²	89	86.9 Å²	86.9	42%	0.416	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	135.8	168.6	-69.1	-167.5	150.5	0	0	110.9	F36 A37 R49	E17-F36 HydrophobicContact CB-CD1 3.93Å; E17-F36 HydrophobicContact CB-CE1 4.32Å; E17-A37 PolarHBondContact O-N 3.1Å; E17-R49 HydrophobicContact CG-CG 4.49Å; E17-R49 VanDerWaalsContact CG-NH1 3.29Å; E17-R49 IonicContact OE1-CZ 2.64Å; E17-R49 IonicContact OE1-NH1 3.98Å; E17-R49 PolarHBondContact OE1-NH1 3.3Å; E17-R49 IonicContact OE1-NH2 3.45Å
18	V	94.3	Very high	87.7	Confident	6 Å²	6	83.9 Å²	83.9	4%	0.036	43%	0.425	C	S	.	.	B	Isolated β-bridge	trans	-80.6	142	177.6	173.3	0	0	0	0	109.9	R20 Q23 A37 P39 V45 G48 V50	V18-R20 PolarHBondContact O-N 3.19Å; V18-R20 VanDerWaalsContact O-N 3.11Å; V18-Q23 HydrophobicContact CG1-CB 4.43Å; V18-A37 WeakPolarHBondContact CA-O 3.42Å; V18-P39 HydrophobicContact CB-CG 4.43Å; V18-P39 HydrophobicContact CG1-CG 3.73Å; V18-P39 HydrophobicContact CG2-CG 3.81Å; V18-V45 HydrophobicContact CG2-CG1 3.96Å; V18-V45 HydrophobicContact CG2-CG2 4.25Å; V18-G48 WeakPolarHBondContact CB-O 3.45Å; V18-G48 PolarHBondContact N-O 3.02Å; V18-V50 HydrophobicContact CG2-CB 3.94Å; V18-V50 HydrophobicContact CG2-CG1 3.79Å
19	C	94.4	Very high	89.5	Confident	2 Å²	2	88.8 Å²	88.8	1%	0.014	43%	0.429	C	S	.	.			trans	-63.5	114.7	177.2	-178.1	0	0	0	0	111	E21 Y22 Q23 C34 F36 A37 H38	C19-E21 PolarHBondContact O-N 3.23Å; C19-Y22 PolarHBondContact O-N 3.45Å; C19-Y22 VanDerWaalsContact O-N 3.13Å; C19-Q23 WeakPolarHBondContact O-CB 2.96Å; C19-Q23 PolarHBondContact O-N 3.39Å; C19-C34 VanDerWaalsContact SG-SG 3.67Å; C19-F36 VanDerWaalsContact CA-CB 3.49Å; C19-F36 HydrophobicContact CB-CB 3.69Å; C19-A37 PolarHBondContact N-O 3.14Å; C19-H38 WeakPolarHBondContact CB-CD2 3.35Å; C19-H38 WeakPolarHBondContact CB-NE2 3.37Å
20	R	92.4	Very high	90.5	Very high	185 Å²	185	80.3 Å²	80.3	70%	0.698	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-27.1	179.9	-66.8	-177.3	176.1	-171.3	-1.6	113.2	V18 R24	V18-R20 PolarHBondContact O-N 3.19Å; V18-R20 VanDerWaalsContact O-N 3.11Å; R20-R24 PolarHBondContact O-N 3.48Å; R20-R24 PolarHBondContact O-NE 3.11Å
21	E	94.3	Very high	91.3	Very high	90 Å²	90	79.5 Å²	79.5	42%	0.421	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-43.8	174.6	-58.8	176.2	148.4	0	0	110.8	C19 Q23 R24 G25 T26 C27	C19-E21 PolarHBondContact O-N 3.23Å; E21-Q23 VanDerWaalsContact C-N 3.32Å; E21-Q23 PolarHBondContact O-N 3.49Å; E21-R24 CarbonylContact O-C 3.57Å; E21-R24 WeakPolarHBondContact O-CA 3.4Å; E21-R24 PolarHBondContact O-N 3.21Å; E21-G25 PolarHBondContact O-N 3.35Å; E21-T26 PolarHBondContact O-N 3.47Å; E21-T26 PolarHBondContact O-OG1 2.95Å; E21-C27 HydrophobicContact CB-CB 3.61Å; E21-C27 PolarHBondContact OE2-SG 3.43Å
22	Y	92.9	Very high	91.6	Very high	93 Å²	93	80 Å²	80	37%	0.365	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-63.9	-40.3	177.7	-178.5	-98.8	0	0	0	111.2	C19 R24 G25 H38	C19-Y22 PolarHBondContact O-N 3.45Å; C19-Y22 VanDerWaalsContact O-N 3.13Å; Y22-R24 PolarHBondContact O-N 3.08Å; Y22-G25 PolarHBondContact O-N 3.47Å; Y22-H38 HydrophobicContact CD1-CB 4.03Å; Y22-H38 HydrophobicContact CD2-CB 4.02Å; Y22-H38 AromaticContact CD2-CD2 3.87Å; Y22-H38 AromaticContact CD2-CE1 3.86Å; Y22-H38 AromaticContact CD2-CG 3.58Å; Y22-H38 AromaticContact CD2-ND1 3.58Å; Y22-H38 HydrophobicContact CE1-CB 3.96Å; Y22-H38 HydrophobicContact CE2-CB 3.95Å; Y22-H38 AromaticContact CE2-CG 3.96Å; Y22-H38 AromaticContact CE2-ND1 3.98Å; Y22-H38 HydrophobicContact CG-CB 4.07Å; Y22-H38 AromaticContact CG-CD2 3.58Å; Y22-H38 AromaticContact CG-CG 3.68Å; Y22-H38 AromaticContact CG-NE2 3.95Å
23	Q	90.4	Very high	91.7	Very high	116 Å²	116	77.5 Å²	77.5	54%	0.542	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-63.2	-19.3	174.1	-160.8	171.7	27.2	0	0	113.1	V18 C19 E21	V18-Q23 HydrophobicContact CG1-CB 4.43Å; C19-Q23 WeakPolarHBondContact O-CB 2.96Å; C19-Q23 PolarHBondContact O-N 3.39Å; E21-Q23 VanDerWaalsContact C-N 3.32Å; E21-Q23 PolarHBondContact O-N 3.49Å
24	R	91.2	Very high	91.8	Very high	174 Å²	174	75.2 Å²	75.2	66%	0.657	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-101.4	0.1	171.1	-73.9	-171.9	-75.6	-99.2	7.7	114.2	R20 E21 Y22 T26	R20-R24 PolarHBondContact O-N 3.48Å; R20-R24 PolarHBondContact O-NE 3.11Å; E21-R24 CarbonylContact O-C 3.57Å; E21-R24 WeakPolarHBondContact O-CA 3.4Å; E21-R24 PolarHBondContact O-N 3.21Å; Y22-R24 PolarHBondContact O-N 3.08Å; R24-T26 VanDerWaalsContact C-N 3.28Å; R24-T26 HydrophobicContact CB-CG2 4.3Å; R24-T26 PolarHBondContact O-N 3.25Å
25	G	89.8	Confident	91.8	Very high	71 Å²	71	81.3 Å²	81.3	73%	0.732	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	10.8	-175.8	0	0	0	0	0	115.3	E21 Y22	E21-G25 PolarHBondContact O-N 3.35Å; Y22-G25 PolarHBondContact O-N 3.47Å
26	T	94.1	Very high	91.9	Very high	93 Å²	93	82.2 Å²	82.2	57%	0.571	42%	0.415	S	S	*	.			trans	-103.9	1.5	-174.3	68.9	0	0	0	0	114.5	E21 R24	E21-T26 PolarHBondContact O-N 3.47Å; E21-T26 PolarHBondContact O-OG1 2.95Å; R24-T26 VanDerWaalsContact C-N 3.28Å; R24-T26 HydrophobicContact CB-CG2 4.3Å; R24-T26 PolarHBondContact O-N 3.25Å
27	C	92.7	Very high	91.9	Very high	24 Å²	24	81.9 Å²	81.9	16%	0.162	41%	0.413	C	S	.	.			trans	-81.7	121.4	179.2	-156.5	0	0	0	0	111.1	E21	E21-C27 HydrophobicContact CB-CB 3.61Å; E21-C27 PolarHBondContact OE2-SG 3.43Å
28	S	91.8	Very high	91.8	Very high	125 Å²	125	78.5 Å²	78.5	87%	0.874	40%	0.397	S	S	*	.			trans	-89.2	-2.9	175	53.6	0	0	0	0	114.1
29	R	93.3	Very high	91.6	Very high	148 Å²	148	78.9 Å²	78.9	56%	0.558	40%	0.4	S	S	*	.	S	Bend	trans	-84	147.6	-179	-59.1	-179.6	-176.2	-114.3	-3.2	111.4	C34 H38	R29-C34 HydrophobicContact CB-CB 4.12Å; R29-H38 PolarHBondContact O-CE1 3.19Å
30	S	88.8	Confident	91.2	Very high	45 Å²	45	82 Å²	82	32%	0.315	42%	0.421	S	S	.	.			trans	-67.5	162.2	165.4	81.1	0	0	0	0	110.6	T32 D33 C34	S30-T32 PolarHBondContact O-N 3.37Å; S30-T32 PolarHBondContact OG-N 3.19Å; S30-T32 PolarHBondContact OG-OG1 3.46Å; S30-D33 WeakPolarHBondContact CB-OD2 2.93Å; S30-D33 PolarHBondContact O-N 3.49Å; S30-D33 PolarHBondContact OG-N 3.05Å; S30-D33 PolarHBondContact OG-OD2 3.2Å; S30-C34 VanDerWaalsContact O-CB 3.25Å; S30-C34 WeakPolarHBondContact O-CB 3.44Å; S30-C34 PolarHBondContact O-N 3.45Å
31	D	87.6	Confident	90.5	Very high	46 Å²	46	85.2 Å²	85.2	25%	0.246	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-34.3	171.8	179.1	-106.3	0	0	0	111.6	D33 H38 P72 H74	D31-D33 PolarHBondContact O-N 3.34Å; D31-H38 HydrophobicContact CB-CB 4.15Å; D31-H38 WeakPolarHBondContact OD2-CB 3.42Å; D31-H38 IonicContact OD2-CG 2.7Å; D31-H38 PolarHBondContact OD2-N 3.13Å; D31-H38 VanDerWaalsContact OD2-N 3.15Å; D31-P72 WeakPolarHBondContact OD1-CD 3.46Å; D31-P72 VanDerWaalsContact OD1-CG 3.22Å; D31-P72 WeakPolarHBondContact OD1-CG 3.31Å; D31-H74 PolarHBondContact O-CE1 2.81Å
32	T	88.3	Confident	89.6	Confident	84 Å²	84	84.7 Å²	84.7	52%	0.515	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.5	173.9	32.6	0	0	0	0	114.6	S30 P72 H74	S30-T32 PolarHBondContact O-N 3.37Å; S30-T32 PolarHBondContact OG-N 3.19Å; S30-T32 PolarHBondContact OG-OG1 3.46Å; T32-P72 HydrophobicContact CG2-CB 4.09Å; T32-H74 PolarHBondContact O-CE1 3.48Å
33	D	90.2	Very high	89.1	Confident	113 Å²	113	81 Å²	81	60%	0.604	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-7.7	-179.8	-55.5	-59.5	0	0	0	113.5	S30 D31	S30-D33 WeakPolarHBondContact CB-OD2 2.93Å; S30-D33 PolarHBondContact O-N 3.49Å; S30-D33 PolarHBondContact OG-N 3.05Å; S30-D33 PolarHBondContact OG-OD2 3.2Å; D31-D33 PolarHBondContact O-N 3.34Å
34	C	92.1	Very high	88.7	Confident	3 Å²	3	80.6 Å²	80.6	2%	0.02	43%	0.425	C	S	.	.			trans	-86.1	136.7	-178.6	-165.8	0	0	0	0	111.3	C19 R29 S30 F36 H38 H74	C19-C34 VanDerWaalsContact SG-SG 3.67Å; R29-C34 HydrophobicContact CB-CB 4.12Å; S30-C34 VanDerWaalsContact O-CB 3.25Å; S30-C34 WeakPolarHBondContact O-CB 3.44Å; S30-C34 PolarHBondContact O-N 3.45Å; C34-F36 PolarHBondContact O-N 2.96Å; C34-F36 PolarHBondContact SG-O 3.4Å; C34-F36 VanDerWaalsContact SG-O 3.33Å; C34-H38 PolarHBondContact SG-NE2 3.26Å; C34-H74 PolarHBondContact O-NE2 2.9Å
35	K	90.9	Very high	88.6	Confident	143 Å²	143	74.9 Å²	74.9	62%	0.622	41%	0.41	S	S	*	.	S	Bend	trans	-68.4	-12.1	175	179.9	173.7	177.2	-60	0	113.3
36	F	93.1	Very high	88.4	Confident	69 Å²	69	76.8 Å²	76.8	30%	0.303	40%	0.4	S	S	.	.	S	Bend	trans	-133.5	151.6	-172.5	-59.7	-82.8	0	0	0	110.2	E17 C19 C34	E17-F36 HydrophobicContact CB-CD1 3.93Å; E17-F36 HydrophobicContact CB-CE1 4.32Å; C19-F36 VanDerWaalsContact CA-CB 3.49Å; C19-F36 HydrophobicContact CB-CB 3.69Å; C34-F36 PolarHBondContact O-N 2.96Å; C34-F36 PolarHBondContact SG-O 3.4Å; C34-F36 VanDerWaalsContact SG-O 3.33Å
37	A	93.2	Very high	88.1	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-66.9	141.4	-173	0	0	0	0	0	113.4	L16 E17 V18 C19 P39 V50 L69 L75	L16-A37 HydrophobicContact CB-CB 4.19Å; L16-A37 HydrophobicContact CD1-CB 4.38Å; E17-A37 PolarHBondContact O-N 3.1Å; V18-A37 WeakPolarHBondContact CA-O 3.42Å; C19-A37 PolarHBondContact N-O 3.14Å; A37-P39 WeakPolarHBondContact O-CD 3.47Å; A37-V50 HydrophobicContact CB-CG1 3.83Å; A37-L69 HydrophobicContact CB-CD2 3.49Å; A37-L69 VanDerWaalsContact CB-CD2 3.49Å; A37-L75 HydrophobicContact CB-CD1 4.36Å
38	H	92.4	Very high	87.9	Confident	19 Å²	19	79.5 Å²	79.5	9%	0.088	42%	0.416	C	S	.	.			trans	-104.9	85.2	170.1	-67.6	-179.6	0	0	0	111	C19 Y22 R29 D31 C34	C19-H38 WeakPolarHBondContact CB-CD2 3.35Å; C19-H38 WeakPolarHBondContact CB-NE2 3.37Å; Y22-H38 HydrophobicContact CD1-CB 4.03Å; Y22-H38 HydrophobicContact CD2-CB 4.02Å; Y22-H38 AromaticContact CD2-CD2 3.87Å; Y22-H38 AromaticContact CD2-CE1 3.86Å; Y22-H38 AromaticContact CD2-CG 3.58Å; Y22-H38 AromaticContact CD2-ND1 3.58Å; Y22-H38 HydrophobicContact CE1-CB 3.96Å; Y22-H38 HydrophobicContact CE2-CB 3.95Å; Y22-H38 AromaticContact CE2-CG 3.96Å; Y22-H38 AromaticContact CE2-ND1 3.98Å; Y22-H38 HydrophobicContact CG-CB 4.07Å; Y22-H38 AromaticContact CG-CD2 3.58Å; Y22-H38 AromaticContact CG-CG 3.68Å; Y22-H38 AromaticContact CG-NE2 3.95Å; R29-H38 PolarHBondContact O-CE1 3.19Å; D31-H38 HydrophobicContact CB-CB 4.15Å; D31-H38 WeakPolarHBondContact OD2-CB 3.42Å; D31-H38 IonicContact OD2-CG 2.7Å; D31-H38 PolarHBondContact OD2-N 3.13Å; D31-H38 VanDerWaalsContact OD2-N 3.15Å; C34-H38 PolarHBondContact SG-NE2 3.26Å
39	P	90.4	Very high	87.8	Confident	13 Å²	13	78.8 Å²	78.8	8%	0.084	39%	0.394	C	S	.	.			trans	-70.9	131.7	-176.8	30.2	-36.6	0	0	0	112.7	V18 A37 C43 V45 V50	V18-P39 HydrophobicContact CB-CG 4.43Å; V18-P39 HydrophobicContact CG1-CG 3.73Å; V18-P39 HydrophobicContact CG2-CG 3.81Å; A37-P39 WeakPolarHBondContact O-CD 3.47Å; P39-C43 HydrophobicContact CB-CB 3.92Å; P39-V45 HydrophobicContact CB-CG2 3.84Å; P39-V45 HydrophobicContact CG-CG2 3.62Å; P39-V50 HydrophobicContact CB-CB 4.48Å; P39-V50 HydrophobicContact CB-CG2 4.2Å
40	S	85.1	Confident	87.8	Confident	67 Å²	67	71.9 Å²	71.9	47%	0.469	37%	0.368	S	S	.	.			trans	-59.7	156.9	169.3	-43.8	0	0	0	0	111.8	S42 C43	S40-S42 PolarHBondContact O-N 2.96Å; S40-C43 WeakPolarHBondContact O-CB 3.36Å; S40-C43 PolarHBondContact O-N 3.43Å
41	R	78.1	Confident	88	Confident	254 Å²	254	71.8 Å²	71.8	96%	0.958	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.2	-178.2	-60	-64.9	-176.6	-174	-2.1	114.8
42	S	75.8	Confident	88.2	Confident	79 Å²	79	69.7 Å²	69.7	55%	0.552	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-12.7	176.9	48.3	0	0	0	0	114.7	S40	S40-S42 PolarHBondContact O-N 2.96Å
43	C	82.8	Confident	88.4	Confident	15 Å²	15	65.9 Å²	65.9	10%	0.101	33%	0.329	C	S	.	.	S	Bend	trans	-80.5	136.9	-177.7	-70.2	0	0	0	0	111.4	P39 S40 V45 V50	P39-C43 HydrophobicContact CB-CB 3.92Å; S40-C43 WeakPolarHBondContact O-CB 3.36Å; S40-C43 PolarHBondContact O-N 3.43Å; C43-V45 PolarHBondContact O-N 2.98Å; C43-V50 HydrophobicContact CB-CG2 4.16Å
44	H	82.1	Confident	88.4	Confident	107 Å²	107	63.9 Å²	63.9	50%	0.495	32%	0.315	S	S	.	.			trans	-72.7	110	176.2	-169.5	-89.7	0	0	0	110.9	E46	H44-E46 IonicContact CE1-OE2 3.16Å; H44-E46 PolarHBondContact CE1-OE2 3.18Å; H44-E46 IonicContact ND1-OE2 2.7Å
45	V	88.4	Confident	88.4	Confident	55 Å²	55	67.4 Å²	67.4	33%	0.333	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122.4	174.4	179.6	0	0	0	0	109.1	V18 P39 C43 R49 V50	V18-V45 HydrophobicContact CG2-CG1 3.96Å; V18-V45 HydrophobicContact CG2-CG2 4.25Å; P39-V45 HydrophobicContact CB-CG2 3.84Å; P39-V45 HydrophobicContact CG-CG2 3.62Å; C43-V45 PolarHBondContact O-N 2.98Å; V45-R49 CarbonylContact C-O 3.37Å; V45-R49 WeakPolarHBondContact CA-O 3.41Å; V45-V50 HydrophobicContact CG2-CB 4.45Å
46	E	84.9	Confident	88.4	Confident	111 Å²	111	61.5 Å²	61.5	52%	0.519	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	125	-175.7	-165.4	-172.2	141.7	0	0	109.3	H44 G48 R49	H44-E46 IonicContact CE1-OE2 3.16Å; H44-E46 PolarHBondContact CE1-OE2 3.18Å; H44-E46 IonicContact ND1-OE2 2.7Å; E46-G48 PolarHBondContact O-N 2.93Å; E46-G48 VanDerWaalsContact O-N 3.09Å; E46-R49 PolarHBondContact N-O 3.08Å; E46-R49 WeakPolarHBondContact O-CA 3.43Å; E46-R49 PolarHBondContact O-N 3.36Å
47	N	87.8	Confident	88.3	Confident	146 Å²	146	58.7 Å²	58.7	78%	0.781	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	35	-179.6	-66.7	-63.4	0	0	0	114.4	R49	N47-R49 VanDerWaalsContact C-N 3.28Å; N47-R49 PolarHBondContact O-N 3.43Å
48	G	88.1	Confident	88.1	Confident	28 Å²	28	64.3 Å²	64.3	29%	0.289	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	11.3	-177.1	0	0	0	0	0	114.9	V18 E46	V18-G48 WeakPolarHBondContact CB-O 3.45Å; V18-G48 PolarHBondContact N-O 3.02Å; E46-G48 PolarHBondContact O-N 2.93Å; E46-G48 VanDerWaalsContact O-N 3.09Å
49	R	91.6	Very high	87.9	Confident	110 Å²	110	66.5 Å²	66.5	42%	0.415	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	155.5	176.5	-52.7	-179.3	-159.4	-69.5	-12.1	110.7	L16 E17 V45 E46 N47	L16-R49 CarbonylContact O-C 3.48Å; L16-R49 WeakPolarHBondContact O-CA 3.44Å; L16-R49 WeakPolarHBondContact O-CB 3.22Å; E17-R49 HydrophobicContact CG-CG 4.49Å; E17-R49 VanDerWaalsContact CG-NH1 3.29Å; E17-R49 IonicContact OE1-CZ 2.64Å; E17-R49 IonicContact OE1-NH1 3.98Å; E17-R49 PolarHBondContact OE1-NH1 3.3Å; E17-R49 IonicContact OE1-NH2 3.45Å; V45-R49 CarbonylContact C-O 3.37Å; V45-R49 WeakPolarHBondContact CA-O 3.41Å; E46-R49 PolarHBondContact N-O 3.08Å; E46-R49 WeakPolarHBondContact O-CA 3.43Å; E46-R49 PolarHBondContact O-N 3.36Å; N47-R49 VanDerWaalsContact C-N 3.28Å; N47-R49 PolarHBondContact O-N 3.43Å
50	V	92.8	Very high	87.9	Confident	2 Å²	2	74.8 Å²	74.8	1%	0.012	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	144.2	175.5	60.4	0	0	0	0	109.7	T15 L16 V18 A37 P39 C43 V45 L69	T15-V50 WeakPolarHBondContact CA-O 3.49Å; L16-V50 HydrophobicContact CB-CG1 4.32Å; L16-V50 PolarHBondContact N-O 3.4Å; L16-V50 PolarHBondContact O-N 3.44Å; V18-V50 HydrophobicContact CG2-CB 3.94Å; V18-V50 HydrophobicContact CG2-CG1 3.79Å; A37-V50 HydrophobicContact CB-CG1 3.83Å; P39-V50 HydrophobicContact CB-CB 4.48Å; P39-V50 HydrophobicContact CB-CG2 4.2Å; C43-V50 HydrophobicContact CB-CG2 4.16Å; V45-V50 HydrophobicContact CG2-CB 4.45Å; V50-L69 HydrophobicContact CG1-CD2 3.87Å; V50-L69 HydrophobicContact CG2-CB 4.04Å
51	I	91.9	Very high	88.2	Confident	44 Å²	44	73.1 Å²	73.1	23%	0.226	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	124.7	177.5	-59.2	169.9	0	0	0	109.3	L14 T15 Y68 L69	L14-I51 HydrophobicContact CB-CG2 4.27Å; T15-I51 HydrophobicContact CG2-CG1 4.21Å; I51-Y68 HydrophobicContact CB-CD1 3.96Å; I51-Y68 HydrophobicContact CB-CE1 4.32Å; I51-Y68 HydrophobicContact CG2-CD1 3.7Å; I51-Y68 HydrophobicContact CG2-CE1 3.94Å; I51-L69 PolarHBondContact O-N 2.73Å; I51-L69 VanDerWaalsContact O-N 3.14Å
52	A	92.4	Very high	88.7	Confident	2 Å²	2	67.6 Å²	67.6	2%	0.017	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-80.1	152.2	175.5	0	0	0	0	0	112.6	L14 F54 L69 P71 L79	L14-A52 PolarHBondContact O-N 3.31Å; A52-F54 PolarHBondContact O-N 3.38Å; A52-L69 CarbonylContact C-O 3.5Å; A52-L69 WeakPolarHBondContact CA-O 3.13Å; A52-P71 HydrophobicContact CB-CG 4.25Å; A52-L79 HydrophobicContact CB-CD1 3.39Å
53	C	92.1	Very high	89.4	Confident	4 Å²	4	72.2 Å²	72.2	3%	0.027	37%	0.368	C	S	.	.			trans	-75.3	111.4	-179.7	-173.1	0	0	0	0	111.1	D55 S56 L57 C66 L69	C53-D55 PolarHBondContact O-N 3Å; C53-S56 PolarHBondContact O-N 3.41Å; C53-S56 VanDerWaalsContact O-N 3.08Å; C53-S56 PolarHBondContact O-OG 2.94Å; C53-S56 PolarHBondContact SG-N 2.95Å; C53-L57 PolarHBondContact O-N 3.44Å; C53-C66 VanDerWaalsContact SG-SG 3.69Å; C53-L69 WeakPolarHBondContact CB-O 3.43Å; C53-L69 PolarHBondContact N-O 2.71Å
54	F	91.3	Very high	89.1	Confident	70 Å²	70	79.4 Å²	79.4	31%	0.307	40%	0.401	S	S	.	.	H	α-helix	trans	-55.1	-36.3	175	-178	-106.8	0	0	0	112.9	W13 L14 A52 K58	W13-F54 AromaticContact CH2-CD2 3.88Å; W13-F54 HydrophobicContact CH2-CD2 3.88Å; W13-F54 AromaticContact CH2-CE2 3.95Å; W13-F54 HydrophobicContact CH2-CE2 3.95Å; W13-F54 AromaticContact CZ2-CD2 3.92Å; W13-F54 HydrophobicContact CZ2-CD2 3.92Å; W13-F54 AromaticContact CZ2-CE2 3.81Å; W13-F54 HydrophobicContact CZ2-CE2 3.81Å; L14-F54 HydrophobicContact CD1-CB 4.15Å; L14-F54 HydrophobicContact CD1-CD2 4.24Å; L14-F54 HydrophobicContact CD2-CB 4.45Å; L14-F54 HydrophobicContact CD2-CD2 4.3Å; A52-F54 PolarHBondContact O-N 3.38Å; F54-K58 HydrophobicContact CD1-CD 4.43Å; F54-K58 HydrophobicContact CE1-CD 4Å; F54-K58 HydrophobicContact CZ-CD 4.15Å; F54-K58 PolarHBondContact O-N 3.36Å
55	D	91.8	Very high	89.1	Confident	77 Å²	77	80.6 Å²	80.6	41%	0.412	41%	0.411	S	S	.	.	H	α-helix	trans	-77.8	-26.3	179	-63.4	-67.9	0	0	0	112.9	C53 K58 G59 R60 C61	C53-D55 PolarHBondContact O-N 3Å; D55-K58 CarbonylContact O-C 3.58Å; D55-K58 PolarHBondContact O-N 3.24Å; D55-G59 PolarHBondContact O-N 3.02Å; D55-G59 VanDerWaalsContact O-N 3.14Å; D55-R60 HydrophobicContact CB-CB 4.34Å; D55-R60 WeakPolarHBondContact O-CA 3.12Å; D55-R60 PolarHBondContact O-N 3.26Å; D55-C61 HydrophobicContact CB-CB 3.89Å; D55-C61 PolarHBondContact O-N 2.84Å
56	S	91.3	Very high	89.1	Confident	20 Å²	20	78.9 Å²	78.9	14%	0.14	40%	0.401	C	S	.	.	H	α-helix	trans	-77.3	-35.8	173.4	86.5	0	0	0	0	111.7	C53 K58 G59 H70	C53-S56 PolarHBondContact O-N 3.41Å; C53-S56 VanDerWaalsContact O-N 3.08Å; C53-S56 PolarHBondContact O-OG 2.94Å; C53-S56 PolarHBondContact SG-N 2.95Å; S56-K58 PolarHBondContact O-N 3.28Å; S56-G59 PolarHBondContact O-N 3.45Å; S56-H70 VanDerWaalsContact CB-CD2 3.44Å; S56-H70 WeakPolarHBondContact CB-CD2 3.3Å
57	L	90.7	Very high	89.3	Confident	9 Å²	9	80.2 Å²	80.2	5%	0.047	41%	0.405	C	S	.	.	H	α-helix	trans	-53.6	-44.5	167	-66.9	174.7	0	0	0	110.2	W13 L14 C53 G59 P71 K76 L79	W13-L57 HydrophobicContact CH2-CD1 4.4Å; W13-L57 HydrophobicContact CZ3-CD1 4.13Å; L14-L57 HydrophobicContact CD2-CD1 3.45Å; L14-L57 VanDerWaalsContact CD2-CD1 3.45Å; C53-L57 PolarHBondContact O-N 3.44Å; L57-G59 VanDerWaalsContact C-N 3.29Å; L57-G59 PolarHBondContact O-N 3.21Å; L57-P71 HydrophobicContact CD2-CG 3.71Å; L57-K76 HydrophobicContact CD2-CB 4.02Å; L57-K76 HydrophobicContact CD2-CG 3.76Å; L57-K76 WeakPolarHBondContact O-CE 3.26Å; L57-K76 PolarHBondContact O-NZ 3.25Å; L57-L79 HydrophobicContact CD1-CB 4.17Å; L57-L79 HydrophobicContact CD1-CD1 4.33Å; L57-L79 HydrophobicContact CD2-CB 4.02Å; L57-L79 HydrophobicContact CD2-CD1 3.97Å
58	K	88.7	Confident	89.4	Confident	119 Å²	119	78 Å²	78	52%	0.517	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	3.3	177.4	-68	-172.6	174.4	-170.2	0	115.6	F54 D55 S56 R60	F54-K58 HydrophobicContact CD1-CD 4.43Å; F54-K58 HydrophobicContact CE1-CD 4Å; F54-K58 HydrophobicContact CZ-CD 4.15Å; F54-K58 PolarHBondContact O-N 3.36Å; D55-K58 CarbonylContact O-C 3.58Å; D55-K58 PolarHBondContact O-N 3.24Å; S56-K58 PolarHBondContact O-N 3.28Å; K58-R60 HydrophobicContact CB-CG 4.32Å; K58-R60 PolarHBondContact O-N 3.29Å
59	G	88.1	Confident	89.6	Confident	65 Å²	65	77.1 Å²	77.1	67%	0.67	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	20.8	-179.6	0	0	0	0	0	114.8	D55 S56 L57	D55-G59 PolarHBondContact O-N 3.02Å; D55-G59 VanDerWaalsContact O-N 3.14Å; S56-G59 PolarHBondContact O-N 3.45Å; L57-G59 VanDerWaalsContact C-N 3.29Å; L57-G59 PolarHBondContact O-N 3.21Å
60	R	91.1	Very high	89.6	Confident	187 Å²	187	75.3 Å²	75.3	71%	0.706	37%	0.371	S	S	*	.			trans	-105.7	-19.4	-177.7	-63.3	-179.1	-178.3	-164.2	-4.3	113.9	D55 K58 T62	D55-R60 HydrophobicContact CB-CB 4.34Å; D55-R60 WeakPolarHBondContact O-CA 3.12Å; D55-R60 PolarHBondContact O-N 3.26Å; K58-R60 HydrophobicContact CB-CG 4.32Å; K58-R60 PolarHBondContact O-N 3.29Å; R60-T62 PolarHBondContact O-N 3.37Å
61	C	90.4	Very high	89.6	Confident	32 Å²	32	76 Å²	76	22%	0.216	38%	0.375	C	S	.	.			trans	-80.2	111.7	178.3	-165.2	0	0	0	0	111.1	D55 H70	D55-C61 HydrophobicContact CB-CB 3.89Å; D55-C61 PolarHBondContact O-N 2.84Å; C61-H70 VanDerWaalsContact SG-CE1 3.52Å; C61-H70 PolarHBondContact SG-NE2 3.22Å
62	T	88.5	Confident	89.6	Confident	137 Å²	137	74.4 Å²	74.4	84%	0.84	37%	0.368	S	S	*	.			trans	-97.8	1.6	173.7	51.4	0	0	0	0	113.5	R60 E64	R60-T62 PolarHBondContact O-N 3.37Å; T62-E64 PolarHBondContact O-N 2.93Å
63	R	89.8	Confident	89.5	Confident	177 Å²	177	78.7 Å²	78.7	67%	0.668	40%	0.396	S	S	*	.			trans	-74.7	118.5	179.3	-80.2	-179.3	163	173.5	-6.4	111.3	C66 H70	R63-C66 HydrophobicContact CB-CB 4.32Å; R63-H70 PolarHBondContact O-CE1 2.88Å
64	E	77.6	Confident	89.5	Confident	166 Å²	166	81.8 Å²	81.8	78%	0.776	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-32.4	170	62.9	-67.7	85.9	0	0	112.2	T62	T62-E64 PolarHBondContact O-N 2.93Å
65	N	83	Confident	89.6	Confident	132 Å²	132	78.6 Å²	78.6	71%	0.706	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	63.7	171.9	-77.5	-94.2	0	0	0	111.1
66	C	87.8	Confident	89.6	Confident	19 Å²	19	78 Å²	78	13%	0.128	39%	0.389	C	S	.	.			trans	-75.5	144.1	176.7	-164.6	0	0	0	0	112.1	C53 R63 Y68 H70	C53-C66 VanDerWaalsContact SG-SG 3.69Å; R63-C66 HydrophobicContact CB-CB 4.32Å; C66-Y68 PolarHBondContact O-N 3.11Å; C66-Y68 PolarHBondContact SG-O 2.7Å; C66-H70 WeakPolarHBondContact CB-NE2 3.43Å; C66-H70 PolarHBondContact SG-NE2 3.37Å; C66-H70 VanDerWaalsContact SG-NE2 3.39Å
67	K	88.3	Confident	89.7	Confident	138 Å²	138	80.7 Å²	80.7	60%	0.6	41%	0.405	S	S	*	.	S	Bend	trans	-67.8	-23.7	173.5	178	176	177.9	-179.7	0	112.9
68	Y	90.7	Very high	89.8	Confident	101 Å²	101	84.6 Å²	84.6	40%	0.396	42%	0.423	S	S	.	.	S	Bend	trans	-114.2	145.6	-174.3	-58.9	-76	0	0	0	109.4	I51 C66 H70	I51-Y68 HydrophobicContact CB-CD1 3.96Å; I51-Y68 HydrophobicContact CB-CE1 4.32Å; I51-Y68 HydrophobicContact CG2-CD1 3.7Å; I51-Y68 HydrophobicContact CG2-CE1 3.94Å; C66-Y68 PolarHBondContact O-N 3.11Å; C66-Y68 PolarHBondContact SG-O 2.7Å; Y68-H70 PolarHBondContact O-N 2.77Å
69	L	92.2	Very high	90	Very high	9 Å²	9	78.9 Å²	78.9	5%	0.047	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-58	136.6	-179.3	178.9	72.1	0	0	0	110.9	L16 A37 V50 I51 A52 C53 P71	L16-L69 HydrophobicContact CD1-CD2 4.11Å; A37-L69 HydrophobicContact CB-CD2 3.49Å; A37-L69 VanDerWaalsContact CB-CD2 3.49Å; V50-L69 HydrophobicContact CG1-CD2 3.87Å; V50-L69 HydrophobicContact CG2-CB 4.04Å; I51-L69 PolarHBondContact O-N 2.73Å; I51-L69 VanDerWaalsContact O-N 3.14Å; A52-L69 CarbonylContact C-O 3.5Å; A52-L69 WeakPolarHBondContact CA-O 3.13Å; C53-L69 WeakPolarHBondContact CB-O 3.43Å; C53-L69 PolarHBondContact N-O 2.71Å; L69-P71 VanDerWaalsContact O-CD 3.26Å; L69-P71 WeakPolarHBondContact O-CD 3.28Å
70	H	92.1	Very high	90.2	Very high	72 Å²	72	79 Å²	79	33%	0.333	38%	0.381	S	S	.	.			trans	-93.1	102.1	165.5	-73.6	-168.7	0	0	0	108.1	S56 C61 R63 C66 Y68	S56-H70 VanDerWaalsContact CB-CD2 3.44Å; S56-H70 WeakPolarHBondContact CB-CD2 3.3Å; C61-H70 VanDerWaalsContact SG-CE1 3.52Å; C61-H70 PolarHBondContact SG-NE2 3.22Å; R63-H70 PolarHBondContact O-CE1 2.88Å; C66-H70 WeakPolarHBondContact CB-NE2 3.43Å; C66-H70 PolarHBondContact SG-NE2 3.37Å; C66-H70 VanDerWaalsContact SG-NE2 3.39Å; Y68-H70 PolarHBondContact O-N 2.77Å
71	P	91.1	Very high	90.3	Very high	16 Å²	16	74.1 Å²	74.1	10%	0.104	37%	0.369	C	S	.	.			trans	-75.2	144	-171.6	29.6	-35.4	0	0	0	112.3	L16 A52 L57 L69 L75 K76 L79	L16-P71 HydrophobicContact CD1-CB 4.09Å; A52-P71 HydrophobicContact CB-CG 4.25Å; L57-P71 HydrophobicContact CD2-CG 3.71Å; L69-P71 VanDerWaalsContact O-CD 3.26Å; L69-P71 WeakPolarHBondContact O-CD 3.28Å; P71-L75 HydrophobicContact CB-CB 3.98Å; P71-K76 HydrophobicContact CG-CB 4.23Å; P71-L79 HydrophobicContact CB-CD1 4.23Å; P71-L79 HydrophobicContact CG-CD1 3.91Å
72	P	92.5	Very high	90.3	Very high	11 Å²	11	75.3 Å²	75.3	7%	0.071	37%	0.373	C	S	.	.			trans	-64.5	162.9	172.1	29.7	-37.4	0	0	0	111.5	D31 T32 H74 L75 K76	D31-P72 WeakPolarHBondContact OD1-CD 3.46Å; D31-P72 VanDerWaalsContact OD1-CG 3.22Å; D31-P72 WeakPolarHBondContact OD1-CG 3.31Å; T32-P72 HydrophobicContact CG2-CB 4.09Å; P72-H74 VanDerWaalsContact C-N 3.32Å; P72-H74 WeakPolarHBondContact CG-CE1 3.49Å; P72-H74 PolarHBondContact O-N 2.74Å; P72-H74 VanDerWaalsContact O-N 3.13Å; P72-L75 HydrophobicContact CG-CB 4.13Å; P72-L75 HydrophobicContact CG-CD1 3.81Å; P72-L75 HydrophobicContact CG-CG 4.11Å; P72-L75 PolarHBondContact O-N 2.89Å; P72-L75 VanDerWaalsContact O-N 3.09Å; P72-K76 WeakPolarHBondContact O-CB 3.37Å; P72-K76 PolarHBondContact O-N 2.91Å
73	P	90.7	Very high	90.5	Very high	92 Å²	92	69.5 Å²	69.5	60%	0.597	34%	0.34	S	S	*	.	H	α-helix	trans	-58.1	-33.8	-164.6	18.9	-32.8	0	0	0	115.6	T77	P73-T77 WeakPolarHBondContact O-CB 3.26Å; P73-T77 PolarHBondContact O-N 2.87Å; P73-T77 PolarHBondContact O-OG1 3.35Å
74	H	92.1	Very high	90.5	Very high	68 Å²	68	69 Å²	69	32%	0.315	34%	0.338	S	S	.	.	H	α-helix	trans	-69.3	-48.2	175.3	58.8	-53.3	0	0	0	112.1	D31 T32 C34 P72 K76 T77 Q78	D31-H74 PolarHBondContact O-CE1 2.81Å; T32-H74 PolarHBondContact O-CE1 3.48Å; C34-H74 PolarHBondContact O-NE2 2.9Å; P72-H74 VanDerWaalsContact C-N 3.32Å; P72-H74 WeakPolarHBondContact CG-CE1 3.49Å; P72-H74 PolarHBondContact O-N 2.74Å; P72-H74 VanDerWaalsContact O-N 3.13Å; H74-K76 VanDerWaalsContact C-N 3.33Å; H74-K76 PolarHBondContact O-N 2.86Å; H74-T77 PolarHBondContact O-N 2.85Å; H74-Q78 PolarHBondContact O-N 3.37Å
75	L	92.9	Very high	91.2	Very high	3 Å²	3	65 Å²	65	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-67.6	-33.3	176.8	-67.1	179	0	0	0	112.1	L16 A37 P71 P72 Q78 L79	L16-L75 HydrophobicContact CD1-CB 3.94Å; L16-L75 HydrophobicContact CD1-CD1 4.24Å; L16-L75 HydrophobicContact CD1-CG 4.49Å; L16-L75 HydrophobicContact CD2-CD2 4.3Å; A37-L75 HydrophobicContact CB-CD1 4.36Å; P71-L75 HydrophobicContact CB-CB 3.98Å; P72-L75 HydrophobicContact CG-CB 4.13Å; P72-L75 HydrophobicContact CG-CD1 3.81Å; P72-L75 HydrophobicContact CG-CG 4.11Å; P72-L75 PolarHBondContact O-N 2.89Å; P72-L75 VanDerWaalsContact O-N 3.09Å; L75-Q78 PolarHBondContact O-N 3.31Å; L75-L79 WeakPolarHBondContact O-CG 3.2Å; L75-L79 PolarHBondContact O-N 3.14Å
76	K	93.1	Very high	91.5	Very high	64 Å²	64	60.5 Å²	60.5	28%	0.278	30%	0.298	S	S	.	.	H	α-helix	trans	-58.4	-51.1	168.6	166.4	168.9	-179.5	172.1	0	111.3	L57 P71 P72 H74 Q78 L79 E80	L57-K76 HydrophobicContact CD2-CB 4.02Å; L57-K76 HydrophobicContact CD2-CG 3.76Å; L57-K76 WeakPolarHBondContact O-CE 3.26Å; L57-K76 PolarHBondContact O-NZ 3.25Å; P71-K76 HydrophobicContact CG-CB 4.23Å; P72-K76 WeakPolarHBondContact O-CB 3.37Å; P72-K76 PolarHBondContact O-N 2.91Å; H74-K76 VanDerWaalsContact C-N 3.33Å; H74-K76 PolarHBondContact O-N 2.86Å; K76-Q78 VanDerWaalsContact C-N 3.31Å; K76-Q78 PolarHBondContact O-N 2.94Å; K76-L79 PolarHBondContact O-N 2.94Å; K76-L79 VanDerWaalsContact O-N 3.15Å; K76-E80 WeakPolarHBondContact CE-OE1 3.37Å; K76-E80 IonicContact NZ-OE1 2.77Å; K76-E80 PolarHBondContact O-N 3.45Å
77	T	92.8	Very high	91.5	Very high	78 Å²	78	63.9 Å²	63.9	48%	0.479	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-42	-179.9	-55.6	0	0	0	0	111.1	P73 H74 L79 E80 I81	P73-T77 WeakPolarHBondContact O-CB 3.26Å; P73-T77 PolarHBondContact O-N 2.87Å; P73-T77 PolarHBondContact O-OG1 3.35Å; H74-T77 PolarHBondContact O-N 2.85Å; T77-L79 PolarHBondContact O-N 3.42Å; T77-E80 PolarHBondContact O-N 3.28Å; T77-I81 HydrophobicContact CG2-CD1 4.2Å; T77-I81 WeakPolarHBondContact O-CG1 3.32Å; T77-I81 PolarHBondContact O-N 2.84Å; T77-I81 VanDerWaalsContact O-N 3.08Å
78	Q	93.1	Very high	91.5	Very high	90 Å²	90	62.5 Å²	62.5	42%	0.421	31%	0.312	S	S	.	.	H	α-helix	trans	-60.7	-41.9	174.6	-174.6	179.3	-13.5	0	0	112.5	H74 L75 K76 I81 N82	H74-Q78 PolarHBondContact O-N 3.37Å; L75-Q78 PolarHBondContact O-N 3.31Å; K76-Q78 VanDerWaalsContact C-N 3.31Å; K76-Q78 PolarHBondContact O-N 2.94Å; Q78-I81 PolarHBondContact O-N 2.89Å; Q78-N82 WeakPolarHBondContact O-CB 3.48Å; Q78-N82 VanDerWaalsContact O-CG 3.25Å; Q78-N82 PolarHBondContact O-N 2.92Å
79	L	93.2	Very high	91.4	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-66.7	-38	176.4	-76.7	169.3	0	0	0	113.1	W13 L16 A52 L57 P71 L75 K76 T77 I81 N82 G83	W13-L79 WeakPolarHBondContact CZ3-O 3.11Å; W13-L79 WeakPolarHBondContact O-CD2 3.41Å; L16-L79 HydrophobicContact CD1-CD1 3.7Å; L16-L79 HydrophobicContact CD1-CG 4.29Å; L16-L79 HydrophobicContact CD2-CD1 4.21Å; L16-L79 HydrophobicContact CD2-CD2 3.92Å; L16-L79 HydrophobicContact CD2-CG 3.87Å; L16-L79 HydrophobicContact CG-CD1 3.88Å; L16-L79 HydrophobicContact CG-CD2 4Å; L16-L79 HydrophobicContact CG-CG 4.05Å; A52-L79 HydrophobicContact CB-CD1 3.39Å; L57-L79 HydrophobicContact CD1-CB 4.17Å; L57-L79 HydrophobicContact CD1-CD1 4.33Å; L57-L79 HydrophobicContact CD2-CB 4.02Å; L57-L79 HydrophobicContact CD2-CD1 3.97Å; P71-L79 HydrophobicContact CB-CD1 4.23Å; P71-L79 HydrophobicContact CG-CD1 3.91Å; L75-L79 WeakPolarHBondContact O-CG 3.2Å; L75-L79 PolarHBondContact O-N 3.14Å; K76-L79 PolarHBondContact O-N 2.94Å; K76-L79 VanDerWaalsContact O-N 3.15Å; T77-L79 PolarHBondContact O-N 3.42Å; L79-I81 VanDerWaalsContact C-N 3.34Å; L79-N82 PolarHBondContact O-N 3.27Å; L79-G83 PolarHBondContact O-N 3.3Å
80	E	92	Very high	91.1	Very high	67 Å²	67	68 Å²	68	31%	0.313	34%	0.341	S	S	.	.	H	α-helix	trans	-65.6	-37.3	175.4	-71.7	-179.1	-163.3	0	0	112.2	K76 T77 R84	K76-E80 WeakPolarHBondContact CE-OE1 3.37Å; K76-E80 IonicContact NZ-OE1 2.77Å; K76-E80 PolarHBondContact O-N 3.45Å; T77-E80 PolarHBondContact O-N 3.28Å; E80-R84 WeakPolarHBondContact O-CG 3.29Å; E80-R84 PolarHBondContact O-N 3.27Å; E80-R84 VanDerWaalsContact O-N 3.14Å
81	I	92.1	Very high	90.9	Very high	85 Å²	85	71.6 Å²	71.6	44%	0.436	36%	0.356	S	S	.	.	H	α-helix	trans	-65.1	-47.5	172.1	-66.7	163.8	0	0	0	110.4	T77 Q78 L79 G83 R84 N85	T77-I81 HydrophobicContact CG2-CD1 4.2Å; T77-I81 WeakPolarHBondContact O-CG1 3.32Å; T77-I81 PolarHBondContact O-N 2.84Å; T77-I81 VanDerWaalsContact O-N 3.08Å; Q78-I81 PolarHBondContact O-N 2.89Å; L79-I81 VanDerWaalsContact C-N 3.34Å; I81-G83 VanDerWaalsContact C-N 3.32Å; I81-G83 PolarHBondContact O-N 3.38Å; I81-R84 PolarHBondContact O-N 3.13Å; I81-N85 PolarHBondContact O-N 2.83Å
82	N	91.7	Very high	90.8	Very high	57 Å²	57	73.2 Å²	73.2	31%	0.305	37%	0.371	S	S	.	.	H	α-helix	trans	-58.5	-42.1	177.2	-73.2	-12	0	0	0	112.3	W13 Q78 L79 N85 N86	W13-N82 HydrophobicContact CB-CB 4.45Å; Q78-N82 WeakPolarHBondContact O-CB 3.48Å; Q78-N82 VanDerWaalsContact O-CG 3.25Å; Q78-N82 PolarHBondContact O-N 2.92Å; L79-N82 PolarHBondContact O-N 3.27Å; N82-N85 PolarHBondContact O-N 3.22Å; N82-N86 VanDerWaalsContact O-CB 3.31Å; N82-N86 WeakPolarHBondContact O-CB 3.41Å; N82-N86 PolarHBondContact O-N 2.9Å
83	G	91.3	Very high	90.5	Very high	14 Å²	14	75.7 Å²	75.7	14%	0.144	39%	0.392	C	S	.	.	H	α-helix	trans	-65.3	-38.7	177.4	0	0	0	0	0	113.4	W13 L79 I81 L87	W13-G83 VanDerWaalsContact CD2-CA 3.46Å; L79-G83 PolarHBondContact O-N 3.3Å; I81-G83 VanDerWaalsContact C-N 3.32Å; I81-G83 PolarHBondContact O-N 3.38Å; G83-L87 WeakPolarHBondContact O-CB 3.42Å; G83-L87 PolarHBondContact O-N 3.25Å
84	R	90.3	Very high	90.2	Very high	166 Å²	166	74.1 Å²	74.1	63%	0.626	39%	0.387	S	S	*	.	H	α-helix	trans	-63.5	-47.7	172.6	-69.3	172.8	-164.6	-168.1	7	111.1	E80 I81 N86 L87 I88	E80-R84 WeakPolarHBondContact O-CG 3.29Å; E80-R84 PolarHBondContact O-N 3.27Å; E80-R84 VanDerWaalsContact O-N 3.14Å; I81-R84 PolarHBondContact O-N 3.13Å; R84-N86 PolarHBondContact O-N 3.16Å; R84-L87 PolarHBondContact O-N 3.13Å; R84-I88 VanDerWaalsContact O-CG1 3.31Å; R84-I88 WeakPolarHBondContact O-CG1 3.43Å; R84-I88 PolarHBondContact O-N 3.38Å
85	N	91.8	Very high	89.8	Confident	82 Å²	82	73.8 Å²	73.8	44%	0.439	40%	0.396	S	S	.	.	H	α-helix	trans	-62.6	-41.2	179.4	-69.9	-14.9	0	0	0	112.1	I81 N82 I88 Q89	I81-N85 PolarHBondContact O-N 2.83Å; N82-N85 PolarHBondContact O-N 3.22Å; N85-I88 PolarHBondContact O-N 3.09Å; N85-Q89 WeakPolarHBondContact O-CG 3.4Å; N85-Q89 PolarHBondContact O-N 2.64Å
86	N	90.2	Very high	89.4	Confident	38 Å²	38	80.3 Å²	80.3	20%	0.203	43%	0.428	C	S	.	.	H	α-helix	trans	-65.6	-39.3	176.6	-175.3	-123.3	0	0	0	112.2	W13 N82 R84 Q89 Q90	W13-N86 HydrophobicContact CB-CB 3.93Å; W13-N86 HydrophobicContact CG-CB 4.26Å; N82-N86 VanDerWaalsContact O-CB 3.31Å; N82-N86 WeakPolarHBondContact O-CB 3.41Å; N82-N86 PolarHBondContact O-N 2.9Å; R84-N86 PolarHBondContact O-N 3.16Å; N86-Q89 PolarHBondContact O-N 2.85Å; N86-Q90 VanDerWaalsContact O-CB 3.31Å; N86-Q90 WeakPolarHBondContact O-CB 3.13Å; N86-Q90 PolarHBondContact O-N 3.17Å
87	L	87.7	Confident	88.9	Confident	90 Å²	90	81.1 Å²	81.1	47%	0.471	44%	0.435	S	S	.	.	H	α-helix	trans	-66.6	-36.8	173.6	-178.2	62.1	0	0	0	112.7	G83 R84 Q90 K91	G83-L87 WeakPolarHBondContact O-CB 3.42Å; G83-L87 PolarHBondContact O-N 3.25Å; R84-L87 PolarHBondContact O-N 3.13Å; L87-Q90 PolarHBondContact O-N 3.12Å; L87-K91 WeakPolarHBondContact O-CG 3Å; L87-K91 PolarHBondContact O-N 3.08Å
88	I	88.8	Confident	88.2	Confident	109 Å²	109	80.1 Å²	80.1	56%	0.559	44%	0.435	S	S	*	.	H	α-helix	trans	-63.9	-47.3	173.7	-68.9	163.4	0	0	0	110.1	R84 N85 Q90 K91 A92	R84-I88 VanDerWaalsContact O-CG1 3.31Å; R84-I88 WeakPolarHBondContact O-CG1 3.43Å; R84-I88 PolarHBondContact O-N 3.38Å; N85-I88 PolarHBondContact O-N 3.09Å; I88-Q90 PolarHBondContact O-N 2.91Å; I88-K91 PolarHBondContact O-N 3.23Å; I88-A92 WeakPolarHBondContact O-CB 3.21Å; I88-A92 PolarHBondContact O-N 3.07Å
89	Q	87.9	Confident	87.5	Confident	130 Å²	130	82.1 Å²	82.1	61%	0.607	44%	0.444	S	S	*	.	H	α-helix	trans	-61.3	-41	175.4	-73.8	175.1	-26.2	0	0	112.4	N85 N86 A92 A93	N85-Q89 WeakPolarHBondContact O-CG 3.4Å; N85-Q89 PolarHBondContact O-N 2.64Å; N86-Q89 PolarHBondContact O-N 2.85Å; Q89-A92 PolarHBondContact O-N 3.49Å; Q89-A93 WeakPolarHBondContact O-CB 3.47Å; Q89-A93 PolarHBondContact O-N 3.46Å
90	Q	85.9	Confident	86.2	Confident	95 Å²	95	88 Å²	88	44%	0.444	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-42.2	177	-174.2	168.7	66.7	0	0	111.7	D10 N86 L87 I88 A94	D10-Q90 PolarHBondContact OD2-NE2 3.3Å; N86-Q90 VanDerWaalsContact O-CB 3.31Å; N86-Q90 WeakPolarHBondContact O-CB 3.13Å; N86-Q90 PolarHBondContact O-N 3.17Å; L87-Q90 PolarHBondContact O-N 3.12Å; I88-Q90 PolarHBondContact O-N 2.91Å; Q90-A94 WeakPolarHBondContact O-CB 3.4Å; Q90-A94 PolarHBondContact O-N 3.36Å
91	K	87.2	Confident	84.7	Confident	148 Å²	148	90.4 Å²	90.4	64%	0.643	48%	0.484	S	S	*	.	H	α-helix	trans	-65.3	-42.5	172.7	-76.4	-173.5	173.4	-170	0	112.7	L87 I88 A94 A95	L87-K91 WeakPolarHBondContact O-CG 3Å; L87-K91 PolarHBondContact O-N 3.08Å; I88-K91 PolarHBondContact O-N 3.23Å; K91-A94 PolarHBondContact O-N 3.37Å; K91-A95 WeakPolarHBondContact O-CB 3.47Å; K91-A95 PolarHBondContact O-N 3.05Å
92	A	88.8	Confident	83.1	Confident	51 Å²	51	94 Å²	94	42%	0.421	50%	0.499	S	S	.	.	H	α-helix	trans	-64.2	-45	178.3	0	0	0	0	0	111.8	I88 Q89 A94 A95 M96	I88-A92 WeakPolarHBondContact O-CB 3.21Å; I88-A92 PolarHBondContact O-N 3.07Å; Q89-A92 PolarHBondContact O-N 3.49Å; A92-A94 PolarHBondContact O-N 2.95Å; A92-A95 PolarHBondContact O-N 3.48Å; A92-M96 WeakPolarHBondContact O-CG 3.08Å; A92-M96 PolarHBondContact O-N 3.34Å
93	A	86.2	Confident	81.6	Confident	62 Å²	62	100.1 Å²	100.1	51%	0.512	52%	0.523	S	S	.	.	H	α-helix	trans	-62.5	-40.9	175.9	0	0	0	0	0	112.2	Q89 M96 L97	Q89-A93 WeakPolarHBondContact O-CB 3.47Å; Q89-A93 PolarHBondContact O-N 3.46Å; A93-M96 PolarHBondContact O-N 3.06Å; A93-L97 WeakPolarHBondContact O-CB 3.25Å; A93-L97 PolarHBondContact O-N 3.46Å
94	A	84.7	Confident	79.7	Confident	60 Å²	60	106 Å²	106	50%	0.496	55%	0.549	S	S	.	.	H	α-helix	trans	-64.3	-39.5	174.3	0	0	0	0	0	112.5	Q90 K91 A92 L97 A98	Q90-A94 WeakPolarHBondContact O-CB 3.4Å; Q90-A94 PolarHBondContact O-N 3.36Å; K91-A94 PolarHBondContact O-N 3.37Å; A92-A94 PolarHBondContact O-N 2.95Å; A94-L97 PolarHBondContact O-N 3.15Å; A94-A98 WeakPolarHBondContact O-CB 3.44Å; A94-A98 PolarHBondContact O-N 3.16Å
95	A	84.3	Confident	78	Confident	60 Å²	60	104.2 Å²	104.2	50%	0.496	55%	0.551	S	S	.	*	H	α-helix	trans	-65.6	-43.3	175.9	0	0	0	0	0	112.2	K91 A92 L97 A98 Q99	K91-A95 WeakPolarHBondContact O-CB 3.47Å; K91-A95 PolarHBondContact O-N 3.05Å; A92-A95 PolarHBondContact O-N 3.48Å; A95-L97 VanDerWaalsContact C-N 3.34Å; A95-L97 PolarHBondContact O-N 2.79Å; A95-A98 PolarHBondContact O-N 3.18Å; A95-Q99 PolarHBondContact O-N 3.19Å
96	M	84.1	Confident	76.1	Confident	141 Å²	141	106.6 Å²	106.6	70%	0.695	57%	0.571	S	S	*	*	H	α-helix	trans	-62.3	-39.8	174.4	-69.7	-174	75.5	0	0	112.2	A92 A93 Q99 Q100	A92-M96 WeakPolarHBondContact O-CG 3.08Å; A92-M96 PolarHBondContact O-N 3.34Å; A93-M96 PolarHBondContact O-N 3.06Å; M96-Q99 PolarHBondContact O-N 3.18Å; M96-Q100 WeakPolarHBondContact O-CB 3.5Å; M96-Q100 PolarHBondContact O-N 2.94Å
97	L	83.3	Confident	74.3	Confident	81 Å²	81	108.1 Å²	108.1	42%	0.424	60%	0.596	S	S	.	*	H	α-helix	trans	-65.9	-40	176.3	-176.4	61.7	0	0	0	112.1	M5 A93 A94 A95 Q100 M101	M5-L97 HydrophobicContact CE-CD2 4.18Å; A93-L97 WeakPolarHBondContact O-CB 3.25Å; A93-L97 PolarHBondContact O-N 3.46Å; A94-L97 PolarHBondContact O-N 3.15Å; A95-L97 VanDerWaalsContact C-N 3.34Å; A95-L97 PolarHBondContact O-N 2.79Å; L97-Q100 PolarHBondContact O-N 3.27Å; L97-M101 WeakPolarHBondContact O-CG 3.47Å; L97-M101 PolarHBondContact O-N 2.82Å
98	A	78.3	Confident	72.4	Confident	57 Å²	57	107.8 Å²	107.8	47%	0.471	61%	0.606	S	S	.	*	H	α-helix	trans	-63.2	-43.5	174.3	0	0	0	0	0	111.9	A94 A95 Q100 M101 Q102	A94-A98 WeakPolarHBondContact O-CB 3.44Å; A94-A98 PolarHBondContact O-N 3.16Å; A95-A98 PolarHBondContact O-N 3.18Å; A98-Q100 VanDerWaalsContact C-N 3.33Å; A98-Q100 PolarHBondContact O-N 2.97Å; A98-M101 PolarHBondContact O-N 3.47Å; A98-Q102 PolarHBondContact O-N 3.26Å; A98-Q102 VanDerWaalsContact O-N 3.13Å
99	Q	77.6	Confident	70.3	Confident	131 Å²	131	111.1 Å²	111.1	61%	0.612	62%	0.619	S	S	*	*	H	α-helix	trans	-64.7	-35.9	175.7	-169.6	177.1	-3.9	0	0	112.1	A95 M96 Q102 F103	A95-Q99 PolarHBondContact O-N 3.19Å; M96-Q99 PolarHBondContact O-N 3.18Å; Q99-Q102 PolarHBondContact O-N 3.5Å; Q99-F103 PolarHBondContact O-N 3.44Å
100	Q	66.3	Low	68.4	Low	123 Å²	123	112.7 Å²	112.7	58%	0.575	63%	0.631	S	S	*	*	H	α-helix	trans	-64.9	-39.1	173.1	-171.1	177.5	13.8	0	0	112.1	M96 L97 A98 F103 M104	M96-Q100 WeakPolarHBondContact O-CB 3.5Å; M96-Q100 PolarHBondContact O-N 2.94Å; L97-Q100 PolarHBondContact O-N 3.27Å; A98-Q100 VanDerWaalsContact C-N 3.33Å; A98-Q100 PolarHBondContact O-N 2.97Å; Q100-F103 PolarHBondContact O-N 3.41Å; Q100-F103 VanDerWaalsContact O-N 3.13Å; Q100-M104 PolarHBondContact O-N 3.15Å
101	M	60.5	Low	66.6	Low	118 Å²	118	116.1 Å²	116.1	58%	0.581	65%	0.646	S	S	*	*	H	α-helix	trans	-66	-35.3	175.9	-71.5	-136.5	70.8	0	0	112.9	L97 A98 F103 M104	L97-M101 WeakPolarHBondContact O-CG 3.47Å; L97-M101 PolarHBondContact O-N 2.82Å; A98-M101 PolarHBondContact O-N 3.47Å; M101-F103 PolarHBondContact O-N 3.39Å; M101-M104 PolarHBondContact O-N 3.45Å; M101-M104 VanDerWaalsContact O-N 3.08Å
102	Q	58.8	Low	64.6	Low	160 Å²	160	114.5 Å²	114.5	75%	0.748	65%	0.651	S	S	*	*	H	α-helix	trans	-60.8	-29.9	171.8	-70.8	-174.2	-85.1	0	0	112.7	A98 Q99	A98-Q102 PolarHBondContact O-N 3.26Å; A98-Q102 VanDerWaalsContact O-N 3.13Å; Q99-Q102 PolarHBondContact O-N 3.5Å
103	F	58.9	Low	62.6	Low	187 Å²	187	119.6 Å²	119.6	82%	0.82	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-4.1	176.4	-116.6	-88.8	0	0	0	114.4	Q99 Q100 M101	Q99-F103 PolarHBondContact O-N 3.44Å; Q100-F103 PolarHBondContact O-N 3.41Å; Q100-F103 VanDerWaalsContact O-N 3.13Å; M101-F103 PolarHBondContact O-N 3.39Å
104	M	53.2	Low	60.8	Low	137 Å²	137	122.2 Å²	122.2	68%	0.675	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	5.7	178.9	-89.3	-153.3	69.2	0	0	114.9	Q100 M101 P106	Q100-M104 PolarHBondContact O-N 3.15Å; M101-M104 PolarHBondContact O-N 3.45Å; M101-M104 VanDerWaalsContact O-N 3.08Å; M104-P106 VanDerWaalsContact O-CD 3.22Å; M104-P106 WeakPolarHBondContact O-CD 3.34Å
105	L	54.4	Low	58.8	Low	129 Å²	129	125.3 Å²	125.3	68%	0.675	69%	0.693	S	S	*	*			trans	-109.9	79.8	164.9	-85.7	78.9	0	0	0	111.3	G107	L105-G107 PolarHBondContact O-N 3.05Å
106	P	50.6	Low	56.8	Low	131 Å²	131	131.2 Å²	131.2	85%	0.851	71%	0.707	S	S	*	*			trans	-73.8	68.5	166.3	33.5	-35.3	0	0	0	110	M104	M104-P106 VanDerWaalsContact O-CD 3.22Å; M104-P106 WeakPolarHBondContact O-CD 3.34Å
107	G	53.3	Low	55.8	Low	71 Å²	71	130 Å²	130	73%	0.732	71%	0.71	S	S	*	*			trans	-170.2	26	-166.1	0	0	0	0	0	118.3	L105	L105-G107 PolarHBondContact O-N 3.05Å
108	A	48.3	Very low	53.8	Low	82 Å²	82	133 Å²	133	68%	0.678	73%	0.731	S	S	*	*			trans	-143.5	65.5	176.1	0	0	0	0	0	112.9	L110	A108-L110 VanDerWaalsContact C-N 3.32Å; A108-L110 PolarHBondContact O-N 3.08Å
109	Q	43.6	Very low	51.9	Low	179 Å²	179	136.8 Å²	136.8	84%	0.836	75%	0.749	S	S	*	*			trans	-71.9	80.2	173.1	-77.1	-83.2	70.9	0	0	111.3
110	L	49.1	Very low	50.7	Low	164 Å²	164	135.9 Å²	135.9	86%	0.859	75%	0.754	S	S	*	*			trans	-84.9	111	163.8	-67.6	-179.1	0	0	0	109	A108	A108-L110 VanDerWaalsContact C-N 3.32Å; A108-L110 PolarHBondContact O-N 3.08Å
111	Q	47.7	Very low	49.2	Very low	166 Å²	166	135 Å²	135	78%	0.776	76%	0.762	S	S	*	*			trans	-74.9	135.3	-175.3	-64.2	-165.3	-8.9	0	0	112	I113	Q111-I113 PolarHBondContact O-N 3.42Å
112	P	44	Very low	47.9	Very low	114 Å²	114	136.9 Å²	136.9	74%	0.74	77%	0.773	S	S	*	*			trans	-73.5	115.5	164.2	30.6	-31	0	0	0	108.9	T114	P112-T114 PolarHBondContact O-N 3.14Å; P112-T114 VanDerWaalsContact O-N 3.15Å
113	I	46.8	Very low	46.6	Very low	158 Å²	158	133.5 Å²	133.5	81%	0.81	77%	0.772	S	S	*	*			trans	-69.3	112.8	174.6	-63.1	177.6	0	0	0	108.6	Q111	Q111-I113 PolarHBondContact O-N 3.42Å
114	T	49.8	Very low	45.3	Very low	117 Å²	117	131.2 Å²	131.2	72%	0.718	77%	0.774	S	S	*	*			trans	-80.9	122.5	173.7	51.2	0	0	0	0	110.9	P112	P112-T114 PolarHBondContact O-N 3.14Å; P112-T114 VanDerWaalsContact O-N 3.15Å
115	T	42	Very low	44.5	Very low	126 Å²	126	129.9 Å²	129.9	77%	0.773	78%	0.778	S	S	*	*			trans	-128.9	145.3	163.5	-38.7	0	0	0	0	109.1
116	F	42.9	Very low	44.3	Very low	184 Å²	184	129.1 Å²	129.1	81%	0.807	78%	0.781	S	S	*	*			trans	-83.7	157	-157.7	-72.1	-93.6	0	0	0	115
117	P	62.4	Low	43.4	Very low	115 Å²	115	128 Å²	128	75%	0.747	78%	0.776	S	S	*	*			trans	-86.4	142.8	-179.2	34.4	-34.6	0	0	0	113.1
118	V	40.7	Very low	42.9	Very low	143 Å²	143	133.3 Å²	133.3	87%	0.867	78%	0.784	S	S	*	*			trans	-144.2	137.8	159.1	-77.6	0	0	0	0	111.8
119	T	38.8	Very low	42.2	Very low	137 Å²	137	133 Å²	133	84%	0.84	78%	0.782	S	S	*	*			trans	-143	168.2	163	56.9	0	0	0	0	106.3
120	P	53.3	Low	41.8	Very low	112 Å²	112	134.4 Å²	134.4	73%	0.727	79%	0.786	S	S	*	*			cis	-135.9	-175	8	39.7	-20.7	0	0	0	116.1
121	S	34	Very low	41.1	Very low	106 Å²	106	131.3 Å²	131.3	74%	0.741	78%	0.778	S	S	*	*			trans	100.4	148.5	133.5	-102.6	0	0	0	0	123.7
122	L	33.5	Very low	41.4	Very low	157 Å²	157	128.7 Å²	128.7	82%	0.822	78%	0.775	S	S	*	*			trans	81.2	114.6	160.3	-95.3	71.1	0	0	0	122.1
123	A	30.3	Very low	41	Very low	88 Å²	88	133.2 Å²	133.2	73%	0.727	78%	0.779	S	S	*	*			trans	62	112	138.4	0	0	0	0	0	121.1
124	T	33.4	Very low	40.8	Very low	139 Å²	139	132.3 Å²	132.3	85%	0.853	78%	0.775	S	S	*	*				-176.5	135	92.3	-71.5	0	0	0	0	111.6
125	S	35.3	Very low	40	Very low	109 Å²	109	131.5 Å²	131.5	76%	0.762	77%	0.774	S	S	*	*			trans	-91.6	173.9	175.7	-62.1	0	0	0	0	110.9
126	P	50	Low	40.1	Very low	113 Å²	113	133.4 Å²	133.4	73%	0.734	77%	0.774	S	S	*	*			cis	-141.1	165.5	12.2	42.5	-25	0	0	0	117.7
127	S	32.9	Very low	40	Very low	108 Å²	108	133.2 Å²	133.2	76%	0.755	78%	0.778	S	S	*	*				180	127.2	116.9	-79.7	0	0	0	0	113.9
128	M	41.5	Very low	38.8	Very low	182 Å²	182	130.7 Å²	130.7	90%	0.897	77%	0.773	S	S	*	*			trans	24.1	134.6	133.9	-53	-53.1	-100.1	0	0	119.8
129	A	34.6	Very low	39.2	Very low	77 Å²	77	130.2 Å²	130.2	64%	0.636	77%	0.772	S	S	*	*			cis	-167.3	179	-0.2	0	0	0	0	0	113.1
130	F	33.9	Very low	39	Very low	207 Å²	207	127.9 Å²	127.9	91%	0.908	77%	0.767	S	S	*	*			trans	72.1	88.3	161	-92.7	-84.3	0	0	0	120.8
131	S	35.5	Very low	38.3	Very low	99 Å²	99	131.7 Å²	131.7	69%	0.692	78%	0.778	S	S	*	*			trans	-95.2	-161.7	140.4	-43.3	0	0	0	0	108.3
132	P	52.7	Low	38.4	Very low	111 Å²	111	129.8 Å²	129.8	72%	0.721	78%	0.775	S	S	*	*			cis	-135.8	168.7	-15.8	35.1	-15.8	0	0	0	115.7
133	Y	36.1	Very low	38.6	Very low	209 Å²	209	130.9 Å²	130.9	82%	0.82	78%	0.781	S	S	*	*			trans	159	138.5	137.1	-107	-119.6	0	0	0	109.3
134	L	43.4	Very low	38.7	Very low	139 Å²	139	134.9 Å²	134.9	73%	0.728	79%	0.786	S	S	*	*			cis	-152.2	164.9	-17.6	-165.5	64.7	0	0	0	109.1
135	S	33.5	Very low	39.6	Very low	100 Å²	100	133 Å²	133	70%	0.699	78%	0.777	S	S	*	*			trans	-78.1	131.3	-165.7	-51.4	0	0	0	0	117.3
136	H	42.7	Very low	39.3	Very low	167 Å²	167	135.6 Å²	135.6	77%	0.773	78%	0.777	S	S	*	*				16.6	112.8	122.2	-172.6	-66.3	0	0	0	119.3
137	M	41.2	Very low	38.5	Very low	179 Å²	179	137.2 Å²	137.2	88%	0.882	78%	0.778	S	S	*	*			trans	-143.4	151.7	149.1	-63.7	-65.3	164.5	0	0	106.2
138	G	36.5	Very low	38.8	Very low	62 Å²	62	139.7 Å²	139.7	64%	0.639	78%	0.782	S	S	*	*			cis	140.6	95.4	9.5	0	0	0	0	0	108.9
139	P	51.1	Low	39.1	Very low	133 Å²	133	136.4 Å²	136.4	86%	0.864	77%	0.774	S	S	*	*			trans	-108.8	133.1	-164.2	36.6	-30.5	0	0	0	115.6
140	A	33.3	Very low	39.1	Very low	89 Å²	89	138.2 Å²	138.2	74%	0.736	78%	0.782	S	S	*	*			trans	-171.3	150	154.7	0	0	0	0	0	112.6
141	M	38.8	Very low	39.4	Very low	191 Å²	191	134.3 Å²	134.3	94%	0.941	78%	0.776	S	S	*	*			trans	61.2	143	170.1	-38.2	-51.1	-84.8	0	0	115.6
142	G	36.6	Very low	40.4	Very low	66 Å²	66	134.7 Å²	134.7	68%	0.68	78%	0.776	S	S	*	*			cis	149.8	123.7	5.6	0	0	0	0	0	105.7
143	L	37.3	Very low	39.6	Very low	181 Å²	181	136.6 Å²	136.6	95%	0.948	78%	0.779	S	S	*	*				-173.1	176	80.3	-79.7	167.4	0	0	0	110.3
144	M	32.9	Very low	39.6	Very low	171 Å²	171	134.6 Å²	134.6	84%	0.842	78%	0.782	S	S	*	*			trans	-85.5	174	166.3	-82.3	-77.5	106.1	0	0	111.5
145	P	51.3	Low	39.6	Very low	101 Å²	101	134 Å²	134	66%	0.656	78%	0.784	S	S	*	*			cis	-136.1	-169.9	-18.5	30.5	-7.5	0	0	0	114.6
146	E	30.5	Very low	40.2	Very low	163 Å²	163	135.3 Å²	135.3	76%	0.762	79%	0.79	S	S	*	*			trans	88.5	151.2	139.8	-119.7	-177.5	96.2	0	0	123.6
147	L	31.7	Very low	39.6	Very low	147 Å²	147	130.7 Å²	130.7	77%	0.77	79%	0.788	S	S	*	*			trans	60.9	116	163.3	-54.4	-176	0	0	0	123.1
148	L	39.7	Very low	39.5	Very low	159 Å²	159	127.9 Å²	127.9	83%	0.832	79%	0.785	S	S	*	*			trans	-71.4	153.6	143	-84.2	163.1	0	0	0	109.3
149	P	49	Very low	40.6	Very low	113 Å²	113	130.5 Å²	130.5	73%	0.734	79%	0.791	S	S	*	*				-158.6	168.1	65.9	42.8	-21.7	0	0	0	120.5
150	S	34.1	Very low	39.8	Very low	115 Å²	115	131.1 Å²	131.1	80%	0.804	79%	0.793	S	S	*	*			trans	70.9	138.5	145.1	-66	0	0	0	0	124.3
151	T	39.6	Very low	40.1	Very low	125 Å²	125	131.5 Å²	131.5	77%	0.767	79%	0.79	S	S	*	*			trans	-60.9	169.7	162.8	51.6	0	0	0	0	113.6
152	P	56.3	Low	40	Very low	107 Å²	107	129.4 Å²	129.4	70%	0.695	78%	0.782	S	S	*	*			cis	-161	-170.9	42.7	43.7	-19.1	0	0	0	121.1
153	L	36.2	Very low	39.9	Very low	152 Å²	152	132.8 Å²	132.8	80%	0.796	79%	0.789	S	S	*	*			trans	72.1	129.6	157.4	-59.4	-177	0	0	0	122.4
154	L	36.3	Very low	40.3	Very low	166 Å²	166	128.1 Å²	128.1	87%	0.869	78%	0.777	S	S	*	*				-159.9	152.3	108.8	-136.9	73.9	0	0	0	112.5
155	V	44	Very low	40.6	Very low	128 Å²	128	128.7 Å²	128.7	78%	0.776	78%	0.78	S	S	*	*			trans	-148.7	134.2	179.8	168.3	0	0	0	0	110
156	P	44.8	Very low	40.1	Very low	127 Å²	127	126.9 Å²	126.9	83%	0.825	78%	0.779	S	S	*	*				-144	160	125.6	36.5	-22.1	0	0	0	112.9
157	G	31.5	Very low	40.3	Very low	70 Å²	70	126.7 Å²	126.7	72%	0.722	78%	0.783	S	S	*	*			cis	-173.5	178.1	-1.6	0	0	0	0	0	111.6
158	S	38.3	Very low	40.5	Very low	120 Å²	120	123.6 Å²	123.6	84%	0.839	79%	0.787	S	S	*	*			trans	-128.8	-171.7	177.9	-51.2	0	0	0	0	108.5
159	P	59.7	Low	40.5	Very low	117 Å²	117	122.7 Å²	122.7	76%	0.76	79%	0.788	S	S	*	*			cis	-140.2	171.7	-1.4	42.9	-26.3	0	0	0	116.5
160	T	33.6	Very low	40	Very low	146 Å²	146	121.5 Å²	121.5	90%	0.896	78%	0.783	S	S	*	*			trans	-145.3	149.3	137.7	-48.7	0	0	0	0	109
161	S	39	Very low	40.1	Very low	96 Å²	96	120.8 Å²	120.8	67%	0.671	78%	0.784	S	S	*	*			trans	-90.2	158.9	179.5	48.3	0	0	0	0	113.3
162	L	36.8	Very low	40.1	Very low	147 Å²	147	121.3 Å²	121.3	77%	0.77	78%	0.777	S	S	*	*				162.7	149.5	117.8	-86.3	173.3	0	0	0	114.2
163	T	36.2	Very low	39.2	Very low	138 Å²	138	126 Å²	126	85%	0.847	79%	0.787	S	S	*	*			trans	62.8	146.1	157	47	0	0	0	0	120.6
164	A	45.2	Very low	39.5	Very low	83 Å²	83	124.7 Å²	124.7	69%	0.686	78%	0.777	S	S	*	*			trans	-84.3	155.1	-179.2	0	0	0	0	0	112.8
165	M	37.9	Very low	39.9	Very low	183 Å²	183	121.8 Å²	121.8	90%	0.901	77%	0.766	S	S	*	*			trans	-150.6	134.4	130.6	-140.7	67.2	69	0	0	108.9
166	G	42	Very low	40.5	Very low	62 Å²	62	123.8 Å²	123.8	64%	0.639	76%	0.759	S	S	*	*			trans	-93	149.3	169	0	0	0	0	0	110.5
167	N	34.5	Very low	41.4	Very low	159 Å²	159	119.3 Å²	119.3	85%	0.85	73%	0.73	S	S	*	*			trans	-161.6	95.8	150.9	-109.8	-9.7	0	0	0	110.7	T169	N167-T169 PolarHBondContact O-N 2.76Å
168	G	35.9	Very low	43.4	Very low	82 Å²	82	116.3 Å²	116.3	85%	0.845	70%	0.697	S	S	*	*			trans	-79.9	96.3	172.1	0	0	0	0	0	110.5	S170	G168-S170 PolarHBondContact O-N 3.33Å
169	T	39.8	Very low	45.6	Very low	140 Å²	140	115.2 Å²	115.2	86%	0.859	68%	0.678	S	S	*	*			trans	-74.5	63.8	176.6	39.4	0	0	0	0	112.5	N167	N167-T169 PolarHBondContact O-N 2.76Å
170	S	37.7	Very low	46.9	Very low	89 Å²	89	111 Å²	111	62%	0.622	65%	0.648	S	S	*	*			trans	-88.5	112.2	164.1	-171.3	0	0	0	0	109.6	G168 Q172	G168-S170 PolarHBondContact O-N 3.33Å; S170-Q172 PolarHBondContact O-N 3.45Å
171	A	37.2	Very low	49.5	Very low	100 Å²	100	110.1 Å²	110.1	83%	0.826	63%	0.634	S	S	*	*			trans	-72.1	75.1	168.7	0	0	0	0	0	109.7	K173	A171-K173 PolarHBondContact O-N 3.45Å
172	Q	39.2	Very low	51.9	Low	135 Å²	135	105.9 Å²	105.9	63%	0.631	60%	0.604	S	S	*	*			trans	-63.4	97.7	179.9	-75.7	-167.5	-26.3	0	0	110.8	S170 H174	S170-Q172 PolarHBondContact O-N 3.45Å; Q172-H174 PolarHBondContact O-N 3.18Å
173	K	37.8	Very low	54.4	Low	205 Å²	205	98.9 Å²	98.9	89%	0.891	57%	0.568	S	S	*	*			trans	-61.6	87.1	152.9	-87.8	-170.8	172.6	-178.4	0	108.2	A171 T175	A171-K173 PolarHBondContact O-N 3.45Å; K173-T175 PolarHBondContact O-N 2.94Å
174	H	41.7	Very low	56.9	Low	126 Å²	126	100.2 Å²	100.2	58%	0.583	56%	0.557	S	S	*	*			trans	21	89.2	168.7	-169.7	79.7	0	0	0	114.3	Q172 R176	Q172-H174 PolarHBondContact O-N 3.18Å; H174-R176 PolarHBondContact O-N 2.86Å
175	T	45.2	Very low	58.9	Low	105 Å²	105	99.8 Å²	99.8	64%	0.644	54%	0.541	S	S	*	.			trans	-72.8	69.1	177.1	51.1	0	0	0	0	111.3	K173	K173-T175 PolarHBondContact O-N 2.94Å
176	R	56.8	Low	61.2	Low	169 Å²	169	94.7 Å²	94.7	64%	0.638	51%	0.514	S	S	*	.			trans	9.7	111.8	159.7	-169.2	-174.4	166.1	141	-7.6	115.1	H174 D178	H174-R176 PolarHBondContact O-N 2.86Å; R176-D178 HydrophobicContact CG-CB 3.69Å; R176-D178 IonicContact CZ-OD1 3.94Å; R176-D178 IonicContact NE-OD1 3.78Å; R176-D178 PolarHBondContact NE-OD1 3.14Å; R176-D178 IonicContact NH2-OD1 3.65Å; R176-D178 PolarHBondContact NH2-OD1 2.89Å; R176-D178 PolarHBondContact O-N 2.98Å
177	T	63.8	Low	63.3	Low	34 Å²	34	96.4 Å²	96.4	21%	0.209	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	48	178.9	-37.4	0	0	0	0	114.6	S248 Q249	T177-S248 VanDerWaalsContact CG2-OG 3.26Å; T177-S248 WeakPolarHBondContact CG2-OG 3.16Å; T177-Q249 HydrophobicContact CG2-CG 3.79Å; T177-Q249 PolarHBondContact O-NE2 3.24Å
178	D	72.9	Confident	65.6	Low	7 Å²	7	98.2 Å²	98.2	4%	0.037	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-2.8	-168.1	-165.6	-160.7	0	0	0	112.4	R176 I217 V218 M220	R176-D178 HydrophobicContact CG-CB 3.69Å; R176-D178 IonicContact CZ-OD1 3.94Å; R176-D178 IonicContact NE-OD1 3.78Å; R176-D178 PolarHBondContact NE-OD1 3.14Å; R176-D178 IonicContact NH2-OD1 3.65Å; R176-D178 PolarHBondContact NH2-OD1 2.89Å; R176-D178 PolarHBondContact O-N 2.98Å; D178-I217 WeakPolarHBondContact O-CA 3.38Å; D178-V218 PolarHBondContact O-N 3.39Å; D178-M220 HydrophobicContact CB-CE 4.13Å; D178-M220 WeakPolarHBondContact OD2-CE 3.45Å; D178-M220 WeakPolarHBondContact OD2-CG 3.11Å
179	K	84	Confident	67.9	Low	97 Å²	97	97.7 Å²	97.7	42%	0.422	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118.6	-178.2	-169.3	173.5	-172.9	-71	0	108.3	E213 S215	K179-E213 WeakPolarHBondContact CE-OE2 3.26Å; K179-E213 VanDerWaalsContact NZ-CB 3.26Å; K179-E213 IonicContact NZ-OE2 3.8Å; K179-E213 PolarHBondContact NZ-OE2 3.15Å; K179-S215 WeakPolarHBondContact CE-OG 3.35Å; K179-S215 PolarHBondContact NZ-OG 2.8Å
180	L	86.9	Confident	70.1	Confident	28 Å²	28	96.7 Å²	96.7	15%	0.147	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129	-178.9	-113.3	62.3	0	0	0	110.1	A201 S215 V216 V218 P237 L241 I245	L180-A201 HydrophobicContact CB-CB 4.37Å; L180-A201 HydrophobicContact CD2-CB 4.48Å; L180-S215 CarbonylContact O-C 3.55Å; L180-S215 WeakPolarHBondContact O-CA 3.42Å; L180-S215 VanDerWaalsContact O-CB 3.32Å; L180-S215 WeakPolarHBondContact O-CB 3.22Å; L180-V216 HydrophobicContact CB-CG2 3.85Å; L180-V216 PolarHBondContact N-O 3.2Å; L180-V216 PolarHBondContact O-N 2.95Å; L180-V218 HydrophobicContact CB-CG2 4.21Å; L180-V218 HydrophobicContact CD1-CG2 4.06Å; L180-V218 HydrophobicContact CD2-CG2 4.06Å; L180-V218 HydrophobicContact CG-CG2 4.33Å; L180-P237 HydrophobicContact CD2-CB 4.34Å; L180-L241 HydrophobicContact CD2-CB 4.24Å; L180-L241 HydrophobicContact CD2-CD1 4.06Å; L180-I245 HydrophobicContact CD1-CD1 3.77Å; L180-I245 HydrophobicContact CD1-CG1 3.74Å; L180-I245 HydrophobicContact CD2-CD1 3.94Å
181	E	89.1	Confident	72.5	Confident	128 Å²	128	93.9 Å²	93.9	60%	0.598	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	139.3	173.5	-64.1	178.7	109.8	0	0	110.9	Y200 A201	E181-Y200 HydrophobicContact CB-CD1 4.09Å; E181-A201 PolarHBondContact O-N 3.01Å
182	V	89.7	Confident	74.7	Confident	7 Å²	7	96 Å²	96	4%	0.042	47%	0.466	C	S	.	.	B	Isolated β-bridge	trans	-81.9	141.9	174.3	174.9	0	0	0	0	110.1	R184 A201 P203 V209 N214 V216	V182-R184 PolarHBondContact O-N 3.28Å; V182-R184 VanDerWaalsContact O-N 3.16Å; V182-A201 WeakPolarHBondContact CA-O 3.22Å; V182-P203 HydrophobicContact CG1-CG 3.94Å; V182-P203 HydrophobicContact CG2-CG 3.89Å; V182-V209 HydrophobicContact CG2-CG1 4.06Å; V182-V209 HydrophobicContact CG2-CG2 4.1Å; V182-N214 WeakPolarHBondContact CB-O 3.42Å; V182-N214 PolarHBondContact N-O 3.27Å; V182-V216 HydrophobicContact CG2-CG1 3.81Å
183	C	88.8	Confident	76.8	Confident	0 Å²	0	97.1 Å²	97.1	0%	0	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-63.8	116.4	175.9	180	0	0	0	0	110.7	E185 F186 Q187 C191 C198 Y200 A201 H202	C183-E185 VanDerWaalsContact C-N 3.31Å; C183-E185 PolarHBondContact O-N 2.8Å; C183-F186 HydrophobicContact CB-CB 3.63Å; C183-F186 PolarHBondContact O-N 3.36Å; C183-F186 PolarHBondContact SG-N 3.22Å; C183-Q187 PolarHBondContact O-N 2.77Å; C183-C191 VanDerWaalsContact SG-SG 3.66Å; C183-C198 VanDerWaalsContact SG-SG 3.69Å; C183-Y200 HydrophobicContact CB-CD2 4.47Å; C183-A201 PolarHBondContact N-O 3.5Å; C183-H202 VanDerWaalsContact CB-CD2 3.43Å; C183-H202 WeakPolarHBondContact CB-CD2 3.12Å; C183-H202 WeakPolarHBondContact CB-NE2 3.42Å
184	R	88.2	Confident	78.3	Confident	166 Å²	166	89.2 Å²	89.2	63%	0.626	44%	0.442	S	S	*	.	H	α-helix	trans	-64	-38.2	177.5	-71.7	179.5	169.2	-178.7	-3.6	111.4	V182 F186 Q187 R188	V182-R184 PolarHBondContact O-N 3.28Å; V182-R184 VanDerWaalsContact O-N 3.16Å; R184-F186 VanDerWaalsContact C-N 3.33Å; R184-F186 PolarHBondContact O-N 3.34Å; R184-Q187 PolarHBondContact O-N 3.3Å; R184-R188 WeakPolarHBondContact O-CG 3.47Å; R184-R188 PolarHBondContact O-N 3.23Å
185	E	87.9	Confident	79.8	Confident	73 Å²	73	86.9 Å²	86.9	34%	0.341	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-37.3	174.2	-53.5	80.7	-91	0	0	111.7	C183 R188 G189 N190 C191	C183-E185 VanDerWaalsContact C-N 3.31Å; C183-E185 PolarHBondContact O-N 2.8Å; E185-R188 PolarHBondContact O-N 3.06Å; E185-G189 PolarHBondContact O-N 3.34Å; E185-G189 VanDerWaalsContact O-N 3.15Å; E185-N190 PolarHBondContact O-N 2.79Å; E185-C191 HydrophobicContact CB-CB 3.82Å; E185-C191 PolarHBondContact O-N 3.09Å; E185-C191 VanDerWaalsContact O-N 3.15Å
186	F	86.7	Confident	81.1	Confident	76 Å²	76	85.1 Å²	85.1	33%	0.333	42%	0.423	S	S	.	.	H	α-helix	trans	-71.3	-42.2	176.7	-178.5	-105.8	0	0	0	110.9	C183 R184 R188 G189 C191 H202	C183-F186 HydrophobicContact CB-CB 3.63Å; C183-F186 PolarHBondContact O-N 3.36Å; C183-F186 PolarHBondContact SG-N 3.22Å; R184-F186 VanDerWaalsContact C-N 3.33Å; R184-F186 PolarHBondContact O-N 3.34Å; F186-R188 PolarHBondContact O-N 3.21Å; F186-R188 VanDerWaalsContact O-N 3.12Å; F186-G189 PolarHBondContact O-N 3.02Å; F186-C191 HydrophobicContact CB-CB 3.9Å; F186-H202 HydrophobicContact CD1-CB 4.01Å; F186-H202 HydrophobicContact CD2-CB 4.28Å; F186-H202 AromaticContact CD2-CE1 3.67Å; F186-H202 AromaticContact CD2-CG 3.73Å; F186-H202 AromaticContact CD2-ND1 3.37Å; F186-H202 WeakPolarHBondContact CD2-ND1 3.16Å; F186-H202 HydrophobicContact CE1-CB 3.93Å; F186-H202 HydrophobicContact CE2-CB 4.21Å; F186-H202 AromaticContact CE2-ND1 3.73Å; F186-H202 HydrophobicContact CG-CB 4.19Å; F186-H202 AromaticContact CG-CD2 3.83Å; F186-H202 AromaticContact CG-CE1 3.99Å; F186-H202 AromaticContact CG-CG 3.69Å; F186-H202 AromaticContact CG-ND1 3.8Å; F186-H202 HydrophobicContact CZ-CB 4.03Å
187	Q	85.5	Confident	82.2	Confident	99 Å²	99	82.6 Å²	82.6	46%	0.463	42%	0.422	S	S	.	.	H	α-helix	trans	-64.7	-12.3	173.1	-163	169.1	35.7	0	0	113.3	C183 R184 N214	C183-Q187 PolarHBondContact O-N 2.77Å; R184-Q187 PolarHBondContact O-N 3.3Å; Q187-N214 PolarHBondContact OE1-ND2 3Å
188	R	83.9	Confident	83.3	Confident	197 Å²	197	81.1 Å²	81.1	74%	0.743	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-11.4	170	-69.3	-85.7	-173.1	-94	2	113.8	R184 E185 F186 N190	R184-R188 WeakPolarHBondContact O-CG 3.47Å; R184-R188 PolarHBondContact O-N 3.23Å; E185-R188 PolarHBondContact O-N 3.06Å; F186-R188 PolarHBondContact O-N 3.21Å; F186-R188 VanDerWaalsContact O-N 3.12Å; R188-N190 PolarHBondContact O-OD1 2.53Å
189	G	82.9	Confident	83.8	Confident	70 Å²	70	88.7 Å²	88.7	72%	0.722	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	11.7	-171.5	0	0	0	0	0	115	E185 F186	E185-G189 PolarHBondContact O-N 3.34Å; E185-G189 VanDerWaalsContact O-N 3.15Å; F186-G189 PolarHBondContact O-N 3.02Å
190	N	86.9	Confident	83.9	Confident	120 Å²	120	88 Å²	88	64%	0.642	44%	0.436	S	S	*	.			trans	-109.1	1.8	-175.2	-63.8	115.8	0	0	0	114.8	E185 R188 T192	E185-N190 PolarHBondContact O-N 2.79Å; R188-N190 PolarHBondContact O-OD1 2.53Å; N190-T192 PolarHBondContact O-N 3.17Å; N190-T192 VanDerWaalsContact O-N 3.13Å
191	C	86.7	Confident	84	Confident	29 Å²	29	86.6 Å²	86.6	20%	0.196	43%	0.429	C	S	.	.			trans	-75.6	103.6	178	-164.2	0	0	0	0	111.4	C183 E185 F186 R193 H202	C183-C191 VanDerWaalsContact SG-SG 3.66Å; E185-C191 HydrophobicContact CB-CB 3.82Å; E185-C191 PolarHBondContact O-N 3.09Å; E185-C191 VanDerWaalsContact O-N 3.15Å; F186-C191 HydrophobicContact CB-CB 3.9Å; C191-R193 VanDerWaalsContact C-N 3.27Å; C191-R193 PolarHBondContact SG-O 3.33Å; C191-R193 VanDerWaalsContact SG-O 3.38Å; C191-H202 VanDerWaalsContact SG-CE1 3.59Å
192	T	84.8	Confident	83.8	Confident	144 Å²	144	81 Å²	81	88%	0.883	40%	0.403	S	S	*	.			trans	-81.8	-3	172.9	53.4	0	0	0	0	113.6	N190	N190-T192 PolarHBondContact O-N 3.17Å; N190-T192 VanDerWaalsContact O-N 3.13Å
193	R	82.1	Confident	83.4	Confident	159 Å²	159	81.3 Å²	81.3	60%	0.6	41%	0.405	S	S	*	.	S	Bend	trans	-89.4	121	174.7	-60.6	174.3	-175.6	141.9	2.3	108.1	C191 C198 H202	C191-R193 VanDerWaalsContact C-N 3.27Å; C191-R193 PolarHBondContact SG-O 3.33Å; C191-R193 VanDerWaalsContact SG-O 3.38Å; R193-C198 HydrophobicContact CB-CB 4.43Å; R193-H202 PolarHBondContact O-CE1 2.93Å; R193-H202 VanDerWaalsContact O-CE1 3.3Å
194	G	70.4	Confident	82.6	Confident	39 Å²	39	88 Å²	88	40%	0.402	44%	0.44	S	S	.	.			trans	-58.2	161.8	-178.8	0	0	0	0	0	113.1	S196 D197 C198	G194-S196 PolarHBondContact O-N 2.85Å; G194-S196 VanDerWaalsContact O-N 3.14Å; G194-D197 PolarHBondContact O-N 2.86Å; G194-C198 PolarHBondContact O-N 2.93Å
195	E	72.1	Confident	81.6	Confident	77 Å²	77	85.7 Å²	85.7	36%	0.36	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-29	178.8	172.8	174.1	-175.4	0	0	113.1	H202 P238	E195-H202 HydrophobicContact CB-CB 4.42Å; E195-H202 HydrophobicContact CG-CB 4.34Å; E195-P238 HydrophobicContact CG-CG 3.5Å
196	S	72.7	Confident	80.3	Confident	69 Å²	69	86.2 Å²	86.2	48%	0.483	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-41	171.6	40.2	0	0	0	0	113.8	G194 H240	G194-S196 PolarHBondContact O-N 2.85Å; G194-S196 VanDerWaalsContact O-N 3.14Å; S196-H240 VanDerWaalsContact O-CB 3.3Å; S196-H240 WeakPolarHBondContact O-CB 3.31Å; S196-H240 PolarHBondContact O-ND1 2.84Å; S196-H240 VanDerWaalsContact O-ND1 3.11Å
197	D	80.9	Confident	79.1	Confident	116 Å²	116	85.7 Å²	85.7	62%	0.62	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-11.8	-162.7	-61.5	-83.2	0	0	0	113.5	G194	G194-D197 PolarHBondContact O-N 2.86Å
198	C	86.6	Confident	78	Confident	2 Å²	2	84.3 Å²	84.3	1%	0.014	46%	0.464	C	S	.	.			trans	-65.8	144.8	175.5	-166.2	0	0	0	0	111.9	C183 R193 G194 Y200 H202 H240	C183-C198 VanDerWaalsContact SG-SG 3.69Å; R193-C198 HydrophobicContact CB-CB 4.43Å; G194-C198 PolarHBondContact O-N 2.93Å; C198-Y200 VanDerWaalsContact C-N 3.25Å; C198-Y200 PolarHBondContact O-N 3.11Å; C198-H202 WeakPolarHBondContact CB-NE2 3.5Å; C198-H202 PolarHBondContact SG-NE2 3.13Å; C198-H240 PolarHBondContact O-CE1 3.46Å; C198-H240 VanDerWaalsContact O-CE1 3.22Å; C198-H240 PolarHBondContact O-ND1 3.31Å
199	R	82.8	Confident	77.6	Confident	167 Å²	167	76 Å²	76	63%	0.63	44%	0.435	S	S	*	.	S	Bend	trans	-73.4	-16.3	175.1	178.7	176.8	-79.6	-160.5	-1.7	112.7	R244	R199-R244 PolarHBondContact O-NH1 3.27Å
200	Y	87.4	Confident	77.1	Confident	81 Å²	81	76 Å²	76	32%	0.318	42%	0.418	S	S	.	.	S	Bend	trans	-126.7	159.2	-172.3	-51.7	-71.6	0	0	0	110.4	E181 C183 C198	E181-Y200 HydrophobicContact CB-CD1 4.09Å; C183-Y200 HydrophobicContact CB-CD2 4.47Å; C198-Y200 VanDerWaalsContact C-N 3.25Å; C198-Y200 PolarHBondContact O-N 3.11Å
201	A	87.1	Confident	75.9	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	43%	0.425	C	S	.	.	B	Isolated β-bridge	trans	-67.8	140.3	-177.2	0	0	0	0	0	112	L180 E181 V182 C183 P203 V216 F235	L180-A201 HydrophobicContact CB-CB 4.37Å; L180-A201 HydrophobicContact CD2-CB 4.48Å; E181-A201 PolarHBondContact O-N 3.01Å; V182-A201 WeakPolarHBondContact CA-O 3.22Å; C183-A201 PolarHBondContact N-O 3.5Å; A201-P203 VanDerWaalsContact O-CD 3.29Å; A201-P203 WeakPolarHBondContact O-CD 3.44Å; A201-V216 HydrophobicContact CB-CG2 3.68Å; A201-F235 HydrophobicContact CB-CD1 4.48Å; A201-F235 HydrophobicContact CB-CE1 3.86Å; A201-F235 HydrophobicContact CB-CZ 4.29Å
202	H	86.4	Confident	75.2	Confident	10 Å²	10	79.2 Å²	79.2	5%	0.046	45%	0.449	C	S	.	.			trans	-110.1	87.1	171.1	-73.9	-161.7	0	0	0	108.7	C183 F186 C191 R193 E195 C198 L204	C183-H202 VanDerWaalsContact CB-CD2 3.43Å; C183-H202 WeakPolarHBondContact CB-CD2 3.12Å; C183-H202 WeakPolarHBondContact CB-NE2 3.42Å; F186-H202 HydrophobicContact CD1-CB 4.01Å; F186-H202 HydrophobicContact CD2-CB 4.28Å; F186-H202 AromaticContact CD2-CE1 3.67Å; F186-H202 AromaticContact CD2-CG 3.73Å; F186-H202 AromaticContact CD2-ND1 3.37Å; F186-H202 WeakPolarHBondContact CD2-ND1 3.16Å; F186-H202 HydrophobicContact CE1-CB 3.93Å; F186-H202 HydrophobicContact CE2-CB 4.21Å; F186-H202 AromaticContact CE2-ND1 3.73Å; F186-H202 HydrophobicContact CG-CB 4.19Å; F186-H202 AromaticContact CG-CD2 3.83Å; F186-H202 AromaticContact CG-CE1 3.99Å; F186-H202 AromaticContact CG-CG 3.69Å; F186-H202 AromaticContact CG-ND1 3.8Å; F186-H202 HydrophobicContact CZ-CB 4.03Å; C191-H202 VanDerWaalsContact SG-CE1 3.59Å; R193-H202 PolarHBondContact O-CE1 2.93Å; R193-H202 VanDerWaalsContact O-CE1 3.3Å; E195-H202 HydrophobicContact CB-CB 4.42Å; E195-H202 HydrophobicContact CG-CB 4.34Å; C198-H202 WeakPolarHBondContact CB-NE2 3.5Å; C198-H202 PolarHBondContact SG-NE2 3.13Å; H202-L204 PolarHBondContact O-N 3.45Å
203	P	81.3	Confident	74.6	Confident	13 Å²	13	78.2 Å²	78.2	8%	0.084	43%	0.434	C	S	.	.			trans	-76.2	112.2	175.7	28.8	-30.4	0	0	0	110.1	V182 A201 E205 V209 V216	V182-P203 HydrophobicContact CG1-CG 3.94Å; V182-P203 HydrophobicContact CG2-CG 3.89Å; A201-P203 VanDerWaalsContact O-CD 3.29Å; A201-P203 WeakPolarHBondContact O-CD 3.44Å; P203-E205 PolarHBondContact O-N 3.38Å; P203-V209 HydrophobicContact CB-CG2 4.09Å; P203-V209 HydrophobicContact CG-CG2 3.51Å; P203-V216 HydrophobicContact CB-CG1 4.02Å; P203-V216 HydrophobicContact CG-CG1 4.09Å
204	L	71.1	Confident	74.5	Confident	141 Å²	141	73.3 Å²	73.3	74%	0.738	42%	0.42	S	S	*	.	S	Bend	trans	-64.7	-27.3	174.9	-73.8	77.2	0	0	0	112.1	H202	H202-L204 PolarHBondContact O-N 3.45Å
205	E	67.9	Low	75.2	Confident	117 Å²	117	71.6 Å²	71.6	55%	0.547	40%	0.402	S	S	.	.	S	Bend	trans	-105.3	114.8	174.1	-156.5	-150	119.3	0	0	111.2	P203 G207 M208	P203-E205 PolarHBondContact O-N 3.38Å; E205-G207 PolarHBondContact O-N 3.24Å; E205-G207 VanDerWaalsContact O-N 3.13Å; E205-G207 WeakPolarHBondContact OE1-CA 3.47Å; E205-M208 PolarHBondContact O-N 3.27Å
206	A	59.8	Low	76	Confident	85 Å²	85	67.9 Å²	67.9	70%	0.702	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-63	-17.8	179.2	0	0	0	0	0	113.9	M208 V209	A206-M208 PolarHBondContact O-N 2.82Å; A206-V209 PolarHBondContact O-N 2.89Å
207	G	62.4	Low	76.7	Confident	64 Å²	64	68.6 Å²	68.6	66%	0.66	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-68.6	-11.1	177.4	0	0	0	0	0	115.2	E205	E205-G207 PolarHBondContact O-N 3.24Å; E205-G207 VanDerWaalsContact O-N 3.13Å; E205-G207 WeakPolarHBondContact OE1-CA 3.47Å
208	M	61.9	Low	77.2	Confident	71 Å²	71	63.2 Å²	63.2	35%	0.35	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-97	-0.3	178.5	-58.8	-165.3	-176.2	0	0	114.5	E205 A206	E205-M208 PolarHBondContact O-N 3.27Å; A206-M208 PolarHBondContact O-N 2.82Å
209	V	75.1	Confident	77.4	Confident	22 Å²	22	63.4 Å²	63.4	13%	0.133	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	123.8	-177.3	-175.3	0	0	0	0	110.6	V182 P203 A206 C211 V216	V182-V209 HydrophobicContact CG2-CG1 4.06Å; V182-V209 HydrophobicContact CG2-CG2 4.1Å; P203-V209 HydrophobicContact CB-CG2 4.09Å; P203-V209 HydrophobicContact CG-CG2 3.51Å; A206-V209 PolarHBondContact O-N 2.89Å; V209-C211 PolarHBondContact O-N 2.96Å; V209-V216 HydrophobicContact CG2-CG1 4.12Å
210	D	72.8	Confident	77.7	Confident	69 Å²	69	57.2 Å²	57.2	37%	0.369	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	112.5	166.5	-178.4	71.2	0	0	0	109.7	S212 E213 N214 S215	D210-S212 VanDerWaalsContact CG-OG 3.31Å; D210-S212 PolarHBondContact O-N 3.03Å; D210-S212 PolarHBondContact OD1-OG 2.89Å; D210-S212 VanDerWaalsContact OD1-OG 3.08Å; D210-S212 WeakPolarHBondContact OD2-CA 3.38Å; D210-S212 WeakPolarHBondContact OD2-CB 3.48Å; D210-S212 PolarHBondContact OD2-N 3.15Å; D210-S212 PolarHBondContact OD2-OG 3.24Å; D210-E213 PolarHBondContact O-N 3.4Å; D210-E213 PolarHBondContact OD2-N 3Å; D210-E213 VanDerWaalsContact OD2-N 3.16Å; D210-N214 PolarHBondContact O-N 3.04Å; D210-N214 VanDerWaalsContact O-N 3.07Å; D210-S215 WeakPolarHBondContact CB-O 3.49Å; D210-S215 PolarHBondContact N-O 3.22Å; D210-S215 PolarHBondContact O-N 3.47Å
211	C	62.3	Low	77.8	Confident	117 Å²	117	56.1 Å²	56.1	79%	0.791	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-19	-177.9	-65.1	0	0	0	0	113.5	V209	V209-C211 PolarHBondContact O-N 2.96Å
212	S	70.9	Confident	78.1	Confident	100 Å²	100	59.7 Å²	59.7	70%	0.699	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-40	178.5	-17.7	0	0	0	0	111.8	D210	D210-S212 VanDerWaalsContact CG-OG 3.31Å; D210-S212 PolarHBondContact O-N 3.03Å; D210-S212 PolarHBondContact OD1-OG 2.89Å; D210-S212 VanDerWaalsContact OD1-OG 3.08Å; D210-S212 WeakPolarHBondContact OD2-CA 3.38Å; D210-S212 WeakPolarHBondContact OD2-CB 3.48Å; D210-S212 PolarHBondContact OD2-N 3.15Å; D210-S212 PolarHBondContact OD2-OG 3.24Å
213	E	72.6	Confident	78.2	Confident	123 Å²	123	59.5 Å²	59.5	58%	0.575	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.8	26.3	-171.9	-61.1	-164.1	146.7	0	0	114.6	K179 D210 S215	K179-E213 WeakPolarHBondContact CE-OE2 3.26Å; K179-E213 VanDerWaalsContact NZ-CB 3.26Å; K179-E213 IonicContact NZ-OE2 3.8Å; K179-E213 PolarHBondContact NZ-OE2 3.15Å; D210-E213 PolarHBondContact O-N 3.4Å; D210-E213 PolarHBondContact OD2-N 3Å; D210-E213 VanDerWaalsContact OD2-N 3.16Å; E213-S215 WeakPolarHBondContact O-CB 3.42Å; E213-S215 PolarHBondContact O-N 3.33Å; E213-S215 VanDerWaalsContact O-N 3.09Å
214	N	80.4	Confident	78.5	Confident	57 Å²	57	64.2 Å²	64.2	31%	0.305	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.3	41.8	176.2	-69.7	103	0	0	0	114.1	V182 Q187 D210	V182-N214 WeakPolarHBondContact CB-O 3.42Å; V182-N214 PolarHBondContact N-O 3.27Å; Q187-N214 PolarHBondContact OE1-ND2 3Å; D210-N214 PolarHBondContact O-N 3.04Å; D210-N214 VanDerWaalsContact O-N 3.07Å
215	S	85.4	Confident	79.4	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.014	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150	-169.2	64	0	0	0	0	114	K179 L180 D210 E213	K179-S215 WeakPolarHBondContact CE-OG 3.35Å; K179-S215 PolarHBondContact NZ-OG 2.8Å; L180-S215 CarbonylContact O-C 3.55Å; L180-S215 WeakPolarHBondContact O-CA 3.42Å; L180-S215 VanDerWaalsContact O-CB 3.32Å; L180-S215 WeakPolarHBondContact O-CB 3.22Å; D210-S215 WeakPolarHBondContact CB-O 3.49Å; D210-S215 PolarHBondContact N-O 3.22Å; D210-S215 PolarHBondContact O-N 3.47Å; E213-S215 WeakPolarHBondContact O-CB 3.42Å; E213-S215 PolarHBondContact O-N 3.33Å; E213-S215 VanDerWaalsContact O-N 3.09Å
216	V	88.1	Confident	80.4	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	145.8	173.5	-66	0	0	0	0	110.9	L180 V182 A201 P203 V209 F235	L180-V216 HydrophobicContact CB-CG2 3.85Å; L180-V216 PolarHBondContact N-O 3.2Å; L180-V216 PolarHBondContact O-N 2.95Å; V182-V216 HydrophobicContact CG2-CG1 3.81Å; A201-V216 HydrophobicContact CB-CG2 3.68Å; P203-V216 HydrophobicContact CB-CG1 4.02Å; P203-V216 HydrophobicContact CG-CG1 4.09Å; V209-V216 HydrophobicContact CG2-CG1 4.12Å; V216-F235 HydrophobicContact CB-CB 4.17Å; V216-F235 HydrophobicContact CB-CG 4.44Å; V216-F235 HydrophobicContact CG2-CB 4.19Å; V216-F235 HydrophobicContact CG2-CD1 3.79Å; V216-F235 HydrophobicContact CG2-CE1 4.41Å; V216-F235 HydrophobicContact CG2-CG 4.07Å
217	I	88.4	Confident	81.9	Confident	84 Å²	84	60.8 Å²	60.8	43%	0.431	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.3	171.8	-56.9	172.5	0	0	0	108.5	D178 Y234 F235	D178-I217 WeakPolarHBondContact O-CA 3.38Å; I217-Y234 HydrophobicContact CB-CD1 4.04Å; I217-Y234 HydrophobicContact CG2-CD1 3.62Å; I217-Y234 HydrophobicContact CG2-CE1 3.94Å; I217-F235 PolarHBondContact O-N 3.23Å
218	V	90.2	Very high	83.3	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.012	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-79.6	151	-178.5	172.9	0	0	0	0	111.1	D178 L180 M220 I223 P237 I245	D178-V218 PolarHBondContact O-N 3.39Å; L180-V218 HydrophobicContact CB-CG2 4.21Å; L180-V218 HydrophobicContact CD1-CG2 4.06Å; L180-V218 HydrophobicContact CD2-CG2 4.06Å; L180-V218 HydrophobicContact CG-CG2 4.33Å; V218-M220 HydrophobicContact CB-CE 4.14Å; V218-M220 HydrophobicContact CG1-CE 3.85Å; V218-M220 PolarHBondContact O-N 2.97Å; V218-I223 HydrophobicContact CG1-CD1 3.91Å; V218-I223 HydrophobicContact CG1-CG1 3.62Å; V218-P237 HydrophobicContact CG1-CG 3.82Å; V218-P237 HydrophobicContact CG2-CG 4.31Å; V218-I245 HydrophobicContact CG1-CD1 4.22Å; V218-I245 HydrophobicContact CG2-CD1 4.07Å
219	C	90.9	Very high	84.7	Confident	7 Å²	7	69.1 Å²	69.1	5%	0.047	37%	0.371	C	S	.	.			trans	-78	97.1	166	-170.5	0	0	0	0	110	D221 Y222 I223 C232 F235 H236	C219-D221 PolarHBondContact O-N 3.15Å; C219-D221 VanDerWaalsContact O-N 3.13Å; C219-Y222 WeakPolarHBondContact O-CB 3.36Å; C219-Y222 PolarHBondContact O-N 3.41Å; C219-Y222 PolarHBondContact SG-N 3.23Å; C219-I223 PolarHBondContact O-N 2.82Å; C219-I223 VanDerWaalsContact O-N 3.14Å; C219-C232 VanDerWaalsContact SG-SG 3.64Å; C219-F235 PolarHBondContact N-O 2.88Å; C219-H236 VanDerWaalsContact CB-CD2 3.43Å; C219-H236 WeakPolarHBondContact CB-CD2 3.32Å
220	M	89.6	Confident	85.1	Confident	37 Å²	37	75.4 Å²	75.4	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-53.8	-31.8	173.3	-84.7	-56.7	108.2	0	0	113.6	D178 V218 I223 K224 I245 Q249	D178-M220 HydrophobicContact CB-CE 4.13Å; D178-M220 WeakPolarHBondContact OD2-CE 3.45Å; D178-M220 WeakPolarHBondContact OD2-CG 3.11Å; V218-M220 HydrophobicContact CB-CE 4.14Å; V218-M220 HydrophobicContact CG1-CE 3.85Å; V218-M220 PolarHBondContact O-N 2.97Å; M220-I223 HydrophobicContact CE-CB 4.48Å; M220-I223 HydrophobicContact CE-CG1 3.89Å; M220-I223 PolarHBondContact O-N 3.49Å; M220-K224 WeakPolarHBondContact O-CE 3.46Å; M220-K224 WeakPolarHBondContact O-CG 3.25Å; M220-K224 PolarHBondContact O-N 3.47Å; M220-K224 VanDerWaalsContact O-N 3.08Å; M220-I245 HydrophobicContact CE-CG2 4.06Å; M220-Q249 PolarHBondContact SD-NE2 3.4Å
221	D	90.1	Very high	85.6	Confident	58 Å²	58	80.9 Å²	80.9	31%	0.31	42%	0.424	S	S	.	.	H	α-helix	trans	-74.7	-25.2	177.6	-70	-47.9	0	0	0	113.2	C219 K224 G225 R226 C227	C219-D221 PolarHBondContact O-N 3.15Å; C219-D221 VanDerWaalsContact O-N 3.13Å; D221-K224 WeakPolarHBondContact OD1-CE 3.46Å; D221-K224 IonicContact OD1-NZ 2.75Å; D221-K224 PolarHBondContact OD1-NZ 3.01Å; D221-G225 PolarHBondContact O-N 3.09Å; D221-R226 HydrophobicContact CB-CB 4.26Å; D221-R226 CarbonylContact O-C 3.52Å; D221-R226 WeakPolarHBondContact O-CA 3.24Å; D221-R226 PolarHBondContact O-N 3.38Å; D221-R226 IonicContact OD1-CZ 3.27Å; D221-R226 VanDerWaalsContact OD1-CZ 3.27Å; D221-R226 IonicContact OD1-NE 3.03Å; D221-R226 PolarHBondContact OD1-NE 3.46Å; D221-R226 IonicContact OD1-NH2 2.69Å; D221-R226 PolarHBondContact OD1-NH2 2.74Å; D221-R226 IonicContact OD2-NH2 3.85Å; D221-C227 HydrophobicContact CB-CB 4.06Å; D221-C227 PolarHBondContact O-N 3.44Å
222	Y	92.1	Very high	86.8	Confident	75 Å²	75	76.4 Å²	76.4	29%	0.294	39%	0.394	S	S	.	.	H	α-helix	trans	-69.4	-44.6	167.4	-176.6	-110.4	0	0	0	111.3	C219 K224 G225 C227 H236 Q242	C219-Y222 WeakPolarHBondContact O-CB 3.36Å; C219-Y222 PolarHBondContact O-N 3.41Å; C219-Y222 PolarHBondContact SG-N 3.23Å; Y222-K224 PolarHBondContact O-N 3.02Å; Y222-G225 PolarHBondContact O-N 3.13Å; Y222-C227 WeakPolarHBondContact CD2-O 2.84Å; Y222-H236 HydrophobicContact CD1-CB 3.8Å; Y222-H236 AromaticContact CD1-CG 3.85Å; Y222-H236 HydrophobicContact CD2-CB 4.39Å; Y222-H236 AromaticContact CD2-CE1 3.61Å; Y222-H236 AromaticContact CD2-CG 3.75Å; Y222-H236 AromaticContact CD2-ND1 3.49Å; Y222-H236 WeakPolarHBondContact CD2-ND1 3.36Å; Y222-H236 AromaticContact CD2-NE2 3.94Å; Y222-H236 HydrophobicContact CE1-CB 3.7Å; Y222-H236 HydrophobicContact CE2-CB 4.33Å; Y222-H236 AromaticContact CE2-ND1 3.7Å; Y222-H236 HydrophobicContact CG-CB 4.14Å; Y222-H236 AromaticContact CG-CD2 3.65Å; Y222-H236 AromaticContact CG-CG 3.65Å; Y222-H236 AromaticContact CG-ND1 3.88Å; Y222-H236 AromaticContact CG-NE2 3.87Å; Y222-Q242 VanDerWaalsContact CE1-NE2 3.34Å
223	I	89.2	Confident	87.5	Confident	6 Å²	6	79.4 Å²	79.4	3%	0.031	40%	0.395	C	S	.	.	H	α-helix	trans	-55.4	-38.8	174.7	-61.1	-57.7	0	0	0	111.6	V218 C219 M220 P237 Q242 I245 K246	V218-I223 HydrophobicContact CG1-CD1 3.91Å; V218-I223 HydrophobicContact CG1-CG1 3.62Å; C219-I223 PolarHBondContact O-N 2.82Å; C219-I223 VanDerWaalsContact O-N 3.14Å; M220-I223 HydrophobicContact CE-CB 4.48Å; M220-I223 HydrophobicContact CE-CG1 3.89Å; M220-I223 PolarHBondContact O-N 3.49Å; I223-P237 HydrophobicContact CD1-CG 3.71Å; I223-Q242 HydrophobicContact CD1-CB 4.2Å; I223-Q242 HydrophobicContact CD1-CG 3.87Å; I223-I245 HydrophobicContact CD1-CD1 3.93Å; I223-I245 HydrophobicContact CD1-CG2 4.31Å; I223-I245 HydrophobicContact CG1-CG2 4.25Å; I223-I245 HydrophobicContact CG2-CG2 4.2Å; I223-K246 HydrophobicContact CG2-CD 4.45Å; I223-K246 HydrophobicContact CG2-CG 3.84Å; I223-K246 WeakPolarHBondContact O-CE 3.33Å; I223-K246 PolarHBondContact O-NZ 3.37Å; I223-K246 VanDerWaalsContact O-NZ 3.1Å
224	K	87.7	Confident	88.2	Confident	112 Å²	112	78.1 Å²	78.1	49%	0.487	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	5.7	177.2	-65.9	173.7	-68.3	171.9	0	114.6	M220 D221 Y222 R226	M220-K224 WeakPolarHBondContact O-CE 3.46Å; M220-K224 WeakPolarHBondContact O-CG 3.25Å; M220-K224 PolarHBondContact O-N 3.47Å; M220-K224 VanDerWaalsContact O-N 3.08Å; D221-K224 WeakPolarHBondContact OD1-CE 3.46Å; D221-K224 IonicContact OD1-NZ 2.75Å; D221-K224 PolarHBondContact OD1-NZ 3.01Å; Y222-K224 PolarHBondContact O-N 3.02Å; K224-R226 VanDerWaalsContact C-N 3.26Å; K224-R226 HydrophobicContact CB-CG 4.2Å; K224-R226 PolarHBondContact O-N 3.12Å
225	G	89	Confident	88.6	Confident	68 Å²	68	76.3 Å²	76.3	70%	0.701	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	15.4	179.5	0	0	0	0	0	115.7	D221 Y222	D221-G225 PolarHBondContact O-N 3.09Å; Y222-G225 PolarHBondContact O-N 3.13Å
226	R	89.8	Confident	88.9	Confident	177 Å²	177	78.3 Å²	78.3	67%	0.668	38%	0.383	S	S	*	.			trans	-99.1	-13.1	-179.6	-49.3	-162.9	-53.5	163	5.4	114	D221 K224	D221-R226 HydrophobicContact CB-CB 4.26Å; D221-R226 CarbonylContact O-C 3.52Å; D221-R226 WeakPolarHBondContact O-CA 3.24Å; D221-R226 PolarHBondContact O-N 3.38Å; D221-R226 IonicContact OD1-CZ 3.27Å; D221-R226 VanDerWaalsContact OD1-CZ 3.27Å; D221-R226 IonicContact OD1-NE 3.03Å; D221-R226 PolarHBondContact OD1-NE 3.46Å; D221-R226 IonicContact OD1-NH2 2.69Å; D221-R226 PolarHBondContact OD1-NH2 2.74Å; D221-R226 IonicContact OD2-NH2 3.85Å; K224-R226 VanDerWaalsContact C-N 3.26Å; K224-R226 HydrophobicContact CB-CG 4.2Å; K224-R226 PolarHBondContact O-N 3.12Å
227	C	91.1	Very high	88.9	Confident	25 Å²	25	78.3 Å²	78.3	17%	0.169	38%	0.384	C	S	.	.			trans	-108.3	127.6	172.4	-174.2	0	0	0	0	109.7	D221 Y222 H236	D221-C227 HydrophobicContact CB-CB 4.06Å; D221-C227 PolarHBondContact O-N 3.44Å; Y222-C227 WeakPolarHBondContact CD2-O 2.84Å; C227-H236 PolarHBondContact SG-NE2 2.85Å
228	S	91.3	Very high	88.9	Confident	124 Å²	124	75.6 Å²	75.6	87%	0.867	37%	0.371	S	S	*	.			trans	-122.5	13.5	171.8	53.7	0	0	0	0	112	D230	S228-D230 PolarHBondContact O-N 2.83Å
229	R	92.2	Very high	88.7	Confident	186 Å²	186	79 Å²	79	70%	0.702	40%	0.4	S	S	*	.			trans	-83.4	109	-172	-167.8	178.4	-169	141.1	5.1	110.8	K231 C232 H236	R229-K231 PolarHBondContact O-N 2.7Å; R229-C232 WeakPolarHBondContact O-CB 3.46Å; R229-C232 PolarHBondContact O-N 2.85Å; R229-H236 PolarHBondContact O-CE1 3.34Å
230	D	82.8	Confident	88.5	Confident	155 Å²	155	82.2 Å²	82.2	83%	0.829	41%	0.414	S	S	*	.	S	Bend	trans	-50	-51.9	-179.9	-153.3	-103.1	0	0	0	112.7	S228 C232	S228-D230 PolarHBondContact O-N 2.83Å; D230-C232 PolarHBondContact O-N 3.31Å
231	K	83.6	Confident	88.4	Confident	184 Å²	184	80.6 Å²	80.6	80%	0.8	41%	0.406	S	S	*	.	S	Bend	trans	-89.8	74.8	171.2	-61.6	-176.8	-177.8	-178.6	0	110.8	R229	R229-K231 PolarHBondContact O-N 2.7Å
232	C	86.9	Confident	88.4	Confident	22 Å²	22	79.5 Å²	79.5	15%	0.149	40%	0.399	C	S	.	.			trans	-84.8	154.1	173.7	-164.5	0	0	0	0	111.8	C219 R229 D230 Y234 H236	C219-C232 VanDerWaalsContact SG-SG 3.64Å; R229-C232 WeakPolarHBondContact O-CB 3.46Å; R229-C232 PolarHBondContact O-N 2.85Å; D230-C232 PolarHBondContact O-N 3.31Å; C232-Y234 PolarHBondContact O-N 2.76Å; C232-H236 WeakPolarHBondContact CB-NE2 3.5Å; C232-H236 PolarHBondContact SG-NE2 3.14Å
233	K	85.9	Confident	88.1	Confident	164 Å²	164	78.8 Å²	78.8	71%	0.713	41%	0.408	S	S	*	.	S	Bend	trans	-71.1	-21.5	172.2	178.7	178.9	175.1	-169.9	0	112.7
234	Y	87.9	Confident	87.9	Confident	95 Å²	95	84 Å²	84	37%	0.373	43%	0.428	S	S	.	.	S	Bend	trans	-124.1	147.4	-171.3	-59.1	-76	0	0	0	110	I217 C232 H236	I217-Y234 HydrophobicContact CB-CD1 4.04Å; I217-Y234 HydrophobicContact CG2-CD1 3.62Å; I217-Y234 HydrophobicContact CG2-CE1 3.94Å; C232-Y234 PolarHBondContact O-N 2.76Å; Y234-H236 PolarHBondContact O-CD2 3.38Å
235	F	89.7	Confident	87.9	Confident	20 Å²	20	79 Å²	79	9%	0.088	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-61.7	137.1	-172.1	-177.8	-116.4	0	0	0	112.2	A201 V216 I217 C219 P237	A201-F235 HydrophobicContact CB-CD1 4.48Å; A201-F235 HydrophobicContact CB-CE1 3.86Å; A201-F235 HydrophobicContact CB-CZ 4.29Å; V216-F235 HydrophobicContact CB-CB 4.17Å; V216-F235 HydrophobicContact CB-CG 4.44Å; V216-F235 HydrophobicContact CG2-CB 4.19Å; V216-F235 HydrophobicContact CG2-CD1 3.79Å; V216-F235 HydrophobicContact CG2-CE1 4.41Å; V216-F235 HydrophobicContact CG2-CG 4.07Å; I217-F235 PolarHBondContact O-N 3.23Å; C219-F235 PolarHBondContact N-O 2.88Å; F235-P237 HydrophobicContact CD1-CB 4.13Å; F235-P237 HydrophobicContact CE1-CB 3.83Å; F235-P237 WeakPolarHBondContact O-CD 3.44Å
236	H	90.3	Very high	87.8	Confident	43 Å²	43	80.2 Å²	80.2	20%	0.199	39%	0.392	C	S	.	.			trans	-103.2	89.3	177	-78.9	-167.8	0	0	0	109.5	C219 Y222 C227 R229 C232 Y234	C219-H236 VanDerWaalsContact CB-CD2 3.43Å; C219-H236 WeakPolarHBondContact CB-CD2 3.32Å; Y222-H236 HydrophobicContact CD1-CB 3.8Å; Y222-H236 AromaticContact CD1-CG 3.85Å; Y222-H236 HydrophobicContact CD2-CB 4.39Å; Y222-H236 AromaticContact CD2-CE1 3.61Å; Y222-H236 AromaticContact CD2-CG 3.75Å; Y222-H236 AromaticContact CD2-ND1 3.49Å; Y222-H236 WeakPolarHBondContact CD2-ND1 3.36Å; Y222-H236 AromaticContact CD2-NE2 3.94Å; Y222-H236 HydrophobicContact CE1-CB 3.7Å; Y222-H236 HydrophobicContact CE2-CB 4.33Å; Y222-H236 AromaticContact CE2-ND1 3.7Å; Y222-H236 HydrophobicContact CG-CB 4.14Å; Y222-H236 AromaticContact CG-CD2 3.65Å; Y222-H236 AromaticContact CG-CG 3.65Å; Y222-H236 AromaticContact CG-ND1 3.88Å; Y222-H236 AromaticContact CG-NE2 3.87Å; C227-H236 PolarHBondContact SG-NE2 2.85Å; R229-H236 PolarHBondContact O-CE1 3.34Å; C232-H236 WeakPolarHBondContact CB-NE2 3.5Å; C232-H236 PolarHBondContact SG-NE2 3.14Å; Y234-H236 PolarHBondContact O-CD2 3.38Å
237	P	87.9	Confident	87.5	Confident	1 Å²	1	74.1 Å²	74.1	1%	0.006	38%	0.379	C	S	.	.			trans	-66.1	146.3	-171.8	21.9	-33	0	0	0	114	L180 V218 I223 F235 L241 Q242 I245	L180-P237 HydrophobicContact CD2-CB 4.34Å; V218-P237 HydrophobicContact CG1-CG 3.82Å; V218-P237 HydrophobicContact CG2-CG 4.31Å; I223-P237 HydrophobicContact CD1-CG 3.71Å; F235-P237 HydrophobicContact CD1-CB 4.13Å; F235-P237 HydrophobicContact CE1-CB 3.83Å; F235-P237 WeakPolarHBondContact O-CD 3.44Å; P237-L241 HydrophobicContact CB-CB 3.9Å; P237-Q242 HydrophobicContact CB-CG 4.49Å; P237-Q242 HydrophobicContact CG-CG 4.13Å; P237-Q242 VanDerWaalsContact O-CG 3.26Å; P237-Q242 WeakPolarHBondContact O-CG 3.37Å; P237-Q242 PolarHBondContact O-NE2 3.32Å; P237-I245 HydrophobicContact CB-CD1 4.34Å; P237-I245 HydrophobicContact CG-CD1 3.79Å
238	P	88.6	Confident	87.2	Confident	26 Å²	26	75.3 Å²	75.3	17%	0.169	39%	0.388	C	S	.	.			trans	-55.2	156.4	168.2	-26	33.1	0	0	0	113.7	E195 H240 L241 Q242	E195-P238 HydrophobicContact CG-CG 3.5Å; P238-H240 VanDerWaalsContact C-N 3.32Å; P238-H240 PolarHBondContact O-N 3.08Å; P238-L241 PolarHBondContact O-N 2.99Å; P238-Q242 PolarHBondContact O-N 3.13Å
239	A	87.1	Confident	86.8	Confident	74 Å²	74	71.9 Å²	71.9	61%	0.612	36%	0.358	S	S	*	.	H	α-helix	trans	-53.6	-40.9	-171.5	0	0	0	0	0	114.6	L241 Q242 A243	A239-L241 VanDerWaalsContact C-N 3.34Å; A239-L241 PolarHBondContact O-N 2.94Å; A239-Q242 WeakPolarHBondContact O-CB 3.31Å; A239-Q242 PolarHBondContact O-N 3.42Å; A239-A243 PolarHBondContact O-N 3.4Å
240	H	86.8	Confident	86.2	Confident	74 Å²	74	68.7 Å²	68.7	34%	0.343	35%	0.352	S	S	.	.	H	α-helix	trans	-58	-43.7	174.6	161.6	-139.2	0	0	0	112.4	S196 C198 P238 R244	S196-H240 VanDerWaalsContact O-CB 3.3Å; S196-H240 WeakPolarHBondContact O-CB 3.31Å; S196-H240 PolarHBondContact O-ND1 2.84Å; S196-H240 VanDerWaalsContact O-ND1 3.11Å; C198-H240 PolarHBondContact O-CE1 3.46Å; C198-H240 VanDerWaalsContact O-CE1 3.22Å; C198-H240 PolarHBondContact O-ND1 3.31Å; P238-H240 VanDerWaalsContact C-N 3.32Å; P238-H240 PolarHBondContact O-N 3.08Å; H240-R244 PolarHBondContact O-N 3.47Å
241	L	86.8	Confident	86	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-73.6	-35.5	177.6	-61.4	-172.7	0	0	0	111.6	L180 P237 P238 A239 A243 R244 I245	L180-L241 HydrophobicContact CD2-CB 4.24Å; L180-L241 HydrophobicContact CD2-CD1 4.06Å; P237-L241 HydrophobicContact CB-CB 3.9Å; P238-L241 PolarHBondContact O-N 2.99Å; A239-L241 VanDerWaalsContact C-N 3.34Å; A239-L241 PolarHBondContact O-N 2.94Å; L241-A243 VanDerWaalsContact C-N 3.34Å; L241-A243 PolarHBondContact O-N 2.99Å; L241-R244 VanDerWaalsContact CD2-NH1 3.29Å; L241-R244 PolarHBondContact O-N 3.46Å; L241-I245 WeakPolarHBondContact O-CD1 3.31Å; L241-I245 VanDerWaalsContact O-CG1 3.28Å; L241-I245 WeakPolarHBondContact O-CG1 3.47Å; L241-I245 PolarHBondContact O-N 3.04Å
242	Q	89.1	Confident	85.2	Confident	35 Å²	35	59.8 Å²	59.8	16%	0.164	31%	0.312	C	S	.	.	H	α-helix	trans	-58.3	-43.9	172	-62.2	-179.7	33.1	0	0	112.4	Y222 I223 P237 P238 A239 R244 I245 K246	Y222-Q242 VanDerWaalsContact CE1-NE2 3.34Å; I223-Q242 HydrophobicContact CD1-CB 4.2Å; I223-Q242 HydrophobicContact CD1-CG 3.87Å; P237-Q242 HydrophobicContact CB-CG 4.49Å; P237-Q242 HydrophobicContact CG-CG 4.13Å; P237-Q242 VanDerWaalsContact O-CG 3.26Å; P237-Q242 WeakPolarHBondContact O-CG 3.37Å; P237-Q242 PolarHBondContact O-NE2 3.32Å; P238-Q242 PolarHBondContact O-N 3.13Å; A239-Q242 WeakPolarHBondContact O-CB 3.31Å; A239-Q242 PolarHBondContact O-N 3.42Å; Q242-R244 VanDerWaalsContact C-N 3.32Å; Q242-R244 PolarHBondContact O-N 2.86Å; Q242-I245 PolarHBondContact O-N 3.39Å; Q242-K246 WeakPolarHBondContact O-CB 3.5Å; Q242-K246 VanDerWaalsContact O-CG 3.31Å; Q242-K246 WeakPolarHBondContact O-CG 3.43Å; Q242-K246 PolarHBondContact O-N 3.46Å
243	A	86.9	Confident	84.5	Confident	59 Å²	59	62.3 Å²	62.3	49%	0.488	33%	0.33	S	S	.	.	H	α-helix	trans	-60.1	-43.1	179.6	0	0	0	0	0	111.4	A239 L241 K246 A247	A239-A243 PolarHBondContact O-N 3.4Å; L241-A243 VanDerWaalsContact C-N 3.34Å; L241-A243 PolarHBondContact O-N 2.99Å; A243-K246 PolarHBondContact O-N 2.88Å; A243-A247 WeakPolarHBondContact O-CB 3.4Å; A243-A247 PolarHBondContact O-N 3.04Å
244	R	84.3	Confident	83.4	Confident	115 Å²	115	59.9 Å²	59.9	43%	0.434	32%	0.321	S	S	.	.	H	α-helix	trans	-66	-40.4	176.9	-71.1	174.8	56.9	-141.5	-4.9	112.9	R199 H240 L241 Q242 S248	R199-R244 PolarHBondContact O-NH1 3.27Å; H240-R244 PolarHBondContact O-N 3.47Å; L241-R244 VanDerWaalsContact CD2-NH1 3.29Å; L241-R244 PolarHBondContact O-N 3.46Å; Q242-R244 VanDerWaalsContact C-N 3.32Å; Q242-R244 PolarHBondContact O-N 2.86Å; R244-S248 WeakPolarHBondContact O-CB 3.45Å; R244-S248 PolarHBondContact O-N 3.33Å
245	I	87.6	Confident	82.1	Confident	7 Å²	7	61.9 Å²	61.9	4%	0.036	34%	0.338	C	S	.	.	H	α-helix	trans	-61.7	-49.6	174.5	-67.5	160.5	0	0	0	110.4	L180 V218 M220 I223 P237 L241 Q242 A247 S248 Q249	L180-I245 HydrophobicContact CD1-CD1 3.77Å; L180-I245 HydrophobicContact CD1-CG1 3.74Å; L180-I245 HydrophobicContact CD2-CD1 3.94Å; V218-I245 HydrophobicContact CG1-CD1 4.22Å; V218-I245 HydrophobicContact CG2-CD1 4.07Å; M220-I245 HydrophobicContact CE-CG2 4.06Å; I223-I245 HydrophobicContact CD1-CD1 3.93Å; I223-I245 HydrophobicContact CD1-CG2 4.31Å; I223-I245 HydrophobicContact CG1-CG2 4.25Å; I223-I245 HydrophobicContact CG2-CG2 4.2Å; P237-I245 HydrophobicContact CB-CD1 4.34Å; P237-I245 HydrophobicContact CG-CD1 3.79Å; L241-I245 WeakPolarHBondContact O-CD1 3.31Å; L241-I245 VanDerWaalsContact O-CG1 3.28Å; L241-I245 WeakPolarHBondContact O-CG1 3.47Å; L241-I245 PolarHBondContact O-N 3.04Å; Q242-I245 PolarHBondContact O-N 3.39Å; I245-A247 PolarHBondContact O-N 2.95Å; I245-S248 PolarHBondContact O-N 2.99Å; I245-Q249 VanDerWaalsContact CG2-NE2 3.35Å; I245-Q249 WeakPolarHBondContact O-CG 3.42Å; I245-Q249 PolarHBondContact O-N 3.45Å
246	K	87.4	Confident	80.4	Confident	95 Å²	95	66.3 Å²	66.3	41%	0.413	37%	0.368	S	S	.	.	H	α-helix	trans	-60.7	-43.7	179.4	-71.6	170.3	178.7	176.9	0	111.8	I223 Q242 A243 S248 Q249 H250	I223-K246 HydrophobicContact CG2-CD 4.45Å; I223-K246 HydrophobicContact CG2-CG 3.84Å; I223-K246 WeakPolarHBondContact O-CE 3.33Å; I223-K246 PolarHBondContact O-NZ 3.37Å; I223-K246 VanDerWaalsContact O-NZ 3.1Å; Q242-K246 WeakPolarHBondContact O-CB 3.5Å; Q242-K246 VanDerWaalsContact O-CG 3.31Å; Q242-K246 WeakPolarHBondContact O-CG 3.43Å; Q242-K246 PolarHBondContact O-N 3.46Å; A243-K246 PolarHBondContact O-N 2.88Å; K246-S248 PolarHBondContact O-N 2.93Å; K246-Q249 PolarHBondContact O-N 3.31Å; K246-H250 PolarHBondContact O-N 3.48Å; K246-H250 VanDerWaalsContact O-N 3.08Å
247	A	84.3	Confident	78.6	Confident	48 Å²	48	68 Å²	68	40%	0.397	39%	0.389	S	S	.	.	H	α-helix	trans	-63.2	-40	176.1	0	0	0	0	0	112.9	A243 I245 H250 Q251	A243-A247 WeakPolarHBondContact O-CB 3.4Å; A243-A247 PolarHBondContact O-N 3.04Å; I245-A247 PolarHBondContact O-N 2.95Å; A247-H250 PolarHBondContact O-N 2.87Å; A247-Q251 WeakPolarHBondContact O-CG 3.5Å; A247-Q251 PolarHBondContact O-N 2.98Å; A247-Q251 PolarHBondContact O-NE2 3.03Å
248	S	83.9	Confident	76.6	Confident	51 Å²	51	72.5 Å²	72.5	36%	0.357	42%	0.42	S	S	.	.	H	α-helix	trans	-69.8	-37.5	177.1	179.3	0	0	0	0	112.5	T177 R244 I245 K246 Q251 A252	T177-S248 VanDerWaalsContact CG2-OG 3.26Å; T177-S248 WeakPolarHBondContact CG2-OG 3.16Å; R244-S248 WeakPolarHBondContact O-CB 3.45Å; R244-S248 PolarHBondContact O-N 3.33Å; I245-S248 PolarHBondContact O-N 2.99Å; K246-S248 PolarHBondContact O-N 2.93Å; S248-Q251 PolarHBondContact O-N 3.47Å; S248-A252 PolarHBondContact O-N 3.4Å
249	Q	82.9	Confident	74.5	Confident	51 Å²	51	74.7 Å²	74.7	24%	0.238	44%	0.44	C	S	.	.	H	α-helix	trans	-63.7	-40.1	173.9	-72.2	177.4	14.5	0	0	112	T177 M220 I245 K246 Q251 A252 S253	T177-Q249 HydrophobicContact CG2-CG 3.79Å; T177-Q249 PolarHBondContact O-NE2 3.24Å; M220-Q249 PolarHBondContact SD-NE2 3.4Å; I245-Q249 VanDerWaalsContact CG2-NE2 3.35Å; I245-Q249 WeakPolarHBondContact O-CG 3.42Å; I245-Q249 PolarHBondContact O-N 3.45Å; K246-Q249 PolarHBondContact O-N 3.31Å; Q249-Q251 PolarHBondContact O-N 3.31Å; Q249-A252 WeakPolarHBondContact O-CB 3.44Å; Q249-A252 PolarHBondContact O-N 2.97Å; Q249-S253 PolarHBondContact O-N 2.94Å; Q249-S253 PolarHBondContact O-OG 3.39Å
250	H	80.8	Confident	72.4	Confident	120 Å²	120	77 Å²	77	56%	0.556	45%	0.449	S	S	*	.	H	α-helix	trans	-62.2	-41.6	176.9	-165.2	-103.3	0	0	0	112.3	K246 A247 S253 Q254	K246-H250 PolarHBondContact O-N 3.48Å; K246-H250 VanDerWaalsContact O-N 3.08Å; A247-H250 PolarHBondContact O-N 2.87Å; H250-S253 PolarHBondContact O-N 3.32Å; H250-Q254 PolarHBondContact CE1-NE2 3.21Å; H250-Q254 WeakPolarHBondContact O-CG 3.22Å; H250-Q254 PolarHBondContact O-N 3.13Å; H250-Q254 VanDerWaalsContact O-N 3.11Å
251	Q	77	Confident	70.5	Confident	125 Å²	125	81.3 Å²	81.3	58%	0.584	47%	0.474	S	S	*	.	H	α-helix	trans	-64.5	-41.7	174	-67.7	167.7	39.7	0	0	111.8	A247 S248 Q249 S253 Q254 N255	A247-Q251 WeakPolarHBondContact O-CG 3.5Å; A247-Q251 PolarHBondContact O-N 2.98Å; A247-Q251 PolarHBondContact O-NE2 3.03Å; S248-Q251 PolarHBondContact O-N 3.47Å; Q249-Q251 PolarHBondContact O-N 3.31Å; Q251-S253 VanDerWaalsContact C-N 3.33Å; Q251-S253 PolarHBondContact O-N 2.89Å; Q251-Q254 PolarHBondContact O-N 3.29Å; Q251-N255 PolarHBondContact O-N 2.94Å
252	A	68.3	Low	68	Low	27 Å²	27	85.4 Å²	85.4	22%	0.223	51%	0.508	C	S	.	.	H	α-helix	trans	-60.3	-40	175.1	0	0	0	0	0	112.9	S248 Q249 T256	S248-A252 PolarHBondContact O-N 3.4Å; Q249-A252 WeakPolarHBondContact O-CB 3.44Å; Q249-A252 PolarHBondContact O-N 2.97Å; A252-T256 PolarHBondContact O-OG1 3.47Å
253	S	70.5	Confident	65.4	Low	75 Å²	75	92.6 Å²	92.6	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-71.2	-28.9	176.6	-60.6	0	0	0	0	113.6	Q249 H250 Q251 T256 A257	Q249-S253 PolarHBondContact O-N 2.94Å; Q249-S253 PolarHBondContact O-OG 3.39Å; H250-S253 PolarHBondContact O-N 3.32Å; Q251-S253 VanDerWaalsContact C-N 3.33Å; Q251-S253 PolarHBondContact O-N 2.89Å; S253-T256 PolarHBondContact O-N 3.08Å; S253-T256 PolarHBondContact O-OG1 2.91Å; S253-A257 PolarHBondContact O-N 3.32Å
254	Q	64.4	Low	62.9	Low	112 Å²	112	93.8 Å²	93.8	52%	0.523	56%	0.557	S	S	.	*	H	α-helix	trans	-69	-41.1	175	-74.2	176.9	-14.9	0	0	111.7	H250 Q251 T256 A257 S258	H250-Q254 PolarHBondContact CE1-NE2 3.21Å; H250-Q254 WeakPolarHBondContact O-CG 3.22Å; H250-Q254 PolarHBondContact O-N 3.13Å; H250-Q254 VanDerWaalsContact O-N 3.11Å; Q251-Q254 PolarHBondContact O-N 3.29Å; Q254-T256 PolarHBondContact O-N 3.13Å; Q254-A257 PolarHBondContact O-N 3.39Å; Q254-S258 PolarHBondContact O-N 2.87Å
255	N	58.9	Low	60.7	Low	137 Å²	137	95 Å²	95	73%	0.733	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-10.7	177.1	-89.1	26.6	0	0	0	114.8	Q251	Q251-N255 PolarHBondContact O-N 2.94Å
256	T	55.5	Low	58.4	Low	114 Å²	114	98.7 Å²	98.7	70%	0.699	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-3.3	170.5	49.4	0	0	0	0	113.6	A252 S253 Q254	A252-T256 PolarHBondContact O-OG1 3.47Å; S253-T256 PolarHBondContact O-N 3.08Å; S253-T256 PolarHBondContact O-OG1 2.91Å; Q254-T256 PolarHBondContact O-N 3.13Å
257	A	51	Low	56	Low	79 Å²	79	98 Å²	98	65%	0.653	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-6.3	174.7	0	0	0	0	0	113.5	S253 Q254 A259	S253-A257 PolarHBondContact O-N 3.32Å; Q254-A257 PolarHBondContact O-N 3.39Å; A257-A259 PolarHBondContact O-N 2.97Å
258	S	47.3	Very low	53.7	Low	94 Å²	94	104.6 Å²	104.6	66%	0.657	66%	0.664	S	S	*	*			trans	-81.7	47.7	175.7	64.8	0	0	0	0	113.1	Q254 P260	Q254-S258 PolarHBondContact O-N 2.87Å; S258-P260 VanDerWaalsContact C-CD 3.47Å; S258-P260 VanDerWaalsContact O-CD 3.31Å; S258-P260 WeakPolarHBondContact O-CD 3.49Å
259	A	43	Very low	51.5	Low	72 Å²	72	110.3 Å²	110.3	60%	0.595	69%	0.686	S	S	*	*			trans	-111.7	80.9	170.2	0	0	0	0	0	109.1	A257 L261	A257-A259 PolarHBondContact O-N 2.97Å; A259-L261 PolarHBondContact O-N 3.4Å; A259-L261 VanDerWaalsContact O-N 3.17Å
260	P	43.8	Very low	49.1	Very low	123 Å²	123	113.3 Å²	113.3	80%	0.799	71%	0.712	S	S	*	*			trans	-64.8	116.4	171.9	27.9	-32.7	0	0	0	109	S258	S258-P260 VanDerWaalsContact C-CD 3.47Å; S258-P260 VanDerWaalsContact O-CD 3.31Å; S258-P260 WeakPolarHBondContact O-CD 3.49Å
261	L	47.2	Very low	47.2	Very low	164 Å²	164	114.6 Å²	114.6	86%	0.859	72%	0.722	S	S	*	*			trans	-67.7	161.1	160.5	-77.7	88.1	0	0	0	109.4	A259	A259-L261 PolarHBondContact O-N 3.4Å; A259-L261 VanDerWaalsContact O-N 3.17Å
262	A	33.8	Very low	45.4	Very low	90 Å²	90	114.6 Å²	114.6	74%	0.744	73%	0.733	S	S	*	*			trans	72.2	104.5	-178.3	0	0	0	0	0	116.1	A264	A262-A264 PolarHBondContact O-N 2.94Å
263	L	33.7	Very low	43.6	Very low	186 Å²	186	122.4 Å²	122.4	97%	0.974	76%	0.762	S	S	*	*			trans	-70.9	113.3	143.4	-87.2	74.2	0	0	0	107.9
264	A	35	Very low	42.3	Very low	85 Å²	85	130.1 Å²	130.1	70%	0.702	78%	0.78	S	S	*	*			trans	-148	117.4	158.7	0	0	0	0	0	108	A262	A262-A264 PolarHBondContact O-N 2.94Å
265	P	38.9	Very low	40.9	Very low	141 Å²	141	130.8 Å²	130.8	92%	0.916	79%	0.793	S	S	*	*			trans	-86	127.7	-174.2	32.1	-32.9	0	0	0	112.1
266	G	38	Very low	39.6	Very low	84 Å²	84	131.7 Å²	131.7	87%	0.866	80%	0.797	S	S	*	*			trans	145.6	101.8	168.6	0	0	0	0	0	113.8
267	G	37	Very low	38.6	Very low	81 Å²	81	133.8 Å²	133.8	84%	0.835	80%	0.803	S	S	*	*			trans	172	124.1	176.6	0	0	0	0	0	111.5
268	M	36.5	Very low	37.7	Very low	186 Å²	186	136.4 Å²	136.4	92%	0.916	80%	0.801	S	S	*	*			trans	-71.6	150.6	-169.7	-72.4	-67.6	-177.4	0	0	114.6
269	Q	38.3	Very low	36.9	Very low	171 Å²	171	139.5 Å²	139.5	80%	0.799	80%	0.803	S	S	*	*			trans	-25.9	140	156.7	-70.3	-88.2	12.3	0	0	116.2
270	S	32.3	Very low	36.6	Very low	113 Å²	113	141 Å²	141	79%	0.79	81%	0.809	S	S	*	*			trans	-152.1	127.8	138.9	69.2	0	0	0	0	111.5
271	L	39.9	Very low	36	Very low	148 Å²	148	143.1 Å²	143.1	78%	0.775	81%	0.814	S	S	*	*			trans	-113.7	113.8	-179.8	-174.3	91.3	0	0	0	110.3
272	P	40.2	Very low	35.3	Very low	125 Å²	125	139.2 Å²	139.2	81%	0.812	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-80.4	129.4	168.2	-16	32.5	0	0	0	111.5
273	K	31.3	Very low	35.1	Very low	191 Å²	191	140 Å²	140	83%	0.83	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-102.7	145.1	-173.9	-158.6	170.3	-175.9	176.2	0	110.8
274	R	41.4	Very low	35	Very low	237 Å²	237	135.8 Å²	135.8	89%	0.894	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-67.2	147	169.7	-65.2	-179.8	-178.4	164.3	-0.7	111.1
275	P	36.1	Very low	35	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	82%	0.816	S	S	*	*			trans	-104.6	174.3	144.9	-0.6	21.7	0	0	0	111.5
276	I	31.8	Very low	35	Very low	157 Å²	157	134.5 Å²	134.5	81%	0.805	81%	0.813	S	S	*	*			trans	-150.8	145.2	179.7	-145.1	170.1	0	0	0	110.5
277	L	34.3	Very low	35	Very low	158 Å²	158	136.6 Å²	136.6	83%	0.827	81%	0.809	S	S	*	*			trans	78.1	143.8	153.7	-163	61.7	0	0	0	122.1
278	E	31.7	Very low	35	Very low	133 Å²	133	141.5 Å²	141.5	62%	0.621	81%	0.807	S	S	*	*			trans	55.4	101.1	161.2	-72.4	-80.8	80.5	0	0	122.9
279	K	31.8	Very low	34.9	Very low	159 Å²	159	139.1 Å²	139.1	69%	0.691	80%	0.798	S	S	*	*				78	119.1	103.7	-168.3	167	168.4	-174.8	0	124.4
280	S	34.8	Very low	35	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	80%	0.795	S	S	*	*			trans	91.1	131.8	140.3	69.8	0	0	0	0	122.2
281	N	33	Very low	35.1	Very low	168 Å²	168	136.3 Å²	136.3	90%	0.898	80%	0.795	S	S	*	*			trans	51.2	102.9	158.5	-68.4	17.9	0	0	0	121.3
282	G	31.6	Very low	35.2	Very low	81 Å²	81	137 Å²	137	84%	0.835	80%	0.796	S	S	*	*			trans	-166.9	131	155	0	0	0	0	0	108.8
283	A	29	Very low	35.3	Very low	107 Å²	107	139.8 Å²	139.8	88%	0.884	80%	0.796	S	S	*	*			trans	-102.3	132.1	-169.3	0	0	0	0	0	113.2
284	A	31.7	Very low	35.7	Very low	97 Å²	97	138.2 Å²	138.2	80%	0.802	79%	0.791	S	S	*	*			trans	178.9	160.7	143.2	0	0	0	0	0	112.6
285	A	35.3	Very low	35.4	Very low	96 Å²	96	137 Å²	137	79%	0.793	79%	0.788	S	S	*	*			trans	67.2	111.7	155.7	0	0	0	0	0	120.9
286	A	38.9	Very low	35.5	Very low	104 Å²	104	136.7 Å²	136.7	86%	0.86	78%	0.776	S	S	*	*			trans	63.3	135.9	145.6	0	0	0	0	0	120.7
287	V	38.9	Very low	36.1	Very low	128 Å²	128	136.3 Å²	136.3	78%	0.776	77%	0.77	S	S	*	*			trans	-130.8	166.2	178.3	-166	0	0	0	0	108.8
288	F	35.6	Very low	36.3	Very low	184 Å²	184	132.8 Å²	132.8	81%	0.807	76%	0.764	S	S	*	*			trans	85.6	86.7	170.5	-75.9	-84.9	0	0	0	119.6
289	N	35	Very low	37	Very low	136 Å²	136	134.3 Å²	134.3	73%	0.727	78%	0.776	S	S	*	*				51.4	116.4	108.4	-159.4	2.1	0	0	0	118.9
290	P	39.6	Very low	37.3	Very low	111 Å²	111	130.8 Å²	130.8	72%	0.721	78%	0.777	S	S	*	*			trans	-86.6	153.9	-174.7	35.3	-37.2	0	0	0	115.2
291	S	35.8	Very low	37.4	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	78%	0.779	S	S	*	*			trans	-160.5	164	159.4	-83.3	0	0	0	0	111.4
292	M	42.3	Very low	37.7	Very low	161 Å²	161	131.4 Å²	131.4	79%	0.793	77%	0.769	S	S	*	*			trans	78.2	99.9	172.2	-50.6	-52.9	-76.2	0	0	118.8
293	F	41.3	Very low	37.9	Very low	185 Å²	185	134.5 Å²	134.5	81%	0.811	76%	0.761	S	S	*	*			trans	32.8	123.1	130.2	-75.9	-92.1	0	0	0	120.7
294	H	40.6	Very low	38.3	Very low	158 Å²	158	136.4 Å²	136.4	73%	0.731	76%	0.756	S	S	*	*			trans	-133	93.7	152	-162.8	87.8	0	0	0	110.6	Q296	H294-Q296 PolarHBondContact CE1-NE2 3.36Å; H294-Q296 PolarHBondContact NE2-NE2 3.15Å
295	Y	33.7	Very low	38.4	Very low	212 Å²	212	140.8 Å²	140.8	83%	0.831	76%	0.76	S	S	*	*			trans	-118.3	101.6	168.3	-175.8	-99.2	0	0	0	109.7
296	Q	40	Very low	38.6	Very low	118 Å²	118	143.7 Å²	143.7	55%	0.551	76%	0.757	S	S	*	*			trans	-101.8	151.5	163.8	-84.4	-165	84.9	0	0	108.2	H294	H294-Q296 PolarHBondContact CE1-NE2 3.36Å; H294-Q296 PolarHBondContact NE2-NE2 3.15Å
297	Q	43.4	Very low	39	Very low	148 Å²	148	144.7 Å²	144.7	69%	0.692	76%	0.755	S	S	*	*			cis	-167.1	172.2	-6.5	167	171.1	79.4	0	0	108.5
298	A	38.6	Very low	38.9	Very low	84 Å²	84	142.3 Å²	142.3	69%	0.694	75%	0.749	S	S	*	*			trans	104.7	142.8	154.2	0	0	0	0	0	117.4
299	L	47.2	Very low	38.7	Very low	165 Å²	165	142.8 Å²	142.8	86%	0.864	75%	0.751	S	S	*	*			cis	-161.4	170.3	-17.3	-113.8	176.4	0	0	0	110.1
300	A	37.5	Very low	38.9	Very low	86 Å²	86	143.6 Å²	143.6	71%	0.711	75%	0.753	S	S	*	*			trans	73.2	81.1	153.9	0	0	0	0	0	122.4
301	N	35.8	Very low	39.4	Very low	146 Å²	146	143.1 Å²	143.1	78%	0.781	75%	0.75	S	S	*	*				66.2	158.3	112.1	-137	-8.9	0	0	0	124
302	M	39.6	Very low	39.5	Very low	138 Å²	138	142.9 Å²	142.9	68%	0.68	74%	0.744	S	S	*	*			trans	76.4	148	173.5	-52.7	-80	90.7	0	0	118.9
303	Q	36.1	Very low	39.3	Very low	146 Å²	146	141.4 Å²	141.4	68%	0.682	74%	0.744	S	S	*	*			cis	-161.1	138.4	-43.7	-178.4	147.4	-45.9	0	0	110
304	L	37.8	Very low	40.1	Very low	148 Å²	148	137.3 Å²	137.3	78%	0.775	74%	0.736	S	S	*	*			trans	25.9	123.1	161.2	-78.7	159.3	0	0	0	121.9
305	Q	33.9	Very low	40.1	Very low	188 Å²	188	137 Å²	137	88%	0.879	74%	0.737	S	S	*	*				-162.1	152.4	110.9	-156.2	103	31.1	0	0	111.6
306	Q	38.1	Very low	40.5	Very low	158 Å²	158	132.6 Å²	132.6	74%	0.738	73%	0.725	S	S	*	*			trans	-135.1	165.3	169.3	-98.4	-126.6	38.1	0	0	107.1
307	P	48.8	Very low	40.3	Very low	124 Å²	124	135 Å²	135	81%	0.805	74%	0.736	S	S	*	*			cis	-142.4	-177	39.6	41.4	-20.9	0	0	0	117.7
308	A	35.6	Very low	39.7	Very low	79 Å²	79	131.2 Å²	131.2	65%	0.653	74%	0.736	S	S	*	*			trans	-103.7	164.3	174.4	0	0	0	0	0	113.2
309	F	31.3	Very low	39.7	Very low	193 Å²	193	132 Å²	132	85%	0.846	74%	0.743	S	S	*	*			trans	-160.8	142.5	154.7	-131	-86.8	0	0	0	113.7
310	I	40.5	Very low	39.2	Very low	153 Å²	153	130.2 Å²	130.2	79%	0.785	74%	0.739	S	S	*	*			trans	-151	126.9	174.7	-65.9	175	0	0	0	106.3
311	P	49.3	Very low	39.1	Very low	101 Å²	101	130.2 Å²	130.2	66%	0.656	73%	0.734	S	S	*	*				-158.2	130.9	109.8	36.3	-14.3	0	0	0	120
312	T	37.2	Very low	39.1	Very low	110 Å²	110	129.4 Å²	129.4	68%	0.675	74%	0.735	S	S	*	*				61.6	112.5	113	-31.6	0	0	0	0	123.3
313	V	39.1	Very low	39.1	Very low	130 Å²	130	129.2 Å²	129.2	79%	0.788	74%	0.741	S	S	*	*			trans	63.5	173.9	140.7	-56.2	0	0	0	0	122.7
314	P	57.4	Low	39.1	Very low	98 Å²	98	127.2 Å²	127.2	64%	0.636	74%	0.743	S	S	*	*			cis	-133.4	-162.4	-31.1	25.4	-0.3	0	0	0	114.6
315	M	42	Very low	39.2	Very low	152 Å²	152	125.9 Å²	125.9	75%	0.749	75%	0.746	S	S	*	*			trans	80.6	154.3	156.9	-52.6	-78.8	82.1	0	0	118.5
316	M	41.3	Very low	39.4	Very low	119 Å²	119	121.7 Å²	121.7	59%	0.586	74%	0.744	S	S	*	*			cis	-166.4	157.4	-17.2	-98.2	-101	67	0	0	111.7
317	H	35.3	Very low	39.5	Very low	169 Å²	169	119.9 Å²	119.9	78%	0.782	75%	0.748	S	S	*	*			trans	59.9	149.3	152.8	-68	132.4	0	0	0	122.8
318	G	31.4	Very low	39.2	Very low	68 Å²	68	120.3 Å²	120.3	70%	0.701	75%	0.749	S	S	*	*			trans	167.6	-9.9	150.7	0	0	0	0	0	123.9
319	A	37.6	Very low	40	Very low	101 Å²	101	122.7 Å²	122.7	84%	0.835	76%	0.758	S	S	*	*			trans	56.6	-170.2	179.3	0	0	0	0	0	114.2
320	T	36.9	Very low	40.5	Very low	127 Å²	127	119.4 Å²	119.4	78%	0.779	75%	0.753	S	S	*	*			cis	-153.2	-178.6	-4.6	-16.8	0	0	0	0	106.3
321	S	35.1	Very low	40.6	Very low	87 Å²	87	119 Å²	119	61%	0.608	76%	0.758	S	S	*	*			cis	-162	149.5	0.3	-145	0	0	0	0	111.4
322	T	36.1	Very low	39.9	Very low	129 Å²	129	121 Å²	121	79%	0.791	76%	0.763	S	S	*	*			trans	59.3	143.4	156.5	59.6	0	0	0	0	120
323	V	39.7	Very low	40.3	Very low	133 Å²	133	121.6 Å²	121.6	81%	0.806	77%	0.766	S	S	*	*			cis	-136.5	158.2	19.9	-76	0	0	0	0	114.8
324	S	36.1	Very low	41	Very low	105 Å²	105	120.9 Å²	120.9	73%	0.734	77%	0.765	S	S	*	*			trans	3.4	133.2	156.7	-55.5	0	0	0	0	121.6
325	S	40.6	Very low	40	Very low	120 Å²	120	125.1 Å²	125.1	84%	0.839	77%	0.773	S	S	*	*				80.6	148.4	61.9	-52.8	0	0	0	0	114.1
326	A	38.1	Very low	39.8	Very low	100 Å²	100	122.9 Å²	122.9	83%	0.826	78%	0.779	S	S	*	*			cis	-148.3	-161.9	21.4	0	0	0	0	0	115.3
327	S	40.8	Very low	39.8	Very low	119 Å²	119	125.3 Å²	125.3	83%	0.832	79%	0.789	S	S	*	*			trans	-100.2	176.9	-155.4	-46	0	0	0	0	118
328	T	41.7	Very low	40.2	Very low	134 Å²	134	123 Å²	123	82%	0.822	79%	0.791	S	S	*	*			trans	-75.6	168	166.6	57	0	0	0	0	112.9
329	P	52.1	Low	41	Very low	128 Å²	128	124.7 Å²	124.7	83%	0.831	80%	0.799	S	S	*	*				-150	-173.6	101.1	40.5	-22.7	0	0	0	116.9
330	V	43	Very low	41.4	Very low	124 Å²	124	124.9 Å²	124.9	75%	0.752	80%	0.801	S	S	*	*			trans	-77	157.9	-170.4	-162.7	0	0	0	0	114.7
331	T	42.7	Very low	41.9	Very low	144 Å²	144	124.1 Å²	124.1	88%	0.883	80%	0.801	S	S	*	*			trans	-152.9	159.4	152.3	-74.9	0	0	0	0	111
332	N	34.7	Very low	42.7	Very low	143 Å²	143	126.8 Å²	126.8	77%	0.765	81%	0.808	S	S	*	*			trans	-101.6	167.4	-161.6	-98.1	-13.2	0	0	0	117.1
333	V	45.2	Very low	43	Very low	123 Å²	123	133 Å²	133	75%	0.745	83%	0.828	S	S	*	*			trans	-35.1	159.7	159.3	-120.1	0	0	0	0	116.2
334	P	53.6	Low	43.1	Very low	116 Å²	116	133 Å²	133	75%	0.753	83%	0.829	S	S	*	*				-151.8	159	74.3	41.9	-22.4	0	0	0	120.2
335	F	36.2	Very low	43.5	Very low	187 Å²	187	134.5 Å²	134.5	82%	0.82	83%	0.834	S	S	*	*			trans	31.6	129	145.1	-96.8	-103.8	0	0	0	122.8
336	A	38.6	Very low	43.7	Very low	104 Å²	104	135.3 Å²	135.3	86%	0.86	83%	0.834	S	S	*	*				-152.8	121.8	119.9	0	0	0	0	0	110.4
337	E	41.3	Very low	44	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.794	83%	0.834	S	S	*	*			trans	-121.3	142.7	166.2	-179.4	167.3	80	0	0	108.2
338	S	43	Very low	44.2	Very low	120 Å²	120	138.5 Å²	138.5	84%	0.839	83%	0.834	S	S	*	*			trans	-155.9	112.2	173.3	-74.6	0	0	0	0	110
339	A	47.3	Very low	44.3	Very low	104 Å²	104	138.8 Å²	138.8	86%	0.86	84%	0.835	S	S	*	*			trans	-82	146.8	173.2	0	0	0	0	0	110.9
340	A	47.1	Very low	43.8	Very low	106 Å²	106	139.6 Å²	139.6	88%	0.876	84%	0.836	S	S	*	*			trans	-133.5	107.6	165.4	0	0	0	0	0	109
341	S	47.4	Very low	43.9	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	84%	0.842	S	S	*	*			trans	-92.1	135.4	165	175.5	0	0	0	0	108.4
342	N	51.3	Low	44	Very low	143 Å²	143	140.5 Å²	140.5	77%	0.765	84%	0.839	S	S	*	*				179.2	159.7	109.4	-137.6	-33.8	0	0	0	112
343	Q	41.9	Very low	44.8	Very low	259 Å²	259	140.3 Å²	140.3	100%	1.21	85%	0.845	S	S	*	*			trans	71.2	0	175.1	-58.4	173	113.7	0	0	116.1

Retrieved 343 of 343 residues in 381.7 ms (Link to these results)

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