A0A087XVJ5_POEFO Loading...

Nucleolar protein 10

AlphaFold DB , UniProt , Accession A0A087XVJ5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 716 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	74.8	Confident	84.7	Confident	56 Å²	56	66.5 Å²	66.5	28%	0.276	35%	0.351	S	S	.	.				0	124.1	0	-169.7	176.4	-162.6	0	0	107.2	Y12 N13 L14 I43 T358 L361	M1-Y12 HydrophobicContact CE-CD1 3.43Å; M1-Y12 VanDerWaalsContact CE-CD1 3.43Å; M1-Y12 HydrophobicContact CE-CD2 4.48Å; M1-Y12 HydrophobicContact CE-CE1 4.33Å; M1-Y12 HydrophobicContact CE-CG 3.5Å; M1-Y12 HydrophobicContact CG-CD1 4.35Å; M1-Y12 HydrophobicContact SD-CD1 4.12Å; M1-N13 CarbonylContact C-O 3.6Å; M1-N13 WeakPolarHBondContact CA-O 3.39Å; M1-L14 HydrophobicContact CE-CD2 3.52Å; M1-L14 HydrophobicContact CE-CG 4.38Å; M1-L14 HydrophobicContact CG-CD2 4.31Å; M1-L14 HydrophobicContact SD-CD2 4.13Å; M1-I43 HydrophobicContact SD-CD1 4.35Å; M1-T358 HydrophobicContact CE-CG2 3.97Å; M1-L361 HydrophobicContact SD-CD2 4.48Å
2	Q	81.6	Confident	85.2	Confident	79 Å²	79	61.1 Å²	61.1	37%	0.369	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.1	172.7	-177.2	-176.6	13.6	0	0	108.1	N13 Y16	Q2-N13 HydrophobicContact CB-CB 4.36Å; Q2-N13 PolarHBondContact N-O 3.08Å; Q2-N13 PolarHBondContact O-N 3.22Å; Q2-Y16 HydrophobicContact CB-CD1 3.65Å; Q2-Y16 HydrophobicContact CB-CD2 4.17Å; Q2-Y16 HydrophobicContact CB-CE1 4.2Å; Q2-Y16 HydrophobicContact CB-CG 3.61Å; Q2-Y16 HydrophobicContact CG-CD1 4.42Å; Q2-Y16 HydrophobicContact CG-CE1 4.49Å; Q2-Y16 VanDerWaalsContact OE1-CZ 3.25Å
3	I	84.1	Confident	85.5	Confident	75 Å²	75	57.3 Å²	57.3	39%	0.385	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.1	174.3	-45.1	175.1	0	0	0	107.2	N5 Y12 L361	I3-N5 WeakPolarHBondContact CG2-OD1 3.5Å; I3-Y12 HydrophobicContact CB-CD1 4.44Å; I3-Y12 HydrophobicContact CB-CE1 4.5Å; I3-Y12 HydrophobicContact CD1-CD1 4.45Å; I3-Y12 HydrophobicContact CD1-CE1 3.98Å; I3-Y12 HydrophobicContact CG1-CD1 3.83Å; I3-Y12 HydrophobicContact CG1-CE1 3.85Å; I3-Y12 HydrophobicContact CG2-CD1 4.21Å; I3-Y12 HydrophobicContact CG2-CE1 3.99Å; I3-L361 HydrophobicContact CD1-CD2 3.61Å; I3-L361 HydrophobicContact CD1-CG 4.07Å; I3-L361 HydrophobicContact CG1-CD2 4.29Å
4	S	84.9	Confident	85.4	Confident	41 Å²	41	53.5 Å²	53.5	29%	0.287	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.7	168.7	56.2	0	0	0	0	108.8	I11	S4-I11 PolarHBondContact N-O 3.42Å; S4-I11 PolarHBondContact O-N 3.37Å; S4-I11 WeakPolarHBondContact OG-CB 3.42Å; S4-I11 PolarHBondContact OG-O 2.83Å
5	N	85.1	Confident	84.9	Confident	101 Å²	101	50.9 Å²	50.9	54%	0.54	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	116.6	176.1	-66.9	-6.4	0	0	0	108.3	I3 V9 K10	I3-N5 WeakPolarHBondContact CG2-OD1 3.5Å; N5-V9 WeakPolarHBondContact CA-O 3.31Å; N5-K10 WeakPolarHBondContact OD1-CA 3.48Å; N5-K10 WeakPolarHBondContact OD1-CB 3.19Å; N5-K10 VanDerWaalsContact OD1-CG 3.29Å; N5-K10 WeakPolarHBondContact OD1-CG 3.46Å
6	V	84.9	Confident	84.2	Confident	40 Å²	40	52.8 Å²	52.8	24%	0.242	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	128.4	175.2	-177.2	0	0	0	0	107.9	D8 V9	V6-D8 VanDerWaalsContact C-N 3.29Å; V6-D8 PolarHBondContact O-N 3.46Å; V6-V9 PolarHBondContact N-O 3.32Å; V6-V9 VanDerWaalsContact N-O 3.12Å; V6-V9 PolarHBondContact O-N 2.98Å
7	N	84.9	Confident	83.3	Confident	93 Å²	93	51.8 Å²	51.8	50%	0.497	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	42.9	-175.9	-62.5	-12	0	0	0	113.3	V9 L305 F306	N7-V9 PolarHBondContact O-N 3.18Å; N7-L305 PolarHBondContact ND2-O 3.46Å; N7-F306 WeakPolarHBondContact CB-O 3.44Å; N7-F306 PolarHBondContact ND2-O 2.97Å
8	D	83.3	Confident	82.4	Confident	167 Å²	167	60.2 Å²	60.2	89%	0.893	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	11	-176.2	-59.3	-31.4	0	0	0	115.4	V6	V6-D8 VanDerWaalsContact C-N 3.29Å; V6-D8 PolarHBondContact O-N 3.46Å
9	V	87.7	Confident	81.6	Confident	14 Å²	14	60 Å²	60	9%	0.085	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.5	171.3	-179.1	0	0	0	0	108.9	N5 V6 N7 F306 I341 A343	N5-V9 WeakPolarHBondContact CA-O 3.31Å; V6-V9 PolarHBondContact N-O 3.32Å; V6-V9 VanDerWaalsContact N-O 3.12Å; V6-V9 PolarHBondContact O-N 2.98Å; N7-V9 PolarHBondContact O-N 3.18Å; V9-F306 HydrophobicContact CG1-CE1 3.91Å; V9-F306 HydrophobicContact CG1-CZ 4.32Å; V9-F306 HydrophobicContact CG2-CD1 4.35Å; V9-F306 HydrophobicContact CG2-CE1 3.91Å; V9-F306 HydrophobicContact CG2-CE2 4.14Å; V9-F306 HydrophobicContact CG2-CZ 3.8Å; V9-I341 HydrophobicContact CG1-CG2 3.71Å; V9-A343 HydrophobicContact CG1-CB 4.03Å
10	K	89.6	Confident	81.1	Confident	66 Å²	66	59.1 Å²	59.1	29%	0.287	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	124.8	174.4	-50.8	-167.6	-172.4	145.1	0	109.9	N5 Y12 E362	N5-K10 WeakPolarHBondContact OD1-CA 3.48Å; N5-K10 WeakPolarHBondContact OD1-CB 3.19Å; N5-K10 VanDerWaalsContact OD1-CG 3.29Å; N5-K10 WeakPolarHBondContact OD1-CG 3.46Å; K10-Y12 HydrophobicContact CB-CE2 3.91Å; K10-E362 HydrophobicContact CD-CG 4.45Å; K10-E362 WeakPolarHBondContact CD-OE1 3.47Å; K10-E362 WeakPolarHBondContact CE-OE1 3.11Å; K10-E362 VanDerWaalsContact NZ-CD 3.27Å; K10-E362 VanDerWaalsContact NZ-CG 3.27Å; K10-E362 IonicContact NZ-OE1 2.96Å; K10-E362 PolarHBondContact NZ-OE1 3.28Å
11	I	91.2	Very high	80.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	127.4	174.2	-61	149.5	0	0	0	107.3	S4 I309 F339 I341	S4-I11 PolarHBondContact N-O 3.42Å; S4-I11 PolarHBondContact O-N 3.37Å; S4-I11 WeakPolarHBondContact OG-CB 3.42Å; S4-I11 PolarHBondContact OG-O 2.83Å; I11-I309 HydrophobicContact CD1-CG1 3.88Å; I11-I309 HydrophobicContact CG1-CG1 4.48Å; I11-I309 HydrophobicContact CG2-CD1 4.32Å; I11-I309 HydrophobicContact CG2-CG1 4.23Å; I11-F339 HydrophobicContact CG2-CB 4.43Å; I11-F339 HydrophobicContact CG2-CD1 4.1Å; I11-I341 HydrophobicContact CB-CG1 4.44Å; I11-I341 HydrophobicContact CG1-CD1 4.04Å; I11-I341 HydrophobicContact CG1-CG1 3.99Å; I11-I341 HydrophobicContact CG2-CG1 4.2Å
12	Y	89.9	Confident	80.5	Confident	1 Å²	1	63.5 Å²	63.5	0%	0.004	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.2	179.1	-59.5	-88.3	0	0	0	110.5	M1 I3 K10 F339 Y340 P342 T358 L361	M1-Y12 HydrophobicContact CE-CD1 3.43Å; M1-Y12 VanDerWaalsContact CE-CD1 3.43Å; M1-Y12 HydrophobicContact CE-CD2 4.48Å; M1-Y12 HydrophobicContact CE-CE1 4.33Å; M1-Y12 HydrophobicContact CE-CG 3.5Å; M1-Y12 HydrophobicContact CG-CD1 4.35Å; M1-Y12 HydrophobicContact SD-CD1 4.12Å; I3-Y12 HydrophobicContact CB-CD1 4.44Å; I3-Y12 HydrophobicContact CB-CE1 4.5Å; I3-Y12 HydrophobicContact CD1-CD1 4.45Å; I3-Y12 HydrophobicContact CD1-CE1 3.98Å; I3-Y12 HydrophobicContact CG1-CD1 3.83Å; I3-Y12 HydrophobicContact CG1-CE1 3.85Å; I3-Y12 HydrophobicContact CG2-CD1 4.21Å; I3-Y12 HydrophobicContact CG2-CE1 3.99Å; K10-Y12 HydrophobicContact CB-CE2 3.91Å; Y12-F339 CarbonylContact O-C 3.51Å; Y12-F339 WeakPolarHBondContact O-CA 3.42Å; Y12-Y340 PolarHBondContact N-O 3.13Å; Y12-Y340 PolarHBondContact O-N 3.39Å; Y12-P342 HydrophobicContact CD2-CG 4.03Å; Y12-P342 HydrophobicContact CE2-CG 3.63Å; Y12-T358 HydrophobicContact CD1-CG2 4.33Å; Y12-T358 HydrophobicContact CD2-CG2 3.9Å; Y12-T358 HydrophobicContact CE1-CG2 4.14Å; Y12-T358 HydrophobicContact CE2-CG2 3.73Å; Y12-T358 HydrophobicContact CG-CG2 4.19Å; Y12-L361 HydrophobicContact CE1-CD2 4.01Å
13	N	88.9	Confident	80.2	Confident	12 Å²	12	69.6 Å²	69.6	6%	0.064	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	110.5	169.9	-173.8	-14.2	0	0	0	109.3	M1 Q2 S15 Y16 F339	M1-N13 CarbonylContact C-O 3.6Å; M1-N13 WeakPolarHBondContact CA-O 3.39Å; Q2-N13 HydrophobicContact CB-CB 4.36Å; Q2-N13 PolarHBondContact N-O 3.08Å; Q2-N13 PolarHBondContact O-N 3.22Å; N13-S15 PolarHBondContact OD1-N 3.07Å; N13-S15 PolarHBondContact OD1-OG 3.24Å; N13-Y16 PolarHBondContact OD1-N 3.32Å; N13-F339 HydrophobicContact CB-CD1 3.89Å; N13-F339 HydrophobicContact CB-CE1 3.75Å
14	L	84.6	Confident	80.2	Confident	4 Å²	4	67.1 Å²	67.1	2%	0.021	34%	0.341	C	S	.	.	S	Bend	trans	-85	-32.9	-173.1	-66.8	150.2	0	0	0	111.7	M1 Y16 L45 T338 L354	M1-L14 HydrophobicContact CE-CD2 3.52Å; M1-L14 HydrophobicContact CE-CG 4.38Å; M1-L14 HydrophobicContact CG-CD2 4.31Å; M1-L14 HydrophobicContact SD-CD2 4.13Å; L14-Y16 VanDerWaalsContact C-N 3.31Å; L14-Y16 PolarHBondContact O-N 3.28Å; L14-L45 HydrophobicContact CB-CD1 3.9Å; L14-L45 HydrophobicContact CD1-CD1 3.33Å; L14-L45 HydrophobicContact CD2-CD1 3.91Å; L14-L45 HydrophobicContact CG-CD1 3.88Å; L14-T338 PolarHBondContact N-O 3.41Å; L14-L354 HydrophobicContact CD1-CD1 4.18Å; L14-L354 HydrophobicContact CD2-CD2 3.72Å
15	S	78.3	Confident	80.1	Confident	14 Å²	14	68 Å²	68	10%	0.098	35%	0.348	C	S	.	.	S	Bend	trans	-82.8	-3.5	179.9	49.3	0	0	0	0	114.1	N13 G17 M336 N337 T338	N13-S15 PolarHBondContact OD1-N 3.07Å; N13-S15 PolarHBondContact OD1-OG 3.24Å; S15-G17 PolarHBondContact O-N 3.35Å; S15-M336 WeakPolarHBondContact CB-O 3.15Å; S15-N337 WeakPolarHBondContact OG-CA 3.23Å; S15-N337 PolarHBondContact OG-OD1 3.14Å; S15-T338 PolarHBondContact OG-N 3.5Å
16	Y	73.1	Confident	79.9	Confident	82 Å²	82	68.2 Å²	68.2	32%	0.322	35%	0.349	S	S	.	.			trans	-58.4	127.9	-176.1	-168.1	-104	0	0	0	113.2	Q2 N13 L14 Q312	Q2-Y16 HydrophobicContact CB-CD1 3.65Å; Q2-Y16 HydrophobicContact CB-CD2 4.17Å; Q2-Y16 HydrophobicContact CB-CE1 4.2Å; Q2-Y16 HydrophobicContact CB-CG 3.61Å; Q2-Y16 HydrophobicContact CG-CD1 4.42Å; Q2-Y16 HydrophobicContact CG-CE1 4.49Å; Q2-Y16 VanDerWaalsContact OE1-CZ 3.25Å; N13-Y16 PolarHBondContact OD1-N 3.32Å; L14-Y16 VanDerWaalsContact C-N 3.31Å; L14-Y16 PolarHBondContact O-N 3.28Å; Y16-Q312 HydrophobicContact CE2-CG 4.49Å; Y16-Q312 VanDerWaalsContact CE2-NE2 3.34Å; Y16-Q312 PolarHBondContact OH-NE2 2.91Å; Y16-Q312 VanDerWaalsContact OH-NE2 3.15Å
17	G	69.4	Low	79.9	Confident	35 Å²	35	75.5 Å²	75.5	36%	0.361	37%	0.372	S	S	.	.	S	Bend	trans	136.1	150.9	174.1	0	0	0	0	0	113.2	S15 S19 K335	S15-G17 PolarHBondContact O-N 3.35Å; G17-S19 PolarHBondContact O-N 3.34Å; G17-K335 PolarHBondContact O-NZ 2.91Å
18	K	67.3	Low	79.8	Confident	204 Å²	204	76.4 Å²	76.4	89%	0.887	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-54.6	136	-178.8	-66.1	-178.3	179.5	178.4	0	111.1	K335	K18-K335 VanDerWaalsContact C-NZ 3.31Å; K18-K335 PolarHBondContact O-NZ 3.38Å
19	S	66.6	Low	79.7	Confident	56 Å²	56	70.9 Å²	70.9	39%	0.392	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-65	134.7	170.1	48.7	0	0	0	0	109.7	G17 K335	G17-S19 PolarHBondContact O-N 3.34Å; S19-K335 VanDerWaalsContact CA-CE 3.4Å; S19-K335 VanDerWaalsContact CA-NZ 3.35Å
20	L	72.8	Confident	79.4	Confident	41 Å²	41	78.2 Å²	78.2	22%	0.215	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-73.6	128.8	166.9	-72.3	174	0	0	0	106.4	E22 K29 L32 I39	L20-E22 PolarHBondContact O-N 3.21Å; L20-K29 HydrophobicContact CD1-CB 4.5Å; L20-K29 HydrophobicContact CD1-CG 4.21Å; L20-L32 HydrophobicContact CD2-CD1 4.18Å; L20-I39 HydrophobicContact CD1-CG2 4.48Å; L20-I39 HydrophobicContact CD2-CD1 4.23Å
21	P	72.1	Confident	79.2	Confident	55 Å²	55	79.5 Å²	79.5	36%	0.357	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-58.1	139.9	179.7	-22.7	31.2	0	0	0	111.6	W23 L24	P21-W23 HydrophobicContact CB-CD2 4.32Å; P21-W23 HydrophobicContact CB-CG 4.23Å; P21-W23 HydrophobicContact CB-CZ2 4.31Å; P21-W23 HydrophobicContact CG-CZ2 4.41Å; P21-W23 PolarHBondContact O-N 3.19Å; P21-L24 WeakPolarHBondContact O-CB 3.18Å; P21-L24 PolarHBondContact O-N 3.04Å; P21-L24 VanDerWaalsContact O-N 3.1Å
22	E	69.6	Low	78.7	Confident	153 Å²	153	82.1 Å²	82.1	72%	0.715	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-32.7	-177.2	-163.1	179.8	174.8	0	0	112.3	L20 L24	L20-E22 PolarHBondContact O-N 3.21Å; E22-L24 PolarHBondContact O-N 3.1Å
23	W	76.4	Confident	78.2	Confident	208 Å²	208	86.5 Å²	86.5	79%	0.788	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-10	178.2	62.5	-97.7	0	0	0	114.3	P21 S25	P21-W23 HydrophobicContact CB-CD2 4.32Å; P21-W23 HydrophobicContact CB-CG 4.23Å; P21-W23 HydrophobicContact CB-CZ2 4.31Å; P21-W23 HydrophobicContact CG-CZ2 4.41Å; P21-W23 PolarHBondContact O-N 3.19Å; W23-S25 PolarHBondContact O-N 3.09Å
24	L	83	Confident	77.9	Confident	22 Å²	22	94.5 Å²	94.5	12%	0.115	44%	0.441	C	S	.	.	S	Bend	trans	-74.8	123.6	177.8	-166	75	0	0	0	109.9	P21 E22 K28 K29 L32	P21-L24 WeakPolarHBondContact O-CB 3.18Å; P21-L24 PolarHBondContact O-N 3.04Å; P21-L24 VanDerWaalsContact O-N 3.1Å; E22-L24 PolarHBondContact O-N 3.1Å; L24-K28 HydrophobicContact CD1-CB 3.74Å; L24-K28 HydrophobicContact CD1-CD 3.69Å; L24-K28 HydrophobicContact CD1-CG 4.38Å; L24-K28 HydrophobicContact CD2-CB 4.11Å; L24-K28 HydrophobicContact CG-CB 3.76Å; L24-K29 HydrophobicContact CB-CG 4.3Å; L24-K29 HydrophobicContact CD2-CB 4.49Å; L24-K29 HydrophobicContact CD2-CG 3.71Å; L24-K29 HydrophobicContact CG-CG 4.16Å; L24-K29 VanDerWaalsContact O-CE 3.26Å; L24-K29 WeakPolarHBondContact O-CE 3.47Å; L24-L32 HydrophobicContact CD2-CD1 3.52Å
25	S	83.1	Confident	77.8	Confident	61 Å²	61	101.9 Å²	101.9	43%	0.427	47%	0.473	S	S	.	.			trans	-62.5	146.5	177.6	65.3	0	0	0	0	112.3	W23 R27 K28 K29	W23-S25 PolarHBondContact O-N 3.09Å; S25-R27 PolarHBondContact O-N 2.7Å; S25-R27 VanDerWaalsContact O-N 3.07Å; S25-K28 WeakPolarHBondContact O-CA 3.42Å; S25-K28 WeakPolarHBondContact O-CB 3.08Å; S25-K28 PolarHBondContact O-N 3.4Å; S25-K29 PolarHBondContact O-N 3.41Å
26	D	81.1	Confident	77.8	Confident	104 Å²	104	104.7 Å²	104.7	56%	0.556	49%	0.487	S	S	*	.	H	α-helix	trans	-56.1	-31.7	-179.2	-62.4	-23.4	0	0	0	113	K28 K29 R30	D26-K28 VanDerWaalsContact C-N 3.34Å; D26-K28 PolarHBondContact O-N 2.9Å; D26-K29 PolarHBondContact O-N 3.29Å; D26-R30 WeakPolarHBondContact O-CB 3.4Å; D26-R30 VanDerWaalsContact O-CG 3.28Å; D26-R30 WeakPolarHBondContact O-CG 3.42Å; D26-R30 PolarHBondContact O-N 3.23Å
27	R	84.3	Confident	78	Confident	193 Å²	193	104 Å²	104	73%	0.728	49%	0.491	S	S	*	.	H	α-helix	trans	-62.9	-41.3	174.7	-171.4	176.9	-178.8	-177	0.8	111.8	S25 Q31	S25-R27 PolarHBondContact O-N 2.7Å; S25-R27 VanDerWaalsContact O-N 3.07Å; R27-Q31 WeakPolarHBondContact O-CG 3.46Å; R27-Q31 PolarHBondContact O-N 3.43Å; R27-Q31 VanDerWaalsContact O-N 3.08Å
28	K	83.6	Confident	78.2	Confident	112 Å²	112	109 Å²	109	49%	0.487	51%	0.509	S	S	.	.	H	α-helix	trans	-72.8	-39.8	176	-74	-178.4	-180	179.4	0	111	L24 S25 D26 R30 Q31 L32	L24-K28 HydrophobicContact CD1-CB 3.74Å; L24-K28 HydrophobicContact CD1-CD 3.69Å; L24-K28 HydrophobicContact CD1-CG 4.38Å; L24-K28 HydrophobicContact CD2-CB 4.11Å; L24-K28 HydrophobicContact CG-CB 3.76Å; S25-K28 WeakPolarHBondContact O-CA 3.42Å; S25-K28 WeakPolarHBondContact O-CB 3.08Å; S25-K28 PolarHBondContact O-N 3.4Å; D26-K28 VanDerWaalsContact C-N 3.34Å; D26-K28 PolarHBondContact O-N 2.9Å; K28-R30 VanDerWaalsContact C-N 3.33Å; K28-R30 PolarHBondContact O-N 3.23Å; K28-Q31 WeakPolarHBondContact O-CB 3.47Å; K28-Q31 PolarHBondContact O-N 2.78Å; K28-Q31 VanDerWaalsContact O-N 3.09Å; K28-L32 WeakPolarHBondContact O-CG 3.4Å; K28-L32 PolarHBondContact O-N 3.18Å
29	K	81.4	Confident	78.6	Confident	52 Å²	52	101 Å²	101	23%	0.226	48%	0.476	C	S	.	.	H	α-helix	trans	-54.6	-47.7	171.8	-69	179.7	176.8	175.1	0	111.3	L20 L24 S25 D26 Q31 L32 Q33	L20-K29 HydrophobicContact CD1-CB 4.5Å; L20-K29 HydrophobicContact CD1-CG 4.21Å; L24-K29 HydrophobicContact CB-CG 4.3Å; L24-K29 HydrophobicContact CD2-CB 4.49Å; L24-K29 HydrophobicContact CD2-CG 3.71Å; L24-K29 HydrophobicContact CG-CG 4.16Å; L24-K29 VanDerWaalsContact O-CE 3.26Å; L24-K29 WeakPolarHBondContact O-CE 3.47Å; S25-K29 PolarHBondContact O-N 3.41Å; D26-K29 PolarHBondContact O-N 3.29Å; K29-Q31 VanDerWaalsContact C-N 3.34Å; K29-Q31 PolarHBondContact O-N 3.19Å; K29-L32 PolarHBondContact O-N 2.95Å; K29-Q33 WeakPolarHBondContact O-CG 3.34Å; K29-Q33 PolarHBondContact O-N 2.93Å
30	R	81.5	Confident	78.9	Confident	167 Å²	167	104.8 Å²	104.8	63%	0.63	49%	0.488	S	S	*	.	H	α-helix	trans	-65.4	-32.1	175.6	-70.6	175.4	-171.3	178.8	4.3	113.6	D26 K28 K34	D26-R30 WeakPolarHBondContact O-CB 3.4Å; D26-R30 VanDerWaalsContact O-CG 3.28Å; D26-R30 WeakPolarHBondContact O-CG 3.42Å; D26-R30 PolarHBondContact O-N 3.23Å; K28-R30 VanDerWaalsContact C-N 3.33Å; K28-R30 PolarHBondContact O-N 3.23Å; R30-K34 WeakPolarHBondContact O-CG 2.89Å; R30-K34 PolarHBondContact O-N 3.31Å
31	Q	84.1	Confident	78.9	Confident	94 Å²	94	111.4 Å²	111.4	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-71.4	-37.2	174.2	-77.4	176	-6.5	0	0	111.9	R27 K28 K29 K34 K35	R27-Q31 WeakPolarHBondContact O-CG 3.46Å; R27-Q31 PolarHBondContact O-N 3.43Å; R27-Q31 VanDerWaalsContact O-N 3.08Å; K28-Q31 WeakPolarHBondContact O-CB 3.47Å; K28-Q31 PolarHBondContact O-N 2.78Å; K28-Q31 VanDerWaalsContact O-N 3.09Å; K29-Q31 VanDerWaalsContact C-N 3.34Å; K29-Q31 PolarHBondContact O-N 3.19Å; Q31-K34 PolarHBondContact O-N 3.28Å; Q31-K35 WeakPolarHBondContact O-CG 3.3Å; Q31-K35 PolarHBondContact O-N 3.07Å
32	L	81.9	Confident	79.1	Confident	54 Å²	54	111.5 Å²	111.5	28%	0.283	50%	0.503	S	S	.	.	H	α-helix	trans	-67.3	-43	174.3	-71	174.3	0	0	0	111.4	L20 L24 K28 K29 K34 K35 D36 I39	L20-L32 HydrophobicContact CD2-CD1 4.18Å; L24-L32 HydrophobicContact CD2-CD1 3.52Å; K28-L32 WeakPolarHBondContact O-CG 3.4Å; K28-L32 PolarHBondContact O-N 3.18Å; K29-L32 PolarHBondContact O-N 2.95Å; L32-K34 PolarHBondContact O-N 2.8Å; L32-K34 VanDerWaalsContact O-N 3.11Å; L32-K35 PolarHBondContact O-N 2.93Å; L32-D36 PolarHBondContact O-N 3.15Å; L32-I39 HydrophobicContact CB-CD1 4.06Å
33	Q	79.8	Confident	79.4	Confident	93 Å²	93	106.5 Å²	106.5	44%	0.435	48%	0.481	S	S	.	.	H	α-helix	trans	-55.5	-28.9	172.4	-78.5	173.4	-12.4	0	0	113.6	K29 I39	K29-Q33 WeakPolarHBondContact O-CG 3.34Å; K29-Q33 PolarHBondContact O-N 2.93Å; Q33-I39 HydrophobicContact CG-CG2 3.63Å
34	K	81.6	Confident	79.4	Confident	180 Å²	180	101.9 Å²	101.9	78%	0.783	47%	0.468	S	S	*	.	H	α-helix	trans	-82.8	-20.4	175.9	-71	179.5	-178.2	-167.5	0	113.8	R30 Q31 L32	R30-K34 WeakPolarHBondContact O-CG 2.89Å; R30-K34 PolarHBondContact O-N 3.31Å; Q31-K34 PolarHBondContact O-N 3.28Å; L32-K34 PolarHBondContact O-N 2.8Å; L32-K34 VanDerWaalsContact O-N 3.11Å
35	K	82.3	Confident	79.4	Confident	160 Å²	160	102.2 Å²	102.2	70%	0.696	47%	0.47	S	S	*	.	H	α-helix	trans	-97.7	-44.7	-175.6	-74.9	179.4	176.4	-170.5	0	111.5	Q31 L32	Q31-K35 WeakPolarHBondContact O-CG 3.3Å; Q31-K35 PolarHBondContact O-N 3.07Å; L32-K35 PolarHBondContact O-N 2.93Å
36	D	78.6	Confident	79.6	Confident	72 Å²	72	99.8 Å²	99.8	39%	0.385	45%	0.452	S	S	.	.			trans	-100.3	115.5	-172.4	-62	-24.6	0	0	0	110.2	L32 D38 I39 Q40	L32-D36 PolarHBondContact O-N 3.15Å; D36-D38 VanDerWaalsContact C-N 3.26Å; D36-D38 PolarHBondContact O-N 2.95Å; D36-I39 HydrophobicContact CB-CB 4.27Å; D36-I39 HydrophobicContact CB-CD1 3.82Å; D36-I39 HydrophobicContact CB-CG1 3.86Å; D36-I39 PolarHBondContact O-N 3.19Å; D36-Q40 PolarHBondContact O-N 3.49Å; D36-Q40 VanDerWaalsContact O-N 3.15Å
37	V	77.7	Confident	79.8	Confident	69 Å²	69	100 Å²	100	42%	0.418	45%	0.45	S	S	.	.	H	α-helix	trans	-63.3	-34.3	179.8	-179.9	0	0	0	0	111.1	I39 Q40 R41	V37-I39 VanDerWaalsContact C-N 3.34Å; V37-I39 PolarHBondContact O-N 3.32Å; V37-Q40 WeakPolarHBondContact O-CB 3.49Å; V37-Q40 PolarHBondContact O-N 3.19Å; V37-R41 HydrophobicContact CG1-CG 4.16Å; V37-R41 WeakPolarHBondContact O-CB 3.48Å; V37-R41 WeakPolarHBondContact O-CG 3.47Å; V37-R41 PolarHBondContact O-N 3.05Å
38	D	73.5	Confident	79.8	Confident	138 Å²	138	94.6 Å²	94.6	74%	0.738	44%	0.435	S	S	*	.	H	α-helix	trans	-65.3	-36.7	179.1	-65.6	-19	0	0	0	112.7	D36 R42	D36-D38 VanDerWaalsContact C-N 3.26Å; D36-D38 PolarHBondContact O-N 2.95Å; D38-R42 PolarHBondContact O-N 3.21Å
39	I	74.9	Confident	80.1	Confident	37 Å²	37	90.4 Å²	90.4	19%	0.19	42%	0.417	C	S	.	.	H	α-helix	trans	-74.1	-36	176.4	-55.4	178.7	0	0	0	109.5	L20 L32 Q33 D36 V37 R42	L20-I39 HydrophobicContact CD1-CG2 4.48Å; L20-I39 HydrophobicContact CD2-CD1 4.23Å; L32-I39 HydrophobicContact CB-CD1 4.06Å; Q33-I39 HydrophobicContact CG-CG2 3.63Å; D36-I39 HydrophobicContact CB-CB 4.27Å; D36-I39 HydrophobicContact CB-CD1 3.82Å; D36-I39 HydrophobicContact CB-CG1 3.86Å; D36-I39 PolarHBondContact O-N 3.19Å; V37-I39 VanDerWaalsContact C-N 3.34Å; V37-I39 PolarHBondContact O-N 3.32Å; I39-R42 WeakPolarHBondContact O-CB 3.48Å; I39-R42 PolarHBondContact O-N 3.06Å
40	Q	73.3	Confident	80.4	Confident	136 Å²	136	90.4 Å²	90.4	64%	0.636	42%	0.418	S	S	*	.	H	α-helix	trans	-67.1	-38.3	176.7	-169.2	-179	0.5	0	0	112.5	D36 V37 R42	D36-Q40 PolarHBondContact O-N 3.49Å; D36-Q40 VanDerWaalsContact O-N 3.15Å; V37-Q40 WeakPolarHBondContact O-CB 3.49Å; V37-Q40 PolarHBondContact O-N 3.19Å; Q40-R42 PolarHBondContact O-N 3.46Å
41	R	73.3	Confident	80.7	Confident	180 Å²	180	82.5 Å²	82.5	68%	0.679	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	0.7	177.2	-67.6	-179.3	179.8	-176.6	-1	113.1	V37 I43	V37-R41 HydrophobicContact CG1-CG 4.16Å; V37-R41 WeakPolarHBondContact O-CB 3.48Å; V37-R41 WeakPolarHBondContact O-CG 3.47Å; V37-R41 PolarHBondContact O-N 3.05Å; R41-I43 PolarHBondContact O-N 3.06Å
42	R	75.6	Confident	80.8	Confident	56 Å²	56	80 Å²	80	21%	0.211	38%	0.38	C	S	.	.			trans	-76.3	124.4	179.4	-173.9	166.9	172.8	-115.5	-23.5	110.1	D38 I39 Q40 E44 K335	D38-R42 PolarHBondContact O-N 3.21Å; I39-R42 WeakPolarHBondContact O-CB 3.48Å; I39-R42 PolarHBondContact O-N 3.06Å; Q40-R42 PolarHBondContact O-N 3.46Å; R42-E44 IonicContact CZ-OE1 3.22Å; R42-E44 IonicContact NE-OE1 2.72Å; R42-E44 IonicContact NH1-OE1 2.8Å; R42-E44 PolarHBondContact NH1-OE1 3.01Å; R42-E44 IonicContact NH2-OE1 2.78Å; R42-E44 PolarHBondContact NH2-OE1 3.17Å; R42-K335 VanDerWaalsContact NH1-NZ 3.14Å
43	I	75.9	Confident	81.1	Confident	48 Å²	48	79.8 Å²	79.8	25%	0.246	38%	0.381	C	S	.	.			trans	-94	125.5	174.9	-57.1	168.6	0	0	0	107	M1 R41 L357	M1-I43 HydrophobicContact SD-CD1 4.35Å; R41-I43 PolarHBondContact O-N 3.06Å; I43-L357 HydrophobicContact CD1-CD1 3.72Å
44	E	77.4	Confident	81.6	Confident	111 Å²	111	77 Å²	77	52%	0.519	37%	0.371	S	S	.	.			trans	-111.4	114.6	167.8	-69.4	-177.4	162.4	0	0	106.9	R42	R42-E44 IonicContact CZ-OE1 3.22Å; R42-E44 IonicContact NE-OE1 2.72Å; R42-E44 IonicContact NH1-OE1 2.8Å; R42-E44 PolarHBondContact NH1-OE1 3.01Å; R42-E44 IonicContact NH2-OE1 2.78Å; R42-E44 PolarHBondContact NH2-OE1 3.17Å
45	L	82.9	Confident	82.1	Confident	30 Å²	30	68.4 Å²	68.4	16%	0.157	33%	0.333	C	S	.	.	S	Bend	trans	-72.6	-58.5	-179.7	-90.1	155.5	0	0	0	111.1	L14 L85 C351 L354	L14-L45 HydrophobicContact CB-CD1 3.9Å; L14-L45 HydrophobicContact CD1-CD1 3.33Å; L14-L45 HydrophobicContact CD2-CD1 3.91Å; L14-L45 HydrophobicContact CG-CD1 3.88Å; L45-L85 WeakPolarHBondContact O-CD2 3.45Å; L45-C351 HydrophobicContact CD2-CB 4.34Å; L45-C351 WeakPolarHBondContact CD2-SG 3.49Å; L45-L354 HydrophobicContact CD1-CD1 3.79Å; L45-L354 HydrophobicContact CD1-CD2 4.23Å; L45-L354 HydrophobicContact CD2-CD1 3.76Å; L45-L354 HydrophobicContact CD2-CD2 4.04Å; L45-L354 HydrophobicContact CD2-CG 3.96Å; L45-L354 HydrophobicContact CG-CD1 4.37Å; L45-L354 HydrophobicContact CG-CD2 4.37Å
46	V	86.8	Confident	82.5	Confident	9 Å²	9	62.5 Å²	62.5	6%	0.055	31%	0.311	C	S	.	.	S	Bend	trans	-105.8	125.1	176.1	178.6	0	0	0	0	107.5	F49 Y80 W350	V46-F49 HydrophobicContact CB-CB 3.95Å; V46-F49 HydrophobicContact CB-CD2 4.1Å; V46-F49 HydrophobicContact CB-CG 4.2Å; V46-F49 HydrophobicContact CG1-CB 4.16Å; V46-F49 HydrophobicContact CG1-CD2 3.95Å; V46-F49 HydrophobicContact CG1-CG 4.42Å; V46-F49 WeakPolarHBondContact O-CB 3.47Å; V46-F49 PolarHBondContact O-N 3.01Å; V46-Y80 HydrophobicContact CG1-CD1 3.59Å; V46-Y80 HydrophobicContact CG1-CE1 4.32Å; V46-Y80 HydrophobicContact CG1-CG 4.06Å; V46-W350 HydrophobicContact CG2-CH2 4.34Å; V46-W350 HydrophobicContact CG2-CZ3 4.21Å
47	Q	86	Confident	83.2	Confident	108 Å²	108	59.6 Å²	59.6	51%	0.505	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	135	176.2	-171.6	-173.5	-21.5	0	0	110	F49 L85	Q47-F49 PolarHBondContact O-N 3.31Å; Q47-L85 VanDerWaalsContact CB-O 3.31Å; Q47-L85 WeakPolarHBondContact CB-O 3.45Å; Q47-L85 PolarHBondContact N-O 3.32Å
48	D	84.9	Confident	84	Confident	80 Å²	80	56.3 Å²	56.3	43%	0.428	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	34.2	178.6	-54.1	-36.7	0	0	0	113.3	E50 Y80	D48-E50 PolarHBondContact O-N 3.12Å; D48-Y80 VanDerWaalsContact O-CE1 3.31Å; D48-Y80 WeakPolarHBondContact O-CE1 3.23Å; D48-Y80 PolarHBondContact O-OH 3.29Å
49	F	88.1	Confident	84.9	Confident	24 Å²	24	52.5 Å²	52.5	11%	0.105	25%	0.253	C	S	.	.			trans	-75.3	58.4	172.6	-158.8	-108.6	0	0	0	112	V46 Q47 I67 Y80 F328 M336 T338	V46-F49 HydrophobicContact CB-CB 3.95Å; V46-F49 HydrophobicContact CB-CD2 4.1Å; V46-F49 HydrophobicContact CB-CG 4.2Å; V46-F49 HydrophobicContact CG1-CB 4.16Å; V46-F49 HydrophobicContact CG1-CD2 3.95Å; V46-F49 HydrophobicContact CG1-CG 4.42Å; V46-F49 WeakPolarHBondContact O-CB 3.47Å; V46-F49 PolarHBondContact O-N 3.01Å; Q47-F49 PolarHBondContact O-N 3.31Å; F49-I67 HydrophobicContact CE2-CG2 4.12Å; F49-I67 HydrophobicContact CZ-CG2 4.37Å; F49-Y80 HydrophobicContact CD2-CD1 4.06Å; F49-Y80 AromaticContact CD2-CD2 3.79Å; F49-Y80 HydrophobicContact CD2-CD2 3.79Å; F49-Y80 AromaticContact CD2-CE1 3.96Å; F49-Y80 HydrophobicContact CD2-CE1 3.96Å; F49-Y80 AromaticContact CD2-CE2 3.7Å; F49-Y80 HydrophobicContact CD2-CE2 3.7Å; F49-Y80 AromaticContact CD2-CG 3.97Å; F49-Y80 HydrophobicContact CD2-CG 3.97Å; F49-Y80 AromaticContact CD2-CZ 3.77Å; F49-Y80 AromaticContact CE2-CD2 3.7Å; F49-Y80 HydrophobicContact CE2-CD2 3.7Å; F49-Y80 AromaticContact CE2-CE2 3.78Å; F49-Y80 HydrophobicContact CE2-CE2 3.78Å; F49-Y80 HydrophobicContact CE2-CG 4.2Å; F49-F328 AromaticContact CE1-CD1 3.93Å; F49-F328 HydrophobicContact CE1-CD1 3.93Å; F49-F328 HydrophobicContact CE1-CE1 4.36Å; F49-F328 AromaticContact CZ-CD1 3.67Å; F49-F328 HydrophobicContact CZ-CD1 3.67Å; F49-F328 HydrophobicContact CZ-CE1 4.08Å; F49-M336 HydrophobicContact CD1-CB 3.77Å; F49-M336 HydrophobicContact CD1-SD 4.42Å; F49-M336 HydrophobicContact CE1-CB 3.42Å; F49-M336 VanDerWaalsContact CE1-CB 3.42Å; F49-M336 HydrophobicContact CE1-CG 4.28Å; F49-M336 HydrophobicContact CE1-SD 3.89Å; F49-M336 HydrophobicContact CE2-SD 4.18Å; F49-M336 HydrophobicContact CZ-CB 4.2Å; F49-M336 HydrophobicContact CZ-SD 3.74Å; F49-T338 HydrophobicContact CD1-CG2 4.19Å; F49-T338 HydrophobicContact CE1-CG2 3.82Å
50	E	88.1	Confident	85.8	Confident	52 Å²	52	51.8 Å²	51.8	24%	0.243	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-134.8	164.9	177.4	58.2	-177	-164.9	0	0	109.9	D48 R78 Y80 P334 K335	D48-E50 PolarHBondContact O-N 3.12Å; E50-R78 PolarHBondContact O-NH1 3.27Å; E50-Y80 PolarHBondContact O-OH 2.89Å; E50-P334 CarbonylContact C-O 3.56Å; E50-P334 WeakPolarHBondContact CA-O 3.43Å; E50-P334 VanDerWaalsContact CB-O 3.3Å; E50-P334 WeakPolarHBondContact CB-O 3.32Å; E50-K335 HydrophobicContact CB-CG 4.38Å
51	M	88.6	Confident	86.8	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.01	22%	0.22	C	C	.	.			trans	-122.3	155.2	164.7	-75	-70.1	172.4	0	0	108.2	T53 C55 A69 R76 R78 P334 M336	M51-T53 PolarHBondContact O-N 3.21Å; M51-C55 HydrophobicContact CG-CB 4.38Å; M51-A69 HydrophobicContact CE-CB 3.72Å; M51-A69 WeakPolarHBondContact CE-O 3.43Å; M51-R76 HydrophobicContact SD-CG 4.27Å; M51-R78 HydrophobicContact CE-CB 3.57Å; M51-R78 HydrophobicContact CE-CG 3.59Å; M51-R78 HydrophobicContact SD-CG 4.14Å; M51-P334 PolarHBondContact N-O 2.85Å; M51-P334 CarbonylContact O-C 3.56Å; M51-P334 WeakPolarHBondContact O-CA 3.19Å; M51-P334 WeakPolarHBondContact O-CB 3.34Å; M51-P334 VanDerWaalsContact O-O 3.07Å; M51-M336 HydrophobicContact CB-CE 4.23Å; M51-M336 HydrophobicContact CE-CE 3.48Å; M51-M336 VanDerWaalsContact CE-CE 3.48Å; M51-M336 HydrophobicContact CG-CE 3.16Å; M51-M336 HydrophobicContact SD-CE 4.2Å
52	P	85.8	Confident	87.6	Confident	41 Å²	41	43.1 Å²	43.1	27%	0.266	21%	0.211	S	C	.	.	S	Bend	trans	-61.6	-30.9	-179.9	-24.3	34	0	0	0	114.3	Y73	P52-Y73 HydrophobicContact CB-CD1 3.82Å; P52-Y73 HydrophobicContact CB-CG 4.5Å; P52-Y73 HydrophobicContact CG-CD1 4.3Å
53	T	87.4	Confident	88.3	Confident	50 Å²	50	45 Å²	45	31%	0.307	23%	0.226	S	C	.	.	S	Bend	trans	-133.4	-80.4	-175.8	51.3	0	0	0	0	111.7	M51 T72 Y73 D333	M51-T53 PolarHBondContact O-N 3.21Å; T53-T72 PolarHBondContact OG1-OG1 3.07Å; T53-T72 VanDerWaalsContact OG1-OG1 3.06Å; T53-Y73 HydrophobicContact CG2-CG 4.09Å; T53-Y73 WeakPolarHBondContact OG1-CB 3.48Å; T53-Y73 PolarHBondContact OG1-N 3.3Å; T53-D333 CarbonylContact O-C 3.59Å; T53-D333 VanDerWaalsContact O-C 3.25Å
54	V	90.9	Very high	88.9	Confident	34 Å²	34	42.8 Å²	42.8	21%	0.206	22%	0.215	C	C	.	.			trans	-133.2	141.6	-170.8	174.6	0	0	0	0	108.6	G71 T72 E332	V54-G71 WeakPolarHBondContact O-CA 3.44Å; V54-T72 HydrophobicContact CB-CG2 4.34Å; V54-T72 PolarHBondContact O-N 3.37Å; V54-E332 HydrophobicContact CG1-CG 4.38Å; V54-E332 HydrophobicContact CG2-CB 4.4Å
55	C	92.1	Very high	89.5	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	129.6	167.9	-171.3	0	0	0	0	109.9	M51 I58 A70 N316 A330 N331 M336	M51-C55 HydrophobicContact CG-CB 4.38Å; C55-I58 VanDerWaalsContact SG-CG1 3.59Å; C55-A70 WeakPolarHBondContact CA-O 3.38Å; C55-A70 PolarHBondContact SG-O 2.91Å; C55-N316 PolarHBondContact O-ND2 3.35Å; C55-A330 HydrophobicContact CB-CB 4.08Å; C55-N331 PolarHBondContact N-O 2.93Å; C55-N331 VanDerWaalsContact N-O 3.08Å; C55-M336 HydrophobicContact CB-CE 3.92Å; C55-M336 HydrophobicContact CB-CG 4.02Å; C55-M336 HydrophobicContact CB-SD 4.38Å; C55-M336 VanDerWaalsContact SG-CE 3.58Å
56	T	91.7	Very high	90.1	Very high	36 Å²	36	38.8 Å²	38.8	22%	0.221	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-53.2	179.7	56.1	0	0	0	0	111.7	A70 T72 V97 N316	T56-A70 PolarHBondContact N-O 3.02Å; T56-A70 WeakPolarHBondContact OG1-CB 3.4Å; T56-T72 HydrophobicContact CG2-CG2 3.52Å; T56-V97 PolarHBondContact OG1-O 3.08Å; T56-N316 WeakPolarHBondContact O-CB 3.49Å
57	S	91.8	Very high	90.4	Very high	10 Å²	10	38.4 Å²	38.4	7%	0.07	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	148.5	-176.4	46	0	0	0	0	111.6	A69 A70 F100	S57-A69 WeakPolarHBondContact O-CA 3.38Å; S57-A70 PolarHBondContact O-N 3.48Å; S57-F100 VanDerWaalsContact OG-CD1 3.28Å; S57-F100 WeakPolarHBondContact OG-CD1 3.34Å; S57-F100 WeakPolarHBondContact OG-CE1 3.35Å
58	I	94.5	Very high	90.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133.6	176.8	-63.6	170	0	0	0	108.3	C55 I67 L68 A69 D317 C319 F328 A330 M336	C55-I58 VanDerWaalsContact SG-CG1 3.59Å; I58-I67 HydrophobicContact CG2-CG2 3.91Å; I58-L68 WeakPolarHBondContact CA-O 3.38Å; I58-A69 HydrophobicContact CG1-CB 3.95Å; I58-D317 PolarHBondContact N-OD2 3.04Å; I58-C319 HydrophobicContact CG2-CB 4.41Å; I58-C319 VanDerWaalsContact O-CB 3.25Å; I58-C319 WeakPolarHBondContact O-CB 3.46Å; I58-F328 HydrophobicContact CD1-CB 4.44Å; I58-F328 HydrophobicContact CG2-CB 3.91Å; I58-A330 HydrophobicContact CD1-CB 3.84Å; I58-A330 HydrophobicContact CG1-CB 3.91Å; I58-M336 HydrophobicContact CD1-CB 4.31Å; I58-M336 HydrophobicContact CD1-CG 4.1Å; I58-M336 HydrophobicContact CD1-SD 3.54Å; I58-M336 VanDerWaalsContact CD1-SD 3.54Å; I58-M336 HydrophobicContact CG1-SD 4.08Å
59	K	93.9	Very high	91.3	Very high	59 Å²	59	29.4 Å²	29.4	26%	0.257	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	142.2	172.8	-71.8	-171.8	171.1	-177.1	0	111.3	L68 F100 D101 I102	K59-L68 PolarHBondContact N-O 3.38Å; K59-L68 PolarHBondContact O-N 3.42Å; K59-F100 HydrophobicContact CB-CE2 3.86Å; K59-F100 HydrophobicContact CB-CZ 4.02Å; K59-F100 HydrophobicContact CD-CD2 4.49Å; K59-F100 HydrophobicContact CD-CE2 4.27Å; K59-F100 VanDerWaalsContact CD-O 3.25Å; K59-F100 WeakPolarHBondContact CD-O 3.45Å; K59-F100 WeakPolarHBondContact CE-O 3.44Å; K59-F100 HydrophobicContact CG-CE2 4.22Å; K59-F100 HydrophobicContact CG-CZ 4.25Å; K59-F100 PolarHBondContact NZ-O 2.73Å; K59-D101 VanDerWaalsContact NZ-CG 3.33Å; K59-D101 IonicContact NZ-OD1 3.8Å; K59-D101 PolarHBondContact NZ-OD1 3.14Å; K59-I102 HydrophobicContact CB-CD1 4.39Å
60	V	93.9	Very high	91.6	Very high	21 Å²	21	28.3 Å²	28.3	13%	0.127	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	137.4	171.4	-173.2	0	0	0	0	108.5	I67 Y321 F328	V60-I67 HydrophobicContact CG2-CG1 4.32Å; V60-Y321 HydrophobicContact CG1-CD2 3.72Å; V60-Y321 HydrophobicContact CG1-CE2 3.79Å; V60-Y321 HydrophobicContact CG2-CD2 4.26Å; V60-F328 HydrophobicContact CG2-CD2 3.91Å; V60-F328 HydrophobicContact CG2-CE2 4.11Å
61	S	93.9	Very high	91.8	Very high	1 Å²	1	26 Å²	26	1%	0.007	13%	0.134	C	C	.	.			trans	-60.5	154.5	170.9	64.8	0	0	0	0	111.3	D63 G64 Q65 F66 D105	S61-D63 VanDerWaalsContact C-N 3.27Å; S61-D63 PolarHBondContact O-N 2.95Å; S61-G64 WeakPolarHBondContact O-CA 3.41Å; S61-G64 PolarHBondContact O-N 3.45Å; S61-G64 PolarHBondContact OG-N 2.97Å; S61-Q65 PolarHBondContact OG-N 3Å; S61-F66 WeakPolarHBondContact CB-O 3.3Å; S61-F66 PolarHBondContact N-O 3.12Å; S61-F66 PolarHBondContact OG-N 3.26Å; S61-F66 PolarHBondContact OG-O 3.41Å; S61-D105 WeakPolarHBondContact CB-O 3.21Å
62	R	89.6	Confident	91.9	Very high	133 Å²	133	27.9 Å²	27.9	50%	0.502	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-34.5	-178.4	-65.9	169.5	167.9	-148	-14.6	113	G64 D105 Y144	R62-G64 PolarHBondContact O-N 3.48Å; R62-D105 HydrophobicContact CB-CB 4.24Å; R62-D105 WeakPolarHBondContact CD-OD1 3.42Å; R62-D105 PolarHBondContact N-O 3.34Å; R62-D105 IonicContact NH1-OD1 2.8Å; R62-Y144 PolarHBondContact NE-OH 3.38Å; R62-Y144 PolarHBondContact NH1-OH 3.05Å; R62-Y144 PolarHBondContact NH2-OH 3.09Å; R62-Y144 VanDerWaalsContact NH2-OH 3.13Å
63	D	89.5	Confident	92.1	Very high	95 Å²	95	32.1 Å²	32.1	51%	0.508	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.4	174.2	-64.7	-28.9	0	0	0	112.9	S61 Q65 D105	S61-D63 VanDerWaalsContact C-N 3.27Å; S61-D63 PolarHBondContact O-N 2.95Å; D63-Q65 PolarHBondContact O-N 3.46Å; D63-D105 PolarHBondContact N-O 3.32Å; D63-D105 WeakPolarHBondContact OD2-CB 3.21Å
64	G	88.5	Confident	92.3	Very high	2 Å²	2	36 Å²	36	2%	0.021	17%	0.17	C	C	.	.	S	Bend	trans	70	4.4	-177.5	0	0	0	0	0	114.4	S61 R62 T82 Y321	S61-G64 WeakPolarHBondContact O-CA 3.41Å; S61-G64 PolarHBondContact O-N 3.45Å; S61-G64 PolarHBondContact OG-N 2.97Å; R62-G64 PolarHBondContact O-N 3.48Å; G64-T82 PolarHBondContact O-OG1 2.96Å; G64-Y321 WeakPolarHBondContact CA-OH 3.48Å; G64-Y321 WeakPolarHBondContact O-CE2 3.35Å; G64-Y321 PolarHBondContact O-OH 2.87Å
65	Q	91.6	Very high	92.3	Very high	53 Å²	53	35.4 Å²	35.4	25%	0.248	17%	0.167	C	C	.	.	S	Bend	trans	-81.1	-36.4	-177.5	179.4	170.2	-7.6	0	0	113	S61 D63 D81 T82 Y83	S61-Q65 PolarHBondContact OG-N 3Å; D63-Q65 PolarHBondContact O-N 3.46Å; Q65-D81 WeakPolarHBondContact CG-OD1 3.26Å; Q65-D81 PolarHBondContact NE2-OD1 3.4Å; Q65-D81 VanDerWaalsContact NE2-OD1 3.15Å; Q65-T82 VanDerWaalsContact C-OG1 3.27Å; Q65-T82 VanDerWaalsContact CA-OG1 3.28Å; Q65-T82 WeakPolarHBondContact CA-OG1 3.48Å; Q65-T82 VanDerWaalsContact O-CB 3.31Å; Q65-T82 WeakPolarHBondContact O-CB 3.37Å; Q65-T82 VanDerWaalsContact O-CG2 3.27Å; Q65-T82 WeakPolarHBondContact O-CG2 3.49Å; Q65-T82 PolarHBondContact O-N 3.16Å; Q65-T82 PolarHBondContact O-OG1 3.16Å; Q65-Y83 HydrophobicContact CB-CE2 4.38Å; Q65-Y83 HydrophobicContact CG-CD2 3.71Å; Q65-Y83 HydrophobicContact CG-CE2 4.01Å
66	F	94.1	Very high	92.3	Very high	5 Å²	5	36.7 Å²	36.7	2%	0.022	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	138	-173.5	-56.4	-73.3	0	0	0	111.3	S61 Y80 D81 K88 D106 Y107	S61-F66 WeakPolarHBondContact CB-O 3.3Å; S61-F66 PolarHBondContact N-O 3.12Å; S61-F66 PolarHBondContact OG-N 3.26Å; S61-F66 PolarHBondContact OG-O 3.41Å; F66-Y80 WeakPolarHBondContact CA-O 3.33Å; F66-D81 HydrophobicContact CD1-CB 4.42Å; F66-D81 HydrophobicContact CE1-CB 4.25Å; F66-K88 HydrophobicContact CD1-CD 4.33Å; F66-K88 HydrophobicContact CE1-CD 3.87Å; F66-D106 HydrophobicContact CE2-CB 4.48Å; F66-Y107 AromaticContact CD1-CD1 3.71Å; F66-Y107 HydrophobicContact CD1-CD1 3.71Å; F66-Y107 HydrophobicContact CD1-CE1 4.3Å; F66-Y107 HydrophobicContact CD1-CG 4.36Å; F66-Y107 AromaticContact CD2-CD1 3.61Å; F66-Y107 HydrophobicContact CD2-CD1 3.61Å; F66-Y107 HydrophobicContact CD2-CG 4.38Å; F66-Y107 AromaticContact CE1-CD1 3.6Å; F66-Y107 HydrophobicContact CE1-CD1 3.6Å; F66-Y107 AromaticContact CE1-CE1 3.76Å; F66-Y107 HydrophobicContact CE1-CE1 3.76Å; F66-Y107 AromaticContact CE2-CD1 3.48Å; F66-Y107 HydrophobicContact CE2-CD1 3.48Å; F66-Y107 VanDerWaalsContact CE2-CD1 3.48Å; F66-Y107 HydrophobicContact CE2-CE1 4Å; F66-Y107 AromaticContact CG-CD1 3.72Å; F66-Y107 HydrophobicContact CG-CD1 3.72Å; F66-Y107 HydrophobicContact CG-CG 4.25Å; F66-Y107 AromaticContact CZ-CD1 3.47Å; F66-Y107 HydrophobicContact CZ-CD1 3.47Å; F66-Y107 VanDerWaalsContact CZ-CD1 3.47Å; F66-Y107 AromaticContact CZ-CE1 3.58Å; F66-Y107 HydrophobicContact CZ-CE1 3.58Å
67	I	94.3	Very high	92.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.1	171.4	-55.6	164.6	0	0	0	106.8	F49 I58 V60 Y80 T82 F328	F49-I67 HydrophobicContact CE2-CG2 4.12Å; F49-I67 HydrophobicContact CZ-CG2 4.37Å; I58-I67 HydrophobicContact CG2-CG2 3.91Å; V60-I67 HydrophobicContact CG2-CG1 4.32Å; I67-Y80 PolarHBondContact N-O 2.85Å; I67-Y80 PolarHBondContact O-N 3.47Å; I67-T82 HydrophobicContact CD1-CG2 3.57Å; I67-T82 HydrophobicContact CG1-CG2 3.8Å; I67-F328 HydrophobicContact CD1-CE1 3.79Å; I67-F328 HydrophobicContact CD1-CE2 3.86Å; I67-F328 HydrophobicContact CD1-CZ 3.37Å; I67-F328 HydrophobicContact CG1-CE2 4.49Å; I67-F328 HydrophobicContact CG1-CZ 4.43Å
68	L	94.5	Very high	92.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	137.8	177	-75.5	159.4	0	0	0	109.1	I58 K59 I77 R78 C79 F100 I102 L110	I58-L68 WeakPolarHBondContact CA-O 3.38Å; K59-L68 PolarHBondContact N-O 3.38Å; K59-L68 PolarHBondContact O-N 3.42Å; L68-I77 HydrophobicContact CD2-CG2 3.73Å; L68-R78 WeakPolarHBondContact CA-O 3.34Å; L68-C79 HydrophobicContact CD2-CB 3.48Å; L68-C79 VanDerWaalsContact CD2-CB 3.48Å; L68-C79 HydrophobicContact CG-CB 4.47Å; L68-F100 HydrophobicContact CB-CE2 3.59Å; L68-F100 HydrophobicContact CB-CZ 3.8Å; L68-F100 HydrophobicContact CD1-CE2 4.36Å; L68-I102 HydrophobicContact CD1-CD1 3.68Å; L68-I102 HydrophobicContact CD1-CG1 3.73Å; L68-L110 HydrophobicContact CD1-CD1 3.88Å; L68-L110 HydrophobicContact CD1-CD2 3.39Å; L68-L110 HydrophobicContact CD1-CG 4.29Å; L68-L110 HydrophobicContact CD2-CD1 4.08Å
69	A	94.3	Very high	92.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	136.8	176.4	0	0	0	0	0	110.5	M51 S57 I58 I77 R78 Y80 M336	M51-A69 HydrophobicContact CE-CB 3.72Å; M51-A69 WeakPolarHBondContact CE-O 3.43Å; S57-A69 WeakPolarHBondContact O-CA 3.38Å; I58-A69 HydrophobicContact CG1-CB 3.95Å; A69-I77 WeakPolarHBondContact O-CA 3.42Å; A69-R78 PolarHBondContact N-O 3.14Å; A69-R78 PolarHBondContact O-N 2.99Å; A69-Y80 HydrophobicContact CB-CE2 4.29Å; A69-M336 HydrophobicContact CB-CE 3.48Å; A69-M336 VanDerWaalsContact CB-CE 3.48Å; A69-M336 HydrophobicContact CB-SD 3.76Å
70	A	94.6	Very high	92.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.9	176.9	0	0	0	0	0	110.6	C55 T56 S57 I77 V97 F100	C55-A70 WeakPolarHBondContact CA-O 3.38Å; C55-A70 PolarHBondContact SG-O 2.91Å; T56-A70 PolarHBondContact N-O 3.02Å; T56-A70 WeakPolarHBondContact OG1-CB 3.4Å; S57-A70 PolarHBondContact O-N 3.48Å; A70-I77 HydrophobicContact CB-CG1 4.34Å; A70-V97 HydrophobicContact CB-CB 4.13Å; A70-V97 HydrophobicContact CB-CG1 4.37Å; A70-F100 HydrophobicContact CB-CD1 4.05Å; A70-F100 HydrophobicContact CB-CE1 3.89Å
71	G	92.6	Very high	92.5	Very high	4 Å²	4	32.4 Å²	32.4	4%	0.041	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	156.9	178.3	0	0	0	0	0	112.6	V54 P75 R76	V54-G71 WeakPolarHBondContact O-CA 3.44Å; G71-P75 WeakPolarHBondContact O-CA 3Å; G71-R76 PolarHBondContact N-O 3.06Å; G71-R76 PolarHBondContact O-N 3.16Å
72	T	90.3	Very high	92.4	Very high	41 Å²	41	32.4 Å²	32.4	25%	0.252	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-41.3	-174.1	57.4	0	0	0	0	113.9	T53 V54 T56 K74	T53-T72 PolarHBondContact OG1-OG1 3.07Å; T53-T72 VanDerWaalsContact OG1-OG1 3.06Å; V54-T72 HydrophobicContact CB-CG2 4.34Å; V54-T72 PolarHBondContact O-N 3.37Å; T56-T72 HydrophobicContact CG2-CG2 3.52Å; T72-K74 PolarHBondContact O-N 2.9Å
73	Y	90.9	Very high	92.4	Very high	130 Å²	130	33.2 Å²	33.2	51%	0.51	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	112.9	-174.5	178	-103.5	0	0	0	113.5	P52 T53 R76	P52-Y73 HydrophobicContact CB-CD1 3.82Å; P52-Y73 HydrophobicContact CB-CG 4.5Å; P52-Y73 HydrophobicContact CG-CD1 4.3Å; T53-Y73 HydrophobicContact CG2-CG 4.09Å; T53-Y73 WeakPolarHBondContact OG1-CB 3.48Å; T53-Y73 PolarHBondContact OG1-N 3.3Å; Y73-R76 PolarHBondContact O-NE 3Å; Y73-R76 VanDerWaalsContact O-NE 3.16Å; Y73-R76 PolarHBondContact O-NH2 3.02Å
74	K	91.2	Very high	92.4	Very high	133 Å²	133	35.1 Å²	35.1	58%	0.578	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	86.7	-157.6	-62.3	-178.4	172.7	-176.9	0	107.3	T72 R76	T72-K74 PolarHBondContact O-N 2.9Å; K74-R76 VanDerWaalsContact O-CB 3.31Å; K74-R76 WeakPolarHBondContact O-CB 3.41Å; K74-R76 PolarHBondContact O-N 3.22Å; K74-R76 PolarHBondContact O-NE 3.44Å; K74-R76 VanDerWaalsContact O-NE 3.13Å
75	P	91.3	Very high	92.5	Very high	21 Å²	21	38 Å²	38	14%	0.136	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	122.2	-164.1	11.4	-24.9	0	0	0	109.3	G71 C92 L93 S95 D96	G71-P75 WeakPolarHBondContact O-CA 3Å; P75-C92 CarbonylContact O-C 3.47Å; P75-C92 WeakPolarHBondContact O-CA 3.47Å; P75-L93 HydrophobicContact CB-CB 4.26Å; P75-L93 PolarHBondContact O-N 2.73Å; P75-S95 WeakPolarHBondContact CB-O 3.24Å; P75-D96 WeakPolarHBondContact CB-OD1 3.41Å
76	R	92	Very high	92.4	Very high	26 Å²	26	36.8 Å²	36.8	10%	0.098	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	153.8	-169.5	65.4	-175.9	70.8	-177.5	17.7	111.3	M51 G71 Y73 K74 E90 R91	M51-R76 HydrophobicContact SD-CG 4.27Å; G71-R76 PolarHBondContact N-O 3.06Å; G71-R76 PolarHBondContact O-N 3.16Å; Y73-R76 PolarHBondContact O-NE 3Å; Y73-R76 VanDerWaalsContact O-NE 3.16Å; Y73-R76 PolarHBondContact O-NH2 3.02Å; K74-R76 VanDerWaalsContact O-CB 3.31Å; K74-R76 WeakPolarHBondContact O-CB 3.41Å; K74-R76 PolarHBondContact O-N 3.22Å; K74-R76 PolarHBondContact O-NE 3.44Å; K74-R76 VanDerWaalsContact O-NE 3.13Å; R76-E90 HydrophobicContact CB-CG 4.27Å; R76-E90 VanDerWaalsContact CD-OE1 3.24Å; R76-E90 WeakPolarHBondContact CD-OE1 3.3Å; R76-E90 IonicContact CZ-OE1 3.94Å; R76-E90 VanDerWaalsContact CZ-OE1 3.26Å; R76-E90 IonicContact NE-OE1 3.95Å; R76-E90 PolarHBondContact NE-OE1 2.94Å; R76-E90 IonicContact NH1-OE1 3.56Å; R76-E90 PolarHBondContact NH1-OE1 3.37Å; R76-E90 IonicContact NH1-OE2 3.4Å; R76-R91 CarbonylContact C-O 3.56Å; R76-R91 WeakPolarHBondContact CA-O 3.24Å; R76-R91 WeakPolarHBondContact CB-O 3.36Å
77	I	93.4	Very high	92.4	Very high	3 Å²	3	39 Å²	39	2%	0.015	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.1	171.8	-68.9	175.6	0	0	0	108.2	L68 A69 A70 E90 R91 L93 V97 L112	L68-I77 HydrophobicContact CD2-CG2 3.73Å; A69-I77 WeakPolarHBondContact O-CA 3.42Å; A70-I77 HydrophobicContact CB-CG1 4.34Å; I77-E90 WeakPolarHBondContact O-CA 3.42Å; I77-R91 PolarHBondContact N-O 3.45Å; I77-R91 PolarHBondContact O-N 3.11Å; I77-L93 HydrophobicContact CD1-CD1 3.82Å; I77-L93 HydrophobicContact CG1-CD1 3.94Å; I77-V97 HydrophobicContact CD1-CG2 4.26Å; I77-V97 HydrophobicContact CG1-CG2 4.5Å; I77-L112 HydrophobicContact CD1-CD1 3.35Å; I77-L112 HydrophobicContact CD1-CD2 3.19Å; I77-L112 HydrophobicContact CD1-CG 3.87Å
78	R	94	Very high	92.3	Very high	27 Å²	27	42.8 Å²	42.8	10%	0.102	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.2	171.7	-71.6	-173.4	170.5	170.9	-5.6	108.8	E50 M51 L68 A69 Y80 L87 E90	E50-R78 PolarHBondContact O-NH1 3.27Å; M51-R78 HydrophobicContact CE-CB 3.57Å; M51-R78 HydrophobicContact CE-CG 3.59Å; M51-R78 HydrophobicContact SD-CG 4.14Å; L68-R78 WeakPolarHBondContact CA-O 3.34Å; A69-R78 PolarHBondContact N-O 3.14Å; A69-R78 PolarHBondContact O-N 2.99Å; R78-Y80 HydrophobicContact CB-CD2 4.42Å; R78-Y80 HydrophobicContact CB-CE2 3.65Å; R78-Y80 VanDerWaalsContact CD-OH 3.23Å; R78-Y80 WeakPolarHBondContact CD-OH 3.41Å; R78-L87 HydrophobicContact CB-CD1 3.53Å; R78-L87 HydrophobicContact CG-CD1 3.78Å; R78-E90 HydrophobicContact CG-CB 4.33Å; R78-E90 HydrophobicContact CG-CG 3.96Å; R78-E90 IonicContact CZ-OE2 2.86Å; R78-E90 VanDerWaalsContact CZ-OE2 3.22Å; R78-E90 IonicContact NE-OE2 3.97Å; R78-E90 PolarHBondContact NE-OE2 2.85Å; R78-E90 IonicContact NH2-OE2 2.7Å; R78-E90 PolarHBondContact NH2-OE2 2.86Å
79	C	94.2	Very high	92.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.4	171.3	-176.1	0	0	0	0	108.4	L68 K88 F89	L68-C79 HydrophobicContact CD2-CB 3.48Å; L68-C79 VanDerWaalsContact CD2-CB 3.48Å; L68-C79 HydrophobicContact CG-CB 4.47Å; C79-K88 WeakPolarHBondContact O-CB 3.35Å; C79-K88 PolarHBondContact O-N 3.47Å; C79-F89 HydrophobicContact CB-CD1 3.79Å; C79-F89 HydrophobicContact CB-CD2 4.26Å; C79-F89 HydrophobicContact CB-CE1 3.37Å; C79-F89 HydrophobicContact CB-CE2 3.9Å; C79-F89 HydrophobicContact CB-CG 4.22Å; C79-F89 HydrophobicContact CB-CZ 3.45Å; C79-F89 VanDerWaalsContact CB-CZ 3.45Å; C79-F89 PolarHBondContact N-O 3.27Å; C79-F89 PolarHBondContact O-N 2.98Å
80	Y	94.4	Very high	92.1	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	134	177.5	-58.9	-83.1	0	0	0	109.4	V46 D48 F49 E50 F66 I67 A69 R78 L87	V46-Y80 HydrophobicContact CG1-CD1 3.59Å; V46-Y80 HydrophobicContact CG1-CE1 4.32Å; V46-Y80 HydrophobicContact CG1-CG 4.06Å; D48-Y80 VanDerWaalsContact O-CE1 3.31Å; D48-Y80 WeakPolarHBondContact O-CE1 3.23Å; D48-Y80 PolarHBondContact O-OH 3.29Å; F49-Y80 HydrophobicContact CD2-CD1 4.06Å; F49-Y80 AromaticContact CD2-CD2 3.79Å; F49-Y80 HydrophobicContact CD2-CD2 3.79Å; F49-Y80 AromaticContact CD2-CE1 3.96Å; F49-Y80 HydrophobicContact CD2-CE1 3.96Å; F49-Y80 AromaticContact CD2-CE2 3.7Å; F49-Y80 HydrophobicContact CD2-CE2 3.7Å; F49-Y80 AromaticContact CD2-CG 3.97Å; F49-Y80 HydrophobicContact CD2-CG 3.97Å; F49-Y80 AromaticContact CD2-CZ 3.77Å; F49-Y80 AromaticContact CE2-CD2 3.7Å; F49-Y80 HydrophobicContact CE2-CD2 3.7Å; F49-Y80 AromaticContact CE2-CE2 3.78Å; F49-Y80 HydrophobicContact CE2-CE2 3.78Å; F49-Y80 HydrophobicContact CE2-CG 4.2Å; E50-Y80 PolarHBondContact O-OH 2.89Å; F66-Y80 WeakPolarHBondContact CA-O 3.33Å; I67-Y80 PolarHBondContact N-O 2.85Å; I67-Y80 PolarHBondContact O-N 3.47Å; A69-Y80 HydrophobicContact CB-CE2 4.29Å; R78-Y80 HydrophobicContact CB-CD2 4.42Å; R78-Y80 HydrophobicContact CB-CE2 3.65Å; R78-Y80 VanDerWaalsContact CD-OH 3.23Å; R78-Y80 WeakPolarHBondContact CD-OH 3.41Å; Y80-L87 HydrophobicContact CD1-CB 4.19Å; Y80-L87 HydrophobicContact CD1-CD1 3.92Å; Y80-L87 HydrophobicContact CE1-CB 4.15Å; Y80-L87 HydrophobicContact CE1-CD1 3.64Å
81	D	94.3	Very high	92	Very high	6 Å²	6	49.6 Å²	49.6	3%	0.032	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.8	173.5	-162.2	-26.7	0	0	0	108.6	Q65 F66 Y83 Q84 L85 S86 K88	Q65-D81 WeakPolarHBondContact CG-OD1 3.26Å; Q65-D81 PolarHBondContact NE2-OD1 3.4Å; Q65-D81 VanDerWaalsContact NE2-OD1 3.15Å; F66-D81 HydrophobicContact CD1-CB 4.42Å; F66-D81 HydrophobicContact CE1-CB 4.25Å; D81-Y83 VanDerWaalsContact C-N 3.34Å; D81-Y83 PolarHBondContact O-N 3.39Å; D81-Y83 PolarHBondContact OD1-N 3.19Å; D81-Q84 HydrophobicContact CB-CB 4.39Å; D81-Q84 PolarHBondContact O-N 3.47Å; D81-L85 WeakPolarHBondContact O-CA 3.39Å; D81-L85 PolarHBondContact O-N 2.87Å; D81-S86 PolarHBondContact N-O 3.48Å; D81-S86 PolarHBondContact O-N 3.08Å; D81-K88 HydrophobicContact CB-CB 4.38Å; D81-K88 HydrophobicContact CB-CD 4.46Å; D81-K88 IonicContact OD2-NZ 2.78Å
82	T	90.3	Very high	92	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.006	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-28.4	-176.1	56.6	0	0	0	0	112.9	G64 Q65 I67 L85 W350	G64-T82 PolarHBondContact O-OG1 2.96Å; Q65-T82 VanDerWaalsContact C-OG1 3.27Å; Q65-T82 VanDerWaalsContact CA-OG1 3.28Å; Q65-T82 WeakPolarHBondContact CA-OG1 3.48Å; Q65-T82 VanDerWaalsContact O-CB 3.31Å; Q65-T82 WeakPolarHBondContact O-CB 3.37Å; Q65-T82 VanDerWaalsContact O-CG2 3.27Å; Q65-T82 WeakPolarHBondContact O-CG2 3.49Å; Q65-T82 PolarHBondContact O-N 3.16Å; Q65-T82 PolarHBondContact O-OG1 3.16Å; I67-T82 HydrophobicContact CD1-CG2 3.57Å; I67-T82 HydrophobicContact CG1-CG2 3.8Å; T82-L85 VanDerWaalsContact O-CD2 3.3Å; T82-L85 WeakPolarHBondContact O-CD2 3.24Å; T82-W350 HydrophobicContact CG2-CD2 4.22Å; T82-W350 HydrophobicContact CG2-CH2 3.95Å; T82-W350 HydrophobicContact CG2-CZ2 3.53Å; T82-W350 HydrophobicContact CG2-CZ3 4.39Å
83	Y	90.1	Very high	92	Very high	151 Å²	151	52.3 Å²	52.3	59%	0.592	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-33.2	177.1	-79	-63.5	0	0	0	112.9	Q65 D81 W350	Q65-Y83 HydrophobicContact CB-CE2 4.38Å; Q65-Y83 HydrophobicContact CG-CD2 3.71Å; Q65-Y83 HydrophobicContact CG-CE2 4.01Å; D81-Y83 VanDerWaalsContact C-N 3.34Å; D81-Y83 PolarHBondContact O-N 3.39Å; D81-Y83 PolarHBondContact OD1-N 3.19Å; Y83-W350 HydrophobicContact CD1-CB 4.36Å
84	Q	89.8	Confident	92	Very high	134 Å²	134	52.3 Å²	52.3	63%	0.626	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-9.4	178	-63.5	-177.9	-4.2	0	0	112.4	D81 S86	D81-Q84 HydrophobicContact CB-CB 4.39Å; D81-Q84 PolarHBondContact O-N 3.47Å; Q84-S86 PolarHBondContact O-N 3.42Å
85	L	89.6	Confident	92	Very high	63 Å²	63	46.5 Å²	46.5	33%	0.33	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	32.9	-176.9	-59.8	174.4	0	0	0	112.7	L45 Q47 D81 T82 W350	L45-L85 WeakPolarHBondContact O-CD2 3.45Å; Q47-L85 VanDerWaalsContact CB-O 3.31Å; Q47-L85 WeakPolarHBondContact CB-O 3.45Å; Q47-L85 PolarHBondContact N-O 3.32Å; D81-L85 WeakPolarHBondContact O-CA 3.39Å; D81-L85 PolarHBondContact O-N 2.87Å; T82-L85 VanDerWaalsContact O-CD2 3.3Å; T82-L85 WeakPolarHBondContact O-CD2 3.24Å; L85-W350 HydrophobicContact CD2-CE3 3.37Å; L85-W350 HydrophobicContact CD2-CZ3 3.44Å; L85-W350 VanDerWaalsContact CD2-CZ3 3.44Å
86	S	91.3	Very high	92.1	Very high	27 Å²	27	48.7 Å²	48.7	19%	0.189	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	161.4	-172.4	65.8	0	0	0	0	112.4	D81 Q84 K88	D81-S86 PolarHBondContact N-O 3.48Å; D81-S86 PolarHBondContact O-N 3.08Å; Q84-S86 PolarHBondContact O-N 3.42Å; S86-K88 PolarHBondContact O-N 2.95Å
87	L	92.3	Very high	92.1	Very high	53 Å²	53	47.8 Å²	47.8	28%	0.277	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	123.1	169.4	-175.3	72.7	0	0	0	110.1	R78 Y80 E90	R78-L87 HydrophobicContact CB-CD1 3.53Å; R78-L87 HydrophobicContact CG-CD1 3.78Å; Y80-L87 HydrophobicContact CD1-CB 4.19Å; Y80-L87 HydrophobicContact CD1-CD1 3.92Å; Y80-L87 HydrophobicContact CE1-CB 4.15Å; Y80-L87 HydrophobicContact CE1-CD1 3.64Å; L87-E90 HydrophobicContact CD2-CB 4.37Å
88	K	92.8	Very high	92.1	Very high	79 Å²	79	50.4 Å²	50.4	34%	0.343	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-48.9	177	-171	171.8	-170.9	159.4	0	111.7	F66 C79 D81 S86 Y107	F66-K88 HydrophobicContact CD1-CD 4.33Å; F66-K88 HydrophobicContact CE1-CD 3.87Å; C79-K88 WeakPolarHBondContact O-CB 3.35Å; C79-K88 PolarHBondContact O-N 3.47Å; D81-K88 HydrophobicContact CB-CB 4.38Å; D81-K88 HydrophobicContact CB-CD 4.46Å; D81-K88 IonicContact OD2-NZ 2.78Å; S86-K88 PolarHBondContact O-N 2.95Å; K88-Y107 HydrophobicContact CD-CE1 4.18Å; K88-Y107 WeakPolarHBondContact CE-OH 3.47Å; K88-Y107 PolarHBondContact NZ-OH 3.13Å
89	F	92.3	Very high	92	Very high	40 Å²	40	49.7 Å²	49.7	18%	0.175	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	160.3	173.4	67.8	-97.1	0	0	0	111	C79 R91 Y107	C79-F89 HydrophobicContact CB-CD1 3.79Å; C79-F89 HydrophobicContact CB-CD2 4.26Å; C79-F89 HydrophobicContact CB-CE1 3.37Å; C79-F89 HydrophobicContact CB-CE2 3.9Å; C79-F89 HydrophobicContact CB-CG 4.22Å; C79-F89 HydrophobicContact CB-CZ 3.45Å; C79-F89 VanDerWaalsContact CB-CZ 3.45Å; C79-F89 PolarHBondContact N-O 3.27Å; C79-F89 PolarHBondContact O-N 2.98Å; F89-R91 HydrophobicContact CD2-CG 3.73Å; F89-R91 HydrophobicContact CE2-CG 3.78Å; F89-R91 VanDerWaalsContact CE2-NE 3.29Å; F89-Y107 HydrophobicContact CD1-CE2 4.34Å; F89-Y107 AromaticContact CE1-CD2 3.52Å; F89-Y107 HydrophobicContact CE1-CD2 3.52Å; F89-Y107 AromaticContact CE1-CE2 3.56Å; F89-Y107 HydrophobicContact CE1-CE2 3.56Å; F89-Y107 HydrophobicContact CE1-CG 4.49Å; F89-Y107 HydrophobicContact CZ-CD2 4.05Å; F89-Y107 HydrophobicContact CZ-CE2 4.41Å
90	E	92.4	Very high	92	Very high	68 Å²	68	49.8 Å²	49.8	32%	0.318	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.3	168.6	-175	-179	132.5	0	0	108.6	R76 I77 R78 L87	R76-E90 HydrophobicContact CB-CG 4.27Å; R76-E90 VanDerWaalsContact CD-OE1 3.24Å; R76-E90 WeakPolarHBondContact CD-OE1 3.3Å; R76-E90 IonicContact CZ-OE1 3.94Å; R76-E90 VanDerWaalsContact CZ-OE1 3.26Å; R76-E90 IonicContact NE-OE1 3.95Å; R76-E90 PolarHBondContact NE-OE1 2.94Å; R76-E90 IonicContact NH1-OE1 3.56Å; R76-E90 PolarHBondContact NH1-OE1 3.37Å; R76-E90 IonicContact NH1-OE2 3.4Å; I77-E90 WeakPolarHBondContact O-CA 3.42Å; R78-E90 HydrophobicContact CG-CB 4.33Å; R78-E90 HydrophobicContact CG-CG 3.96Å; R78-E90 IonicContact CZ-OE2 2.86Å; R78-E90 VanDerWaalsContact CZ-OE2 3.22Å; R78-E90 IonicContact NE-OE2 3.97Å; R78-E90 PolarHBondContact NE-OE2 2.85Å; R78-E90 IonicContact NH2-OE2 2.7Å; R78-E90 PolarHBondContact NH2-OE2 2.86Å; L87-E90 HydrophobicContact CD2-CB 4.37Å
91	R	91.8	Very high	91.9	Very high	35 Å²	35	51.4 Å²	51.4	13%	0.132	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.4	173.3	-72.6	175.2	-168.7	-178.5	1.9	109.1	R76 I77 F89 H122 A123 Q124 G126	R76-R91 CarbonylContact C-O 3.56Å; R76-R91 WeakPolarHBondContact CA-O 3.24Å; R76-R91 WeakPolarHBondContact CB-O 3.36Å; I77-R91 PolarHBondContact N-O 3.45Å; I77-R91 PolarHBondContact O-N 3.11Å; F89-R91 HydrophobicContact CD2-CG 3.73Å; F89-R91 HydrophobicContact CE2-CG 3.78Å; F89-R91 VanDerWaalsContact CE2-NE 3.29Å; R91-H122 WeakPolarHBondContact CD-ND1 3.47Å; R91-H122 PolarHBondContact NH1-ND1 3.47Å; R91-A123 PolarHBondContact NH1-O 3.44Å; R91-A123 PolarHBondContact NH2-O 3.12Å; R91-Q124 PolarHBondContact NH2-O 3.41Å; R91-G126 VanDerWaalsContact CZ-CA 3.49Å; R91-G126 PolarHBondContact NH1-O 2.94Å
92	C	92.6	Very high	91.9	Very high	86 Å²	86	51.5 Å²	51.5	58%	0.581	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	144.7	166.5	-58.9	0	0	0	0	109.6	P75	P75-C92 CarbonylContact O-C 3.47Å; P75-C92 WeakPolarHBondContact O-CA 3.47Å
93	L	90.7	Very high	92.1	Very high	16 Å²	16	52.4 Å²	52.4	8%	0.084	27%	0.267	C	S	.	.			trans	-116.5	167.1	179	-54.7	174.1	0	0	0	108.9	P75 I77 V97 L112 H122	P75-L93 HydrophobicContact CB-CB 4.26Å; P75-L93 PolarHBondContact O-N 2.73Å; I77-L93 HydrophobicContact CD1-CD1 3.82Å; I77-L93 HydrophobicContact CG1-CD1 3.94Å; L93-V97 HydrophobicContact CD1-CG2 3.2Å; L93-L112 HydrophobicContact CD1-CD1 3.84Å; L93-L112 HydrophobicContact CD2-CD1 3.65Å; L93-L112 HydrophobicContact CG-CD1 4.42Å; L93-H122 VanDerWaalsContact CD2-CE1 3.44Å; L93-H122 WeakPolarHBondContact CD2-CE1 3.46Å
94	D	90.8	Very high	92.1	Very high	130 Å²	130	46.7 Å²	46.7	70%	0.695	25%	0.249	S	C	*	.	S	Bend	trans	-77	-36.1	177.3	-62.5	-25.6	0	0	0	112.1	K130	D94-K130 IonicContact OD2-NZ 2.84Å; D94-K130 PolarHBondContact OD2-NZ 3.28Å
95	S	91.8	Very high	92.1	Very high	10 Å²	10	44 Å²	44	7%	0.07	24%	0.239	C	C	.	.	S	Bend	trans	-140.8	163.2	-175.7	58.2	0	0	0	0	111.9	P75 Q114 D116	P75-S95 WeakPolarHBondContact CB-O 3.24Å; S95-Q114 VanDerWaalsContact OG-CB 3.26Å; S95-Q114 WeakPolarHBondContact OG-CB 3.45Å; S95-Q114 WeakPolarHBondContact OG-CG 3.28Å; S95-Q114 PolarHBondContact OG-OE1 3.38Å; S95-Q114 VanDerWaalsContact OG-OE1 3.07Å; S95-D116 VanDerWaalsContact CB-OD2 3.3Å; S95-D116 WeakPolarHBondContact CB-OD2 3.34Å
96	D	92.4	Very high	92.1	Very high	67 Å²	67	43.7 Å²	43.7	36%	0.358	24%	0.238	S	C	.	.			trans	-63.5	144.8	-177.3	-66.5	-21.2	0	0	0	112.1	P75 Q114 C115	P75-D96 WeakPolarHBondContact CB-OD1 3.41Å; D96-Q114 WeakPolarHBondContact O-CA 3.47Å; D96-C115 PolarHBondContact O-N 3.05Å
97	V	93.1	Very high	92.1	Very high	7 Å²	7	44.2 Å²	44.2	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	121.9	179.3	-177.7	0	0	0	0	109	T56 A70 I77 L93 A99 F100	T56-V97 PolarHBondContact OG1-O 3.08Å; A70-V97 HydrophobicContact CB-CB 4.13Å; A70-V97 HydrophobicContact CB-CG1 4.37Å; I77-V97 HydrophobicContact CD1-CG2 4.26Å; I77-V97 HydrophobicContact CG1-CG2 4.5Å; L93-V97 HydrophobicContact CD1-CG2 3.2Å; V97-A99 WeakPolarHBondContact CG1-O 3.29Å; V97-F100 HydrophobicContact CG1-CB 4.01Å; V97-F100 HydrophobicContact CG1-CD1 4.11Å
98	V	92.4	Very high	92.1	Very high	58 Å²	58	42.4 Å²	42.4	35%	0.352	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	-57.1	173.1	-178.6	0	0	0	0	109.2	L113 C115 R138	V98-L113 PolarHBondContact N-O 3.48Å; V98-C115 HydrophobicContact CG2-CB 4.41Å; V98-C115 WeakPolarHBondContact CG2-SG 3.44Å; V98-R138 WeakPolarHBondContact CG1-O 3.31Å
99	A	92	Very high	92.1	Very high	13 Å²	13	44.7 Å²	44.7	11%	0.107	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	151.4	177.6	0	0	0	0	0	109	V97 L113 F140	V97-A99 WeakPolarHBondContact CG1-O 3.29Å; A99-L113 WeakPolarHBondContact O-CB 3.39Å; A99-L113 PolarHBondContact O-N 3.38Å; A99-F140 HydrophobicContact CB-CD1 4.15Å; A99-F140 HydrophobicContact CB-CE1 4.1Å; A99-F140 WeakPolarHBondContact O-CE1 3.46Å
100	F	94.9	Very high	92.2	Very high	2 Å²	2	43 Å²	43	1%	0.009	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	160.3	169.3	71.7	-90.5	0	0	0	110.4	S57 K59 L68 A70 V97 V111 L112	S57-F100 VanDerWaalsContact OG-CD1 3.28Å; S57-F100 WeakPolarHBondContact OG-CD1 3.34Å; S57-F100 WeakPolarHBondContact OG-CE1 3.35Å; K59-F100 HydrophobicContact CB-CE2 3.86Å; K59-F100 HydrophobicContact CB-CZ 4.02Å; K59-F100 HydrophobicContact CD-CD2 4.49Å; K59-F100 HydrophobicContact CD-CE2 4.27Å; K59-F100 VanDerWaalsContact CD-O 3.25Å; K59-F100 WeakPolarHBondContact CD-O 3.45Å; K59-F100 WeakPolarHBondContact CE-O 3.44Å; K59-F100 HydrophobicContact CG-CE2 4.22Å; K59-F100 HydrophobicContact CG-CZ 4.25Å; K59-F100 PolarHBondContact NZ-O 2.73Å; L68-F100 HydrophobicContact CB-CE2 3.59Å; L68-F100 HydrophobicContact CB-CZ 3.8Å; L68-F100 HydrophobicContact CD1-CE2 4.36Å; A70-F100 HydrophobicContact CB-CD1 4.05Å; A70-F100 HydrophobicContact CB-CE1 3.89Å; V97-F100 HydrophobicContact CG1-CB 4.01Å; V97-F100 HydrophobicContact CG1-CD1 4.11Å; F100-V111 CarbonylContact C-O 3.56Å; F100-V111 WeakPolarHBondContact CA-O 3.46Å; F100-V111 VanDerWaalsContact CB-O 3.3Å; F100-V111 WeakPolarHBondContact CB-O 3.48Å; F100-L112 HydrophobicContact CB-CD2 3.45Å; F100-L112 VanDerWaalsContact CB-CD2 3.45Å; F100-L112 HydrophobicContact CG-CD2 4.19Å
101	D	93.4	Very high	92.3	Very high	34 Å²	34	39.8 Å²	39.8	18%	0.182	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	154.6	175.5	-154.8	24.6	0	0	0	112	K59 V111 F140	K59-D101 VanDerWaalsContact NZ-CG 3.33Å; K59-D101 IonicContact NZ-OD1 3.8Å; K59-D101 PolarHBondContact NZ-OD1 3.14Å; D101-V111 PolarHBondContact N-O 2.9Å; D101-V111 PolarHBondContact O-N 3.08Å; D101-F140 HydrophobicContact CB-CE2 3.71Å; D101-F140 HydrophobicContact CB-CZ 3.7Å
102	I	94.1	Very high	92.5	Very high	7 Å²	7	38.1 Å²	38.1	4%	0.036	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	113	-178.8	-48.6	173.2	0	0	0	107.5	K59 L68 S104 D106 L110 Y144	K59-I102 HydrophobicContact CB-CD1 4.39Å; L68-I102 HydrophobicContact CD1-CD1 3.68Å; L68-I102 HydrophobicContact CD1-CG1 3.73Å; I102-S104 VanDerWaalsContact CG2-O 3.25Å; I102-S104 WeakPolarHBondContact CG2-O 3.5Å; I102-D106 WeakPolarHBondContact CG2-O 3.19Å; I102-L110 HydrophobicContact CB-CD2 4.08Å; I102-L110 HydrophobicContact CG1-CD2 3.83Å; I102-L110 HydrophobicContact CG2-CD2 3.82Å; I102-Y144 PolarHBondContact O-OH 3.15Å
103	L	92.6	Very high	92.6	Very high	20 Å²	20	34 Å²	34	11%	0.105	18%	0.181	C	C	.	.			trans	-78.2	-37.6	-177	-62.1	179.3	0	0	0	112.3	K109 V111 Y142 Y144 L149 L163	L103-K109 HydrophobicContact CB-CB 4.11Å; L103-K109 HydrophobicContact CD1-CB 4.43Å; L103-K109 PolarHBondContact N-O 3.43Å; L103-V111 HydrophobicContact CD1-CG2 3.43Å; L103-V111 VanDerWaalsContact CD1-CG2 3.43Å; L103-V111 HydrophobicContact CD2-CG2 3.82Å; L103-V111 HydrophobicContact CG-CG2 3.63Å; L103-Y142 HydrophobicContact CD2-CD1 3.53Å; L103-Y142 HydrophobicContact CD2-CD2 3.73Å; L103-Y142 HydrophobicContact CD2-CE1 3.94Å; L103-Y142 HydrophobicContact CD2-CE2 4.09Å; L103-Y142 HydrophobicContact CD2-CG 3.42Å; L103-Y142 VanDerWaalsContact CD2-CG 3.42Å; L103-Y144 VanDerWaalsContact O-CE1 3.25Å; L103-Y144 WeakPolarHBondContact O-CE1 3.5Å; L103-Y144 PolarHBondContact O-OH 3.45Å; L103-L149 HydrophobicContact CD2-CD2 4.25Å; L103-L163 HydrophobicContact CD1-CD1 3.67Å; L103-L163 HydrophobicContact CD2-CD1 4.42Å
104	S	91.7	Very high	92.7	Very high	32 Å²	32	33.3 Å²	33.3	22%	0.224	18%	0.178	C	C	.	.	S	Bend	trans	-84.9	164.5	177.8	-166.3	0	0	0	0	110.1	I102 D106 S108	I102-S104 VanDerWaalsContact CG2-O 3.25Å; I102-S104 WeakPolarHBondContact CG2-O 3.5Å; S104-D106 CarbonylContact C-O 3.54Å; S104-D106 PolarHBondContact O-N 3.28Å; S104-S108 WeakPolarHBondContact CB-OG 3.43Å; S104-S108 PolarHBondContact OG-OG 3.34Å
105	D	90.2	Very high	92.8	Very high	77 Å²	77	29.7 Å²	29.7	41%	0.412	16%	0.162	S	C	.	.	S	Bend	trans	-66.9	-32.6	170.7	-56.8	-40.6	0	0	0	111.5	S61 R62 D63	S61-D105 WeakPolarHBondContact CB-O 3.21Å; R62-D105 HydrophobicContact CB-CB 4.24Å; R62-D105 WeakPolarHBondContact CD-OD1 3.42Å; R62-D105 PolarHBondContact N-O 3.34Å; R62-D105 IonicContact NH1-OD1 2.8Å; D63-D105 PolarHBondContact N-O 3.32Å; D63-D105 WeakPolarHBondContact OD2-CB 3.21Å
106	D	89	Confident	92.8	Very high	57 Å²	57	33.5 Å²	33.5	31%	0.305	18%	0.182	S	C	.	.	S	Bend	trans	-78.9	-179.1	165.8	-74.3	-42	0	0	0	115	F66 I102 S104 S108	F66-D106 HydrophobicContact CE2-CB 4.48Å; I102-D106 WeakPolarHBondContact CG2-O 3.19Å; S104-D106 CarbonylContact C-O 3.54Å; S104-D106 PolarHBondContact O-N 3.28Å; D106-S108 PolarHBondContact O-N 2.69Å
107	Y	90.4	Very high	92.8	Very high	38 Å²	38	33.7 Å²	33.7	15%	0.149	18%	0.177	C	C	.	.	S	Bend	trans	-74.7	4.3	165.4	77.8	-79.2	0	0	0	115.4	F66 K88 F89 K109	F66-Y107 AromaticContact CD1-CD1 3.71Å; F66-Y107 HydrophobicContact CD1-CD1 3.71Å; F66-Y107 HydrophobicContact CD1-CE1 4.3Å; F66-Y107 HydrophobicContact CD1-CG 4.36Å; F66-Y107 AromaticContact CD2-CD1 3.61Å; F66-Y107 HydrophobicContact CD2-CD1 3.61Å; F66-Y107 HydrophobicContact CD2-CG 4.38Å; F66-Y107 AromaticContact CE1-CD1 3.6Å; F66-Y107 HydrophobicContact CE1-CD1 3.6Å; F66-Y107 AromaticContact CE1-CE1 3.76Å; F66-Y107 HydrophobicContact CE1-CE1 3.76Å; F66-Y107 AromaticContact CE2-CD1 3.48Å; F66-Y107 HydrophobicContact CE2-CD1 3.48Å; F66-Y107 VanDerWaalsContact CE2-CD1 3.48Å; F66-Y107 HydrophobicContact CE2-CE1 4Å; F66-Y107 AromaticContact CG-CD1 3.72Å; F66-Y107 HydrophobicContact CG-CD1 3.72Å; F66-Y107 HydrophobicContact CG-CG 4.25Å; F66-Y107 AromaticContact CZ-CD1 3.47Å; F66-Y107 HydrophobicContact CZ-CD1 3.47Å; F66-Y107 VanDerWaalsContact CZ-CD1 3.47Å; F66-Y107 AromaticContact CZ-CE1 3.58Å; F66-Y107 HydrophobicContact CZ-CE1 3.58Å; K88-Y107 HydrophobicContact CD-CE1 4.18Å; K88-Y107 WeakPolarHBondContact CE-OH 3.47Å; K88-Y107 PolarHBondContact NZ-OH 3.13Å; F89-Y107 HydrophobicContact CD1-CE2 4.34Å; F89-Y107 AromaticContact CE1-CD2 3.52Å; F89-Y107 HydrophobicContact CE1-CD2 3.52Å; F89-Y107 AromaticContact CE1-CE2 3.56Å; F89-Y107 HydrophobicContact CE1-CE2 3.56Å; F89-Y107 HydrophobicContact CE1-CG 4.49Å; F89-Y107 HydrophobicContact CZ-CD2 4.05Å; F89-Y107 HydrophobicContact CZ-CE2 4.41Å; Y107-K109 VanDerWaalsContact C-N 3.3Å; Y107-K109 PolarHBondContact O-N 3.39Å
108	S	92	Very high	92.9	Very high	15 Å²	15	35.5 Å²	35.5	11%	0.105	19%	0.185	C	C	.	.	S	Bend	trans	-62.8	-33.9	-163.6	73.8	0	0	0	0	114.4	S104 D106 A123 Q124	S104-S108 WeakPolarHBondContact CB-OG 3.43Å; S104-S108 PolarHBondContact OG-OG 3.34Å; D106-S108 PolarHBondContact O-N 2.69Å; S108-A123 CarbonylContact O-C 3.57Å; S108-A123 VanDerWaalsContact O-CA 3.22Å; S108-A123 WeakPolarHBondContact O-CA 3.33Å; S108-Q124 PolarHBondContact O-N 3.38Å
109	K	93.2	Very high	93	Very high	127 Å²	127	32.8 Å²	32.8	55%	0.552	17%	0.169	S	C	*	.	S	Bend	trans	-132	122.4	-178.7	-64	177.1	-171.5	175.4	0	109	L103 Y107 H122	L103-K109 HydrophobicContact CB-CB 4.11Å; L103-K109 HydrophobicContact CD1-CB 4.43Å; L103-K109 PolarHBondContact N-O 3.43Å; Y107-K109 VanDerWaalsContact C-N 3.3Å; Y107-K109 PolarHBondContact O-N 3.39Å; K109-H122 CarbonylContact C-O 3.56Å; K109-H122 WeakPolarHBondContact CA-O 3.39Å
110	L	94.4	Very high	93.1	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	144.9	-178	-53.9	174.3	0	0	0	110	L68 I102 L112 H122	L68-L110 HydrophobicContact CD1-CD1 3.88Å; L68-L110 HydrophobicContact CD1-CD2 3.39Å; L68-L110 HydrophobicContact CD1-CG 4.29Å; L68-L110 HydrophobicContact CD2-CD1 4.08Å; I102-L110 HydrophobicContact CB-CD2 4.08Å; I102-L110 HydrophobicContact CG1-CD2 3.83Å; I102-L110 HydrophobicContact CG2-CD2 3.82Å; L110-L112 HydrophobicContact CB-CD2 4.47Å; L110-H122 HydrophobicContact CB-CB 4.02Å; L110-H122 PolarHBondContact N-O 2.97Å; L110-H122 PolarHBondContact O-N 2.8Å
111	V	95.3	Very high	93.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.4	172.4	-178.7	0	0	0	0	108.2	F100 D101 L103 V119 F121 F140 L149	F100-V111 CarbonylContact C-O 3.56Å; F100-V111 WeakPolarHBondContact CA-O 3.46Å; F100-V111 VanDerWaalsContact CB-O 3.3Å; F100-V111 WeakPolarHBondContact CB-O 3.48Å; D101-V111 PolarHBondContact N-O 2.9Å; D101-V111 PolarHBondContact O-N 3.08Å; L103-V111 HydrophobicContact CD1-CG2 3.43Å; L103-V111 VanDerWaalsContact CD1-CG2 3.43Å; L103-V111 HydrophobicContact CD2-CG2 3.82Å; L103-V111 HydrophobicContact CG-CG2 3.63Å; V111-V119 HydrophobicContact CG1-CG1 3.58Å; V111-F121 HydrophobicContact CB-CE1 4.43Å; V111-F121 HydrophobicContact CG1-CE1 4.04Å; V111-F121 HydrophobicContact CG2-CD1 3.69Å; V111-F121 HydrophobicContact CG2-CE1 3.58Å; V111-F140 HydrophobicContact CB-CE2 3.95Å; V111-F140 HydrophobicContact CB-CZ 3.9Å; V111-F140 HydrophobicContact CG1-CE2 3.76Å; V111-F140 HydrophobicContact CG1-CZ 3.74Å; V111-F140 WeakPolarHBondContact O-CZ 3.39Å; V111-L149 HydrophobicContact CG1-CD1 4.14Å; V111-L149 HydrophobicContact CG2-CD1 4.12Å
112	L	94.9	Very high	93.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	123.3	-179.4	-43.6	176.4	0	0	0	108.4	I77 L93 F100 L110 V119 E120 H122	I77-L112 HydrophobicContact CD1-CD1 3.35Å; I77-L112 HydrophobicContact CD1-CD2 3.19Å; I77-L112 HydrophobicContact CD1-CG 3.87Å; L93-L112 HydrophobicContact CD1-CD1 3.84Å; L93-L112 HydrophobicContact CD2-CD1 3.65Å; L93-L112 HydrophobicContact CG-CD1 4.42Å; F100-L112 HydrophobicContact CB-CD2 3.45Å; F100-L112 VanDerWaalsContact CB-CD2 3.45Å; F100-L112 HydrophobicContact CG-CD2 4.19Å; L110-L112 HydrophobicContact CB-CD2 4.47Å; L112-V119 CarbonylContact O-C 3.59Å; L112-V119 VanDerWaalsContact O-CA 3.3Å; L112-V119 WeakPolarHBondContact O-CA 3.36Å; L112-E120 HydrophobicContact CB-CB 4.32Å; L112-E120 HydrophobicContact CD1-CB 4.43Å; L112-E120 PolarHBondContact N-O 2.95Å; L112-E120 PolarHBondContact O-N 3.33Å; L112-H122 WeakPolarHBondContact CD1-NE2 3.41Å
113	L	95.1	Very high	93	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	116.4	169.2	-179.8	68.2	0	0	0	108.5	V98 A99 V119 I133 F140 F151	V98-L113 PolarHBondContact N-O 3.48Å; A99-L113 WeakPolarHBondContact O-CB 3.39Å; A99-L113 PolarHBondContact O-N 3.38Å; L113-V119 HydrophobicContact CD1-CG2 3.76Å; L113-I133 HydrophobicContact CD1-CD1 4.17Å; L113-F140 HydrophobicContact CB-CD1 3.73Å; L113-F140 HydrophobicContact CB-CE1 3.8Å; L113-F140 HydrophobicContact CD2-CD1 4.1Å; L113-F151 HydrophobicContact CD1-CD1 4.18Å; L113-F151 HydrophobicContact CD1-CE1 4.41Å
114	Q	93.8	Very high	92.9	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	156	-179.9	-72.6	179	-21.6	0	0	112.2	S95 D96 D116 R117 H118 E120	S95-Q114 VanDerWaalsContact OG-CB 3.26Å; S95-Q114 WeakPolarHBondContact OG-CB 3.45Å; S95-Q114 WeakPolarHBondContact OG-CG 3.28Å; S95-Q114 PolarHBondContact OG-OE1 3.38Å; S95-Q114 VanDerWaalsContact OG-OE1 3.07Å; D96-Q114 WeakPolarHBondContact O-CA 3.47Å; Q114-D116 PolarHBondContact O-N 3.22Å; Q114-R117 PolarHBondContact O-N 2.91Å; Q114-H118 HydrophobicContact CB-CB 4.45Å; Q114-H118 WeakPolarHBondContact CB-O 3.49Å; Q114-H118 PolarHBondContact N-O 3.16Å; Q114-E120 PolarHBondContact NE2-OE1 3.17Å; Q114-E120 PolarHBondContact NE2-OE2 3.22Å; Q114-E120 PolarHBondContact OE1-OE1 3.31Å
115	C	92.2	Very high	92.7	Very high	55 Å²	55	43 Å²	43	37%	0.372	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.9	172.3	-68.3	0	0	0	0	112.8	D96 V98 R117 F136	D96-C115 PolarHBondContact O-N 3.05Å; V98-C115 HydrophobicContact CG2-CB 4.41Å; V98-C115 WeakPolarHBondContact CG2-SG 3.44Å; C115-R117 PolarHBondContact O-N 3.49Å; C115-F136 VanDerWaalsContact O-CD1 3.25Å; C115-F136 WeakPolarHBondContact O-CD1 3.39Å; C115-F136 WeakPolarHBondContact O-CE1 3.48Å
116	D	91.8	Very high	92.6	Very high	90 Å²	90	39.9 Å²	39.9	48%	0.481	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	20.7	-175.3	-68.6	-16.7	0	0	0	114.6	S95 Q114 H118	S95-D116 VanDerWaalsContact CB-OD2 3.3Å; S95-D116 WeakPolarHBondContact CB-OD2 3.34Å; Q114-D116 PolarHBondContact O-N 3.22Å; D116-H118 PolarHBondContact O-CD2 2.87Å; D116-H118 PolarHBondContact O-N 2.8Å; D116-H118 VanDerWaalsContact O-N 3.14Å
117	R	92.4	Very high	92.7	Very high	70 Å²	70	41.7 Å²	41.7	26%	0.264	21%	0.205	S	C	.	.	S	Bend	trans	62	11.2	-173.2	-47.5	-179.5	-84.2	178.6	-15.7	114	Q114 C115 I133 P134 F136	Q114-R117 PolarHBondContact O-N 2.91Å; C115-R117 PolarHBondContact O-N 3.49Å; R117-I133 PolarHBondContact O-N 2.78Å; R117-P134 PolarHBondContact NH1-O 3.43Å; R117-F136 HydrophobicContact CG-CB 4.3Å; R117-F136 HydrophobicContact CG-CD1 3.32Å; R117-F136 HydrophobicContact CG-CD2 4.22Å; R117-F136 HydrophobicContact CG-CE1 3.56Å; R117-F136 HydrophobicContact CG-CE2 4.43Å; R117-F136 HydrophobicContact CG-CG 3.69Å; R117-F136 HydrophobicContact CG-CZ 4.13Å
118	H	94.5	Very high	92.9	Very high	46 Å²	46	47.6 Å²	47.6	21%	0.213	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	145	176.1	-78.8	-69.3	0	0	0	110.1	Q114 D116 K130 T131	Q114-H118 HydrophobicContact CB-CB 4.45Å; Q114-H118 WeakPolarHBondContact CB-O 3.49Å; Q114-H118 PolarHBondContact N-O 3.16Å; D116-H118 PolarHBondContact O-CD2 2.87Å; D116-H118 PolarHBondContact O-N 2.8Å; D116-H118 VanDerWaalsContact O-N 3.14Å; H118-K130 HydrophobicContact CB-CG 4.2Å; H118-K130 VanDerWaalsContact CG-CE 3.5Å; H118-T131 CarbonylContact C-O 3.42Å; H118-T131 VanDerWaalsContact CA-O 3.29Å; H118-T131 WeakPolarHBondContact CA-O 3.49Å; H118-T131 PolarHBondContact ND1-O 2.78Å; H118-T131 VanDerWaalsContact ND1-O 3.15Å
119	V	94.6	Very high	92.9	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.4	169.2	178.5	0	0	0	0	107.1	V111 L112 L113 F121 K130 T131 I133 F151	V111-V119 HydrophobicContact CG1-CG1 3.58Å; L112-V119 CarbonylContact O-C 3.59Å; L112-V119 VanDerWaalsContact O-CA 3.3Å; L112-V119 WeakPolarHBondContact O-CA 3.36Å; L113-V119 HydrophobicContact CD1-CG2 3.76Å; V119-F121 HydrophobicContact CG1-CE1 4.44Å; V119-F121 HydrophobicContact CG1-CE2 4.05Å; V119-F121 HydrophobicContact CG1-CZ 3.89Å; V119-K130 WeakPolarHBondContact O-CA 3.32Å; V119-T131 PolarHBondContact N-O 3.37Å; V119-T131 PolarHBondContact O-N 3.07Å; V119-T131 PolarHBondContact O-OG1 2.88Å; V119-I133 HydrophobicContact CG2-CD1 3.37Å; V119-I133 HydrophobicContact CG2-CG1 3.92Å; V119-F151 HydrophobicContact CB-CE1 4.5Å; V119-F151 HydrophobicContact CB-CZ 4.37Å; V119-F151 HydrophobicContact CG1-CE1 4.13Å; V119-F151 HydrophobicContact CG1-CZ 3.92Å; V119-F151 HydrophobicContact CG2-CD1 4.22Å; V119-F151 HydrophobicContact CG2-CE1 3.56Å; V119-F151 HydrophobicContact CG2-CZ 3.73Å
120	E	94	Very high	93	Very high	5 Å²	5	50 Å²	50	2%	0.023	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	131	176.3	-67.5	-167.8	-179.5	0	0	111.1	L112 Q114 H122 H127 K130	L112-E120 HydrophobicContact CB-CB 4.32Å; L112-E120 HydrophobicContact CD1-CB 4.43Å; L112-E120 PolarHBondContact N-O 2.95Å; L112-E120 PolarHBondContact O-N 3.33Å; Q114-E120 PolarHBondContact NE2-OE1 3.17Å; Q114-E120 PolarHBondContact NE2-OE2 3.22Å; Q114-E120 PolarHBondContact OE1-OE1 3.31Å; E120-H122 IonicContact OE2-CD2 3.76Å; E120-H122 IonicContact OE2-NE2 2.87Å; E120-H122 PolarHBondContact OE2-NE2 2.79Å; E120-H122 VanDerWaalsContact OE2-NE2 3.08Å; E120-H127 IonicContact OE2-CE1 3.08Å; E120-H127 IonicContact OE2-ND1 3.67Å; E120-K130 HydrophobicContact CG-CB 4.47Å; E120-K130 HydrophobicContact CG-CD 4.15Å; E120-K130 HydrophobicContact CG-CG 4.02Å; E120-K130 IonicContact OE1-NZ 2.91Å; E120-K130 PolarHBondContact OE1-NZ 2.83Å
121	F	94.7	Very high	92.9	Very high	22 Å²	22	50.6 Å²	50.6	10%	0.096	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.5	170.7	-63.2	-78.6	0	0	0	108.7	V111 V119 Y128 Y129 T131 L149 L161 L163	V111-F121 HydrophobicContact CB-CE1 4.43Å; V111-F121 HydrophobicContact CG1-CE1 4.04Å; V111-F121 HydrophobicContact CG2-CD1 3.69Å; V111-F121 HydrophobicContact CG2-CE1 3.58Å; V119-F121 HydrophobicContact CG1-CE1 4.44Å; V119-F121 HydrophobicContact CG1-CE2 4.05Å; V119-F121 HydrophobicContact CG1-CZ 3.89Å; F121-Y128 HydrophobicContact CB-CD1 4.25Å; F121-Y128 WeakPolarHBondContact O-CA 3.43Å; F121-Y128 WeakPolarHBondContact O-CB 3.37Å; F121-Y128 PolarHBondContact O-N 2.7Å; F121-Y129 HydrophobicContact CD2-CD1 4.24Å; F121-Y129 PolarHBondContact N-O 3.33Å; F121-Y129 PolarHBondContact O-N 2.96Å; F121-T131 HydrophobicContact CE2-CG2 4.16Å; F121-L149 HydrophobicContact CE1-CD1 3.7Å; F121-L149 HydrophobicContact CZ-CD1 3.95Å; F121-L161 HydrophobicContact CZ-CD2 3.8Å; F121-L163 HydrophobicContact CD1-CD2 4.3Å; F121-L163 HydrophobicContact CE1-CD2 3.48Å; F121-L163 VanDerWaalsContact CE1-CD2 3.48Å; F121-L163 HydrophobicContact CZ-CD2 3.76Å
122	H	93.9	Very high	92.9	Very high	11 Å²	11	57.2 Å²	57.2	5%	0.051	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	133	179.6	-85.8	-129.5	0	0	0	108.7	R91 L93 K109 L110 L112 E120 G126 H127	R91-H122 WeakPolarHBondContact CD-ND1 3.47Å; R91-H122 PolarHBondContact NH1-ND1 3.47Å; L93-H122 VanDerWaalsContact CD2-CE1 3.44Å; L93-H122 WeakPolarHBondContact CD2-CE1 3.46Å; K109-H122 CarbonylContact C-O 3.56Å; K109-H122 WeakPolarHBondContact CA-O 3.39Å; L110-H122 HydrophobicContact CB-CB 4.02Å; L110-H122 PolarHBondContact N-O 2.97Å; L110-H122 PolarHBondContact O-N 2.8Å; L112-H122 WeakPolarHBondContact CD1-NE2 3.41Å; E120-H122 IonicContact OE2-CD2 3.76Å; E120-H122 IonicContact OE2-NE2 2.87Å; E120-H122 PolarHBondContact OE2-NE2 2.79Å; E120-H122 VanDerWaalsContact OE2-NE2 3.08Å; H122-G126 CarbonylContact C-O 3.55Å; H122-G126 WeakPolarHBondContact CA-O 3.44Å; H122-H127 AromaticContact NE2-ND1 3.9Å
123	A	92.5	Very high	92.8	Very high	20 Å²	20	57.4 Å²	57.4	17%	0.165	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-178.4	171.7	0	0	0	0	0	110.2	R91 S108 H125 G126	R91-A123 PolarHBondContact NH1-O 3.44Å; R91-A123 PolarHBondContact NH2-O 3.12Å; S108-A123 CarbonylContact O-C 3.57Å; S108-A123 VanDerWaalsContact O-CA 3.22Å; S108-A123 WeakPolarHBondContact O-CA 3.33Å; A123-H125 PolarHBondContact O-N 2.96Å; A123-G126 PolarHBondContact N-O 3.12Å; A123-G126 PolarHBondContact O-N 3.17Å; A123-G126 VanDerWaalsContact O-N 3.12Å
124	Q	89.9	Confident	92.6	Very high	118 Å²	118	60.9 Å²	60.9	55%	0.551	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-38.6	175.2	-70.8	-179.2	-8.7	0	0	112.4	R91 S108 G126	R91-Q124 PolarHBondContact NH2-O 3.41Å; S108-Q124 PolarHBondContact O-N 3.38Å; Q124-G126 VanDerWaalsContact C-N 3.27Å; Q124-G126 PolarHBondContact O-N 3.13Å
125	H	87.9	Confident	92.5	Very high	146 Å²	146	66 Å²	66	68%	0.676	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	1.5	-179	64.6	62.5	0	0	0	114.3	A123	A123-H125 PolarHBondContact O-N 2.96Å
126	G	89	Confident	92.6	Very high	13 Å²	13	67.7 Å²	67.7	13%	0.134	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.6	-147.3	178.8	0	0	0	0	0	113.7	R91 H122 A123 Q124 Y128	R91-G126 VanDerWaalsContact CZ-CA 3.49Å; R91-G126 PolarHBondContact NH1-O 2.94Å; H122-G126 CarbonylContact C-O 3.55Å; H122-G126 WeakPolarHBondContact CA-O 3.44Å; A123-G126 PolarHBondContact N-O 3.12Å; A123-G126 PolarHBondContact O-N 3.17Å; A123-G126 VanDerWaalsContact O-N 3.12Å; Q124-G126 VanDerWaalsContact C-N 3.27Å; Q124-G126 PolarHBondContact O-N 3.13Å; G126-Y128 PolarHBondContact O-N 2.76Å
127	H	90.8	Very high	92.6	Very high	95 Å²	95	64 Å²	64	44%	0.44	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	128.9	174.2	-176.7	82.9	0	0	0	110.3	E120 H122	E120-H127 IonicContact OE2-CE1 3.08Å; E120-H127 IonicContact OE2-ND1 3.67Å; H122-H127 AromaticContact NE2-ND1 3.9Å
128	Y	93.3	Very high	92.6	Very high	161 Å²	161	64.4 Å²	64.4	63%	0.631	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	-54.1	179.2	178.7	-102.9	0	0	0	111.3	F121 G126	F121-Y128 HydrophobicContact CB-CD1 4.25Å; F121-Y128 WeakPolarHBondContact O-CA 3.43Å; F121-Y128 WeakPolarHBondContact O-CB 3.37Å; F121-Y128 PolarHBondContact O-N 2.7Å; G126-Y128 PolarHBondContact O-N 2.76Å
129	Y	93.5	Very high	92.5	Very high	137 Å²	137	63.9 Å²	63.9	54%	0.537	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	152.7	-175.8	-171.2	-125.3	0	0	0	112.1	F121 T131	F121-Y129 HydrophobicContact CD2-CD1 4.24Å; F121-Y129 PolarHBondContact N-O 3.33Å; F121-Y129 PolarHBondContact O-N 2.96Å; Y129-T131 HydrophobicContact CD1-CG2 3.58Å; Y129-T131 HydrophobicContact CE1-CG2 3.11Å
130	K	93.9	Very high	92.5	Very high	56 Å²	56	64.2 Å²	64.2	24%	0.243	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	118.2	177.7	-169.7	165.2	-175.2	146.9	0	109.6	D94 H118 V119 E120	D94-K130 IonicContact OD2-NZ 2.84Å; D94-K130 PolarHBondContact OD2-NZ 3.28Å; H118-K130 HydrophobicContact CB-CG 4.2Å; H118-K130 VanDerWaalsContact CG-CE 3.5Å; V119-K130 WeakPolarHBondContact O-CA 3.32Å; E120-K130 HydrophobicContact CG-CB 4.47Å; E120-K130 HydrophobicContact CG-CD 4.15Å; E120-K130 HydrophobicContact CG-CG 4.02Å; E120-K130 IonicContact OE1-NZ 2.91Å; E120-K130 PolarHBondContact OE1-NZ 2.83Å
131	T	93.7	Very high	92.5	Very high	16 Å²	16	64.5 Å²	64.5	10%	0.098	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	161	172.8	52.9	0	0	0	0	111	H118 V119 F121 Y129 L161	H118-T131 CarbonylContact C-O 3.42Å; H118-T131 VanDerWaalsContact CA-O 3.29Å; H118-T131 WeakPolarHBondContact CA-O 3.49Å; H118-T131 PolarHBondContact ND1-O 2.78Å; H118-T131 VanDerWaalsContact ND1-O 3.15Å; V119-T131 PolarHBondContact N-O 3.37Å; V119-T131 PolarHBondContact O-N 3.07Å; V119-T131 PolarHBondContact O-OG1 2.88Å; F121-T131 HydrophobicContact CE2-CG2 4.16Å; Y129-T131 HydrophobicContact CD1-CG2 3.58Å; Y129-T131 HydrophobicContact CE1-CG2 3.11Å; T131-L161 HydrophobicContact CG2-CD1 4.48Å
132	R	93.6	Very high	92.5	Very high	140 Å²	140	64.8 Å²	64.8	53%	0.528	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	135.6	175.5	-167	177	-177.4	172.5	3.4	110.1
133	I	93.6	Very high	92.5	Very high	3 Å²	3	64.8 Å²	64.8	2%	0.015	30%	0.297	C	S	.	.			trans	-96.3	146.4	172.6	-61.4	175.9	0	0	0	108.8	L113 R117 V119 K135 F151 Y159 F168	L113-I133 HydrophobicContact CD1-CD1 4.17Å; R117-I133 PolarHBondContact O-N 2.78Å; V119-I133 HydrophobicContact CG2-CD1 3.37Å; V119-I133 HydrophobicContact CG2-CG1 3.92Å; I133-K135 VanDerWaalsContact C-N 3.35Å; I133-K135 WeakPolarHBondContact CG2-O 3.35Å; I133-K135 PolarHBondContact O-N 3.17Å; I133-F151 HydrophobicContact CD1-CB 3.76Å; I133-F151 HydrophobicContact CD1-CD1 3.47Å; I133-F151 VanDerWaalsContact CD1-CD1 3.47Å; I133-F151 HydrophobicContact CD1-CD2 3.63Å; I133-F151 HydrophobicContact CD1-CE1 3.94Å; I133-F151 HydrophobicContact CD1-CE2 4.05Å; I133-F151 HydrophobicContact CD1-CG 3.32Å; I133-F151 HydrophobicContact CD1-CZ 4.2Å; I133-Y159 HydrophobicContact CG2-CD2 3.35Å; I133-Y159 HydrophobicContact CG2-CE2 3.76Å; I133-Y159 HydrophobicContact CG2-CG 4.02Å; I133-F168 HydrophobicContact CG1-CE1 4.5Å; I133-F168 HydrophobicContact CG1-CZ 4.38Å
134	P	91.6	Very high	92.3	Very high	74 Å²	74	67.4 Å²	67.4	48%	0.481	30%	0.304	S	S	.	.	S	Bend	trans	-59.2	-42	-178.3	-25.9	35.3	0	0	0	113.8	R117 Y159	R117-P134 PolarHBondContact NH1-O 3.43Å; P134-Y159 HydrophobicContact CB-CE1 4.49Å; P134-Y159 HydrophobicContact CG-CE1 4Å
135	K	91.8	Very high	92.4	Very high	109 Å²	109	65.6 Å²	65.6	47%	0.474	30%	0.302	S	S	.	.	S	Bend	trans	-116.8	167.8	-177.7	-60.1	-70.2	-173.9	169.4	0	111.2	I133 G137 Y159	I133-K135 VanDerWaalsContact C-N 3.35Å; I133-K135 WeakPolarHBondContact CG2-O 3.35Å; I133-K135 PolarHBondContact O-N 3.17Å; K135-G137 PolarHBondContact O-N 3.19Å; K135-Y159 HydrophobicContact CB-CE2 4.11Å; K135-Y159 HydrophobicContact CG-CE2 4.4Å; K135-Y159 WeakPolarHBondContact CG-OH 3.38Å
136	F	93.6	Very high	92.5	Very high	90 Å²	90	60.2 Å²	60.2	40%	0.395	28%	0.281	S	S	.	.			trans	-71	124.1	177.6	-65.7	-84.6	0	0	0	110.6	C115 R117 G153 M154	C115-F136 VanDerWaalsContact O-CD1 3.25Å; C115-F136 WeakPolarHBondContact O-CD1 3.39Å; C115-F136 WeakPolarHBondContact O-CE1 3.48Å; R117-F136 HydrophobicContact CG-CB 4.3Å; R117-F136 HydrophobicContact CG-CD1 3.32Å; R117-F136 HydrophobicContact CG-CD2 4.22Å; R117-F136 HydrophobicContact CG-CE1 3.56Å; R117-F136 HydrophobicContact CG-CE2 4.43Å; R117-F136 HydrophobicContact CG-CG 3.69Å; R117-F136 HydrophobicContact CG-CZ 4.13Å; F136-G153 VanDerWaalsContact O-CA 3.25Å; F136-G153 WeakPolarHBondContact O-CA 3.39Å; F136-M154 HydrophobicContact CB-CE 3.34Å; F136-M154 HydrophobicContact CD1-CE 4.49Å; F136-M154 HydrophobicContact CD2-CE 3.44Å; F136-M154 VanDerWaalsContact CD2-CE 3.44Å; F136-M154 HydrophobicContact CE2-CE 4.34Å; F136-M154 HydrophobicContact CG-CE 3.52Å; F136-M154 PolarHBondContact O-N 2.86Å
137	G	91.9	Very high	92.6	Very high	12 Å²	12	61.4 Å²	61.4	12%	0.124	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	142.4	173.4	0	0	0	0	0	111	K135 V152	K135-G137 PolarHBondContact O-N 3.19Å; G137-V152 CarbonylContact C-O 3.59Å; G137-V152 VanDerWaalsContact CA-O 3.24Å; G137-V152 WeakPolarHBondContact CA-O 3.48Å
138	R	91.9	Very high	92.7	Very high	79 Å²	79	57 Å²	57	30%	0.298	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-40.5	170.9	-72.9	-177.3	172.9	139.1	4.2	111.1	V98 V152 E178 N180	V98-R138 WeakPolarHBondContact CG1-O 3.31Å; R138-V152 PolarHBondContact N-O 3.47Å; R138-E178 IonicContact CZ-OE2 3.67Å; R138-E178 VanDerWaalsContact CZ-OE2 3.24Å; R138-E178 IonicContact NH1-OE2 3.39Å; R138-E178 PolarHBondContact NH1-OE2 2.7Å; R138-E178 IonicContact NH2-OE2 2.62Å; R138-E178 PolarHBondContact NH2-OE2 3.24Å; R138-N180 WeakPolarHBondContact CB-O 3.18Å; R138-N180 WeakPolarHBondContact CD-OD1 3.25Å; R138-N180 PolarHBondContact NH1-OD1 3.25Å
139	D	93.4	Very high	92.8	Very high	34 Å²	34	49.4 Å²	49.4	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	163.5	-177.6	-169.8	24.1	0	0	0	110.8	V152 N180 V181 C182	D139-V152 PolarHBondContact N-O 3.12Å; D139-V152 PolarHBondContact O-N 3.36Å; D139-V152 VanDerWaalsContact O-O 3.1Å; D139-N180 WeakPolarHBondContact CB-O 3.45Å; D139-V181 WeakPolarHBondContact OD2-CG1 3.31Å; D139-C182 PolarHBondContact OD2-N 2.92Å
140	F	94.8	Very high	92.8	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.035	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	154.1	174	76.7	-86.4	0	0	0	112.1	A99 D101 V111 L113 L149 Y150 F151 C182	A99-F140 HydrophobicContact CB-CD1 4.15Å; A99-F140 HydrophobicContact CB-CE1 4.1Å; A99-F140 WeakPolarHBondContact O-CE1 3.46Å; D101-F140 HydrophobicContact CB-CE2 3.71Å; D101-F140 HydrophobicContact CB-CZ 3.7Å; V111-F140 HydrophobicContact CB-CE2 3.95Å; V111-F140 HydrophobicContact CB-CZ 3.9Å; V111-F140 HydrophobicContact CG1-CE2 3.76Å; V111-F140 HydrophobicContact CG1-CZ 3.74Å; V111-F140 WeakPolarHBondContact O-CZ 3.39Å; L113-F140 HydrophobicContact CB-CD1 3.73Å; L113-F140 HydrophobicContact CB-CE1 3.8Å; L113-F140 HydrophobicContact CD2-CD1 4.1Å; F140-L149 HydrophobicContact CD2-CD2 3.95Å; F140-L149 HydrophobicContact CE2-CD2 4.08Å; F140-Y150 CarbonylContact C-O 3.33Å; F140-Y150 WeakPolarHBondContact CA-O 3.19Å; F140-Y150 WeakPolarHBondContact CB-O 3.4Å; F140-F151 HydrophobicContact CB-CD1 3.42Å; F140-F151 VanDerWaalsContact CB-CD1 3.42Å; F140-F151 HydrophobicContact CB-CE1 3.78Å; F140-F151 HydrophobicContact CB-CG 4.24Å; F140-F151 HydrophobicContact CD1-CE1 4.38Å; F140-F151 HydrophobicContact CD2-CE1 4.2Å; F140-F151 HydrophobicContact CG-CD1 4.02Å; F140-F151 AromaticContact CG-CE1 3.87Å; F140-F151 HydrophobicContact CG-CE1 3.87Å; F140-C182 WeakPolarHBondContact CA-SG 3.49Å
141	S	94.1	Very high	92.9	Very high	11 Å²	11	40.3 Å²	40.3	8%	0.077	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	145.1	177.7	-167.3	0	0	0	0	111.3	Y150 C182 I184	S141-Y150 PolarHBondContact N-O 2.84Å; S141-Y150 PolarHBondContact O-N 3.37Å; S141-C182 PolarHBondContact N-SG 3.35Å; S141-C182 VanDerWaalsContact N-SG 3.43Å; S141-I184 WeakPolarHBondContact OG-CD1 2.82Å; S141-I184 WeakPolarHBondContact OG-CG1 3.34Å
142	Y	94.2	Very high	92.8	Very high	27 Å²	27	39.6 Å²	39.6	11%	0.106	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124	-177.8	179.4	-121.6	0	0	0	112.3	L103 Y144 C147 L149 L163	L103-Y142 HydrophobicContact CD2-CD1 3.53Å; L103-Y142 HydrophobicContact CD2-CD2 3.73Å; L103-Y142 HydrophobicContact CD2-CE1 3.94Å; L103-Y142 HydrophobicContact CD2-CE2 4.09Å; L103-Y142 HydrophobicContact CD2-CG 3.42Å; L103-Y142 VanDerWaalsContact CD2-CG 3.42Å; Y142-Y144 HydrophobicContact CD1-CD1 4.26Å; Y142-Y144 AromaticContact CD1-CD2 3.69Å; Y142-Y144 HydrophobicContact CD1-CD2 3.69Å; Y142-Y144 HydrophobicContact CD1-CE1 4.02Å; Y142-Y144 AromaticContact CD1-CE2 3.35Å; Y142-Y144 HydrophobicContact CD1-CE2 3.35Å; Y142-Y144 HydrophobicContact CD1-CG 4.1Å; Y142-Y144 AromaticContact CD1-CZ 3.54Å; Y142-Y144 AromaticContact CE1-CD1 3.74Å; Y142-Y144 HydrophobicContact CE1-CD1 3.74Å; Y142-Y144 AromaticContact CE1-CD2 3.94Å; Y142-Y144 HydrophobicContact CE1-CD2 3.94Å; Y142-Y144 AromaticContact CE1-CE1 3.69Å; Y142-Y144 HydrophobicContact CE1-CE1 3.69Å; Y142-Y144 AromaticContact CE1-CE2 3.85Å; Y142-Y144 HydrophobicContact CE1-CE2 3.85Å; Y142-Y144 AromaticContact CE1-CG 3.85Å; Y142-Y144 HydrophobicContact CE1-CG 3.85Å; Y142-Y144 AromaticContact CE1-CZ 3.73Å; Y142-Y144 HydrophobicContact CG-CE2 4.43Å; Y142-C147 HydrophobicContact CE2-CB 4.45Å; Y142-C147 PolarHBondContact OH-SG 2.84Å; Y142-L149 HydrophobicContact CD2-CD2 3.52Å; Y142-L149 HydrophobicContact CD2-CG 3.89Å; Y142-L149 HydrophobicContact CG-CD2 3.96Å; Y142-L163 HydrophobicContact CD2-CD1 4.27Å; Y142-L163 HydrophobicContact CE2-CD1 3.69Å
143	H	93.4	Very high	92.6	Very high	12 Å²	12	33 Å²	33	6%	0.056	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	104.9	175.5	-176.8	-99.3	0	0	0	110.8	P145 S146 C147 D148 Y150 I184 H189	H143-P145 VanDerWaalsContact CE1-CD 3.5Å; H143-P145 WeakPolarHBondContact CE1-CD 3.47Å; H143-S146 PolarHBondContact CE1-N 3.3Å; H143-S146 PolarHBondContact CE1-OG 3.44Å; H143-S146 WeakPolarHBondContact ND1-CB 3.35Å; H143-S146 PolarHBondContact ND1-N 3.26Å; H143-S146 VanDerWaalsContact ND1-N 3.1Å; H143-S146 PolarHBondContact ND1-OG 3Å; H143-C147 WeakPolarHBondContact O-CA 3.46Å; H143-C147 PolarHBondContact O-N 3.4Å; H143-D148 HydrophobicContact CB-CB 4.4Å; H143-D148 WeakPolarHBondContact CB-O 3.44Å; H143-D148 PolarHBondContact N-O 3.07Å; H143-D148 PolarHBondContact O-N 3.37Å; H143-Y150 HydrophobicContact CB-CD2 4.32Å; H143-Y150 HydrophobicContact CB-CE2 3.77Å; H143-I184 HydrophobicContact CB-CD1 3.76Å; H143-H189 VanDerWaalsContact NE2-CB 3.32Å; H143-H189 WeakPolarHBondContact NE2-CB 3.45Å; H143-H189 AromaticContact NE2-CG 3.84Å
144	Y	89.4	Confident	92.5	Very high	75 Å²	75	37 Å²	37	29%	0.294	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-46.1	-177.3	-81.5	-95.1	0	0	0	114.8	R62 I102 L103 Y142 S146	R62-Y144 PolarHBondContact NE-OH 3.38Å; R62-Y144 PolarHBondContact NH1-OH 3.05Å; R62-Y144 PolarHBondContact NH2-OH 3.09Å; R62-Y144 VanDerWaalsContact NH2-OH 3.13Å; I102-Y144 PolarHBondContact O-OH 3.15Å; L103-Y144 VanDerWaalsContact O-CE1 3.25Å; L103-Y144 WeakPolarHBondContact O-CE1 3.5Å; L103-Y144 PolarHBondContact O-OH 3.45Å; Y142-Y144 HydrophobicContact CD1-CD1 4.26Å; Y142-Y144 AromaticContact CD1-CD2 3.69Å; Y142-Y144 HydrophobicContact CD1-CD2 3.69Å; Y142-Y144 HydrophobicContact CD1-CE1 4.02Å; Y142-Y144 AromaticContact CD1-CE2 3.35Å; Y142-Y144 HydrophobicContact CD1-CE2 3.35Å; Y142-Y144 HydrophobicContact CD1-CG 4.1Å; Y142-Y144 AromaticContact CD1-CZ 3.54Å; Y142-Y144 AromaticContact CE1-CD1 3.74Å; Y142-Y144 HydrophobicContact CE1-CD1 3.74Å; Y142-Y144 AromaticContact CE1-CD2 3.94Å; Y142-Y144 HydrophobicContact CE1-CD2 3.94Å; Y142-Y144 AromaticContact CE1-CE1 3.69Å; Y142-Y144 HydrophobicContact CE1-CE1 3.69Å; Y142-Y144 AromaticContact CE1-CE2 3.85Å; Y142-Y144 HydrophobicContact CE1-CE2 3.85Å; Y142-Y144 AromaticContact CE1-CG 3.85Å; Y142-Y144 HydrophobicContact CE1-CG 3.85Å; Y142-Y144 AromaticContact CE1-CZ 3.73Å; Y142-Y144 HydrophobicContact CG-CE2 4.43Å; Y144-S146 PolarHBondContact O-N 3.38Å
145	P	91.3	Very high	92.5	Very high	79 Å²	79	34.1 Å²	34.1	51%	0.513	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-32.7	-173.8	-21.3	30.3	0	0	0	115.5	H143 H189	H143-P145 VanDerWaalsContact CE1-CD 3.5Å; H143-P145 WeakPolarHBondContact CE1-CD 3.47Å; P145-H189 WeakPolarHBondContact CG-NE2 3.27Å
146	S	89.5	Confident	92.4	Very high	34 Å²	34	30.5 Å²	30.5	24%	0.238	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-1.6	-179.5	71.2	0	0	0	0	113.8	H143 Y144 D148 N162	H143-S146 PolarHBondContact CE1-N 3.3Å; H143-S146 PolarHBondContact CE1-OG 3.44Å; H143-S146 WeakPolarHBondContact ND1-CB 3.35Å; H143-S146 PolarHBondContact ND1-N 3.26Å; H143-S146 VanDerWaalsContact ND1-N 3.1Å; H143-S146 PolarHBondContact ND1-OG 3Å; Y144-S146 PolarHBondContact O-N 3.38Å; S146-D148 PolarHBondContact O-N 3.02Å; S146-D148 WeakPolarHBondContact OG-CB 3.4Å; S146-D148 PolarHBondContact OG-OD2 2.87Å; S146-N162 PolarHBondContact O-ND2 2.95Å; S146-N162 VanDerWaalsContact O-ND2 3.15Å
147	C	92.1	Very high	92.4	Very high	37 Å²	37	29.9 Å²	29.9	25%	0.25	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	32.9	-173.6	-57.6	0	0	0	0	113.5	Y142 H143 L163 E164	Y142-C147 HydrophobicContact CE2-CB 4.45Å; Y142-C147 PolarHBondContact OH-SG 2.84Å; H143-C147 WeakPolarHBondContact O-CA 3.46Å; H143-C147 PolarHBondContact O-N 3.4Å; C147-L163 HydrophobicContact CB-CB 4.41Å; C147-L163 WeakPolarHBondContact O-CB 3.39Å; C147-L163 PolarHBondContact O-N 3.13Å; C147-E164 HydrophobicContact CB-CB 4.4Å
148	D	93.1	Very high	92.5	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.021	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	133.3	177.8	-68.2	-31.4	0	0	0	110.9	H143 S146 Y150 R160 N162	H143-D148 HydrophobicContact CB-CB 4.4Å; H143-D148 WeakPolarHBondContact CB-O 3.44Å; H143-D148 PolarHBondContact N-O 3.07Å; H143-D148 PolarHBondContact O-N 3.37Å; S146-D148 PolarHBondContact O-N 3.02Å; S146-D148 WeakPolarHBondContact OG-CB 3.4Å; S146-D148 PolarHBondContact OG-OD2 2.87Å; D148-Y150 HydrophobicContact CB-CD2 4.44Å; D148-Y150 HydrophobicContact CB-CE2 3.82Å; D148-R160 IonicContact OD2-CZ 3.26Å; D148-R160 IonicContact OD2-NH2 2.74Å; D148-R160 PolarHBondContact OD2-NH2 3.09Å; D148-N162 VanDerWaalsContact OD1-CB 3.23Å; D148-N162 WeakPolarHBondContact OD1-CB 3.34Å; D148-N162 VanDerWaalsContact OD1-CG 3.27Å; D148-N162 PolarHBondContact OD1-ND2 3.26Å
149	L	94.1	Very high	92.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	128.7	165.8	-73.2	169.3	0	0	0	109.9	L103 V111 F121 F140 Y142 F151 R160 L161 L163	L103-L149 HydrophobicContact CD2-CD2 4.25Å; V111-L149 HydrophobicContact CG1-CD1 4.14Å; V111-L149 HydrophobicContact CG2-CD1 4.12Å; F121-L149 HydrophobicContact CE1-CD1 3.7Å; F121-L149 HydrophobicContact CZ-CD1 3.95Å; F140-L149 HydrophobicContact CD2-CD2 3.95Å; F140-L149 HydrophobicContact CE2-CD2 4.08Å; Y142-L149 HydrophobicContact CD2-CD2 3.52Å; Y142-L149 HydrophobicContact CD2-CG 3.89Å; Y142-L149 HydrophobicContact CG-CD2 3.96Å; L149-F151 HydrophobicContact CB-CD2 4.48Å; L149-F151 HydrophobicContact CB-CE2 3.73Å; L149-F151 HydrophobicContact CB-CZ 3.89Å; L149-F151 HydrophobicContact CD1-CE2 4.44Å; L149-F151 HydrophobicContact CD1-CZ 3.97Å; L149-F151 HydrophobicContact CG-CZ 4.49Å; L149-R160 CarbonylContact O-C 3.46Å; L149-R160 VanDerWaalsContact O-CA 3.32Å; L149-R160 WeakPolarHBondContact O-CA 3.43Å; L149-L161 HydrophobicContact CB-CB 4.46Å; L149-L161 HydrophobicContact CD1-CD2 4.09Å; L149-L161 PolarHBondContact N-O 3.04Å; L149-L161 PolarHBondContact O-N 3.34Å; L149-L163 HydrophobicContact CD1-CD1 3.9Å; L149-L163 HydrophobicContact CD1-CD2 3.77Å; L149-L163 HydrophobicContact CD1-CG 3.98Å; L149-L163 HydrophobicContact CG-CD1 4.1Å; L149-L163 HydrophobicContact CG-CG 4.26Å
150	Y	94.4	Very high	92.6	Very high	1 Å²	1	25.8 Å²	25.8	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.6	175.3	-67.7	-96.1	0	0	0	109.3	F140 S141 H143 D148 V158 Y159 R160 L172 I184 F191 P205	F140-Y150 CarbonylContact C-O 3.33Å; F140-Y150 WeakPolarHBondContact CA-O 3.19Å; F140-Y150 WeakPolarHBondContact CB-O 3.4Å; S141-Y150 PolarHBondContact N-O 2.84Å; S141-Y150 PolarHBondContact O-N 3.37Å; H143-Y150 HydrophobicContact CB-CD2 4.32Å; H143-Y150 HydrophobicContact CB-CE2 3.77Å; D148-Y150 HydrophobicContact CB-CD2 4.44Å; D148-Y150 HydrophobicContact CB-CE2 3.82Å; Y150-V158 HydrophobicContact CD1-CG1 4.1Å; Y150-Y159 WeakPolarHBondContact CA-O 3.49Å; Y150-R160 HydrophobicContact CD1-CG 3.63Å; Y150-R160 VanDerWaalsContact CE1-CD 3.49Å; Y150-R160 HydrophobicContact CE1-CG 3.56Å; Y150-R160 HydrophobicContact CG-CG 4.48Å; Y150-R160 PolarHBondContact OH-NE 2.94Å; Y150-R160 PolarHBondContact OH-NH2 2.92Å; Y150-L172 HydrophobicContact CD1-CD1 4.31Å; Y150-L172 HydrophobicContact CE1-CD1 3.9Å; Y150-I184 HydrophobicContact CD2-CD1 4.01Å; Y150-I184 HydrophobicContact CE2-CD1 4.39Å; Y150-F191 HydrophobicContact CD1-CD1 4.06Å; Y150-F191 HydrophobicContact CD1-CD2 4.22Å; Y150-F191 AromaticContact CD1-CE1 3.89Å; Y150-F191 HydrophobicContact CD1-CE1 3.89Å; Y150-F191 HydrophobicContact CD1-CE2 4.05Å; Y150-F191 HydrophobicContact CD1-CG 4.22Å; Y150-F191 AromaticContact CD1-CZ 3.9Å; Y150-F191 HydrophobicContact CD1-CZ 3.9Å; Y150-F191 HydrophobicContact CD2-CD2 4.34Å; Y150-F191 HydrophobicContact CD2-CE2 4.43Å; Y150-F191 HydrophobicContact CE1-CD1 4.32Å; Y150-F191 HydrophobicContact CE1-CG 4.43Å; Y150-F191 AromaticContact CG-CD2 3.98Å; Y150-F191 HydrophobicContact CG-CD2 3.98Å; Y150-F191 HydrophobicContact CG-CE1 4.4Å; Y150-F191 AromaticContact CG-CE2 3.73Å; Y150-F191 HydrophobicContact CG-CE2 3.73Å; Y150-F191 HydrophobicContact CG-CG 4.42Å; Y150-F191 AromaticContact CG-CZ 3.98Å; Y150-F191 HydrophobicContact CG-CZ 3.98Å; Y150-P205 WeakPolarHBondContact OH-CB 3.35Å
151	F	94.5	Very high	92.5	Very high	1 Å²	1	25.9 Å²	25.9	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.5	177.4	-61.1	-80.3	0	0	0	110.8	L113 V119 I133 F140 L149 V158 Y159 L161	L113-F151 HydrophobicContact CD1-CD1 4.18Å; L113-F151 HydrophobicContact CD1-CE1 4.41Å; V119-F151 HydrophobicContact CB-CE1 4.5Å; V119-F151 HydrophobicContact CB-CZ 4.37Å; V119-F151 HydrophobicContact CG1-CE1 4.13Å; V119-F151 HydrophobicContact CG1-CZ 3.92Å; V119-F151 HydrophobicContact CG2-CD1 4.22Å; V119-F151 HydrophobicContact CG2-CE1 3.56Å; V119-F151 HydrophobicContact CG2-CZ 3.73Å; I133-F151 HydrophobicContact CD1-CB 3.76Å; I133-F151 HydrophobicContact CD1-CD1 3.47Å; I133-F151 VanDerWaalsContact CD1-CD1 3.47Å; I133-F151 HydrophobicContact CD1-CD2 3.63Å; I133-F151 HydrophobicContact CD1-CE1 3.94Å; I133-F151 HydrophobicContact CD1-CE2 4.05Å; I133-F151 HydrophobicContact CD1-CG 3.32Å; I133-F151 HydrophobicContact CD1-CZ 4.2Å; F140-F151 HydrophobicContact CB-CD1 3.42Å; F140-F151 VanDerWaalsContact CB-CD1 3.42Å; F140-F151 HydrophobicContact CB-CE1 3.78Å; F140-F151 HydrophobicContact CB-CG 4.24Å; F140-F151 HydrophobicContact CD1-CE1 4.38Å; F140-F151 HydrophobicContact CD2-CE1 4.2Å; F140-F151 HydrophobicContact CG-CD1 4.02Å; F140-F151 AromaticContact CG-CE1 3.87Å; F140-F151 HydrophobicContact CG-CE1 3.87Å; L149-F151 HydrophobicContact CB-CD2 4.48Å; L149-F151 HydrophobicContact CB-CE2 3.73Å; L149-F151 HydrophobicContact CB-CZ 3.89Å; L149-F151 HydrophobicContact CD1-CE2 4.44Å; L149-F151 HydrophobicContact CD1-CZ 3.97Å; L149-F151 HydrophobicContact CG-CZ 4.49Å; F151-V158 WeakPolarHBondContact O-CA 3.5Å; F151-V158 WeakPolarHBondContact O-CG1 3.43Å; F151-Y159 PolarHBondContact N-O 3.41Å; F151-Y159 PolarHBondContact O-N 3.47Å; F151-L161 HydrophobicContact CE2-CB 3.91Å
152	V	93.2	Very high	92.6	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.012	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	145.7	-179.8	156.3	0	0	0	0	109.3	G137 R138 D139 V158 N179 C182 F191 T193	G137-V152 CarbonylContact C-O 3.59Å; G137-V152 VanDerWaalsContact CA-O 3.24Å; G137-V152 WeakPolarHBondContact CA-O 3.48Å; R138-V152 PolarHBondContact N-O 3.47Å; D139-V152 PolarHBondContact N-O 3.12Å; D139-V152 PolarHBondContact O-N 3.36Å; D139-V152 VanDerWaalsContact O-O 3.1Å; V152-V158 HydrophobicContact CG2-CG1 4.03Å; V152-V158 HydrophobicContact CG2-CG2 4.09Å; V152-N179 HydrophobicContact CB-CB 4.33Å; V152-N179 HydrophobicContact CG1-CB 3.35Å; V152-N179 WeakPolarHBondContact CG1-O 3.24Å; V152-N179 HydrophobicContact CG2-CB 4.3Å; V152-C182 HydrophobicContact CB-CB 4.34Å; V152-C182 HydrophobicContact CG2-CB 3.79Å; V152-F191 HydrophobicContact CG2-CZ 4.18Å; V152-T193 HydrophobicContact CG2-CG2 3.8Å
153	G	89.3	Confident	92.4	Very high	2 Å²	2	27 Å²	27	2%	0.021	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	-147.6	179	0	0	0	0	0	115.2	F136 S155 N179	F136-G153 VanDerWaalsContact O-CA 3.25Å; F136-G153 WeakPolarHBondContact O-CA 3.39Å; G153-S155 PolarHBondContact O-N 2.84Å; G153-N179 CarbonylContact C-O 3.58Å; G153-N179 WeakPolarHBondContact CA-O 3.42Å; G153-N179 PolarHBondContact N-O 2.9Å; G153-N179 PolarHBondContact O-N 3.11Å
154	M	91	Very high	92.4	Very high	85 Å²	85	33.9 Å²	33.9	42%	0.419	18%	0.178	S	C	.	.	S	Bend	trans	-73.6	40	-178.5	-62.7	-161.6	-86	0	0	113.2	F136	F136-M154 HydrophobicContact CB-CE 3.34Å; F136-M154 HydrophobicContact CD1-CE 4.49Å; F136-M154 HydrophobicContact CD2-CE 3.44Å; F136-M154 VanDerWaalsContact CD2-CE 3.44Å; F136-M154 HydrophobicContact CE2-CE 4.34Å; F136-M154 HydrophobicContact CG-CE 3.52Å; F136-M154 PolarHBondContact O-N 2.86Å
155	S	90.6	Very high	92.6	Very high	14 Å²	14	34.8 Å²	34.8	10%	0.098	18%	0.184	C	C	.	.	S	Bend	trans	-144.5	150.9	178.8	51.8	0	0	0	0	111.2	G153 E157 V177	G153-S155 PolarHBondContact O-N 2.84Å; S155-E157 PolarHBondContact O-N 3.27Å; S155-E157 PolarHBondContact OG-O 2.85Å; S155-V177 CarbonylContact C-O 3.52Å
156	S	91.2	Very high	92.5	Very high	34 Å²	34	34.1 Å²	34.1	24%	0.238	19%	0.191	C	C	.	.	S	Bend	trans	-67.7	-17.4	165.4	159.5	0	0	0	0	112.1	T174 G176 V177	S156-T174 WeakPolarHBondContact O-CB 3.36Å; S156-T174 PolarHBondContact O-N 3.18Å; S156-T174 PolarHBondContact O-OG1 2.89Å; S156-T174 PolarHBondContact OG-O 3.31Å; S156-G176 VanDerWaalsContact CA-O 3.25Å; S156-G176 WeakPolarHBondContact CA-O 3.44Å; S156-G176 WeakPolarHBondContact CB-O 3.41Å; S156-V177 PolarHBondContact N-O 3.05Å
157	E	92.3	Very high	92.7	Very high	76 Å²	76	39.8 Å²	39.8	36%	0.355	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	134.6	175.7	-70.1	179.5	-147.4	0	0	111.4	S155 Y159 S171 L172	S155-E157 PolarHBondContact O-N 3.27Å; S155-E157 PolarHBondContact OG-O 2.85Å; E157-Y159 HydrophobicContact CB-CE1 4.14Å; E157-S171 PolarHBondContact OE2-OG 3.25Å; E157-L172 CarbonylContact C-O 3.58Å; E157-L172 WeakPolarHBondContact CA-O 3.38Å
158	V	93.9	Very high	92.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	117.3	166.7	-176.5	0	0	0	0	108.3	Y150 F151 V152 S171 L172 T174 F191 T193	Y150-V158 HydrophobicContact CD1-CG1 4.1Å; F151-V158 WeakPolarHBondContact O-CA 3.5Å; F151-V158 WeakPolarHBondContact O-CG1 3.43Å; V152-V158 HydrophobicContact CG2-CG1 4.03Å; V152-V158 HydrophobicContact CG2-CG2 4.09Å; V158-S171 CarbonylContact O-C 3.51Å; V158-S171 WeakPolarHBondContact O-CA 3.49Å; V158-S171 VanDerWaalsContact O-CB 3.28Å; V158-S171 WeakPolarHBondContact O-CB 3.19Å; V158-L172 HydrophobicContact CB-CB 4.18Å; V158-L172 PolarHBondContact N-O 3.35Å; V158-L172 PolarHBondContact O-N 3.41Å; V158-T174 HydrophobicContact CG2-CG2 3.84Å; V158-F191 HydrophobicContact CB-CE1 4.47Å; V158-F191 HydrophobicContact CG1-CE1 3.77Å; V158-F191 HydrophobicContact CG1-CZ 3.66Å; V158-F191 HydrophobicContact CG2-CE1 4.26Å; V158-T193 HydrophobicContact CG2-CG2 4.05Å
159	Y	94	Very high	92.7	Very high	29 Å²	29	44.6 Å²	44.6	11%	0.114	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	133.2	-178.4	-58.7	-65.8	0	0	0	110.9	I133 P134 K135 Y150 F151 E157	I133-Y159 HydrophobicContact CG2-CD2 3.35Å; I133-Y159 HydrophobicContact CG2-CE2 3.76Å; I133-Y159 HydrophobicContact CG2-CG 4.02Å; P134-Y159 HydrophobicContact CB-CE1 4.49Å; P134-Y159 HydrophobicContact CG-CE1 4Å; K135-Y159 HydrophobicContact CB-CE2 4.11Å; K135-Y159 HydrophobicContact CG-CE2 4.4Å; K135-Y159 WeakPolarHBondContact CG-OH 3.38Å; Y150-Y159 WeakPolarHBondContact CA-O 3.49Å; F151-Y159 PolarHBondContact N-O 3.41Å; F151-Y159 PolarHBondContact O-N 3.47Å; E157-Y159 HydrophobicContact CB-CE1 4.14Å
160	R	93.2	Very high	92.6	Very high	11 Å²	11	51.7 Å²	51.7	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.4	179.2	-69.2	179.5	66.8	177.7	1.9	110.2	D148 L149 Y150 F168 L169	D148-R160 IonicContact OD2-CZ 3.26Å; D148-R160 IonicContact OD2-NH2 2.74Å; D148-R160 PolarHBondContact OD2-NH2 3.09Å; L149-R160 CarbonylContact O-C 3.46Å; L149-R160 VanDerWaalsContact O-CA 3.32Å; L149-R160 WeakPolarHBondContact O-CA 3.43Å; Y150-R160 HydrophobicContact CD1-CG 3.63Å; Y150-R160 VanDerWaalsContact CE1-CD 3.49Å; Y150-R160 HydrophobicContact CE1-CG 3.56Å; Y150-R160 HydrophobicContact CG-CG 4.48Å; Y150-R160 PolarHBondContact OH-NE 2.94Å; Y150-R160 PolarHBondContact OH-NH2 2.92Å; R160-F168 CarbonylContact O-C 3.55Å; R160-F168 WeakPolarHBondContact O-CA 3.33Å; R160-L169 HydrophobicContact CB-CB 3.99Å; R160-L169 PolarHBondContact O-N 2.92Å
161	L	94.4	Very high	92.4	Very high	9 Å²	9	53.8 Å²	53.8	5%	0.047	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	115.6	174.6	-178.5	130.3	0	0	0	109.3	F121 T131 L149 F151 L163 F168	F121-L161 HydrophobicContact CZ-CD2 3.8Å; T131-L161 HydrophobicContact CG2-CD1 4.48Å; L149-L161 HydrophobicContact CB-CB 4.46Å; L149-L161 HydrophobicContact CD1-CD2 4.09Å; L149-L161 PolarHBondContact N-O 3.04Å; L149-L161 PolarHBondContact O-N 3.34Å; F151-L161 HydrophobicContact CE2-CB 3.91Å; L161-L163 HydrophobicContact CD2-CD2 3.46Å; L161-L163 VanDerWaalsContact CD2-CD2 3.46Å; L161-L163 HydrophobicContact CD2-CG 4.29Å; L161-F168 HydrophobicContact CB-CD1 3.95Å; L161-F168 HydrophobicContact CB-CE1 3.86Å; L161-F168 HydrophobicContact CD1-CD1 3.96Å; L161-F168 HydrophobicContact CD1-CD2 4.15Å; L161-F168 HydrophobicContact CD1-CE1 3.51Å; L161-F168 HydrophobicContact CD1-CE2 3.72Å; L161-F168 HydrophobicContact CD1-CG 4.27Å; L161-F168 HydrophobicContact CD1-CZ 3.38Å; L161-F168 HydrophobicContact CG-CD1 4.46Å; L161-F168 HydrophobicContact CG-CE1 4.29Å
162	N	94.7	Very high	92.3	Very high	10 Å²	10	54.2 Å²	54.2	5%	0.053	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	122.6	176.5	-172	-63.1	0	0	0	109.5	S146 D148 E164 Q165 G166 R167 L169	S146-N162 PolarHBondContact O-ND2 2.95Å; S146-N162 VanDerWaalsContact O-ND2 3.15Å; D148-N162 VanDerWaalsContact OD1-CB 3.23Å; D148-N162 WeakPolarHBondContact OD1-CB 3.34Å; D148-N162 VanDerWaalsContact OD1-CG 3.27Å; D148-N162 PolarHBondContact OD1-ND2 3.26Å; N162-E164 WeakPolarHBondContact OD1-CA 3.21Å; N162-E164 WeakPolarHBondContact OD1-CB 3.36Å; N162-E164 PolarHBondContact OD1-N 3.41Å; N162-Q165 HydrophobicContact CB-CB 4.34Å; N162-Q165 PolarHBondContact OD1-N 3.02Å; N162-G166 VanDerWaalsContact O-CA 3.3Å; N162-G166 WeakPolarHBondContact O-CA 3.22Å; N162-G166 PolarHBondContact O-N 3.01Å; N162-R167 PolarHBondContact N-O 3.3Å; N162-R167 PolarHBondContact O-N 3.42Å; N162-L169 HydrophobicContact CB-CD1 4.07Å; N162-L169 HydrophobicContact CB-CG 4.18Å
163	L	91.6	Very high	92.1	Very high	53 Å²	53	61 Å²	61	28%	0.277	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-26	-178.1	-65.9	179.3	0	0	0	113.7	L103 F121 Y142 C147 L149 L161	L103-L163 HydrophobicContact CD1-CD1 3.67Å; L103-L163 HydrophobicContact CD2-CD1 4.42Å; F121-L163 HydrophobicContact CD1-CD2 4.3Å; F121-L163 HydrophobicContact CE1-CD2 3.48Å; F121-L163 VanDerWaalsContact CE1-CD2 3.48Å; F121-L163 HydrophobicContact CZ-CD2 3.76Å; Y142-L163 HydrophobicContact CD2-CD1 4.27Å; Y142-L163 HydrophobicContact CE2-CD1 3.69Å; C147-L163 HydrophobicContact CB-CB 4.41Å; C147-L163 WeakPolarHBondContact O-CB 3.39Å; C147-L163 PolarHBondContact O-N 3.13Å; L149-L163 HydrophobicContact CD1-CD1 3.9Å; L149-L163 HydrophobicContact CD1-CD2 3.77Å; L149-L163 HydrophobicContact CD1-CG 3.98Å; L149-L163 HydrophobicContact CG-CD1 4.1Å; L149-L163 HydrophobicContact CG-CG 4.26Å; L161-L163 HydrophobicContact CD2-CD2 3.46Å; L161-L163 VanDerWaalsContact CD2-CD2 3.46Å; L161-L163 HydrophobicContact CD2-CG 4.29Å
164	E	92.8	Very high	92.1	Very high	156 Å²	156	61 Å²	61	73%	0.729	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-45	176.6	-174.8	-177.1	179.3	0	0	110.7	C147 N162	C147-E164 HydrophobicContact CB-CB 4.4Å; N162-E164 WeakPolarHBondContact OD1-CA 3.21Å; N162-E164 WeakPolarHBondContact OD1-CB 3.36Å; N162-E164 PolarHBondContact OD1-N 3.41Å
165	Q	92.9	Very high	91.9	Very high	94 Å²	94	60.9 Å²	60.9	44%	0.439	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-20.1	-179.7	-58.7	-173.4	3.2	0	0	113.4	N162 R167	N162-Q165 HydrophobicContact CB-CB 4.34Å; N162-Q165 PolarHBondContact OD1-N 3.02Å; Q165-R167 HydrophobicContact CB-CG 3.76Å; Q165-R167 WeakPolarHBondContact O-CG 3.2Å
166	G	90.6	Very high	91.4	Very high	64 Å²	64	60.2 Å²	60.2	66%	0.66	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	28.9	-177.3	0	0	0	0	0	114.2	N162	N162-G166 VanDerWaalsContact O-CA 3.3Å; N162-G166 WeakPolarHBondContact O-CA 3.22Å; N162-G166 PolarHBondContact O-N 3.01Å
167	R	93.1	Very high	91.2	Very high	154 Å²	154	63.3 Å²	63.3	58%	0.581	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	150.5	-174.3	-20.4	178.3	-170.3	170.6	9.1	110.9	N162 Q165	N162-R167 PolarHBondContact N-O 3.3Å; N162-R167 PolarHBondContact O-N 3.42Å; Q165-R167 HydrophobicContact CB-CG 3.76Å; Q165-R167 WeakPolarHBondContact O-CG 3.2Å
168	F	92.9	Very high	91.1	Very high	91 Å²	91	62.5 Å²	62.5	40%	0.399	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	128.3	161.9	-74	-77.8	0	0	0	109.4	I133 R160 L161	I133-F168 HydrophobicContact CG1-CE1 4.5Å; I133-F168 HydrophobicContact CG1-CZ 4.38Å; R160-F168 CarbonylContact O-C 3.55Å; R160-F168 WeakPolarHBondContact O-CA 3.33Å; L161-F168 HydrophobicContact CB-CD1 3.95Å; L161-F168 HydrophobicContact CB-CE1 3.86Å; L161-F168 HydrophobicContact CD1-CD1 3.96Å; L161-F168 HydrophobicContact CD1-CD2 4.15Å; L161-F168 HydrophobicContact CD1-CE1 3.51Å; L161-F168 HydrophobicContact CD1-CE2 3.72Å; L161-F168 HydrophobicContact CD1-CG 4.27Å; L161-F168 HydrophobicContact CD1-CZ 3.38Å; L161-F168 HydrophobicContact CG-CD1 4.46Å; L161-F168 HydrophobicContact CG-CE1 4.29Å
169	L	92.1	Very high	91	Very high	50 Å²	50	62.5 Å²	62.5	26%	0.262	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	169.9	169.4	-60.4	178.4	0	0	0	109.3	R160 N162 S171	R160-L169 HydrophobicContact CB-CB 3.99Å; R160-L169 PolarHBondContact O-N 2.92Å; N162-L169 HydrophobicContact CB-CD1 4.07Å; N162-L169 HydrophobicContact CB-CG 4.18Å; L169-S171 PolarHBondContact O-N 3.33Å
170	N	91.5	Very high	90.9	Very high	149 Å²	149	62.3 Å²	62.3	80%	0.797	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.3	132	173.9	-65.4	1.5	0	0	0	110.1
171	S	91.6	Very high	91	Very high	45 Å²	45	62.8 Å²	62.8	32%	0.315	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	151.5	177.2	40.5	0	0	0	0	111.2	E157 V158 L169	E157-S171 PolarHBondContact OE2-OG 3.25Å; V158-S171 CarbonylContact O-C 3.51Å; V158-S171 WeakPolarHBondContact O-CA 3.49Å; V158-S171 VanDerWaalsContact O-CB 3.28Å; V158-S171 WeakPolarHBondContact O-CB 3.19Å; L169-S171 PolarHBondContact O-N 3.33Å
172	L	91.2	Very high	90.9	Very high	10 Å²	10	62.6 Å²	62.6	5%	0.052	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.2	168.7	-55.8	175.3	0	0	0	108.2	Y150 E157 V158 F191 W203	Y150-L172 HydrophobicContact CD1-CD1 4.31Å; Y150-L172 HydrophobicContact CE1-CD1 3.9Å; E157-L172 CarbonylContact C-O 3.58Å; E157-L172 WeakPolarHBondContact CA-O 3.38Å; V158-L172 HydrophobicContact CB-CB 4.18Å; V158-L172 PolarHBondContact N-O 3.35Å; V158-L172 PolarHBondContact O-N 3.41Å; L172-F191 HydrophobicContact CD1-CD1 4.2Å; L172-F191 HydrophobicContact CD1-CE1 4.33Å; L172-W203 HydrophobicContact CB-CD2 4.32Å; L172-W203 HydrophobicContact CB-CE3 4.13Å; L172-W203 HydrophobicContact CB-CH2 4.2Å; L172-W203 HydrophobicContact CB-CZ2 4.38Å; L172-W203 HydrophobicContact CB-CZ3 4.06Å; L172-W203 HydrophobicContact CD1-CB 4.22Å; L172-W203 HydrophobicContact CD1-CD2 3.97Å; L172-W203 HydrophobicContact CD1-CE3 3.92Å; L172-W203 HydrophobicContact CD1-CG 4.11Å; L172-W203 HydrophobicContact CD2-CE3 3.84Å; L172-W203 HydrophobicContact CD2-CZ3 3.91Å; L172-W203 HydrophobicContact CG-CE3 4.18Å; L172-W203 HydrophobicContact CG-CZ3 4.41Å
173	Q	90.3	Very high	90.9	Very high	145 Å²	145	62.9 Å²	62.9	68%	0.678	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	111.6	-179.2	-171.4	171.8	3.9	0	0	109.8	W203	Q173-W203 VanDerWaalsContact O-CH2 3.24Å; Q173-W203 WeakPolarHBondContact O-CH2 3.48Å; Q173-W203 WeakPolarHBondContact O-CZ2 3.37Å
174	T	88.8	Confident	91	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.018	32%	0.319	C	S	.	.			trans	-89.9	156.3	176.8	64.9	0	0	0	0	111	S156 V158 G176 N179 E201 W203	S156-T174 WeakPolarHBondContact O-CB 3.36Å; S156-T174 PolarHBondContact O-N 3.18Å; S156-T174 PolarHBondContact O-OG1 2.89Å; S156-T174 PolarHBondContact OG-O 3.31Å; V158-T174 HydrophobicContact CG2-CG2 3.84Å; T174-G176 VanDerWaalsContact C-N 3.33Å; T174-N179 WeakPolarHBondContact CG2-ND2 3.09Å; T174-N179 PolarHBondContact OG1-ND2 3.41Å; T174-E201 VanDerWaalsContact CA-OE2 3.24Å; T174-E201 WeakPolarHBondContact CA-OE2 3.39Å; T174-E201 WeakPolarHBondContact CB-OE2 3.47Å; T174-E201 WeakPolarHBondContact CG2-OE2 3.37Å; T174-W203 HydrophobicContact CG2-CZ2 4.28Å
175	D	85.9	Confident	91	Very high	81 Å²	81	53.8 Å²	53.8	43%	0.433	29%	0.285	S	S	.	.	S	Bend	trans	-72.9	-29.5	178.5	-75.7	-10	0	0	0	112	E201 R210	D175-E201 WeakPolarHBondContact CB-OE1 3.29Å; D175-E201 PolarHBondContact N-OE1 3.47Å; D175-R210 IonicContact OD1-CZ 3.79Å; D175-R210 IonicContact OD1-NH1 2.97Å; D175-R210 PolarHBondContact OD1-NH1 2.91Å; D175-R210 IonicContact OD2-CZ 3.12Å; D175-R210 IonicContact OD2-NH1 2.99Å; D175-R210 PolarHBondContact OD2-NH1 3.28Å
176	G	80.4	Confident	90.8	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.291	C	S	.	.	S	Bend	trans	-72.4	149.9	179.2	0	0	0	0	0	113.5	S156 T174	S156-G176 VanDerWaalsContact CA-O 3.25Å; S156-G176 WeakPolarHBondContact CA-O 3.44Å; S156-G176 WeakPolarHBondContact CB-O 3.41Å; T174-G176 VanDerWaalsContact C-N 3.33Å
177	V	86.6	Confident	90.7	Very high	99 Å²	99	54.4 Å²	54.4	60%	0.6	28%	0.284	S	S	*	.	S	Bend	trans	-67.9	-38	177.8	-177.2	0	0	0	0	112.3	S155 S156	S155-V177 CarbonylContact C-O 3.52Å; S156-V177 PolarHBondContact N-O 3.05Å
178	E	90.8	Very high	90.5	Very high	60 Å²	60	51.9 Å²	51.9	28%	0.28	28%	0.278	S	S	.	.			trans	-138.9	143.5	-179	-58.3	-174.7	170.3	0	0	111	R138 T195 S196	R138-E178 IonicContact CZ-OE2 3.67Å; R138-E178 VanDerWaalsContact CZ-OE2 3.24Å; R138-E178 IonicContact NH1-OE2 3.39Å; R138-E178 PolarHBondContact NH1-OE2 2.7Å; R138-E178 IonicContact NH2-OE2 2.62Å; R138-E178 PolarHBondContact NH2-OE2 3.24Å; E178-T195 WeakPolarHBondContact O-CA 3.24Å; E178-S196 PolarHBondContact O-N 3.04Å
179	N	92.8	Very high	90.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.7	177	-67.3	-29.1	0	0	0	109	V152 G153 T174 G194 T195	V152-N179 HydrophobicContact CB-CB 4.33Å; V152-N179 HydrophobicContact CG1-CB 3.35Å; V152-N179 WeakPolarHBondContact CG1-O 3.24Å; V152-N179 HydrophobicContact CG2-CB 4.3Å; G153-N179 CarbonylContact C-O 3.58Å; G153-N179 WeakPolarHBondContact CA-O 3.42Å; G153-N179 PolarHBondContact N-O 2.9Å; G153-N179 PolarHBondContact O-N 3.11Å; T174-N179 WeakPolarHBondContact CG2-ND2 3.09Å; T174-N179 PolarHBondContact OG1-ND2 3.41Å; N179-G194 CarbonylContact C-O 3.59Å; N179-G194 WeakPolarHBondContact CA-O 3.2Å; N179-T195 VanDerWaalsContact OD1-CG2 3.31Å; N179-T195 WeakPolarHBondContact OD1-CG2 3.5Å
180	N	92	Very high	90.4	Very high	25 Å²	25	48.6 Å²	48.6	13%	0.134	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-47.1	-174.7	-68	-27.3	0	0	0	112.6	R138 D139 G194 S196 I233	R138-N180 WeakPolarHBondContact CB-O 3.18Å; R138-N180 WeakPolarHBondContact CD-OD1 3.25Å; R138-N180 PolarHBondContact NH1-OD1 3.25Å; D139-N180 WeakPolarHBondContact CB-O 3.45Å; N180-G194 PolarHBondContact N-O 3.21Å; N180-S196 PolarHBondContact ND2-OG 3.46Å; N180-S196 PolarHBondContact OD1-OG 2.94Å; N180-I233 VanDerWaalsContact CB-O 3.25Å; N180-I233 WeakPolarHBondContact CB-O 3.34Å; N180-I233 PolarHBondContact ND2-O 3.35Å
181	V	93.3	Very high	90.5	Very high	20 Å²	20	41.6 Å²	41.6	12%	0.121	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.3	-169.5	-179	0	0	0	0	110.4	D139 T193 G194 S234 L236	D139-V181 WeakPolarHBondContact OD2-CG1 3.31Å; V181-T193 WeakPolarHBondContact O-CA 3.47Å; V181-G194 PolarHBondContact O-N 3.01Å; V181-S234 VanDerWaalsContact CG2-C 3.48Å; V181-S234 WeakPolarHBondContact CG2-O 3.48Å; V181-L236 HydrophobicContact CG1-CB 3.9Å
182	C	93.7	Very high	90.5	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.034	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.7	168.8	58	0	0	0	0	112.6	D139 F140 S141 V152 F191 A192 T193	D139-C182 PolarHBondContact OD2-N 2.92Å; F140-C182 WeakPolarHBondContact CA-SG 3.49Å; S141-C182 PolarHBondContact N-SG 3.35Å; S141-C182 VanDerWaalsContact N-SG 3.43Å; V152-C182 HydrophobicContact CB-CB 4.34Å; V152-C182 HydrophobicContact CG2-CB 3.79Å; C182-F191 HydrophobicContact CB-CE2 3.57Å; C182-F191 HydrophobicContact CB-CZ 3.86Å; C182-A192 VanDerWaalsContact CA-O 3.24Å; C182-A192 WeakPolarHBondContact CA-O 3.37Å; C182-T193 HydrophobicContact CB-CG2 4.29Å
183	D	94.4	Very high	90.6	Very high	17 Å²	17	39 Å²	39	9%	0.091	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159	167	-158.8	21.9	0	0	0	109.7	A192 L236 K237 F238	D183-A192 PolarHBondContact N-O 3.32Å; D183-A192 VanDerWaalsContact N-O 3.09Å; D183-A192 PolarHBondContact O-N 2.84Å; D183-L236 HydrophobicContact CB-CD2 3.49Å; D183-L236 VanDerWaalsContact CB-CD2 3.49Å; D183-K237 VanDerWaalsContact CG-NZ 3.3Å; D183-K237 IonicContact OD1-NZ 2.64Å; D183-K237 PolarHBondContact OD1-NZ 2.71Å; D183-K237 WeakPolarHBondContact OD2-CA 3.49Å; D183-K237 WeakPolarHBondContact OD2-CD 3.45Å; D183-K237 WeakPolarHBondContact OD2-CE 3.37Å; D183-K237 IonicContact OD2-NZ 2.73Å; D183-K237 PolarHBondContact OD2-NZ 2.96Å; D183-F238 HydrophobicContact CB-CD2 4.13Å; D183-F238 HydrophobicContact CB-CE2 4.45Å; D183-F238 PolarHBondContact OD2-N 3.09Å; D183-F238 VanDerWaalsContact OD2-N 3.1Å
184	I	93.8	Very high	90.8	Very high	16 Å²	16	32 Å²	32	8%	0.082	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	132	175.8	-66.5	166.4	0	0	0	108	S141 H143 Y150 H189 L190 F191	S141-I184 WeakPolarHBondContact OG-CD1 2.82Å; S141-I184 WeakPolarHBondContact OG-CG1 3.34Å; H143-I184 HydrophobicContact CB-CD1 3.76Å; Y150-I184 HydrophobicContact CD2-CD1 4.01Å; Y150-I184 HydrophobicContact CE2-CD1 4.39Å; I184-H189 HydrophobicContact CG2-CB 4.47Å; I184-L190 WeakPolarHBondContact CA-O 3.43Å; I184-F191 HydrophobicContact CD1-CD2 4.28Å; I184-F191 HydrophobicContact CG1-CB 4.38Å; I184-F191 HydrophobicContact CG1-CD2 3.69Å
185	N	92.5	Very high	90.9	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.175	C	C	.	.			trans	-65.3	125.4	173.9	-177.1	-27.4	0	0	0	109.9	V187 H189 L190 F238 G240 S241	N185-V187 VanDerWaalsContact C-N 3.27Å; N185-V187 PolarHBondContact O-N 2.95Å; N185-V187 PolarHBondContact OD1-N 3.09Å; N185-H189 WeakPolarHBondContact O-CA 3.35Å; N185-H189 PolarHBondContact O-N 3.38Å; N185-H189 PolarHBondContact O-ND1 3.32Å; N185-L190 HydrophobicContact CB-CB 4.39Å; N185-L190 PolarHBondContact N-O 2.77Å; N185-F238 HydrophobicContact CB-CB 4.25Å; N185-F238 HydrophobicContact CB-CD1 4.29Å; N185-F238 HydrophobicContact CB-CD2 3.96Å; N185-F238 HydrophobicContact CB-CE2 4.36Å; N185-F238 HydrophobicContact CB-CG 3.9Å; N185-G240 PolarHBondContact ND2-O 2.96Å; N185-G240 VanDerWaalsContact ND2-O 3.14Å; N185-G240 PolarHBondContact OD1-O 3.32Å; N185-S241 PolarHBondContact ND2-O 3.1Å
186	P	88.1	Confident	91.1	Very high	87 Å²	87	29.6 Å²	29.6	57%	0.565	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.4	-179.4	25.6	-34.7	0	0	0	114.2	H189	P186-H189 PolarHBondContact O-CE1 2.92Å; P186-H189 PolarHBondContact O-ND1 3.38Å
187	V	90	Very high	91.4	Very high	84 Å²	84	32.7 Å²	32.7	51%	0.509	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-53.6	-174.6	-176.8	0	0	0	0	112.2	N185	N185-V187 VanDerWaalsContact C-N 3.27Å; N185-V187 PolarHBondContact O-N 2.95Å; N185-V187 PolarHBondContact OD1-N 3.09Å
188	H	88.1	Confident	91.4	Very high	102 Å²	102	28 Å²	28	47%	0.472	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-15	-176.2	-60	-44.6	0	0	0	113.4	L190 S241	H188-L190 PolarHBondContact O-N 2.95Å; H188-S241 PolarHBondContact CD2-O 2.76Å; H188-S241 VanDerWaalsContact CD2-O 3.23Å; H188-S241 WeakPolarHBondContact NE2-CB 3.42Å
189	H	90.6	Very high	91.4	Very high	47 Å²	47	28.3 Å²	28.3	22%	0.218	15%	0.15	C	C	.	.			trans	61.6	25.2	-176.5	-47.5	-57.1	0	0	0	114.9	H143 P145 I184 N185 P186 F191 P205	H143-H189 VanDerWaalsContact NE2-CB 3.32Å; H143-H189 WeakPolarHBondContact NE2-CB 3.45Å; H143-H189 AromaticContact NE2-CG 3.84Å; P145-H189 WeakPolarHBondContact CG-NE2 3.27Å; I184-H189 HydrophobicContact CG2-CB 4.47Å; N185-H189 WeakPolarHBondContact O-CA 3.35Å; N185-H189 PolarHBondContact O-N 3.38Å; N185-H189 PolarHBondContact O-ND1 3.32Å; P186-H189 PolarHBondContact O-CE1 2.92Å; P186-H189 PolarHBondContact O-ND1 3.38Å; H189-F191 PolarHBondContact O-N 3.44Å; H189-P205 WeakPolarHBondContact O-CD 3.39Å; H189-P205 VanDerWaalsContact O-CG 3.31Å; H189-P205 WeakPolarHBondContact O-CG 3.4Å
190	L	91.6	Very high	91.3	Very high	25 Å²	25	28.3 Å²	28.3	13%	0.131	15%	0.15	C	C	.	.			trans	-65.6	129.3	167.5	-169.5	74.8	0	0	0	108.9	I184 N185 H188 C202 W203 D204 V211 L258	I184-L190 WeakPolarHBondContact CA-O 3.43Å; N185-L190 HydrophobicContact CB-CB 4.39Å; N185-L190 PolarHBondContact N-O 2.77Å; H188-L190 PolarHBondContact O-N 2.95Å; L190-C202 HydrophobicContact CD1-CB 4.4Å; L190-C202 HydrophobicContact CD2-CB 3.88Å; L190-C202 HydrophobicContact CG-CB 4.24Å; L190-W203 WeakPolarHBondContact CD1-O 3.47Å; L190-D204 HydrophobicContact CD1-CB 4.42Å; L190-V211 HydrophobicContact CD1-CG2 4.43Å; L190-L258 HydrophobicContact CD2-CD2 3.37Å
191	F	93.4	Very high	91.3	Very high	1 Å²	1	27.1 Å²	27.1	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	129.9	175	173.9	-113.9	0	0	0	108.8	Y150 V152 V158 L172 C182 I184 H189 T193 C202 W203	Y150-F191 HydrophobicContact CD1-CD1 4.06Å; Y150-F191 HydrophobicContact CD1-CD2 4.22Å; Y150-F191 AromaticContact CD1-CE1 3.89Å; Y150-F191 HydrophobicContact CD1-CE1 3.89Å; Y150-F191 HydrophobicContact CD1-CE2 4.05Å; Y150-F191 HydrophobicContact CD1-CG 4.22Å; Y150-F191 AromaticContact CD1-CZ 3.9Å; Y150-F191 HydrophobicContact CD1-CZ 3.9Å; Y150-F191 HydrophobicContact CD2-CD2 4.34Å; Y150-F191 HydrophobicContact CD2-CE2 4.43Å; Y150-F191 HydrophobicContact CE1-CD1 4.32Å; Y150-F191 HydrophobicContact CE1-CG 4.43Å; Y150-F191 AromaticContact CG-CD2 3.98Å; Y150-F191 HydrophobicContact CG-CD2 3.98Å; Y150-F191 HydrophobicContact CG-CE1 4.4Å; Y150-F191 AromaticContact CG-CE2 3.73Å; Y150-F191 HydrophobicContact CG-CE2 3.73Å; Y150-F191 HydrophobicContact CG-CG 4.42Å; Y150-F191 AromaticContact CG-CZ 3.98Å; Y150-F191 HydrophobicContact CG-CZ 3.98Å; V152-F191 HydrophobicContact CG2-CZ 4.18Å; V158-F191 HydrophobicContact CB-CE1 4.47Å; V158-F191 HydrophobicContact CG1-CE1 3.77Å; V158-F191 HydrophobicContact CG1-CZ 3.66Å; V158-F191 HydrophobicContact CG2-CE1 4.26Å; L172-F191 HydrophobicContact CD1-CD1 4.2Å; L172-F191 HydrophobicContact CD1-CE1 4.33Å; C182-F191 HydrophobicContact CB-CE2 3.57Å; C182-F191 HydrophobicContact CB-CZ 3.86Å; I184-F191 HydrophobicContact CD1-CD2 4.28Å; I184-F191 HydrophobicContact CG1-CB 4.38Å; I184-F191 HydrophobicContact CG1-CD2 3.69Å; H189-F191 PolarHBondContact O-N 3.44Å; F191-T193 HydrophobicContact CD1-CG2 4.03Å; F191-T193 HydrophobicContact CE1-CG2 3.13Å; F191-T193 HydrophobicContact CE2-CG2 4.18Å; F191-T193 HydrophobicContact CZ-CG2 3.21Å; F191-C202 CarbonylContact O-C 3.52Å; F191-C202 WeakPolarHBondContact O-CA 3.31Å; F191-W203 HydrophobicContact CB-CB 4.38Å; F191-W203 HydrophobicContact CD1-CB 4Å; F191-W203 HydrophobicContact CD1-CG 4.37Å; F191-W203 PolarHBondContact N-O 2.95Å; F191-W203 PolarHBondContact O-N 2.79Å
192	A	93.2	Very high	91.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	143.5	173.7	0	0	0	0	0	111.8	C182 D183 V200 E201 L236 F238	C182-A192 VanDerWaalsContact CA-O 3.24Å; C182-A192 WeakPolarHBondContact CA-O 3.37Å; D183-A192 PolarHBondContact N-O 3.32Å; D183-A192 VanDerWaalsContact N-O 3.09Å; D183-A192 PolarHBondContact O-N 2.84Å; A192-V200 HydrophobicContact CB-CG1 4.16Å; A192-E201 CarbonylContact C-O 3.5Å; A192-E201 VanDerWaalsContact CA-O 3.28Å; A192-E201 WeakPolarHBondContact CA-O 3.49Å; A192-L236 HydrophobicContact CB-CD1 3.89Å; A192-L236 HydrophobicContact CB-CD2 4.05Å; A192-F238 HydrophobicContact CB-CE2 3.63Å; A192-F238 HydrophobicContact CB-CZ 3.5Å
193	T	93.4	Very high	91.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.3	178.6	53.7	0	0	0	0	110.8	V152 V158 V181 C182 F191 V200 E201	V152-T193 HydrophobicContact CG2-CG2 3.8Å; V158-T193 HydrophobicContact CG2-CG2 4.05Å; V181-T193 WeakPolarHBondContact O-CA 3.47Å; C182-T193 HydrophobicContact CB-CG2 4.29Å; F191-T193 HydrophobicContact CD1-CG2 4.03Å; F191-T193 HydrophobicContact CE1-CG2 3.13Å; F191-T193 HydrophobicContact CE2-CG2 4.18Å; F191-T193 HydrophobicContact CZ-CG2 3.21Å; T193-V200 WeakPolarHBondContact O-CA 3.44Å; T193-E201 PolarHBondContact N-O 3.01Å; T193-E201 PolarHBondContact O-N 3.16Å; T193-E201 PolarHBondContact OG1-O 2.95Å
194	G	93.2	Very high	91.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	120.1	172	0	0	0	0	0	111.3	N179 N180 V181	N179-G194 CarbonylContact C-O 3.59Å; N179-G194 WeakPolarHBondContact CA-O 3.2Å; N180-G194 PolarHBondContact N-O 3.21Å; V181-G194 PolarHBondContact O-N 3.01Å
195	T	91.8	Very high	90.8	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	158.1	174.7	64.9	0	0	0	0	111.3	E178 N179 E197 G198 R199 E201 I233	E178-T195 WeakPolarHBondContact O-CA 3.24Å; N179-T195 VanDerWaalsContact OD1-CG2 3.31Å; N179-T195 WeakPolarHBondContact OD1-CG2 3.5Å; T195-E197 PolarHBondContact O-N 3.03Å; T195-G198 PolarHBondContact O-N 3.25Å; T195-R199 WeakPolarHBondContact CB-O 3.5Å; T195-R199 WeakPolarHBondContact CG2-O 3.29Å; T195-R199 PolarHBondContact N-O 3.34Å; T195-R199 WeakPolarHBondContact OG1-CA 3.36Å; T195-R199 WeakPolarHBondContact OG1-CB 3.46Å; T195-R199 PolarHBondContact OG1-N 3.12Å; T195-R199 PolarHBondContact OG1-O 3.14Å; T195-E201 HydrophobicContact CG2-CG 4.43Å; T195-I233 PolarHBondContact O-N 3Å
196	S	89.5	Confident	90.5	Very high	32 Å²	32	37.5 Å²	37.5	22%	0.224	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.7	170.5	-71.7	0	0	0	0	113.5	E178 N180 G198 S232	E178-S196 PolarHBondContact O-N 3.04Å; N180-S196 PolarHBondContact ND2-OG 3.46Å; N180-S196 PolarHBondContact OD1-OG 2.94Å; S196-G198 PolarHBondContact O-N 3.26Å; S196-S232 VanDerWaalsContact O-CA 3.31Å; S196-S232 WeakPolarHBondContact O-CA 3.3Å; S196-S232 WeakPolarHBondContact O-CB 3.37Å
197	E	86.9	Confident	90.4	Very high	66 Å²	66	38.3 Å²	38.3	31%	0.308	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	5.6	-179.5	-64.2	173.8	-175.8	0	0	113.2	T195 R199	T195-E197 PolarHBondContact O-N 3.03Å; E197-R199 IonicContact OE2-CZ 3Å; E197-R199 IonicContact OE2-NE 3.5Å; E197-R199 PolarHBondContact OE2-NE 3.08Å; E197-R199 IonicContact OE2-NH2 2.96Å; E197-R199 PolarHBondContact OE2-NH2 2.95Å
198	G	86.4	Confident	89.9	Confident	1 Å²	1	42 Å²	42	1%	0.01	19%	0.188	C	C	.	.	S	Bend	trans	80.3	18.5	179.8	0	0	0	0	0	113.8	T195 S196 C216 A217 P231 I233	T195-G198 PolarHBondContact O-N 3.25Å; S196-G198 PolarHBondContact O-N 3.26Å; G198-C216 WeakPolarHBondContact O-CA 3.38Å; G198-C216 VanDerWaalsContact O-CB 3.23Å; G198-C216 WeakPolarHBondContact O-CB 3.17Å; G198-C216 PolarHBondContact O-N 2.74Å; G198-A217 PolarHBondContact O-N 2.92Å; G198-P231 WeakPolarHBondContact CA-O 3.41Å; G198-I233 VanDerWaalsContact C-CD1 3.45Å
199	R	90	Very high	89.8	Confident	65 Å²	65	42.2 Å²	42.2	25%	0.245	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.7	174.7	-57.8	-173.2	-78.7	172.5	-0.1	111.3	T195 E197 V213 L214 I233	T195-R199 WeakPolarHBondContact CB-O 3.5Å; T195-R199 WeakPolarHBondContact CG2-O 3.29Å; T195-R199 PolarHBondContact N-O 3.34Å; T195-R199 WeakPolarHBondContact OG1-CA 3.36Å; T195-R199 WeakPolarHBondContact OG1-CB 3.46Å; T195-R199 PolarHBondContact OG1-N 3.12Å; T195-R199 PolarHBondContact OG1-O 3.14Å; E197-R199 IonicContact OE2-CZ 3Å; E197-R199 IonicContact OE2-NE 3.5Å; E197-R199 PolarHBondContact OE2-NE 3.08Å; E197-R199 IonicContact OE2-NH2 2.96Å; E197-R199 PolarHBondContact OE2-NH2 2.95Å; R199-V213 HydrophobicContact CB-CG1 4.26Å; R199-L214 CarbonylContact C-O 3.52Å; R199-L214 VanDerWaalsContact CA-O 3.3Å; R199-L214 WeakPolarHBondContact CA-O 3.22Å; R199-I233 WeakPolarHBondContact O-CD1 3.5Å
200	V	91.9	Very high	89.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.9	169.4	177.5	0	0	0	0	108.3	A192 T193 V213 L214 I233 L236 M244 V246	A192-V200 HydrophobicContact CB-CG1 4.16Å; T193-V200 WeakPolarHBondContact O-CA 3.44Å; V200-V213 WeakPolarHBondContact O-CA 3.21Å; V200-L214 HydrophobicContact CB-CB 4.33Å; V200-L214 PolarHBondContact N-O 3.41Å; V200-L214 PolarHBondContact O-N 3.03Å; V200-I233 HydrophobicContact CB-CD1 4.48Å; V200-I233 HydrophobicContact CG2-CD1 3.49Å; V200-I233 VanDerWaalsContact CG2-CD1 3.49Å; V200-I233 HydrophobicContact CG2-CG1 4.4Å; V200-L236 HydrophobicContact CG1-CD1 3.74Å; V200-L236 HydrophobicContact CG2-CD1 4.2Å; V200-M244 HydrophobicContact CG1-CE 4.11Å; V200-M244 HydrophobicContact CG1-SD 4.15Å; V200-V246 HydrophobicContact CG2-CG1 3.97Å; V200-V246 HydrophobicContact CG2-CG2 3.89Å
201	E	91.9	Very high	89.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130	173.8	-60.7	-173.3	-172.8	0	0	110.3	T174 D175 A192 T193 T195 W203 V213	T174-E201 VanDerWaalsContact CA-OE2 3.24Å; T174-E201 WeakPolarHBondContact CA-OE2 3.39Å; T174-E201 WeakPolarHBondContact CB-OE2 3.47Å; T174-E201 WeakPolarHBondContact CG2-OE2 3.37Å; D175-E201 WeakPolarHBondContact CB-OE1 3.29Å; D175-E201 PolarHBondContact N-OE1 3.47Å; A192-E201 CarbonylContact C-O 3.5Å; A192-E201 VanDerWaalsContact CA-O 3.28Å; A192-E201 WeakPolarHBondContact CA-O 3.49Å; T193-E201 PolarHBondContact N-O 3.01Å; T193-E201 PolarHBondContact O-N 3.16Å; T193-E201 PolarHBondContact OG1-O 2.95Å; T195-E201 HydrophobicContact CG2-CG 4.43Å; E201-W203 PolarHBondContact OE2-NE1 3.44Å; E201-V213 HydrophobicContact CG-CG1 4.49Å; E201-V213 HydrophobicContact CG-CG2 4.27Å
202	C	92.4	Very high	89.2	Confident	13 Å²	13	50.6 Å²	50.6	9%	0.088	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.8	178.3	-69.2	0	0	0	0	110.2	L190 F191 V211 G212	L190-C202 HydrophobicContact CD1-CB 4.4Å; L190-C202 HydrophobicContact CD2-CB 3.88Å; L190-C202 HydrophobicContact CG-CB 4.24Å; F191-C202 CarbonylContact O-C 3.52Å; F191-C202 WeakPolarHBondContact O-CA 3.31Å; C202-V211 PolarHBondContact O-N 3.4Å; C202-G212 PolarHBondContact N-O 2.9Å; C202-G212 PolarHBondContact O-N 3.32Å
203	W	92.6	Very high	89.1	Confident	15 Å²	15	53.9 Å²	53.9	6%	0.057	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.7	-175.7	-68.9	81.1	0	0	0	110.3	L172 Q173 T174 L190 F191 E201 R210	L172-W203 HydrophobicContact CB-CD2 4.32Å; L172-W203 HydrophobicContact CB-CE3 4.13Å; L172-W203 HydrophobicContact CB-CH2 4.2Å; L172-W203 HydrophobicContact CB-CZ2 4.38Å; L172-W203 HydrophobicContact CB-CZ3 4.06Å; L172-W203 HydrophobicContact CD1-CB 4.22Å; L172-W203 HydrophobicContact CD1-CD2 3.97Å; L172-W203 HydrophobicContact CD1-CE3 3.92Å; L172-W203 HydrophobicContact CD1-CG 4.11Å; L172-W203 HydrophobicContact CD2-CE3 3.84Å; L172-W203 HydrophobicContact CD2-CZ3 3.91Å; L172-W203 HydrophobicContact CG-CE3 4.18Å; L172-W203 HydrophobicContact CG-CZ3 4.41Å; Q173-W203 VanDerWaalsContact O-CH2 3.24Å; Q173-W203 WeakPolarHBondContact O-CH2 3.48Å; Q173-W203 WeakPolarHBondContact O-CZ2 3.37Å; T174-W203 HydrophobicContact CG2-CZ2 4.28Å; L190-W203 WeakPolarHBondContact CD1-O 3.47Å; F191-W203 HydrophobicContact CB-CB 4.38Å; F191-W203 HydrophobicContact CD1-CB 4Å; F191-W203 HydrophobicContact CD1-CG 4.37Å; F191-W203 PolarHBondContact N-O 2.95Å; F191-W203 PolarHBondContact O-N 2.79Å; E201-W203 PolarHBondContact OE2-NE1 3.44Å; W203-R210 HydrophobicContact CD2-CB 4.05Å; W203-R210 HydrophobicContact CE3-CB 4.22Å; W203-R210 HydrophobicContact CH2-CB 4.03Å; W203-R210 HydrophobicContact CZ2-CB 3.84Å; W203-R210 HydrophobicContact CZ3-CB 4.22Å; W203-R210 VanDerWaalsContact CZ3-N 3.25Å
204	D	90.9	Very high	88.9	Confident	35 Å²	35	54.9 Å²	54.9	19%	0.187	27%	0.265	C	S	.	.			trans	-94.2	119.7	170.3	-177.2	-9.2	0	0	0	109.5	L190 R206 I207 R208 V211	L190-D204 HydrophobicContact CD1-CB 4.42Å; D204-R206 PolarHBondContact O-N 2.98Å; D204-R206 VanDerWaalsContact O-N 3.1Å; D204-R206 WeakPolarHBondContact OD1-CB 3.42Å; D204-R206 WeakPolarHBondContact OD1-CG 3.44Å; D204-R206 PolarHBondContact OD1-N 3.42Å; D204-I207 HydrophobicContact CB-CB 4.43Å; D204-I207 HydrophobicContact CB-CG1 4.47Å; D204-I207 PolarHBondContact O-N 3.32Å; D204-R208 PolarHBondContact O-N 2.8Å; D204-V211 HydrophobicContact CB-CG2 3.67Å
205	P	87.6	Confident	88.6	Confident	14 Å²	14	58.2 Å²	58.2	9%	0.091	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-29	175.7	-28.6	36.5	0	0	0	114.6	Y150 H189 R208	Y150-P205 WeakPolarHBondContact OH-CB 3.35Å; H189-P205 WeakPolarHBondContact O-CD 3.39Å; H189-P205 VanDerWaalsContact O-CG 3.31Å; H189-P205 WeakPolarHBondContact O-CG 3.4Å; P205-R208 WeakPolarHBondContact O-CG 3.44Å
206	R	87.6	Confident	88	Confident	201 Å²	201	58.3 Å²	58.3	76%	0.758	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-47.6	-176.8	-59.9	175	-177.8	-171.9	1.5	111.8	D204	D204-R206 PolarHBondContact O-N 2.98Å; D204-R206 VanDerWaalsContact O-N 3.1Å; D204-R206 WeakPolarHBondContact OD1-CB 3.42Å; D204-R206 WeakPolarHBondContact OD1-CG 3.44Å; D204-R206 PolarHBondContact OD1-N 3.42Å
207	I	84.9	Confident	87.3	Confident	104 Å²	104	57.3 Å²	57.3	53%	0.533	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-23.6	-176.4	-55.5	174.7	0	0	0	110.5	D204 N209	D204-I207 HydrophobicContact CB-CB 4.43Å; D204-I207 HydrophobicContact CB-CG1 4.47Å; D204-I207 PolarHBondContact O-N 3.32Å; I207-N209 HydrophobicContact CG2-CB 4.05Å; I207-N209 PolarHBondContact O-N 3.43Å
208	R	80.9	Confident	86.6	Confident	162 Å²	162	60.4 Å²	60.4	61%	0.611	30%	0.295	S	S	*	.			trans	59.7	12.1	-179	-50.1	177.6	-178.8	178.3	-1	114.1	D204 P205	D204-R208 PolarHBondContact O-N 2.8Å; P205-R208 WeakPolarHBondContact O-CG 3.44Å
209	N	85.2	Confident	85.8	Confident	105 Å²	105	62 Å²	62	56%	0.561	31%	0.306	S	S	*	.	S	Bend	trans	-111.8	155.6	172	-68.2	-20.1	0	0	0	108.8	I207	I207-N209 HydrophobicContact CG2-CB 4.05Å; I207-N209 PolarHBondContact O-N 3.43Å
210	R	87.7	Confident	84.5	Confident	124 Å²	124	59.1 Å²	59.1	47%	0.468	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	135	169.9	67.1	-173.5	-176.1	-175.2	4.4	110	D175 W203	D175-R210 IonicContact OD1-CZ 3.79Å; D175-R210 IonicContact OD1-NH1 2.97Å; D175-R210 PolarHBondContact OD1-NH1 2.91Å; D175-R210 IonicContact OD2-CZ 3.12Å; D175-R210 IonicContact OD2-NH1 2.99Å; D175-R210 PolarHBondContact OD2-NH1 3.28Å; W203-R210 HydrophobicContact CD2-CB 4.05Å; W203-R210 HydrophobicContact CE3-CB 4.22Å; W203-R210 HydrophobicContact CH2-CB 4.03Å; W203-R210 HydrophobicContact CZ2-CB 3.84Å; W203-R210 HydrophobicContact CZ3-CB 4.22Å; W203-R210 VanDerWaalsContact CZ3-N 3.25Å
211	V	88.3	Confident	83.2	Confident	95 Å²	95	63.7 Å²	63.7	58%	0.576	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	-39.9	179	179.1	0	0	0	0	110.4	L190 C202 D204	L190-V211 HydrophobicContact CD1-CG2 4.43Å; C202-V211 PolarHBondContact O-N 3.4Å; D204-V211 HydrophobicContact CB-CG2 3.67Å
212	G	86.8	Confident	81.8	Confident	31 Å²	31	67.4 Å²	67.4	32%	0.32	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	153.8	-178.2	0	0	0	0	0	112.4	C202	C202-G212 PolarHBondContact N-O 2.9Å; C202-G212 PolarHBondContact O-N 3.32Å
213	V	90.7	Very high	79.8	Confident	68 Å²	68	76.6 Å²	76.6	41%	0.412	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.4	172.3	-178	0	0	0	0	106.9	R199 V200 E201	R199-V213 HydrophobicContact CB-CG1 4.26Å; V200-V213 WeakPolarHBondContact O-CA 3.21Å; E201-V213 HydrophobicContact CG-CG1 4.49Å; E201-V213 HydrophobicContact CG-CG2 4.27Å
214	L	89.3	Confident	77.8	Confident	22 Å²	22	79.8 Å²	79.8	12%	0.115	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.2	176.9	-165.7	150.6	0	0	0	108.4	R199 V200 C216 M244 Y256	R199-L214 CarbonylContact C-O 3.52Å; R199-L214 VanDerWaalsContact CA-O 3.3Å; R199-L214 WeakPolarHBondContact CA-O 3.22Å; V200-L214 HydrophobicContact CB-CB 4.33Å; V200-L214 PolarHBondContact N-O 3.41Å; V200-L214 PolarHBondContact O-N 3.03Å; L214-C216 WeakPolarHBondContact CD2-SG 3.42Å; L214-M244 HydrophobicContact CD1-CE 4.34Å; L214-Y256 HydrophobicContact CD1-CD1 3.63Å; L214-Y256 HydrophobicContact CD1-CD2 4.45Å; L214-Y256 HydrophobicContact CD1-CE1 3.94Å; L214-Y256 HydrophobicContact CD1-CG 3.92Å; L214-Y256 HydrophobicContact CD2-CD1 4.06Å; L214-Y256 HydrophobicContact CD2-CD2 4.2Å; L214-Y256 HydrophobicContact CD2-CE1 3.56Å; L214-Y256 HydrophobicContact CD2-CE2 3.71Å; L214-Y256 HydrophobicContact CD2-CG 4.36Å; L214-Y256 HydrophobicContact CG-CD1 4.42Å; L214-Y256 HydrophobicContact CG-CE1 4.24Å
215	D	86.4	Confident	76.3	Confident	70 Å²	70	80.3 Å²	80.3	37%	0.374	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	103.6	177.3	-168.3	-5.8	0	0	0	109.8	A217	D215-A217 PolarHBondContact OD1-N 3.36Å
216	C	80.9	Confident	74.6	Confident	1 Å²	1	87.1 Å²	87.1	1%	0.007	46%	0.457	C	S	.	.			trans	-84	-24.4	179.2	-63	0	0	0	0	112	G198 L214 L218 S219 S220 L254	G198-C216 WeakPolarHBondContact O-CA 3.38Å; G198-C216 VanDerWaalsContact O-CB 3.23Å; G198-C216 WeakPolarHBondContact O-CB 3.17Å; G198-C216 PolarHBondContact O-N 2.74Å; L214-C216 WeakPolarHBondContact CD2-SG 3.42Å; C216-L218 VanDerWaalsContact C-N 3.34Å; C216-L218 PolarHBondContact O-N 2.98Å; C216-S219 PolarHBondContact O-N 3.21Å; C216-S219 VanDerWaalsContact O-N 3.08Å; C216-S220 PolarHBondContact O-N 2.83Å; C216-S220 VanDerWaalsContact O-N 3.1Å; C216-S220 PolarHBondContact O-OG 3.42Å; C216-L254 HydrophobicContact CB-CD1 3.68Å
217	A	73.4	Confident	73.2	Confident	11 Å²	11	82.1 Å²	82.1	9%	0.091	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-40.4	-169.5	0	0	0	0	0	112.4	G198 D215 S219 S220 L221 P231	G198-A217 PolarHBondContact O-N 2.92Å; D215-A217 PolarHBondContact OD1-N 3.36Å; A217-S219 VanDerWaalsContact C-N 3.3Å; A217-S219 PolarHBondContact O-N 3.12Å; A217-S220 WeakPolarHBondContact CA-OG 3.35Å; A217-S220 PolarHBondContact O-OG 3Å; A217-L221 WeakPolarHBondContact O-CD1 3.44Å; A217-P231 HydrophobicContact CB-CG 3.81Å
218	L	72.8	Confident	71.8	Confident	132 Å²	132	85 Å²	85	69%	0.691	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-33	176.7	-64.3	176.3	0	0	0	112.5	C216	C216-L218 VanDerWaalsContact C-N 3.34Å; C216-L218 PolarHBondContact O-N 2.98Å
219	S	69.3	Low	71	Confident	35 Å²	35	79.4 Å²	79.4	25%	0.245	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-19.7	-175.4	-60.5	0	0	0	0	113.3	C216 A217 Y256	C216-S219 PolarHBondContact O-N 3.21Å; C216-S219 VanDerWaalsContact O-N 3.08Å; A217-S219 VanDerWaalsContact C-N 3.3Å; A217-S219 PolarHBondContact O-N 3.12Å; S219-Y256 WeakPolarHBondContact CB-OH 3.26Å
220	S	62.6	Low	70.4	Confident	3 Å²	3	80.7 Å²	80.7	2%	0.021	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-16.2	174.5	39.9	0	0	0	0	114.6	C216 A217 T222 P231 Q252	C216-S220 PolarHBondContact O-N 2.83Å; C216-S220 VanDerWaalsContact O-N 3.1Å; C216-S220 PolarHBondContact O-OG 3.42Å; A217-S220 WeakPolarHBondContact CA-OG 3.35Å; A217-S220 PolarHBondContact O-OG 3Å; S220-T222 PolarHBondContact O-N 3.1Å; S220-P231 VanDerWaalsContact OG-CG 3.23Å; S220-P231 WeakPolarHBondContact OG-CG 3.47Å; S220-Q252 VanDerWaalsContact C-OE1 3.3Å; S220-Q252 VanDerWaalsContact O-CD 3.25Å; S220-Q252 PolarHBondContact O-NE2 2.94Å; S220-Q252 PolarHBondContact O-OE1 2.61Å
221	L	64.8	Low	70.1	Confident	97 Å²	97	75.1 Å²	75.1	51%	0.508	44%	0.437	S	S	.	.			trans	-78.3	87.2	177.2	-92.7	72.5	0	0	0	109.8	A217 V227	A217-L221 WeakPolarHBondContact O-CD1 3.44Å; L221-V227 HydrophobicContact CD2-CG2 3.87Å; L221-V227 HydrophobicContact CG-CG2 4.18Å
222	T	62.3	Low	70.1	Confident	77 Å²	77	71.9 Å²	71.9	47%	0.472	42%	0.419	S	S	.	.			trans	-81.9	144.3	168.4	-31.9	0	0	0	0	109	S220 G224 T225	S220-T222 PolarHBondContact O-N 3.1Å; T222-G224 PolarHBondContact O-N 2.95Å; T222-T225 PolarHBondContact O-N 2.75Å; T222-T225 PolarHBondContact O-OG1 3.18Å
223	E	50.5	Low	70.4	Confident	206 Å²	206	70.4 Å²	70.4	96%	0.963	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	102.1	177.5	-66.7	-179.9	174.2	0	0	110.5
224	G	51.2	Low	70.4	Confident	82 Å²	82	68.4 Å²	68.4	85%	0.845	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	128.3	-3.6	-179.4	0	0	0	0	0	116.4	T222	T222-G224 PolarHBondContact O-N 2.95Å
225	T	59.4	Low	70.6	Confident	47 Å²	47	67.6 Å²	67.6	29%	0.288	39%	0.389	S	S	.	.			trans	-91.6	119.3	174.1	26.5	0	0	0	0	111.8	T222 V227	T222-T225 PolarHBondContact O-N 2.75Å; T222-T225 PolarHBondContact O-OG1 3.18Å; T225-V227 PolarHBondContact O-N 2.94Å
226	E	52.9	Low	70.9	Confident	156 Å²	156	64.7 Å²	64.7	73%	0.729	37%	0.374	S	S	*	.			trans	-68	119.2	171.1	-67.4	-177.3	173.8	0	0	109.6	H228	E226-H228 PolarHBondContact O-CD2 3.34Å; E226-H228 PolarHBondContact O-N 3.42Å; E226-H228 IonicContact OE2-CE1 3.38Å; E226-H228 IonicContact OE2-NE2 3.23Å; E226-H228 PolarHBondContact OE2-NE2 3.18Å
227	V	56.8	Low	71.5	Confident	97 Å²	97	68 Å²	68	59%	0.588	39%	0.388	S	S	*	.			trans	-74.2	87.2	-178.9	-174.5	0	0	0	0	109.4	L221 T225 G229	L221-V227 HydrophobicContact CD2-CG2 3.87Å; L221-V227 HydrophobicContact CG-CG2 4.18Å; T225-V227 PolarHBondContact O-N 2.94Å; V227-G229 VanDerWaalsContact C-N 3.25Å
228	H	55	Low	72.4	Confident	165 Å²	165	68 Å²	68	76%	0.764	39%	0.386	S	S	*	.	S	Bend	trans	-80	-5.8	173.3	-74.8	-76.1	0	0	0	112.9	E226	E226-H228 PolarHBondContact O-CD2 3.34Å; E226-H228 PolarHBondContact O-N 3.42Å; E226-H228 IonicContact OE2-CE1 3.38Å; E226-H228 IonicContact OE2-NE2 3.23Å; E226-H228 PolarHBondContact OE2-NE2 3.18Å
229	G	64.3	Low	73.2	Confident	43 Å²	43	62.4 Å²	62.4	44%	0.443	36%	0.357	S	S	.	.	S	Bend	trans	174.6	174	175.3	0	0	0	0	0	112.9	V227	V227-G229 VanDerWaalsContact C-N 3.25Å
230	L	72.9	Confident	73.9	Confident	133 Å²	133	62 Å²	62	70%	0.696	36%	0.359	S	S	*	.			trans	-66.8	128.4	170.4	-74.8	167.9	0	0	0	109.3	S232	L230-S232 PolarHBondContact O-N 3.29Å
231	P	82.2	Confident	75	Confident	6 Å²	6	64.1 Å²	64.1	4%	0.039	37%	0.374	C	S	.	.			trans	-69.9	104.9	179.8	28	-34.1	0	0	0	110.1	G198 A217 S220 T248 T250	G198-P231 WeakPolarHBondContact CA-O 3.41Å; A217-P231 HydrophobicContact CB-CG 3.81Å; S220-P231 VanDerWaalsContact OG-CG 3.23Å; S220-P231 WeakPolarHBondContact OG-CG 3.47Å; P231-T248 HydrophobicContact CB-CG2 4.34Å; P231-T250 HydrophobicContact CB-CG2 4.02Å
232	S	88.8	Confident	76.2	Confident	27 Å²	27	61.7 Å²	61.7	19%	0.189	36%	0.361	C	S	.	.			trans	-77.4	149.6	174	61.7	0	0	0	0	111.4	S196 L230 T248 S249	S196-S232 VanDerWaalsContact O-CA 3.31Å; S196-S232 WeakPolarHBondContact O-CA 3.3Å; S196-S232 WeakPolarHBondContact O-CB 3.37Å; L230-S232 PolarHBondContact O-N 3.29Å; S232-T248 CarbonylContact O-C 3.2Å; S232-T248 VanDerWaalsContact O-CA 3.3Å; S232-T248 WeakPolarHBondContact O-CA 3.48Å; S232-S249 PolarHBondContact N-OG 2.8Å; S232-S249 VanDerWaalsContact N-OG 3.12Å; S232-S249 PolarHBondContact O-N 2.91Å; S232-S249 PolarHBondContact O-OG 3.47Å; S232-S249 WeakPolarHBondContact OG-CB 3.41Å; S232-S249 PolarHBondContact OG-OG 3.1Å
233	I	91.9	Very high	77.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	127	176.5	-65.5	149.2	0	0	0	109	N180 T195 G198 R199 V200 V246 G247	N180-I233 VanDerWaalsContact CB-O 3.25Å; N180-I233 WeakPolarHBondContact CB-O 3.34Å; N180-I233 PolarHBondContact ND2-O 3.35Å; T195-I233 PolarHBondContact O-N 3Å; G198-I233 VanDerWaalsContact C-CD1 3.45Å; R199-I233 WeakPolarHBondContact O-CD1 3.5Å; V200-I233 HydrophobicContact CB-CD1 4.48Å; V200-I233 HydrophobicContact CG2-CD1 3.49Å; V200-I233 VanDerWaalsContact CG2-CD1 3.49Å; V200-I233 HydrophobicContact CG2-CG1 4.4Å; I233-V246 HydrophobicContact CB-CG1 4.43Å; I233-V246 HydrophobicContact CD1-CG1 4.39Å; I233-V246 HydrophobicContact CG1-CG1 3.83Å; I233-V246 HydrophobicContact CG2-CG1 3.76Å; I233-G247 WeakPolarHBondContact CA-O 3.4Å
234	S	91.4	Very high	79.6	Confident	27 Å²	27	49.2 Å²	49.2	19%	0.189	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-18.3	-175.1	63.7	0	0	0	0	114.2	V181 G247 T248 I275	V181-S234 VanDerWaalsContact CG2-C 3.48Å; V181-S234 WeakPolarHBondContact CG2-O 3.48Å; S234-G247 PolarHBondContact N-O 3.19Å; S234-G247 PolarHBondContact OG-O 2.82Å; S234-T248 PolarHBondContact OG-O 3.44Å; S234-I275 VanDerWaalsContact CB-O 3.29Å; S234-I275 WeakPolarHBondContact CB-O 3.43Å; S234-I275 PolarHBondContact OG-O 3.15Å
235	A	91.9	Very high	81.6	Confident	4 Å²	4	45.3 Å²	45.3	3%	0.033	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	145.6	175.3	0	0	0	0	0	110.3	G247 I275 L278	A235-G247 PolarHBondContact N-O 3.45Å; A235-G247 PolarHBondContact O-N 3.32Å; A235-I275 HydrophobicContact CB-CG2 3.99Å; A235-L278 HydrophobicContact CB-CB 4.47Å; A235-L278 HydrophobicContact CB-CD1 3.81Å; A235-L278 HydrophobicContact CB-CG 3.88Å
236	L	93.6	Very high	83.2	Confident	10 Å²	10	43 Å²	43	5%	0.052	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	131.5	176.7	-168.7	153.5	0	0	0	108.6	V181 D183 A192 V200 F238 M244 A245	V181-L236 HydrophobicContact CG1-CB 3.9Å; D183-L236 HydrophobicContact CB-CD2 3.49Å; D183-L236 VanDerWaalsContact CB-CD2 3.49Å; A192-L236 HydrophobicContact CB-CD1 3.89Å; A192-L236 HydrophobicContact CB-CD2 4.05Å; V200-L236 HydrophobicContact CG1-CD1 3.74Å; V200-L236 HydrophobicContact CG2-CD1 4.2Å; L236-F238 HydrophobicContact CD2-CD2 4.14Å; L236-F238 HydrophobicContact CD2-CE2 3.83Å; L236-F238 HydrophobicContact CD2-CZ 4.3Å; L236-M244 HydrophobicContact CD1-SD 4.38Å; L236-M244 HydrophobicContact CD2-CG 4.49Å; L236-M244 HydrophobicContact CD2-SD 4.46Å; L236-M244 HydrophobicContact CG-SD 4.49Å; L236-A245 WeakPolarHBondContact CA-O 3.43Å
237	K	93.6	Very high	85.1	Confident	69 Å²	69	35.6 Å²	35.6	30%	0.3	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	138.5	174.2	-157.1	76.4	-160.6	143.5	0	111.8	D183 A245 L278 F280	D183-K237 VanDerWaalsContact CG-NZ 3.3Å; D183-K237 IonicContact OD1-NZ 2.64Å; D183-K237 PolarHBondContact OD1-NZ 2.71Å; D183-K237 WeakPolarHBondContact OD2-CA 3.49Å; D183-K237 WeakPolarHBondContact OD2-CD 3.45Å; D183-K237 WeakPolarHBondContact OD2-CE 3.37Å; D183-K237 IonicContact OD2-NZ 2.73Å; D183-K237 PolarHBondContact OD2-NZ 2.96Å; K237-A245 PolarHBondContact N-O 2.87Å; K237-A245 PolarHBondContact O-N 3.21Å; K237-L278 HydrophobicContact CB-CB 4.13Å; K237-L278 WeakPolarHBondContact CB-O 3.3Å; K237-L278 WeakPolarHBondContact CG-O 3.34Å; K237-F280 HydrophobicContact CB-CD2 4.18Å; K237-F280 HydrophobicContact CB-CE2 3.97Å; K237-F280 HydrophobicContact CG-CD2 4.01Å; K237-F280 HydrophobicContact CG-CE2 4.28Å; K237-F280 WeakPolarHBondContact O-CE2 3.46Å
238	F	92.8	Very high	86.8	Confident	11 Å²	11	31 Å²	31	5%	0.048	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	143.6	169	-72.2	-71.3	0	0	0	112.1	D183 N185 A192 L236 M244 L258	D183-F238 HydrophobicContact CB-CD2 4.13Å; D183-F238 HydrophobicContact CB-CE2 4.45Å; D183-F238 PolarHBondContact OD2-N 3.09Å; D183-F238 VanDerWaalsContact OD2-N 3.1Å; N185-F238 HydrophobicContact CB-CB 4.25Å; N185-F238 HydrophobicContact CB-CD1 4.29Å; N185-F238 HydrophobicContact CB-CD2 3.96Å; N185-F238 HydrophobicContact CB-CE2 4.36Å; N185-F238 HydrophobicContact CB-CG 3.9Å; A192-F238 HydrophobicContact CB-CE2 3.63Å; A192-F238 HydrophobicContact CB-CZ 3.5Å; L236-F238 HydrophobicContact CD2-CD2 4.14Å; L236-F238 HydrophobicContact CD2-CE2 3.83Å; L236-F238 HydrophobicContact CD2-CZ 4.3Å; F238-M244 HydrophobicContact CD1-CB 3.85Å; F238-M244 HydrophobicContact CD1-CG 3.92Å; F238-M244 HydrophobicContact CD1-SD 4.38Å; F238-M244 HydrophobicContact CE1-CB 3.77Å; F238-M244 HydrophobicContact CE1-CG 3.62Å; F238-M244 HydrophobicContact CE1-SD 3.49Å; F238-M244 WeakPolarHBondContact CE1-SD 3.18Å; F238-M244 HydrophobicContact CZ-CG 4.23Å; F238-M244 HydrophobicContact CZ-SD 3.69Å; F238-L258 HydrophobicContact CD1-CD1 4.18Å; F238-L258 HydrophobicContact CE1-CD1 3.91Å; F238-L258 HydrophobicContact CE1-CD2 4.45Å; F238-L258 HydrophobicContact CE1-CG 4.44Å
239	N	88.6	Confident	88.4	Confident	15 Å²	15	24.7 Å²	24.7	8%	0.08	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119.5	165	178.9	-9.8	0	0	0	109.4	T243 F280 D282	N239-T243 PolarHBondContact N-O 3.22Å; N239-T243 PolarHBondContact O-N 3.06Å; N239-T243 VanDerWaalsContact O-O 3.12Å; N239-T243 PolarHBondContact O-OG1 3.48Å; N239-F280 HydrophobicContact CB-CB 3.96Å; N239-F280 HydrophobicContact CB-CD1 3.56Å; N239-F280 HydrophobicContact CB-CD2 3.59Å; N239-F280 HydrophobicContact CB-CE1 3.73Å; N239-F280 HydrophobicContact CB-CE2 3.77Å; N239-F280 HydrophobicContact CB-CG 3.45Å; N239-F280 VanDerWaalsContact CB-CG 3.45Å; N239-F280 HydrophobicContact CB-CZ 3.81Å; N239-F280 VanDerWaalsContact ND2-CD1 3.26Å; N239-F280 WeakPolarHBondContact ND2-CD1 3.22Å; N239-D282 PolarHBondContact OD1-OD1 2.81Å
240	G	85.1	Confident	89.5	Confident	28 Å²	28	24.8 Å²	24.8	29%	0.289	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	-142.3	178.9	0	0	0	0	0	112.3	N185	N185-G240 PolarHBondContact ND2-O 2.96Å; N185-G240 VanDerWaalsContact ND2-O 3.14Å; N185-G240 PolarHBondContact OD1-O 3.32Å
241	S	84.9	Confident	90.2	Very high	47 Å²	47	18.5 Å²	18.5	33%	0.329	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-39.8	-175	42.8	0	0	0	0	114.1	N185 H188 L258	N185-S241 PolarHBondContact ND2-O 3.1Å; H188-S241 PolarHBondContact CD2-O 2.76Å; H188-S241 VanDerWaalsContact CD2-O 3.23Å; H188-S241 WeakPolarHBondContact NE2-CB 3.42Å; S241-L258 WeakPolarHBondContact O-CD1 3.24Å
242	L	89.8	Confident	90.6	Very high	46 Å²	46	18.3 Å²	18.3	24%	0.241	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-23.3	-160.6	-67.6	168.6	0	0	0	114.5	D257 L258 R259	L242-D257 CarbonylContact O-C 3.55Å; L242-D257 WeakPolarHBondContact O-CA 3.39Å; L242-L258 WeakPolarHBondContact O-CD1 3.49Å; L242-L258 PolarHBondContact O-N 2.99Å; L242-R259 HydrophobicContact CD2-CG 4.21Å; L242-R259 VanDerWaalsContact CD2-NE 3.34Å
243	T	91.9	Very high	90.7	Very high	17 Å²	17	17 Å²	17	10%	0.104	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	136.2	-169.9	48.6	0	0	0	0	111.9	N239 Y256 K300	N239-T243 PolarHBondContact N-O 3.22Å; N239-T243 PolarHBondContact O-N 3.06Å; N239-T243 VanDerWaalsContact O-O 3.12Å; N239-T243 PolarHBondContact O-OG1 3.48Å; T243-Y256 WeakPolarHBondContact CA-O 3.44Å; T243-K300 VanDerWaalsContact CG2-CE 3.43Å; T243-K300 WeakPolarHBondContact OG1-CE 2.98Å; T243-K300 PolarHBondContact OG1-NZ 3.17Å
244	M	92.3	Very high	90.7	Very high	3 Å²	3	17 Å²	17	2%	0.015	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	129.5	-178.1	-177	177.2	66.8	0	0	108.6	V200 L214 L236 F238 V246 Y256	V200-M244 HydrophobicContact CG1-CE 4.11Å; V200-M244 HydrophobicContact CG1-SD 4.15Å; L214-M244 HydrophobicContact CD1-CE 4.34Å; L236-M244 HydrophobicContact CD1-SD 4.38Å; L236-M244 HydrophobicContact CD2-CG 4.49Å; L236-M244 HydrophobicContact CD2-SD 4.46Å; L236-M244 HydrophobicContact CG-SD 4.49Å; F238-M244 HydrophobicContact CD1-CB 3.85Å; F238-M244 HydrophobicContact CD1-CG 3.92Å; F238-M244 HydrophobicContact CD1-SD 4.38Å; F238-M244 HydrophobicContact CE1-CB 3.77Å; F238-M244 HydrophobicContact CE1-CG 3.62Å; F238-M244 HydrophobicContact CE1-SD 3.49Å; F238-M244 WeakPolarHBondContact CE1-SD 3.18Å; F238-M244 HydrophobicContact CZ-CG 4.23Å; F238-M244 HydrophobicContact CZ-SD 3.69Å; M244-V246 HydrophobicContact CE-CG2 3.87Å; M244-V246 HydrophobicContact CG-CG2 4.24Å; M244-V246 HydrophobicContact SD-CG2 4.41Å; M244-Y256 HydrophobicContact CE-CD2 4.46Å; M244-Y256 PolarHBondContact N-O 2.99Å; M244-Y256 PolarHBondContact O-N 2.66Å
245	A	93.4	Very high	90.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.9	169.3	0	0	0	0	0	109.7	L236 K237 V253 L254 L278 F280	L236-A245 WeakPolarHBondContact CA-O 3.43Å; K237-A245 PolarHBondContact N-O 2.87Å; K237-A245 PolarHBondContact O-N 3.21Å; A245-V253 HydrophobicContact CB-CG1 4.47Å; A245-L254 WeakPolarHBondContact CA-O 3.34Å; A245-L278 HydrophobicContact CB-CD1 4.01Å; A245-F280 HydrophobicContact CB-CE1 4.4Å; A245-F280 HydrophobicContact CB-CE2 3.71Å; A245-F280 HydrophobicContact CB-CZ 3.39Å
246	V	93.1	Very high	90.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.8	178.3	-176.5	0	0	0	0	107.9	V200 I233 M244 V253 L254 Y256	V200-V246 HydrophobicContact CG2-CG1 3.97Å; V200-V246 HydrophobicContact CG2-CG2 3.89Å; I233-V246 HydrophobicContact CB-CG1 4.43Å; I233-V246 HydrophobicContact CD1-CG1 4.39Å; I233-V246 HydrophobicContact CG1-CG1 3.83Å; I233-V246 HydrophobicContact CG2-CG1 3.76Å; M244-V246 HydrophobicContact CE-CG2 3.87Å; M244-V246 HydrophobicContact CG-CG2 4.24Å; M244-V246 HydrophobicContact SD-CG2 4.41Å; V246-V253 WeakPolarHBondContact O-CA 3.34Å; V246-L254 HydrophobicContact CB-CB 4.41Å; V246-L254 PolarHBondContact N-O 3.1Å; V246-L254 PolarHBondContact O-N 2.76Å; V246-Y256 HydrophobicContact CB-CD2 4.49Å; V246-Y256 HydrophobicContact CB-CE2 4.48Å; V246-Y256 HydrophobicContact CG2-CD2 3.96Å; V246-Y256 HydrophobicContact CG2-CE2 4.28Å
247	G	93.1	Very high	90.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	132.6	174.7	0	0	0	0	0	110.4	I233 S234 A235	I233-G247 WeakPolarHBondContact CA-O 3.4Å; S234-G247 PolarHBondContact N-O 3.19Å; S234-G247 PolarHBondContact OG-O 2.82Å; A235-G247 PolarHBondContact N-O 3.45Å; A235-G247 PolarHBondContact O-N 3.32Å
248	T	91.1	Very high	90.4	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.006	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	159.4	173.9	65.9	0	0	0	0	111.5	P231 S232 S234 T250 G251 Q252 L254 I275	P231-T248 HydrophobicContact CB-CG2 4.34Å; S232-T248 CarbonylContact O-C 3.2Å; S232-T248 VanDerWaalsContact O-CA 3.3Å; S232-T248 WeakPolarHBondContact O-CA 3.48Å; S234-T248 PolarHBondContact OG-O 3.44Å; T248-T250 PolarHBondContact O-N 3.32Å; T248-T250 PolarHBondContact OG1-OG1 2.85Å; T248-G251 PolarHBondContact O-N 3.48Å; T248-Q252 PolarHBondContact N-O 2.87Å; T248-Q252 PolarHBondContact OG1-N 3.37Å; T248-Q252 VanDerWaalsContact OG1-N 3.14Å; T248-Q252 PolarHBondContact OG1-O 3.1Å; T248-L254 HydrophobicContact CG2-CD1 4.08Å; T248-I275 PolarHBondContact O-N 2.79Å
249	S	90.2	Very high	90.3	Very high	32 Å²	32	25.1 Å²	25.1	22%	0.224	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-18.8	172	51.9	0	0	0	0	113.6	S232 G251 L273 P274	S232-S249 PolarHBondContact N-OG 2.8Å; S232-S249 VanDerWaalsContact N-OG 3.12Å; S232-S249 PolarHBondContact O-N 2.91Å; S232-S249 PolarHBondContact O-OG 3.47Å; S232-S249 WeakPolarHBondContact OG-CB 3.41Å; S232-S249 PolarHBondContact OG-OG 3.1Å; S249-G251 PolarHBondContact O-N 3.05Å; S249-L273 CarbonylContact O-C 3.36Å; S249-P274 VanDerWaalsContact O-CA 3.25Å; S249-P274 WeakPolarHBondContact O-CA 3.46Å
250	T	87.4	Confident	90.2	Very high	45 Å²	45	26.3 Å²	26.3	28%	0.276	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-2.7	174.5	55.4	0	0	0	0	113.4	P231 T248 N272	P231-T250 HydrophobicContact CB-CG2 4.02Å; T248-T250 PolarHBondContact O-N 3.32Å; T248-T250 PolarHBondContact OG1-OG1 2.85Å; T250-N272 WeakPolarHBondContact O-CA 3.33Å
251	G	87.2	Confident	90.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	89.8	17.2	177.6	0	0	0	0	0	114.6	T248 S249 H269 L273	T248-G251 PolarHBondContact O-N 3.48Å; S249-G251 PolarHBondContact O-N 3.05Å; G251-H269 WeakPolarHBondContact O-CB 3.11Å; G251-H269 PolarHBondContact O-N 3.05Å; G251-L273 WeakPolarHBondContact CA-O 3.43Å; G251-L273 PolarHBondContact N-O 3.36Å
252	Q	89.7	Confident	90.3	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.009	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	134.1	177.7	-62.1	174.8	-5	0	0	111.7	S220 T248 K267 D268 I275	S220-Q252 VanDerWaalsContact C-OE1 3.3Å; S220-Q252 VanDerWaalsContact O-CD 3.25Å; S220-Q252 PolarHBondContact O-NE2 2.94Å; S220-Q252 PolarHBondContact O-OE1 2.61Å; T248-Q252 PolarHBondContact N-O 2.87Å; T248-Q252 PolarHBondContact OG1-N 3.37Å; T248-Q252 VanDerWaalsContact OG1-N 3.14Å; T248-Q252 PolarHBondContact OG1-O 3.1Å; Q252-K267 CarbonylContact C-O 3.55Å; Q252-K267 WeakPolarHBondContact CA-O 3.37Å; Q252-D268 HydrophobicContact CG-CB 4.25Å; Q252-I275 WeakPolarHBondContact O-CD1 3.44Å
253	V	92.5	Very high	90.3	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119	173.3	-168.5	0	0	0	0	108.2	A245 V246 K267 I275 L278 W298	A245-V253 HydrophobicContact CB-CG1 4.47Å; V246-V253 WeakPolarHBondContact O-CA 3.34Å; V253-K267 PolarHBondContact N-O 3.18Å; V253-K267 PolarHBondContact O-N 3.05Å; V253-I275 HydrophobicContact CB-CD1 4.31Å; V253-I275 HydrophobicContact CG2-CD1 3.44Å; V253-I275 VanDerWaalsContact CG2-CD1 3.44Å; V253-I275 HydrophobicContact CG2-CG1 4.23Å; V253-L278 HydrophobicContact CG1-CD1 4.33Å; V253-L278 HydrophobicContact CG1-CD2 3.75Å; V253-L278 HydrophobicContact CG2-CD2 4.04Å; V253-W298 HydrophobicContact CB-CZ2 4.19Å; V253-W298 HydrophobicContact CG1-CZ2 3.87Å
254	L	91.9	Very high	90.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	121.6	176.2	-57.7	168	0	0	0	108.6	C216 A245 V246 T248 Y256 V266	C216-L254 HydrophobicContact CB-CD1 3.68Å; A245-L254 WeakPolarHBondContact CA-O 3.34Å; V246-L254 HydrophobicContact CB-CB 4.41Å; V246-L254 PolarHBondContact N-O 3.1Å; V246-L254 PolarHBondContact O-N 2.76Å; T248-L254 HydrophobicContact CG2-CD1 4.08Å; L254-Y256 HydrophobicContact CB-CD2 4.11Å; L254-Y256 HydrophobicContact CB-CE2 3.47Å; L254-Y256 VanDerWaalsContact CB-CE2 3.47Å; L254-Y256 HydrophobicContact CD1-CE2 4.1Å; L254-Y256 HydrophobicContact CG-CE2 4.38Å; L254-V266 HydrophobicContact CD2-CB 3.98Å; L254-V266 HydrophobicContact CD2-CG1 3.65Å; L254-V266 HydrophobicContact CD2-CG2 3.46Å; L254-V266 VanDerWaalsContact CD2-CG2 3.46Å
255	L	93	Very high	90	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.5	172.7	-165.9	118.1	0	0	0	109.8	P263 L264 L265 F280 I287 W298 K300	L255-P263 CarbonylContact O-C 3.39Å; L255-P263 WeakPolarHBondContact O-CA 3.15Å; L255-L264 HydrophobicContact CD2-CB 3.88Å; L255-L264 HydrophobicContact CD2-CD1 3.74Å; L255-L264 HydrophobicContact CD2-CG 4.4Å; L255-L264 PolarHBondContact O-N 3.43Å; L255-L265 HydrophobicContact CB-CB 4.17Å; L255-L265 PolarHBondContact N-O 3.12Å; L255-F280 HydrophobicContact CD1-CE1 4.19Å; L255-F280 HydrophobicContact CD1-CZ 4.5Å; L255-I287 HydrophobicContact CD1-CD1 3.19Å; L255-W298 HydrophobicContact CD1-CH2 4.25Å; L255-K300 HydrophobicContact CD1-CG 3.91Å; L255-K300 HydrophobicContact CD2-CG 4.23Å
256	Y	91.8	Very high	89.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	146.5	178.1	-72.1	-80.2	0	0	0	111.2	L214 S219 T243 M244 V246 L254 P263	L214-Y256 HydrophobicContact CD1-CD1 3.63Å; L214-Y256 HydrophobicContact CD1-CD2 4.45Å; L214-Y256 HydrophobicContact CD1-CE1 3.94Å; L214-Y256 HydrophobicContact CD1-CG 3.92Å; L214-Y256 HydrophobicContact CD2-CD1 4.06Å; L214-Y256 HydrophobicContact CD2-CD2 4.2Å; L214-Y256 HydrophobicContact CD2-CE1 3.56Å; L214-Y256 HydrophobicContact CD2-CE2 3.71Å; L214-Y256 HydrophobicContact CD2-CG 4.36Å; L214-Y256 HydrophobicContact CG-CD1 4.42Å; L214-Y256 HydrophobicContact CG-CE1 4.24Å; S219-Y256 WeakPolarHBondContact CB-OH 3.26Å; T243-Y256 WeakPolarHBondContact CA-O 3.44Å; M244-Y256 HydrophobicContact CE-CD2 4.46Å; M244-Y256 PolarHBondContact N-O 2.99Å; M244-Y256 PolarHBondContact O-N 2.66Å; V246-Y256 HydrophobicContact CB-CD2 4.49Å; V246-Y256 HydrophobicContact CB-CE2 4.48Å; V246-Y256 HydrophobicContact CG2-CD2 3.96Å; V246-Y256 HydrophobicContact CG2-CE2 4.28Å; L254-Y256 HydrophobicContact CB-CD2 4.11Å; L254-Y256 HydrophobicContact CB-CE2 3.47Å; L254-Y256 VanDerWaalsContact CB-CE2 3.47Å; L254-Y256 HydrophobicContact CD1-CE2 4.1Å; L254-Y256 HydrophobicContact CG-CE2 4.38Å; Y256-P263 HydrophobicContact CD1-CB 4.19Å; Y256-P263 VanDerWaalsContact CE1-CA 3.45Å; Y256-P263 HydrophobicContact CE1-CB 3.72Å; Y256-P263 HydrophobicContact CE1-CG 4.28Å; Y256-P263 HydrophobicContact CE2-CB 4.45Å
257	D	91.1	Very high	89.7	Confident	33 Å²	33	46.1 Å²	46.1	18%	0.176	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.7	153.9	-176.3	-18.3	0	0	0	107.3	L242 R259 S260 L264	L242-D257 CarbonylContact O-C 3.55Å; L242-D257 WeakPolarHBondContact O-CA 3.39Å; D257-R259 PolarHBondContact O-N 2.82Å; D257-R259 PolarHBondContact OD1-N 3.5Å; D257-R259 VanDerWaalsContact OD1-N 3.11Å; D257-S260 PolarHBondContact O-N 3.37Å; D257-S260 PolarHBondContact O-OG 3.32Å; D257-S260 VanDerWaalsContact O-OG 3.12Å; D257-L264 HydrophobicContact CB-CD1 3.88Å; D257-L264 HydrophobicContact CB-CG 4.42Å
258	L	88.5	Confident	89.5	Confident	62 Å²	62	47.6 Å²	47.6	33%	0.325	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-23.4	177.8	-90.8	132.8	0	0	0	113.7	L190 F238 S241 L242	L190-L258 HydrophobicContact CD2-CD2 3.37Å; F238-L258 HydrophobicContact CD1-CD1 4.18Å; F238-L258 HydrophobicContact CE1-CD1 3.91Å; F238-L258 HydrophobicContact CE1-CD2 4.45Å; F238-L258 HydrophobicContact CE1-CG 4.44Å; S241-L258 WeakPolarHBondContact O-CD1 3.24Å; L242-L258 WeakPolarHBondContact O-CD1 3.49Å; L242-L258 PolarHBondContact O-N 2.99Å
259	R	89.5	Confident	89.3	Confident	194 Å²	194	47.6 Å²	47.6	73%	0.732	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-22.2	178.4	-63.1	169.2	178.2	168	0.2	113.8	L242 D257	L242-R259 HydrophobicContact CD2-CG 4.21Å; L242-R259 VanDerWaalsContact CD2-NE 3.34Å; D257-R259 PolarHBondContact O-N 2.82Å; D257-R259 PolarHBondContact OD1-N 3.5Å; D257-R259 VanDerWaalsContact OD1-N 3.11Å
260	S	86.7	Confident	89.2	Confident	40 Å²	40	53.6 Å²	53.6	28%	0.28	26%	0.263	S	S	.	.			trans	-116.4	135.1	-172.8	59.1	0	0	0	0	111.5	D257 R262	D257-S260 PolarHBondContact O-N 3.37Å; D257-S260 PolarHBondContact O-OG 3.32Å; D257-S260 VanDerWaalsContact O-OG 3.12Å; S260-R262 VanDerWaalsContact C-N 3.28Å; S260-R262 PolarHBondContact O-N 2.79Å; S260-R262 PolarHBondContact OG-O 3.18Å
261	S	85.8	Confident	89.1	Confident	95 Å²	95	56.6 Å²	56.6	66%	0.664	27%	0.27	S	S	*	.	S	Bend	trans	-77.4	-12.5	174.1	55.2	0	0	0	0	113.9
262	R	86.9	Confident	89.1	Confident	198 Å²	198	61.7 Å²	61.7	75%	0.747	30%	0.297	S	S	*	.	S	Bend	trans	-96.4	143.6	177.4	-66	-177.9	177.7	167.6	-1.1	110	S260	S260-R262 VanDerWaalsContact C-N 3.28Å; S260-R262 PolarHBondContact O-N 2.79Å; S260-R262 PolarHBondContact OG-O 3.18Å
263	P	89.4	Confident	89.1	Confident	32 Å²	32	64 Å²	64	21%	0.208	31%	0.309	C	S	.	.			trans	-67.4	143.3	174.4	30.7	-36.8	0	0	0	109.8	L255 Y256 V266	L255-P263 CarbonylContact O-C 3.39Å; L255-P263 WeakPolarHBondContact O-CA 3.15Å; Y256-P263 HydrophobicContact CD1-CB 4.19Å; Y256-P263 VanDerWaalsContact CE1-CA 3.45Å; Y256-P263 HydrophobicContact CE1-CB 3.72Å; Y256-P263 HydrophobicContact CE1-CG 4.28Å; Y256-P263 HydrophobicContact CE2-CB 4.45Å; P263-V266 HydrophobicContact CB-CG2 4.02Å; P263-V266 HydrophobicContact CG-CG2 3.74Å
264	L	88.4	Confident	89	Confident	108 Å²	108	66.5 Å²	66.5	57%	0.565	33%	0.326	S	S	*	.	S	Bend	trans	-74	-41	169.6	-68.8	174.7	0	0	0	110.8	L255 D257	L255-L264 HydrophobicContact CD2-CB 3.88Å; L255-L264 HydrophobicContact CD2-CD1 3.74Å; L255-L264 HydrophobicContact CD2-CG 4.4Å; L255-L264 PolarHBondContact O-N 3.43Å; D257-L264 HydrophobicContact CB-CD1 3.88Å; D257-L264 HydrophobicContact CB-CG 4.42Å
265	L	89.6	Confident	89.1	Confident	43 Å²	43	66.5 Å²	66.5	23%	0.225	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	136	179.8	-166.3	85.9	0	0	0	110.1	L255 K267 W298 G303	L255-L265 HydrophobicContact CB-CB 4.17Å; L255-L265 PolarHBondContact N-O 3.12Å; L265-K267 HydrophobicContact CD2-CB 4.43Å; L265-W298 HydrophobicContact CD2-CE3 3.85Å; L265-W298 HydrophobicContact CD2-CH2 3.79Å; L265-W298 HydrophobicContact CD2-CZ3 3.2Å; L265-G303 VanDerWaalsContact CD2-CA 3.46Å
266	V	90.3	Very high	89.1	Confident	55 Å²	55	69.8 Å²	69.8	33%	0.333	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.9	168.6	-178.5	0	0	0	0	107.5	L254 P263	L254-V266 HydrophobicContact CD2-CB 3.98Å; L254-V266 HydrophobicContact CD2-CG1 3.65Å; L254-V266 HydrophobicContact CD2-CG2 3.46Å; L254-V266 VanDerWaalsContact CD2-CG2 3.46Å; P263-V266 HydrophobicContact CB-CG2 4.02Å; P263-V266 HydrophobicContact CG-CG2 3.74Å
267	K	89.3	Confident	89.1	Confident	26 Å²	26	70.3 Å²	70.3	11%	0.113	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	125	179.4	-172.2	167.1	-174.3	150.5	0	111.4	Q252 V253 L265 W298 G303	Q252-K267 CarbonylContact C-O 3.55Å; Q252-K267 WeakPolarHBondContact CA-O 3.37Å; V253-K267 PolarHBondContact N-O 3.18Å; V253-K267 PolarHBondContact O-N 3.05Å; L265-K267 HydrophobicContact CD2-CB 4.43Å; K267-W298 HydrophobicContact CB-CZ2 4.39Å; K267-W298 HydrophobicContact CD-CB 4.28Å; K267-W298 HydrophobicContact CD-CD2 3.45Å; K267-W298 VanDerWaalsContact CD-CD2 3.45Å; K267-W298 HydrophobicContact CD-CE3 3.99Å; K267-W298 HydrophobicContact CD-CG 3.57Å; K267-W298 HydrophobicContact CD-CZ2 4.19Å; K267-G303 PolarHBondContact NZ-O 3.44Å
268	D	88.6	Confident	89.3	Confident	30 Å²	30	69.1 Å²	69.1	16%	0.16	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	141.4	-179.7	-159.1	-15.6	0	0	0	112.2	Q252 F270 K296	Q252-D268 HydrophobicContact CG-CB 4.25Å; D268-F270 HydrophobicContact CB-CD1 4.17Å; D268-F270 HydrophobicContact CB-CE1 4.03Å; D268-F270 HydrophobicContact CB-CZ 4.37Å; D268-F270 PolarHBondContact OD1-N 2.73Å; D268-K296 PolarHBondContact O-NZ 3.42Å
269	H	88.5	Confident	89.5	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	33%	0.33	C	S	.	.			trans	-83.9	-19.8	169.9	-81.2	-122.9	0	0	0	113.9	G251 Y271 S289 D291 K296	G251-H269 WeakPolarHBondContact O-CB 3.11Å; G251-H269 PolarHBondContact O-N 3.05Å; H269-Y271 WeakPolarHBondContact O-CD2 3.28Å; H269-Y271 PolarHBondContact O-N 2.96Å; H269-S289 PolarHBondContact CE1-O 3.06Å; H269-S289 PolarHBondContact CE1-OG 3.07Å; H269-S289 VanDerWaalsContact CE1-OG 3.28Å; H269-S289 VanDerWaalsContact NE2-CB 3.35Å; H269-S289 WeakPolarHBondContact NE2-CB 3.45Å; H269-S289 PolarHBondContact NE2-OG 3.3Å; H269-D291 WeakPolarHBondContact CB-OD2 3.35Å; H269-D291 IonicContact CE1-OD1 2.7Å; H269-D291 IonicContact CE1-OD2 3.85Å; H269-D291 IonicContact CG-OD1 3.72Å; H269-D291 IonicContact CG-OD2 3.83Å; H269-D291 IonicContact ND1-OD1 3.34Å; H269-D291 PolarHBondContact ND1-OD1 3.34Å; H269-D291 IonicContact ND1-OD2 2.74Å; H269-D291 PolarHBondContact ND1-OD2 3.08Å; H269-K296 VanDerWaalsContact CA-NZ 3.35Å; H269-K296 PolarHBondContact O-NZ 3.47Å; H269-K296 VanDerWaalsContact O-NZ 3.07Å
270	F	87.7	Confident	89.6	Confident	159 Å²	159	59.7 Å²	59.7	70%	0.697	30%	0.301	S	S	*	.	S	Bend	trans	69.3	-6	-179.7	-54	-68	0	0	0	116.3	D268	D268-F270 HydrophobicContact CB-CD1 4.17Å; D268-F270 HydrophobicContact CB-CE1 4.03Å; D268-F270 HydrophobicContact CB-CZ 4.37Å; D268-F270 PolarHBondContact OD1-N 2.73Å
271	Y	85.6	Confident	89.7	Confident	108 Å²	108	58 Å²	58	42%	0.424	29%	0.289	S	S	.	.	S	Bend	trans	-86.6	-6.3	178.6	-72	-71	0	0	0	113.8	H269 L273 I294	H269-Y271 WeakPolarHBondContact O-CD2 3.28Å; H269-Y271 PolarHBondContact O-N 2.96Å; Y271-L273 PolarHBondContact O-N 3.46Å; Y271-L273 VanDerWaalsContact O-N 3.14Å; Y271-I294 HydrophobicContact CD2-CG2 3.88Å; Y271-I294 HydrophobicContact CE2-CB 4.25Å; Y271-I294 HydrophobicContact CE2-CD1 4.15Å; Y271-I294 HydrophobicContact CE2-CG2 3.85Å
272	N	85.8	Confident	89.5	Confident	106 Å²	106	58.8 Å²	58.8	57%	0.567	29%	0.285	S	S	*	.			trans	51.8	31.3	-174.7	-60.3	-23.8	0	0	0	113.3	T250	T250-N272 WeakPolarHBondContact O-CA 3.33Å
273	L	90	Very high	89.3	Confident	50 Å²	50	54.2 Å²	54.2	26%	0.262	27%	0.272	S	S	.	.			trans	-105.6	150.1	175.8	-69.4	174.6	0	0	0	109.1	S249 G251 Y271 D291 K293	S249-L273 CarbonylContact O-C 3.36Å; G251-L273 WeakPolarHBondContact CA-O 3.43Å; G251-L273 PolarHBondContact N-O 3.36Å; Y271-L273 PolarHBondContact O-N 3.46Å; Y271-L273 VanDerWaalsContact O-N 3.14Å; L273-D291 HydrophobicContact CB-CB 4.49Å; L273-K293 HydrophobicContact CD1-CD 3.92Å; L273-K293 HydrophobicContact CD1-CG 3.98Å
274	P	91.3	Very high	89	Confident	53 Å²	53	56.2 Å²	56.2	34%	0.344	28%	0.281	S	S	.	.			trans	-65.9	138.6	179.9	27.2	-35.1	0	0	0	111.4	S249 K276	S249-P274 VanDerWaalsContact O-CA 3.25Å; S249-P274 WeakPolarHBondContact O-CA 3.46Å; P274-K276 PolarHBondContact O-N 2.98Å
275	I	93.8	Very high	89	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	119.7	170.4	-67.7	150.3	0	0	0	107.8	S234 A235 T248 Q252 V253 L278 A290 D291	S234-I275 VanDerWaalsContact CB-O 3.29Å; S234-I275 WeakPolarHBondContact CB-O 3.43Å; S234-I275 PolarHBondContact OG-O 3.15Å; A235-I275 HydrophobicContact CB-CG2 3.99Å; T248-I275 PolarHBondContact O-N 2.79Å; Q252-I275 WeakPolarHBondContact O-CD1 3.44Å; V253-I275 HydrophobicContact CB-CD1 4.31Å; V253-I275 HydrophobicContact CG2-CD1 3.44Å; V253-I275 VanDerWaalsContact CG2-CD1 3.44Å; V253-I275 HydrophobicContact CG2-CG1 4.23Å; I275-L278 HydrophobicContact CG2-CD1 4.44Å; I275-L278 HydrophobicContact CG2-CD2 3.89Å; I275-L278 HydrophobicContact CG2-CG 3.85Å; I275-A290 CarbonylContact C-O 3.48Å; I275-A290 WeakPolarHBondContact CA-O 3.27Å; I275-D291 WeakPolarHBondContact CG1-OD1 3.35Å
276	K	92.6	Very high	89.1	Confident	72 Å²	72	52.5 Å²	52.5	31%	0.313	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-40.4	-177.8	-67.1	-169.9	179.6	178	0	112	P274 A290 S292 L315 N316	P274-K276 PolarHBondContact O-N 2.98Å; K276-A290 PolarHBondContact N-O 3.48Å; K276-S292 PolarHBondContact NZ-OG 2.85Å; K276-L315 WeakPolarHBondContact CD-O 3.43Å; K276-L315 VanDerWaalsContact CE-O 3.3Å; K276-L315 WeakPolarHBondContact CE-O 3.38Å; K276-L315 PolarHBondContact NZ-O 2.86Å; K276-N316 WeakPolarHBondContact CD-O 3.34Å; K276-N316 PolarHBondContact NZ-OD1 3.25Å
277	S	92.3	Very high	89.3	Confident	11 Å²	11	50 Å²	50	8%	0.077	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	148.9	-179.1	56.9	0	0	0	0	112.9	A290 V318	S277-A290 PolarHBondContact N-O 3.33Å; S277-A290 PolarHBondContact O-N 3.27Å; S277-A290 WeakPolarHBondContact OG-CB 3.35Å; S277-V318 WeakPolarHBondContact OG-CB 3.48Å; S277-V318 PolarHBondContact OG-N 3Å
278	L	94.4	Very high	89.5	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	124	177.5	-71.8	174	0	0	0	108.5	A235 K237 A245 V253 I275 V288	A235-L278 HydrophobicContact CB-CB 4.47Å; A235-L278 HydrophobicContact CB-CD1 3.81Å; A235-L278 HydrophobicContact CB-CG 3.88Å; K237-L278 HydrophobicContact CB-CB 4.13Å; K237-L278 WeakPolarHBondContact CB-O 3.3Å; K237-L278 WeakPolarHBondContact CG-O 3.34Å; A245-L278 HydrophobicContact CB-CD1 4.01Å; V253-L278 HydrophobicContact CG1-CD1 4.33Å; V253-L278 HydrophobicContact CG1-CD2 3.75Å; V253-L278 HydrophobicContact CG2-CD2 4.04Å; I275-L278 HydrophobicContact CG2-CD1 4.44Å; I275-L278 HydrophobicContact CG2-CD2 3.89Å; I275-L278 HydrophobicContact CG2-CG 3.85Å; L278-V288 WeakPolarHBondContact CA-O 3.39Å
279	N	93.1	Very high	89.7	Confident	34 Å²	34	47.3 Å²	47.3	18%	0.182	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148	174.6	-68.4	-49.9	0	0	0	110.5	V288 V318 M320	N279-V288 HydrophobicContact CB-CB 4.43Å; N279-V288 PolarHBondContact N-O 3.12Å; N279-V288 PolarHBondContact O-N 3.01Å; N279-V318 PolarHBondContact ND2-O 3.11Å; N279-M320 HydrophobicContact CB-CE 4.43Å; N279-M320 HydrophobicContact CB-CG 3.81Å; N279-M320 HydrophobicContact CB-SD 4.11Å
280	F	91.6	Very high	90	Very high	24 Å²	24	47.3 Å²	47.3	11%	0.105	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	142.1	174.3	-71	-90.9	0	0	0	110.6	K237 N239 A245 L255 I287 M320	K237-F280 HydrophobicContact CB-CD2 4.18Å; K237-F280 HydrophobicContact CB-CE2 3.97Å; K237-F280 HydrophobicContact CG-CD2 4.01Å; K237-F280 HydrophobicContact CG-CE2 4.28Å; K237-F280 WeakPolarHBondContact O-CE2 3.46Å; N239-F280 HydrophobicContact CB-CB 3.96Å; N239-F280 HydrophobicContact CB-CD1 3.56Å; N239-F280 HydrophobicContact CB-CD2 3.59Å; N239-F280 HydrophobicContact CB-CE1 3.73Å; N239-F280 HydrophobicContact CB-CE2 3.77Å; N239-F280 HydrophobicContact CB-CG 3.45Å; N239-F280 VanDerWaalsContact CB-CG 3.45Å; N239-F280 HydrophobicContact CB-CZ 3.81Å; N239-F280 VanDerWaalsContact ND2-CD1 3.26Å; N239-F280 WeakPolarHBondContact ND2-CD1 3.22Å; A245-F280 HydrophobicContact CB-CE1 4.4Å; A245-F280 HydrophobicContact CB-CE2 3.71Å; A245-F280 HydrophobicContact CB-CZ 3.39Å; L255-F280 HydrophobicContact CD1-CE1 4.19Å; L255-F280 HydrophobicContact CD1-CZ 4.5Å; F280-I287 HydrophobicContact CD1-CD1 4.12Å; F280-I287 HydrophobicContact CD1-CG1 3.45Å; F280-I287 VanDerWaalsContact CD1-CG1 3.45Å; F280-I287 HydrophobicContact CE1-CD1 3.6Å; F280-I287 HydrophobicContact CE1-CG1 3.45Å; F280-I287 VanDerWaalsContact CE1-CG1 3.45Å; F280-I287 HydrophobicContact CG-CG1 4.48Å; F280-I287 HydrophobicContact CZ-CD1 4.47Å; F280-I287 HydrophobicContact CZ-CG1 4.45Å; F280-M320 WeakPolarHBondContact O-CE 3.37Å
281	H	88.9	Confident	90.3	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.028	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	101.7	171.3	-172.2	-91.9	0	0	0	109.4	Q283 L284 D285 L286 M320 L344	H281-Q283 VanDerWaalsContact C-N 3.33Å; H281-Q283 PolarHBondContact O-N 2.9Å; H281-L284 PolarHBondContact ND1-N 3Å; H281-L284 PolarHBondContact O-N 3.33Å; H281-D285 WeakPolarHBondContact O-CA 3.18Å; H281-D285 PolarHBondContact O-N 3.38Å; H281-L286 HydrophobicContact CB-CB 4.12Å; H281-L286 PolarHBondContact N-O 2.93Å; H281-L286 PolarHBondContact O-N 3.43Å; H281-M320 HydrophobicContact CB-CE 3.8Å; H281-L344 PolarHBondContact CE1-O 3.03Å; H281-L344 VanDerWaalsContact CE1-O 3.26Å
282	D	82.3	Confident	90.6	Very high	110 Å²	110	35.4 Å²	35.4	59%	0.588	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-30	-170.4	-63	-16.6	0	0	0	113.6	N239 L284	N239-D282 PolarHBondContact OD1-OD1 2.81Å; D282-L284 VanDerWaalsContact C-N 3.32Å; D282-L284 PolarHBondContact O-N 3.37Å
283	Q	82.4	Confident	90.8	Very high	103 Å²	103	35.1 Å²	35.1	48%	0.481	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-25.4	-175	-54.7	-179.7	-7.4	0	0	113.7	H281 N323	H281-Q283 VanDerWaalsContact C-N 3.33Å; H281-Q283 PolarHBondContact O-N 2.9Å; Q283-N323 PolarHBondContact NE2-OD1 2.83Å
284	L	83	Confident	91	Very high	74 Å²	74	33.3 Å²	33.3	39%	0.387	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	6.2	-175.6	-66	175.5	0	0	0	112.4	H281 D282 L286 L344	H281-L284 PolarHBondContact ND1-N 3Å; H281-L284 PolarHBondContact O-N 3.33Å; D282-L284 VanDerWaalsContact C-N 3.32Å; D282-L284 PolarHBondContact O-N 3.37Å; L284-L286 HydrophobicContact CB-CD1 3.73Å; L284-L286 HydrophobicContact CB-CG 3.82Å; L284-L286 HydrophobicContact CD1-CD1 3.87Å; L284-L286 HydrophobicContact CG-CD1 4.48Å; L284-L286 PolarHBondContact O-N 2.99Å; L284-L286 VanDerWaalsContact O-N 3.15Å; L284-L344 HydrophobicContact CD1-CD1 4.46Å; L284-L344 WeakPolarHBondContact CD1-O 3.49Å
285	D	88.4	Confident	91.1	Very high	66 Å²	66	30.8 Å²	30.8	35%	0.353	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	40.3	-172.6	-72	-51.4	0	0	0	113	H281 K300	H281-D285 WeakPolarHBondContact O-CA 3.18Å; H281-D285 PolarHBondContact O-N 3.38Å; D285-K300 HydrophobicContact CB-CB 4.4Å; D285-K300 WeakPolarHBondContact O-CB 3.33Å; D285-K300 PolarHBondContact O-N 2.48Å
286	L	91.8	Very high	91.1	Very high	7 Å²	7	31.8 Å²	31.8	4%	0.037	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	149.2	177.5	-65.2	168.9	0	0	0	110.4	H281 L284 I297 W298 N299 F306 L344	H281-L286 HydrophobicContact CB-CB 4.12Å; H281-L286 PolarHBondContact N-O 2.93Å; H281-L286 PolarHBondContact O-N 3.43Å; L284-L286 HydrophobicContact CB-CD1 3.73Å; L284-L286 HydrophobicContact CB-CG 3.82Å; L284-L286 HydrophobicContact CD1-CD1 3.87Å; L284-L286 HydrophobicContact CG-CD1 4.48Å; L284-L286 PolarHBondContact O-N 2.99Å; L284-L286 VanDerWaalsContact O-N 3.15Å; L286-I297 HydrophobicContact CB-CG2 4.06Å; L286-I297 HydrophobicContact CD1-CG2 4.08Å; L286-I297 HydrophobicContact CD2-CG2 4.41Å; L286-I297 HydrophobicContact CG-CG2 4.42Å; L286-W298 CarbonylContact C-O 3.55Å; L286-W298 WeakPolarHBondContact CA-O 3.41Å; L286-N299 HydrophobicContact CD2-CB 4Å; L286-F306 HydrophobicContact CD1-CD1 4.26Å; L286-F306 HydrophobicContact CD1-CE1 4.47Å; L286-F306 HydrophobicContact CD1-CG 4.36Å; L286-F306 HydrophobicContact CD2-CB 4.01Å; L286-F306 HydrophobicContact CD2-CG 4.22Å; L286-L344 HydrophobicContact CD1-CD1 3.38Å
287	I	93.2	Very high	91.2	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127	175.2	-64.5	163.6	0	0	0	107.5	L255 F280 I297 W298 K300	L255-I287 HydrophobicContact CD1-CD1 3.19Å; F280-I287 HydrophobicContact CD1-CD1 4.12Å; F280-I287 HydrophobicContact CD1-CG1 3.45Å; F280-I287 VanDerWaalsContact CD1-CG1 3.45Å; F280-I287 HydrophobicContact CE1-CD1 3.6Å; F280-I287 HydrophobicContact CE1-CG1 3.45Å; F280-I287 VanDerWaalsContact CE1-CG1 3.45Å; F280-I287 HydrophobicContact CG-CG1 4.48Å; F280-I287 HydrophobicContact CZ-CD1 4.47Å; F280-I287 HydrophobicContact CZ-CG1 4.45Å; I287-I297 CarbonylContact O-C 3.47Å; I287-I297 WeakPolarHBondContact O-CA 3.41Å; I287-W298 HydrophobicContact CB-CD2 4.06Å; I287-W298 HydrophobicContact CB-CE3 4.43Å; I287-W298 HydrophobicContact CB-CH2 4.21Å; I287-W298 HydrophobicContact CB-CZ2 3.82Å; I287-W298 HydrophobicContact CB-CZ3 4.48Å; I287-W298 HydrophobicContact CD1-CE3 4.17Å; I287-W298 HydrophobicContact CD1-CH2 3.27Å; I287-W298 HydrophobicContact CD1-CZ2 3.75Å; I287-W298 HydrophobicContact CD1-CZ3 3.5Å; I287-W298 VanDerWaalsContact CD1-CZ3 3.5Å; I287-W298 HydrophobicContact CG1-CH2 4.32Å; I287-W298 HydrophobicContact CG1-CZ2 4.39Å; I287-W298 HydrophobicContact CG2-CH2 4.28Å; I287-W298 HydrophobicContact CG2-CZ2 3.57Å; I287-W298 PolarHBondContact N-O 3.37Å; I287-W298 PolarHBondContact O-N 3.26Å; I287-K300 HydrophobicContact CD1-CB 3.9Å; I287-K300 HydrophobicContact CD1-CG 4.11Å; I287-K300 HydrophobicContact CG1-CB 4.4Å
288	V	93.6	Very high	91.2	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	108.8	172.7	-177.6	0	0	0	0	107.1	L278 N279 I295 I297 V318 M320	L278-V288 WeakPolarHBondContact CA-O 3.39Å; N279-V288 HydrophobicContact CB-CB 4.43Å; N279-V288 PolarHBondContact N-O 3.12Å; N279-V288 PolarHBondContact O-N 3.01Å; V288-I295 HydrophobicContact CG1-CG2 3.46Å; V288-I295 VanDerWaalsContact CG1-CG2 3.46Å; V288-I297 HydrophobicContact CG1-CG1 4.44Å; V288-I297 HydrophobicContact CG2-CD1 4.26Å; V288-I297 HydrophobicContact CG2-CG1 4.02Å; V288-I297 HydrophobicContact CG2-CG2 4.23Å; V288-V318 HydrophobicContact CG1-CG1 4.43Å; V288-M320 HydrophobicContact CB-SD 4.02Å; V288-M320 HydrophobicContact CG2-SD 3.35Å; V288-M320 WeakPolarHBondContact CG2-SD 3.42Å
289	S	94.3	Very high	91.1	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.7	174.3	52.7	0	0	0	0	110.3	H269 I295 K296 W298	H269-S289 PolarHBondContact CE1-O 3.06Å; H269-S289 PolarHBondContact CE1-OG 3.07Å; H269-S289 VanDerWaalsContact CE1-OG 3.28Å; H269-S289 VanDerWaalsContact NE2-CB 3.35Å; H269-S289 WeakPolarHBondContact NE2-CB 3.45Å; H269-S289 PolarHBondContact NE2-OG 3.3Å; S289-I295 CarbonylContact O-C 3.59Å; S289-I295 WeakPolarHBondContact O-CA 3.47Å; S289-K296 PolarHBondContact N-O 3.23Å; S289-K296 PolarHBondContact O-N 3.49Å; S289-K296 PolarHBondContact OG-O 3.06Å; S289-W298 PolarHBondContact OG-NE1 3.42Å
290	A	94.2	Very high	91	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.008	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.1	-176.5	0	0	0	0	0	111.7	I275 K276 S277 I295 V318	I275-A290 CarbonylContact C-O 3.48Å; I275-A290 WeakPolarHBondContact CA-O 3.27Å; K276-A290 PolarHBondContact N-O 3.48Å; S277-A290 PolarHBondContact N-O 3.33Å; S277-A290 PolarHBondContact O-N 3.27Å; S277-A290 WeakPolarHBondContact OG-CB 3.35Å; A290-I295 HydrophobicContact CB-CG1 4.12Å; A290-V318 HydrophobicContact CB-CB 4.18Å; A290-V318 HydrophobicContact CB-CG2 3.47Å; A290-V318 VanDerWaalsContact CB-CG2 3.47Å
291	D	93	Very high	90.8	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-175.6	163.5	-53.5	-28.8	0	0	0	109.6	H269 L273 I275 K293 I294	H269-D291 WeakPolarHBondContact CB-OD2 3.35Å; H269-D291 IonicContact CE1-OD1 2.7Å; H269-D291 IonicContact CE1-OD2 3.85Å; H269-D291 IonicContact CG-OD1 3.72Å; H269-D291 IonicContact CG-OD2 3.83Å; H269-D291 IonicContact ND1-OD1 3.34Å; H269-D291 PolarHBondContact ND1-OD1 3.34Å; H269-D291 IonicContact ND1-OD2 2.74Å; H269-D291 PolarHBondContact ND1-OD2 3.08Å; L273-D291 HydrophobicContact CB-CB 4.49Å; I275-D291 WeakPolarHBondContact CG1-OD1 3.35Å; D291-K293 PolarHBondContact O-N 3.39Å; D291-I294 HydrophobicContact CB-CG2 4.49Å; D291-I294 PolarHBondContact N-O 3.15Å
292	S	91.7	Very high	90.7	Very high	16 Å²	16	37.3 Å²	37.3	11%	0.112	20%	0.195	C	C	.	.	S	Bend	trans	-58.3	-30.3	169.6	-156.9	0	0	0	0	113.4	K276 D314 L315	K276-S292 PolarHBondContact NZ-OG 2.85Å; S292-D314 CarbonylContact O-C 3.49Å; S292-D314 VanDerWaalsContact O-CA 3.28Å; S292-D314 WeakPolarHBondContact O-CA 3.03Å; S292-L315 PolarHBondContact O-N 3.14Å
293	K	91.7	Very high	90.9	Very high	100 Å²	100	32.9 Å²	32.9	44%	0.435	18%	0.175	S	C	.	.	S	Bend	trans	-113	-26.8	-171.2	-70.3	-175.8	179.5	-179.7	0	115.6	L273 D291 P311 D314	L273-K293 HydrophobicContact CD1-CD 3.92Å; L273-K293 HydrophobicContact CD1-CG 3.98Å; D291-K293 PolarHBondContact O-N 3.39Å; K293-P311 WeakPolarHBondContact O-CD 3.43Å; K293-D314 WeakPolarHBondContact CG-OD1 3.07Å
294	I	93.2	Very high	91.3	Very high	12 Å²	12	35.6 Å²	35.6	6%	0.062	19%	0.185	C	C	.	.			trans	-139	144.4	-171.7	-162.2	169.6	0	0	0	110.4	Y271 D291 K296 I309	Y271-I294 HydrophobicContact CD2-CG2 3.88Å; Y271-I294 HydrophobicContact CE2-CB 4.25Å; Y271-I294 HydrophobicContact CE2-CD1 4.15Å; Y271-I294 HydrophobicContact CE2-CG2 3.85Å; D291-I294 HydrophobicContact CB-CG2 4.49Å; D291-I294 PolarHBondContact N-O 3.15Å; I294-K296 HydrophobicContact CD1-CG 4.4Å; I294-K296 HydrophobicContact CG1-CG 4.45Å; I294-K296 HydrophobicContact CG2-CG 4.46Å; I294-I309 WeakPolarHBondContact CG1-O 3.43Å
295	I	93.8	Very high	91.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.4	167.5	-51.8	173.1	0	0	0	106.8	V288 S289 A290 S308 I309 L315 V318 T329	V288-I295 HydrophobicContact CG1-CG2 3.46Å; V288-I295 VanDerWaalsContact CG1-CG2 3.46Å; S289-I295 CarbonylContact O-C 3.59Å; S289-I295 WeakPolarHBondContact O-CA 3.47Å; A290-I295 HydrophobicContact CB-CG1 4.12Å; I295-S308 CarbonylContact O-C 3.25Å; I295-S308 VanDerWaalsContact O-CA 3.3Å; I295-S308 WeakPolarHBondContact O-CA 3.4Å; I295-I309 HydrophobicContact CB-CB 4.17Å; I295-I309 PolarHBondContact N-O 3.02Å; I295-I309 PolarHBondContact O-N 2.75Å; I295-L315 HydrophobicContact CD1-CD1 3.61Å; I295-L315 HydrophobicContact CG1-CD1 3.36Å; I295-V318 HydrophobicContact CD1-CG1 4.24Å; I295-V318 HydrophobicContact CD1-CG2 3.75Å; I295-V318 HydrophobicContact CG1-CG2 4.13Å; I295-T329 HydrophobicContact CD1-CG2 3.6Å
296	K	93.3	Very high	91.7	Very high	21 Å²	21	34.9 Å²	34.9	9%	0.091	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	129.9	173.8	-68.2	-171.7	-173.3	-176.1	0	108.7	D268 H269 S289 I294 L305	D268-K296 PolarHBondContact O-NZ 3.42Å; H269-K296 VanDerWaalsContact CA-NZ 3.35Å; H269-K296 PolarHBondContact O-NZ 3.47Å; H269-K296 VanDerWaalsContact O-NZ 3.07Å; S289-K296 PolarHBondContact N-O 3.23Å; S289-K296 PolarHBondContact O-N 3.49Å; S289-K296 PolarHBondContact OG-O 3.06Å; I294-K296 HydrophobicContact CD1-CG 4.4Å; I294-K296 HydrophobicContact CG1-CG 4.45Å; I294-K296 HydrophobicContact CG2-CG 4.46Å; K296-L305 HydrophobicContact CB-CD1 3.76Å; K296-L305 HydrophobicContact CD-CD1 4.12Å; K296-L305 HydrophobicContact CG-CD1 4.02Å
297	I	94.1	Very high	91.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.8	172	-51	-173.4	0	0	0	107.2	L286 I287 V288 L305 F306 S307 I309 L327 I341 L344	L286-I297 HydrophobicContact CB-CG2 4.06Å; L286-I297 HydrophobicContact CD1-CG2 4.08Å; L286-I297 HydrophobicContact CD2-CG2 4.41Å; L286-I297 HydrophobicContact CG-CG2 4.42Å; I287-I297 CarbonylContact O-C 3.47Å; I287-I297 WeakPolarHBondContact O-CA 3.41Å; V288-I297 HydrophobicContact CG1-CG1 4.44Å; V288-I297 HydrophobicContact CG2-CD1 4.26Å; V288-I297 HydrophobicContact CG2-CG1 4.02Å; V288-I297 HydrophobicContact CG2-CG2 4.23Å; I297-L305 WeakPolarHBondContact O-CD1 3.5Å; I297-F306 HydrophobicContact CG2-CB 4.27Å; I297-F306 HydrophobicContact CG2-CD1 4.11Å; I297-F306 WeakPolarHBondContact O-CA 3.37Å; I297-F306 WeakPolarHBondContact O-CB 3.42Å; I297-F306 PolarHBondContact O-N 2.82Å; I297-S307 PolarHBondContact N-O 3.4Å; I297-S307 PolarHBondContact O-N 2.95Å; I297-I309 HydrophobicContact CD1-CD1 4.47Å; I297-L327 HydrophobicContact CD1-CD1 4.07Å; I297-I341 HydrophobicContact CD1-CD1 3.47Å; I297-I341 VanDerWaalsContact CD1-CD1 3.47Å; I297-L344 HydrophobicContact CG2-CD1 4.28Å
298	W	93.6	Very high	91.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	156.8	-175.1	55.1	-84.5	0	0	0	113	V253 L255 L265 K267 L286 I287 S289 K304 L305	V253-W298 HydrophobicContact CB-CZ2 4.19Å; V253-W298 HydrophobicContact CG1-CZ2 3.87Å; L255-W298 HydrophobicContact CD1-CH2 4.25Å; L265-W298 HydrophobicContact CD2-CE3 3.85Å; L265-W298 HydrophobicContact CD2-CH2 3.79Å; L265-W298 HydrophobicContact CD2-CZ3 3.2Å; K267-W298 HydrophobicContact CB-CZ2 4.39Å; K267-W298 HydrophobicContact CD-CB 4.28Å; K267-W298 HydrophobicContact CD-CD2 3.45Å; K267-W298 VanDerWaalsContact CD-CD2 3.45Å; K267-W298 HydrophobicContact CD-CE3 3.99Å; K267-W298 HydrophobicContact CD-CG 3.57Å; K267-W298 HydrophobicContact CD-CZ2 4.19Å; L286-W298 CarbonylContact C-O 3.55Å; L286-W298 WeakPolarHBondContact CA-O 3.41Å; I287-W298 HydrophobicContact CB-CD2 4.06Å; I287-W298 HydrophobicContact CB-CE3 4.43Å; I287-W298 HydrophobicContact CB-CH2 4.21Å; I287-W298 HydrophobicContact CB-CZ2 3.82Å; I287-W298 HydrophobicContact CB-CZ3 4.48Å; I287-W298 HydrophobicContact CD1-CE3 4.17Å; I287-W298 HydrophobicContact CD1-CH2 3.27Å; I287-W298 HydrophobicContact CD1-CZ2 3.75Å; I287-W298 HydrophobicContact CD1-CZ3 3.5Å; I287-W298 VanDerWaalsContact CD1-CZ3 3.5Å; I287-W298 HydrophobicContact CG1-CH2 4.32Å; I287-W298 HydrophobicContact CG1-CZ2 4.39Å; I287-W298 HydrophobicContact CG2-CH2 4.28Å; I287-W298 HydrophobicContact CG2-CZ2 3.57Å; I287-W298 PolarHBondContact N-O 3.37Å; I287-W298 PolarHBondContact O-N 3.26Å; S289-W298 PolarHBondContact OG-NE1 3.42Å; W298-K304 WeakPolarHBondContact CA-O 3.43Å; W298-K304 VanDerWaalsContact CB-O 3.3Å; W298-K304 WeakPolarHBondContact CB-O 3.32Å; W298-L305 HydrophobicContact CB-CD1 4.41Å
299	N	92.6	Very high	91.5	Very high	52 Å²	52	35.9 Å²	35.9	28%	0.278	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.8	-175.8	-177.5	-26.2	0	0	0	111.2	L286 D301 S302 G303 K304	L286-N299 HydrophobicContact CD2-CB 4Å; N299-D301 PolarHBondContact O-N 3.07Å; N299-D301 PolarHBondContact OD1-N 2.84Å; N299-S302 WeakPolarHBondContact CB-OG 3.41Å; N299-G303 VanDerWaalsContact O-CA 3.31Å; N299-G303 WeakPolarHBondContact O-CA 3.34Å; N299-G303 PolarHBondContact O-N 3.34Å; N299-K304 PolarHBondContact N-O 3.33Å; N299-K304 VanDerWaalsContact N-O 3.1Å
300	K	89.4	Confident	91.3	Very high	27 Å²	27	42.6 Å²	42.6	12%	0.117	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-45.5	-180	-179.9	-178.5	-176.4	-178.9	0	114.2	T243 L255 D285 I287	T243-K300 VanDerWaalsContact CG2-CE 3.43Å; T243-K300 WeakPolarHBondContact OG1-CE 2.98Å; T243-K300 PolarHBondContact OG1-NZ 3.17Å; L255-K300 HydrophobicContact CD1-CG 3.91Å; L255-K300 HydrophobicContact CD2-CG 4.23Å; D285-K300 HydrophobicContact CB-CB 4.4Å; D285-K300 WeakPolarHBondContact O-CB 3.33Å; D285-K300 PolarHBondContact O-N 2.48Å; I287-K300 HydrophobicContact CD1-CB 3.9Å; I287-K300 HydrophobicContact CD1-CG 4.11Å; I287-K300 HydrophobicContact CG1-CB 4.4Å
301	D	88.9	Confident	90.9	Very high	132 Å²	132	43.1 Å²	43.1	71%	0.706	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-39.4	-172	-66.5	-18.9	0	0	0	112.4	N299	N299-D301 PolarHBondContact O-N 3.07Å; N299-D301 PolarHBondContact OD1-N 2.84Å
302	S	87.1	Confident	90.6	Very high	60 Å²	60	50 Å²	50	42%	0.42	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-17.1	-174.1	66.7	0	0	0	0	114	N299 K304	N299-S302 WeakPolarHBondContact CB-OG 3.41Å; S302-K304 PolarHBondContact O-N 3.37Å; S302-K304 PolarHBondContact OG-N 3.01Å
303	G	85.9	Confident	90.5	Very high	17 Å²	17	50 Å²	50	18%	0.175	25%	0.253	C	S	.	.			trans	66.6	-4.3	-173.5	0	0	0	0	0	115	L265 K267 N299 L305	L265-G303 VanDerWaalsContact CD2-CA 3.46Å; K267-G303 PolarHBondContact NZ-O 3.44Å; N299-G303 VanDerWaalsContact O-CA 3.31Å; N299-G303 WeakPolarHBondContact O-CA 3.34Å; N299-G303 PolarHBondContact O-N 3.34Å; G303-L305 PolarHBondContact O-N 3.17Å
304	K	90.5	Very high	90.5	Very high	160 Å²	160	48 Å²	48	70%	0.696	25%	0.247	S	C	*	.			trans	-63.7	136.1	-179.8	-69	-176.1	-180	179.6	0	110.2	W298 N299 S302 F306	W298-K304 WeakPolarHBondContact CA-O 3.43Å; W298-K304 VanDerWaalsContact CB-O 3.3Å; W298-K304 WeakPolarHBondContact CB-O 3.32Å; N299-K304 PolarHBondContact N-O 3.33Å; N299-K304 VanDerWaalsContact N-O 3.1Å; S302-K304 PolarHBondContact O-N 3.37Å; S302-K304 PolarHBondContact OG-N 3.01Å; K304-F306 PolarHBondContact O-N 3.3Å
305	L	89.6	Confident	90.5	Very high	65 Å²	65	47.4 Å²	47.4	34%	0.34	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	120.9	176.5	-171.4	70.9	0	0	0	109.1	N7 K296 I297 W298 G303	N7-L305 PolarHBondContact ND2-O 3.46Å; K296-L305 HydrophobicContact CB-CD1 3.76Å; K296-L305 HydrophobicContact CD-CD1 4.12Å; K296-L305 HydrophobicContact CG-CD1 4.02Å; I297-L305 WeakPolarHBondContact O-CD1 3.5Å; W298-L305 HydrophobicContact CB-CD1 4.41Å; G303-L305 PolarHBondContact O-N 3.17Å
306	F	90.6	Very high	90.4	Very high	60 Å²	60	49.3 Å²	49.3	26%	0.263	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-58.5	175	-177.5	-103.6	0	0	0	109.4	N7 V9 L286 I297 K304 A343	N7-F306 WeakPolarHBondContact CB-O 3.44Å; N7-F306 PolarHBondContact ND2-O 2.97Å; V9-F306 HydrophobicContact CG1-CE1 3.91Å; V9-F306 HydrophobicContact CG1-CZ 4.32Å; V9-F306 HydrophobicContact CG2-CD1 4.35Å; V9-F306 HydrophobicContact CG2-CE1 3.91Å; V9-F306 HydrophobicContact CG2-CE2 4.14Å; V9-F306 HydrophobicContact CG2-CZ 3.8Å; L286-F306 HydrophobicContact CD1-CD1 4.26Å; L286-F306 HydrophobicContact CD1-CE1 4.47Å; L286-F306 HydrophobicContact CD1-CG 4.36Å; L286-F306 HydrophobicContact CD2-CB 4.01Å; L286-F306 HydrophobicContact CD2-CG 4.22Å; I297-F306 HydrophobicContact CG2-CB 4.27Å; I297-F306 HydrophobicContact CG2-CD1 4.11Å; I297-F306 WeakPolarHBondContact O-CA 3.37Å; I297-F306 WeakPolarHBondContact O-CB 3.42Å; I297-F306 PolarHBondContact O-N 2.82Å; K304-F306 PolarHBondContact O-N 3.3Å; F306-A343 HydrophobicContact CE1-CB 4.37Å; F306-A343 HydrophobicContact CZ-CB 3.89Å
307	S	90.5	Very high	90.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	163.2	176.6	68.3	0	0	0	0	111.1	I297	I297-S307 PolarHBondContact N-O 3.4Å; I297-S307 PolarHBondContact O-N 2.95Å
308	S	92.1	Very high	90.4	Very high	27 Å²	27	50 Å²	50	19%	0.189	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	136	171.2	63.6	0	0	0	0	110.8	I295	I295-S308 CarbonylContact O-C 3.25Å; I295-S308 VanDerWaalsContact O-CA 3.3Å; I295-S308 WeakPolarHBondContact O-CA 3.4Å
309	I	91.9	Very high	90.3	Very high	3 Å²	3	51 Å²	51	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.2	179.5	-46.6	172.7	0	0	0	107.5	I11 I294 I295 I297 P311 L327 F339 I341	I11-I309 HydrophobicContact CD1-CG1 3.88Å; I11-I309 HydrophobicContact CG1-CG1 4.48Å; I11-I309 HydrophobicContact CG2-CD1 4.32Å; I11-I309 HydrophobicContact CG2-CG1 4.23Å; I294-I309 WeakPolarHBondContact CG1-O 3.43Å; I295-I309 HydrophobicContact CB-CB 4.17Å; I295-I309 PolarHBondContact N-O 3.02Å; I295-I309 PolarHBondContact O-N 2.75Å; I297-I309 HydrophobicContact CD1-CD1 4.47Å; I309-P311 WeakPolarHBondContact O-CD 3.46Å; I309-L327 HydrophobicContact CD1-CD1 3.7Å; I309-F339 HydrophobicContact CD1-CB 4.31Å; I309-F339 HydrophobicContact CD1-CD2 4.49Å; I309-F339 HydrophobicContact CD1-CG 4.28Å; I309-F339 HydrophobicContact CG2-CD1 3.78Å; I309-F339 HydrophobicContact CG2-CD2 4.18Å; I309-F339 HydrophobicContact CG2-CE1 3.51Å; I309-F339 HydrophobicContact CG2-CE2 3.94Å; I309-F339 HydrophobicContact CG2-CG 4.1Å; I309-F339 HydrophobicContact CG2-CZ 3.61Å; I309-I341 HydrophobicContact CD1-CD1 4.06Å
310	Q	89.9	Confident	90.3	Very high	140 Å²	140	49.8 Å²	49.8	65%	0.654	26%	0.258	S	S	*	.			trans	-110	99	173.1	-170.2	173.2	9.4	0	0	109.1
311	P	86.2	Confident	90.3	Very high	13 Å²	13	49.6 Å²	49.6	8%	0.084	26%	0.257	C	S	.	.			trans	-67.2	162.7	171.3	29.9	-36.3	0	0	0	111.5	K293 I309 S313 L315 F339	K293-P311 WeakPolarHBondContact O-CD 3.43Å; I309-P311 WeakPolarHBondContact O-CD 3.46Å; P311-S313 WeakPolarHBondContact CG-O 3.42Å; P311-L315 HydrophobicContact CB-CD2 4.24Å; P311-L315 HydrophobicContact CG-CD1 3.78Å; P311-L315 HydrophobicContact CG-CD2 3.73Å; P311-L315 HydrophobicContact CG-CG 3.61Å; P311-F339 HydrophobicContact CB-CZ 4.25Å
312	Q	85.9	Confident	90.2	Very high	146 Å²	146	46 Å²	46	68%	0.682	24%	0.241	S	C	*	.	S	Bend	trans	-76.9	-34.4	177	-69.1	-173.7	-30.9	0	0	113	Y16	Y16-Q312 HydrophobicContact CE2-CG 4.49Å; Y16-Q312 VanDerWaalsContact CE2-NE2 3.34Å; Y16-Q312 PolarHBondContact OH-NE2 2.91Å; Y16-Q312 VanDerWaalsContact OH-NE2 3.15Å
313	S	89.1	Confident	90.1	Very high	14 Å²	14	48.7 Å²	48.7	10%	0.098	25%	0.251	C	S	.	.	S	Bend	trans	-101.2	158.2	176.9	29.9	0	0	0	0	111.8	P311 N331 D333	P311-S313 WeakPolarHBondContact CG-O 3.42Å; S313-N331 PolarHBondContact OG-ND2 2.92Å; S313-N331 VanDerWaalsContact OG-ND2 3.11Å; S313-D333 WeakPolarHBondContact CB-OD2 3.45Å; S313-D333 PolarHBondContact OG-OD2 3.4Å
314	D	92.1	Very high	90.2	Very high	58 Å²	58	48 Å²	48	31%	0.31	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-65.4	139.9	172.7	-72.9	-36.8	0	0	0	110.8	S292 K293 N331 E332	S292-D314 CarbonylContact O-C 3.49Å; S292-D314 VanDerWaalsContact O-CA 3.28Å; S292-D314 WeakPolarHBondContact O-CA 3.03Å; K293-D314 WeakPolarHBondContact CG-OD1 3.07Å; D314-N331 VanDerWaalsContact O-CA 3.25Å; D314-N331 WeakPolarHBondContact O-CA 3.42Å; D314-N331 WeakPolarHBondContact O-CB 3.47Å; D314-E332 HydrophobicContact CB-CG 4.33Å; D314-E332 PolarHBondContact O-N 3.01Å; D314-E332 VanDerWaalsContact O-N 3.09Å
315	L	92.9	Very high	90	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	139.9	-178.6	-64.3	179.1	0	0	0	110.7	K276 S292 I295 P311 V318 T329 A330 N331	K276-L315 WeakPolarHBondContact CD-O 3.43Å; K276-L315 VanDerWaalsContact CE-O 3.3Å; K276-L315 WeakPolarHBondContact CE-O 3.38Å; K276-L315 PolarHBondContact NZ-O 2.86Å; S292-L315 PolarHBondContact O-N 3.14Å; I295-L315 HydrophobicContact CD1-CD1 3.61Å; I295-L315 HydrophobicContact CG1-CD1 3.36Å; P311-L315 HydrophobicContact CB-CD2 4.24Å; P311-L315 HydrophobicContact CG-CD1 3.78Å; P311-L315 HydrophobicContact CG-CD2 3.73Å; P311-L315 HydrophobicContact CG-CG 3.61Å; L315-V318 HydrophobicContact CD1-CG2 4.25Å; L315-T329 HydrophobicContact CD2-CG2 4.4Å; L315-A330 CarbonylContact C-O 3.18Å; L315-A330 WeakPolarHBondContact CA-O 3.35Å; L315-N331 HydrophobicContact CD2-CB 4.42Å
316	N	92.9	Very high	90.1	Very high	39 Å²	39	37.6 Å²	37.6	21%	0.209	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-40.9	171.1	-70.4	-35.1	0	0	0	112.3	C55 T56 K276 A330	C55-N316 PolarHBondContact O-ND2 3.35Å; T56-N316 WeakPolarHBondContact O-CB 3.49Å; K276-N316 WeakPolarHBondContact CD-O 3.34Å; K276-N316 PolarHBondContact NZ-OD1 3.25Å; N316-A330 HydrophobicContact CB-CB 4.4Å; N316-A330 PolarHBondContact N-O 2.76Å
317	D	92.4	Very high	90.1	Very high	33 Å²	33	34.8 Å²	34.8	18%	0.176	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	153.5	-176.4	-168.9	16	0	0	0	110.5	I58 T329 A330	I58-D317 PolarHBondContact N-OD2 3.04Å; D317-T329 WeakPolarHBondContact O-CA 3.31Å; D317-A330 HydrophobicContact CB-CB 3.92Å; D317-A330 PolarHBondContact O-N 2.85Å
318	V	93.9	Very high	90.2	Very high	3 Å²	3	35 Å²	35	2%	0.018	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	125.4	177.5	-179.3	0	0	0	0	108.2	S277 N279 V288 A290 I295 L315 F328 T329	S277-V318 WeakPolarHBondContact OG-CB 3.48Å; S277-V318 PolarHBondContact OG-N 3Å; N279-V318 PolarHBondContact ND2-O 3.11Å; V288-V318 HydrophobicContact CG1-CG1 4.43Å; A290-V318 HydrophobicContact CB-CB 4.18Å; A290-V318 HydrophobicContact CB-CG2 3.47Å; A290-V318 VanDerWaalsContact CB-CG2 3.47Å; I295-V318 HydrophobicContact CD1-CG1 4.24Å; I295-V318 HydrophobicContact CD1-CG2 3.75Å; I295-V318 HydrophobicContact CG1-CG2 4.13Å; L315-V318 HydrophobicContact CD1-CG2 4.25Å; V318-F328 WeakPolarHBondContact CA-O 3.48Å; V318-T329 HydrophobicContact CG1-CG2 4.11Å; V318-T329 HydrophobicContact CG2-CG2 4.01Å
319	C	92	Very high	90.3	Very high	20 Å²	20	33.7 Å²	33.7	14%	0.135	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.2	177.2	-173.4	0	0	0	0	109.6	I58 F328	I58-C319 HydrophobicContact CG2-CB 4.41Å; I58-C319 VanDerWaalsContact O-CB 3.25Å; I58-C319 WeakPolarHBondContact O-CB 3.46Å; C319-F328 PolarHBondContact N-O 3.07Å; C319-F328 PolarHBondContact O-N 3.25Å
320	M	91.4	Very high	90.3	Very high	27 Å²	27	33.6 Å²	33.6	13%	0.133	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	144.7	171.6	-48.3	-156.7	-42.6	0	0	110.5	N279 F280 H281 V288 L327	N279-M320 HydrophobicContact CB-CE 4.43Å; N279-M320 HydrophobicContact CB-CG 3.81Å; N279-M320 HydrophobicContact CB-SD 4.11Å; F280-M320 WeakPolarHBondContact O-CE 3.37Å; H281-M320 HydrophobicContact CB-CE 3.8Å; V288-M320 HydrophobicContact CB-SD 4.02Å; V288-M320 HydrophobicContact CG2-SD 3.35Å; V288-M320 WeakPolarHBondContact CG2-SD 3.42Å; M320-L327 HydrophobicContact CB-CD2 3.91Å; M320-L327 HydrophobicContact CG-CD2 3.4Å; M320-L327 VanDerWaalsContact CG-CD2 3.4Å; M320-L327 HydrophobicContact SD-CD2 3.81Å
321	Y	91.4	Very high	90.4	Very high	23 Å²	23	26.9 Å²	26.9	9%	0.09	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-77.9	136.2	167.8	-168.8	-84.6	0	0	0	110	V60 G64 N323 S324 M326 F328 P348 W350	V60-Y321 HydrophobicContact CG1-CD2 3.72Å; V60-Y321 HydrophobicContact CG1-CE2 3.79Å; V60-Y321 HydrophobicContact CG2-CD2 4.26Å; G64-Y321 WeakPolarHBondContact CA-OH 3.48Å; G64-Y321 WeakPolarHBondContact O-CE2 3.35Å; G64-Y321 PolarHBondContact O-OH 2.87Å; Y321-N323 PolarHBondContact O-N 2.88Å; Y321-S324 WeakPolarHBondContact CB-OG 3.5Å; Y321-S324 WeakPolarHBondContact CD1-OG 3.47Å; Y321-M326 HydrophobicContact CD2-CE 4.22Å; Y321-M326 HydrophobicContact CG-CE 4.21Å; Y321-M326 PolarHBondContact N-O 2.94Å; Y321-F328 HydrophobicContact CD2-CE2 4.1Å; Y321-P348 HydrophobicContact CD1-CB 4.08Å; Y321-P348 HydrophobicContact CE1-CB 3.51Å; Y321-P348 HydrophobicContact CE1-CG 4.32Å; Y321-W350 HydrophobicContact CE2-CZ2 4.25Å; Y321-W350 AromaticContact CE2-NE1 3.76Å; Y321-W350 AromaticContact CZ-NE1 3.53Å; Y321-W350 PolarHBondContact OH-NE1 2.83Å; Y321-W350 VanDerWaalsContact OH-NE1 3.12Å
322	P	86.7	Confident	90.6	Very high	58 Å²	58	31 Å²	31	38%	0.377	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	134.4	-177.5	25.4	-34.2	0	0	0	111.5	S324	P322-S324 PolarHBondContact O-N 3.4Å
323	N	83.6	Confident	90.7	Very high	116 Å²	116	27.4 Å²	27.4	62%	0.62	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	23.7	176.6	-61.9	-42	0	0	0	115.6	Q283 Y321	Q283-N323 PolarHBondContact NE2-OD1 2.83Å; Y321-N323 PolarHBondContact O-N 2.88Å
324	S	87.8	Confident	90.7	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.014	16%	0.155	C	C	.	.	S	Bend	trans	-139.3	163.1	176.3	86.6	0	0	0	0	112.4	Y321 P322 M326 P346	Y321-S324 WeakPolarHBondContact CB-OG 3.5Å; Y321-S324 WeakPolarHBondContact CD1-OG 3.47Å; P322-S324 PolarHBondContact O-N 3.4Å; S324-M326 PolarHBondContact O-N 2.85Å; S324-M326 PolarHBondContact OG-N 2.82Å; S324-P346 WeakPolarHBondContact CA-O 3.38Å; S324-P346 VanDerWaalsContact CB-O 3.28Å; S324-P346 WeakPolarHBondContact CB-O 3.3Å
325	G	86.9	Confident	90.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.144	C	C	.	.	S	Bend	trans	-77.4	14.2	177.2	0	0	0	0	0	115.6	I341 G345 P346	G325-I341 PolarHBondContact O-N 2.96Å; G325-G345 PolarHBondContact N-O 3.04Å; G325-P346 PolarHBondContact N-O 2.93Å
326	M	90.9	Very high	90.3	Very high	6 Å²	6	26.9 Å²	26.9	3%	0.03	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	136.6	-175.6	-63.7	-163.5	-30.1	0	0	113.3	Y321 S324 F328 F339 Y340 P348 W350 L354	Y321-M326 HydrophobicContact CD2-CE 4.22Å; Y321-M326 HydrophobicContact CG-CE 4.21Å; Y321-M326 PolarHBondContact N-O 2.94Å; S324-M326 PolarHBondContact O-N 2.85Å; S324-M326 PolarHBondContact OG-N 2.82Å; M326-F328 HydrophobicContact CE-CE2 3.99Å; M326-F328 HydrophobicContact CE-CZ 3.77Å; M326-F339 WeakPolarHBondContact CA-O 3.44Å; M326-Y340 HydrophobicContact CG-CD2 3.68Å; M326-Y340 HydrophobicContact CG-CE2 4.33Å; M326-P348 HydrophobicContact CE-CG 3.49Å; M326-P348 VanDerWaalsContact CE-CG 3.49Å; M326-P348 WeakPolarHBondContact SD-CD 3.39Å; M326-P348 HydrophobicContact SD-CG 3.73Å; M326-W350 HydrophobicContact CE-CH2 3.91Å; M326-W350 HydrophobicContact CE-CZ2 3.5Å; M326-L354 HydrophobicContact SD-CD1 4.28Å
327	L	92.3	Very high	90.2	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	126.5	178.3	-57.2	170.1	0	0	0	109.5	I297 I309 M320 T338 F339 I341	I297-L327 HydrophobicContact CD1-CD1 4.07Å; I309-L327 HydrophobicContact CD1-CD1 3.7Å; M320-L327 HydrophobicContact CB-CD2 3.91Å; M320-L327 HydrophobicContact CG-CD2 3.4Å; M320-L327 VanDerWaalsContact CG-CD2 3.4Å; M320-L327 HydrophobicContact SD-CD2 3.81Å; L327-T338 WeakPolarHBondContact O-CA 3.41Å; L327-F339 HydrophobicContact CB-CB 4.23Å; L327-F339 PolarHBondContact N-O 2.99Å; L327-F339 PolarHBondContact O-N 2.85Å; L327-I341 HydrophobicContact CD1-CD1 4.04Å
328	F	92.8	Very high	90.2	Very high	5 Å²	5	24.8 Å²	24.8	2%	0.022	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	136.9	169.1	-63.4	-79.2	0	0	0	109.1	F49 I58 V60 I67 V318 C319 Y321 M326 T338	F49-F328 AromaticContact CE1-CD1 3.93Å; F49-F328 HydrophobicContact CE1-CD1 3.93Å; F49-F328 HydrophobicContact CE1-CE1 4.36Å; F49-F328 AromaticContact CZ-CD1 3.67Å; F49-F328 HydrophobicContact CZ-CD1 3.67Å; F49-F328 HydrophobicContact CZ-CE1 4.08Å; I58-F328 HydrophobicContact CD1-CB 4.44Å; I58-F328 HydrophobicContact CG2-CB 3.91Å; V60-F328 HydrophobicContact CG2-CD2 3.91Å; V60-F328 HydrophobicContact CG2-CE2 4.11Å; I67-F328 HydrophobicContact CD1-CE1 3.79Å; I67-F328 HydrophobicContact CD1-CE2 3.86Å; I67-F328 HydrophobicContact CD1-CZ 3.37Å; I67-F328 HydrophobicContact CG1-CE2 4.49Å; I67-F328 HydrophobicContact CG1-CZ 4.43Å; V318-F328 WeakPolarHBondContact CA-O 3.48Å; C319-F328 PolarHBondContact N-O 3.07Å; C319-F328 PolarHBondContact O-N 3.25Å; Y321-F328 HydrophobicContact CD2-CE2 4.1Å; M326-F328 HydrophobicContact CE-CE2 3.99Å; M326-F328 HydrophobicContact CE-CZ 3.77Å; F328-T338 HydrophobicContact CD1-CG2 3.47Å; F328-T338 VanDerWaalsContact CD1-CG2 3.47Å; F328-T338 HydrophobicContact CE1-CG2 3.49Å; F328-T338 VanDerWaalsContact CE1-CG2 3.49Å
329	T	92.8	Very high	90.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	125.6	-177.6	55.5	0	0	0	0	109.8	I295 L315 D317 V318 N337 F339	I295-T329 HydrophobicContact CD1-CG2 3.6Å; L315-T329 HydrophobicContact CD2-CG2 4.4Å; D317-T329 WeakPolarHBondContact O-CA 3.31Å; V318-T329 HydrophobicContact CG1-CG2 4.11Å; V318-T329 HydrophobicContact CG2-CG2 4.01Å; T329-N337 PolarHBondContact N-O 3.27Å; T329-N337 PolarHBondContact O-N 3.19Å; T329-N337 WeakPolarHBondContact OG1-CA 3.49Å; T329-N337 WeakPolarHBondContact OG1-CB 2.97Å; T329-N337 PolarHBondContact OG1-O 2.89Å; T329-F339 HydrophobicContact CG2-CD2 3.83Å; T329-F339 HydrophobicContact CG2-CE2 3.83Å
330	A	92.7	Very high	90.1	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.9	172.7	0	0	0	0	0	107.7	C55 I58 L315 N316 D317	C55-A330 HydrophobicContact CB-CB 4.08Å; I58-A330 HydrophobicContact CD1-CB 3.84Å; I58-A330 HydrophobicContact CG1-CB 3.91Å; L315-A330 CarbonylContact C-O 3.18Å; L315-A330 WeakPolarHBondContact CA-O 3.35Å; N316-A330 HydrophobicContact CB-CB 4.4Å; N316-A330 PolarHBondContact N-O 2.76Å; D317-A330 HydrophobicContact CB-CB 3.92Å; D317-A330 PolarHBondContact O-N 2.85Å
331	N	91.3	Very high	90.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	171.8	-175	59.6	-16.1	0	0	0	111.7	C55 S313 D314 L315 D333 K335 M336 N337	C55-N331 PolarHBondContact N-O 2.93Å; C55-N331 VanDerWaalsContact N-O 3.08Å; S313-N331 PolarHBondContact OG-ND2 2.92Å; S313-N331 VanDerWaalsContact OG-ND2 3.11Å; D314-N331 VanDerWaalsContact O-CA 3.25Å; D314-N331 WeakPolarHBondContact O-CA 3.42Å; D314-N331 WeakPolarHBondContact O-CB 3.47Å; L315-N331 HydrophobicContact CD2-CB 4.42Å; N331-D333 PolarHBondContact O-N 2.87Å; N331-D333 PolarHBondContact OD1-O 3.14Å; N331-K335 PolarHBondContact ND2-O 2.84Å; N331-K335 PolarHBondContact OD1-O 3.44Å; N331-K335 VanDerWaalsContact OD1-O 3.05Å; N331-M336 WeakPolarHBondContact OD1-CA 3.36Å; N331-N337 PolarHBondContact ND2-ND2 3.3Å
332	E	90.8	Very high	90	Very high	99 Å²	99	23.6 Å²	23.6	46%	0.463	13%	0.13	S	C	.	.	S	Bend	trans	-79.9	-0.3	175.9	-62.5	-167.1	167	0	0	114.4	V54 D314	V54-E332 HydrophobicContact CG1-CG 4.38Å; V54-E332 HydrophobicContact CG2-CB 4.4Å; D314-E332 HydrophobicContact CB-CG 4.33Å; D314-E332 PolarHBondContact O-N 3.01Å; D314-E332 VanDerWaalsContact O-N 3.09Å
333	D	89	Confident	90.1	Very high	70 Å²	70	23.5 Å²	23.5	37%	0.374	13%	0.134	S	C	.	.	S	Bend	trans	-90.8	155.8	172	-75.3	-38.9	0	0	0	111.9	T53 S313 N331 K335	T53-D333 CarbonylContact O-C 3.59Å; T53-D333 VanDerWaalsContact O-C 3.25Å; S313-D333 WeakPolarHBondContact CB-OD2 3.45Å; S313-D333 PolarHBondContact OG-OD2 3.4Å; N331-D333 PolarHBondContact O-N 2.87Å; N331-D333 PolarHBondContact OD1-O 3.14Å; D333-K335 PolarHBondContact O-N 3.31Å
334	P	87.9	Confident	90.3	Very high	43 Å²	43	18.1 Å²	18.1	28%	0.279	11%	0.105	S	C	.	.	S	Bend	trans	-55.4	-35.8	172.2	-29.8	36.9	0	0	0	113.2	E50 M51	E50-P334 CarbonylContact C-O 3.56Å; E50-P334 WeakPolarHBondContact CA-O 3.43Å; E50-P334 VanDerWaalsContact CB-O 3.3Å; E50-P334 WeakPolarHBondContact CB-O 3.32Å; M51-P334 PolarHBondContact N-O 2.85Å; M51-P334 CarbonylContact O-C 3.56Å; M51-P334 WeakPolarHBondContact O-CA 3.19Å; M51-P334 WeakPolarHBondContact O-CB 3.34Å; M51-P334 VanDerWaalsContact O-O 3.07Å
335	K	87.5	Confident	90.3	Very high	18 Å²	18	18.4 Å²	18.4	8%	0.078	11%	0.109	C	C	.	.	B	Isolated β-bridge	trans	-91.3	122.6	177.8	-75.5	-177.3	-179.6	168.9	0	110.9	G17 K18 S19 R42 E50 N331 D333	G17-K335 PolarHBondContact O-NZ 2.91Å; K18-K335 VanDerWaalsContact C-NZ 3.31Å; K18-K335 PolarHBondContact O-NZ 3.38Å; S19-K335 VanDerWaalsContact CA-CE 3.4Å; S19-K335 VanDerWaalsContact CA-NZ 3.35Å; R42-K335 VanDerWaalsContact NH1-NZ 3.14Å; E50-K335 HydrophobicContact CB-CG 4.38Å; N331-K335 PolarHBondContact ND2-O 2.84Å; N331-K335 PolarHBondContact OD1-O 3.44Å; N331-K335 VanDerWaalsContact OD1-O 3.05Å; D333-K335 PolarHBondContact O-N 3.31Å
336	M	90.4	Very high	90.4	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-70.4	142.3	170.6	-63.4	176.3	-153.9	0	0	110.5	S15 F49 M51 C55 I58 A69 N331	S15-M336 WeakPolarHBondContact CB-O 3.15Å; F49-M336 HydrophobicContact CD1-CB 3.77Å; F49-M336 HydrophobicContact CD1-SD 4.42Å; F49-M336 HydrophobicContact CE1-CB 3.42Å; F49-M336 VanDerWaalsContact CE1-CB 3.42Å; F49-M336 HydrophobicContact CE1-CG 4.28Å; F49-M336 HydrophobicContact CE1-SD 3.89Å; F49-M336 HydrophobicContact CE2-SD 4.18Å; F49-M336 HydrophobicContact CZ-CB 4.2Å; F49-M336 HydrophobicContact CZ-SD 3.74Å; M51-M336 HydrophobicContact CB-CE 4.23Å; M51-M336 HydrophobicContact CE-CE 3.48Å; M51-M336 VanDerWaalsContact CE-CE 3.48Å; M51-M336 HydrophobicContact CG-CE 3.16Å; M51-M336 HydrophobicContact SD-CE 4.2Å; C55-M336 HydrophobicContact CB-CE 3.92Å; C55-M336 HydrophobicContact CB-CG 4.02Å; C55-M336 HydrophobicContact CB-SD 4.38Å; C55-M336 VanDerWaalsContact SG-CE 3.58Å; I58-M336 HydrophobicContact CD1-CB 4.31Å; I58-M336 HydrophobicContact CD1-CG 4.1Å; I58-M336 HydrophobicContact CD1-SD 3.54Å; I58-M336 VanDerWaalsContact CD1-SD 3.54Å; I58-M336 HydrophobicContact CG1-SD 4.08Å; A69-M336 HydrophobicContact CB-CE 3.48Å; A69-M336 VanDerWaalsContact CB-CE 3.48Å; A69-M336 HydrophobicContact CB-SD 3.76Å; N331-M336 WeakPolarHBondContact OD1-CA 3.36Å
337	N	90.4	Very high	90.3	Very high	13 Å²	13	22.4 Å²	22.4	7%	0.07	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	133.6	-175.7	-82.6	-29.3	0	0	0	112.1	S15 T329 N331 F339	S15-N337 WeakPolarHBondContact OG-CA 3.23Å; S15-N337 PolarHBondContact OG-OD1 3.14Å; T329-N337 PolarHBondContact N-O 3.27Å; T329-N337 PolarHBondContact O-N 3.19Å; T329-N337 WeakPolarHBondContact OG1-CA 3.49Å; T329-N337 WeakPolarHBondContact OG1-CB 2.97Å; T329-N337 PolarHBondContact OG1-O 2.89Å; N331-N337 PolarHBondContact ND2-ND2 3.3Å; N337-F339 HydrophobicContact CB-CE2 3.89Å; N337-F339 HydrophobicContact CB-CZ 4.12Å
338	T	91.6	Very high	90.1	Very high	15 Å²	15	22.9 Å²	22.9	9%	0.092	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	116	177	43.1	0	0	0	0	109.5	L14 S15 F49 L327 F328	L14-T338 PolarHBondContact N-O 3.41Å; S15-T338 PolarHBondContact OG-N 3.5Å; F49-T338 HydrophobicContact CD1-CG2 4.19Å; F49-T338 HydrophobicContact CE1-CG2 3.82Å; L327-T338 WeakPolarHBondContact O-CA 3.41Å; F328-T338 HydrophobicContact CD1-CG2 3.47Å; F328-T338 VanDerWaalsContact CD1-CG2 3.47Å; F328-T338 HydrophobicContact CE1-CG2 3.49Å; F328-T338 VanDerWaalsContact CE1-CG2 3.49Å
339	F	91.9	Very high	89.8	Confident	5 Å²	5	33.6 Å²	33.6	2%	0.022	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	137.5	176.9	-59.4	-77.1	0	0	0	109.9	I11 Y12 N13 I309 P311 M326 L327 T329 N337	I11-F339 HydrophobicContact CG2-CB 4.43Å; I11-F339 HydrophobicContact CG2-CD1 4.1Å; Y12-F339 CarbonylContact O-C 3.51Å; Y12-F339 WeakPolarHBondContact O-CA 3.42Å; N13-F339 HydrophobicContact CB-CD1 3.89Å; N13-F339 HydrophobicContact CB-CE1 3.75Å; I309-F339 HydrophobicContact CD1-CB 4.31Å; I309-F339 HydrophobicContact CD1-CD2 4.49Å; I309-F339 HydrophobicContact CD1-CG 4.28Å; I309-F339 HydrophobicContact CG2-CD1 3.78Å; I309-F339 HydrophobicContact CG2-CD2 4.18Å; I309-F339 HydrophobicContact CG2-CE1 3.51Å; I309-F339 HydrophobicContact CG2-CE2 3.94Å; I309-F339 HydrophobicContact CG2-CG 4.1Å; I309-F339 HydrophobicContact CG2-CZ 3.61Å; P311-F339 HydrophobicContact CB-CZ 4.25Å; M326-F339 WeakPolarHBondContact CA-O 3.44Å; L327-F339 HydrophobicContact CB-CB 4.23Å; L327-F339 PolarHBondContact N-O 2.99Å; L327-F339 PolarHBondContact O-N 2.85Å; T329-F339 HydrophobicContact CG2-CD2 3.83Å; T329-F339 HydrophobicContact CG2-CE2 3.83Å; N337-F339 HydrophobicContact CB-CE2 3.89Å; N337-F339 HydrophobicContact CB-CZ 4.12Å
340	Y	92.3	Very high	89.6	Confident	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129.9	172.9	-179.7	-127.2	0	0	0	110.2	Y12 M326 P342 G345 A347 L354 D355 T358	Y12-Y340 PolarHBondContact N-O 3.13Å; Y12-Y340 PolarHBondContact O-N 3.39Å; M326-Y340 HydrophobicContact CG-CD2 3.68Å; M326-Y340 HydrophobicContact CG-CE2 4.33Å; Y340-P342 HydrophobicContact CD1-CG 4.18Å; Y340-P342 HydrophobicContact CE1-CB 4.36Å; Y340-P342 HydrophobicContact CE1-CG 3.7Å; Y340-G345 PolarHBondContact OH-O 3.38Å; Y340-A347 HydrophobicContact CE2-CB 4.14Å; Y340-A347 PolarHBondContact OH-N 3.13Å; Y340-A347 VanDerWaalsContact OH-N 3.07Å; Y340-L354 HydrophobicContact CD1-CB 4.44Å; Y340-L354 HydrophobicContact CE1-CB 4.36Å; Y340-D355 VanDerWaalsContact CZ-OD1 3.27Å; Y340-D355 PolarHBondContact OH-OD1 3.12Å; Y340-T358 HydrophobicContact CD1-CG2 4.06Å; Y340-T358 HydrophobicContact CE1-CG2 4.04Å
341	I	91.3	Very high	89.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.188	C	C	.	.			trans	-125.8	100	179.9	-53.4	179.3	0	0	0	107.8	V9 I11 I297 I309 G325 L327 A343 L344	V9-I341 HydrophobicContact CG1-CG2 3.71Å; I11-I341 HydrophobicContact CB-CG1 4.44Å; I11-I341 HydrophobicContact CG1-CD1 4.04Å; I11-I341 HydrophobicContact CG1-CG1 3.99Å; I11-I341 HydrophobicContact CG2-CG1 4.2Å; I297-I341 HydrophobicContact CD1-CD1 3.47Å; I297-I341 VanDerWaalsContact CD1-CD1 3.47Å; I309-I341 HydrophobicContact CD1-CD1 4.06Å; G325-I341 PolarHBondContact O-N 2.96Å; L327-I341 HydrophobicContact CD1-CD1 4.04Å; I341-A343 HydrophobicContact CG2-CB 4.24Å; I341-A343 PolarHBondContact O-N 3.43Å; I341-L344 HydrophobicContact CB-CB 4.05Å; I341-L344 HydrophobicContact CG2-CB 4.08Å; I341-L344 WeakPolarHBondContact O-CB 3.3Å; I341-L344 PolarHBondContact O-N 2.79Å
342	P	89.6	Confident	88.9	Confident	42 Å²	42	39.5 Å²	39.5	27%	0.273	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-30.9	-179.6	-24.1	32.4	0	0	0	113.1	Y12 Y340 L344 G345 T358	Y12-P342 HydrophobicContact CD2-CG 4.03Å; Y12-P342 HydrophobicContact CE2-CG 3.63Å; Y340-P342 HydrophobicContact CD1-CG 4.18Å; Y340-P342 HydrophobicContact CE1-CB 4.36Å; Y340-P342 HydrophobicContact CE1-CG 3.7Å; P342-L344 PolarHBondContact O-N 2.98Å; P342-G345 PolarHBondContact O-N 3.32Å; P342-T358 HydrophobicContact CG-CG2 4.4Å
343	A	88.6	Confident	88.7	Confident	56 Å²	56	40.8 Å²	40.8	46%	0.463	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-19.3	178.5	0	0	0	0	0	113.9	V9 F306 I341	V9-A343 HydrophobicContact CG1-CB 4.03Å; F306-A343 HydrophobicContact CE1-CB 4.37Å; F306-A343 HydrophobicContact CZ-CB 3.89Å; I341-A343 HydrophobicContact CG2-CB 4.24Å; I341-A343 PolarHBondContact O-N 3.43Å
344	L	87.4	Confident	88.6	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.016	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-32	176.8	-163.3	85.6	0	0	0	111.1	H281 L284 L286 I297 I341 P342	H281-L344 PolarHBondContact CE1-O 3.03Å; H281-L344 VanDerWaalsContact CE1-O 3.26Å; L284-L344 HydrophobicContact CD1-CD1 4.46Å; L284-L344 WeakPolarHBondContact CD1-O 3.49Å; L286-L344 HydrophobicContact CD1-CD1 3.38Å; I297-L344 HydrophobicContact CG2-CD1 4.28Å; I341-L344 HydrophobicContact CB-CB 4.05Å; I341-L344 HydrophobicContact CG2-CB 4.08Å; I341-L344 WeakPolarHBondContact O-CB 3.3Å; I341-L344 PolarHBondContact O-N 2.79Å; P342-L344 PolarHBondContact O-N 2.98Å
345	G	87.7	Confident	88.6	Confident	9 Å²	9	37.2 Å²	37.2	9%	0.093	20%	0.198	C	C	.	.			trans	165.1	165.8	179.4	0	0	0	0	0	111.4	G325 Y340 P342	G325-G345 PolarHBondContact N-O 3.04Å; Y340-G345 PolarHBondContact OH-O 3.38Å; P342-G345 PolarHBondContact O-N 3.32Å
346	P	90.3	Very high	88.6	Confident	78 Å²	78	38.7 Å²	38.7	51%	0.506	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-64.5	162.2	-179.8	29	-35.7	0	0	0	111.8	S324 G325	S324-P346 WeakPolarHBondContact CA-O 3.38Å; S324-P346 VanDerWaalsContact CB-O 3.28Å; S324-P346 WeakPolarHBondContact CB-O 3.3Å; G325-P346 PolarHBondContact N-O 2.93Å
347	A	88.9	Confident	88.4	Confident	12 Å²	12	40.2 Å²	40.2	10%	0.099	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-65.7	150.8	172.6	0	0	0	0	0	110.6	Y340 C351 L354 D355	Y340-A347 HydrophobicContact CE2-CB 4.14Å; Y340-A347 PolarHBondContact OH-N 3.13Å; Y340-A347 VanDerWaalsContact OH-N 3.07Å; A347-C351 HydrophobicContact CB-CB 4.38Å; A347-C351 VanDerWaalsContact CB-O 3.27Å; A347-C351 WeakPolarHBondContact CB-O 3.35Å; A347-L354 HydrophobicContact CB-CB 4.12Å; A347-D355 WeakPolarHBondContact CB-OD1 3.01Å; A347-D355 PolarHBondContact N-OD1 3.48Å; A347-D355 PolarHBondContact N-OD2 2.92Å; A347-D355 VanDerWaalsContact N-OD2 3.14Å
348	P	87.6	Confident	88.1	Confident	10 Å²	10	39.9 Å²	39.9	7%	0.065	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-65.6	160.9	177.7	31.6	-38.5	0	0	0	111.2	Y321 M326 W350 C351 S352	Y321-P348 HydrophobicContact CD1-CB 4.08Å; Y321-P348 HydrophobicContact CE1-CB 3.51Å; Y321-P348 HydrophobicContact CE1-CG 4.32Å; M326-P348 HydrophobicContact CE-CG 3.49Å; M326-P348 VanDerWaalsContact CE-CG 3.49Å; M326-P348 WeakPolarHBondContact SD-CD 3.39Å; M326-P348 HydrophobicContact SD-CG 3.73Å; P348-W350 HydrophobicContact CG-CD2 4.25Å; P348-W350 HydrophobicContact CG-CG 4.49Å; P348-W350 HydrophobicContact CG-CZ2 3.97Å; P348-W350 PolarHBondContact O-N 3.34Å; P348-C351 HydrophobicContact CG-CB 4.02Å; P348-C351 CarbonylContact O-C 3.58Å; P348-C351 WeakPolarHBondContact O-CA 3.49Å; P348-C351 PolarHBondContact O-N 2.97Å; P348-S352 PolarHBondContact O-N 3.11Å
349	R	86.4	Confident	87.7	Confident	230 Å²	230	44.8 Å²	44.8	87%	0.868	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-53.7	-33.5	-173.3	-67.9	-177.5	176.8	173.7	-0	114.6	C351	R349-C351 VanDerWaalsContact C-N 3.29Å
350	W	88	Confident	87.3	Confident	37 Å²	37	49.6 Å²	49.6	14%	0.14	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-78.8	-12.6	179	56.8	-90	0	0	0	113.2	V46 T82 Y83 L85 Y321 M326 P348	V46-W350 HydrophobicContact CG2-CH2 4.34Å; V46-W350 HydrophobicContact CG2-CZ3 4.21Å; T82-W350 HydrophobicContact CG2-CD2 4.22Å; T82-W350 HydrophobicContact CG2-CH2 3.95Å; T82-W350 HydrophobicContact CG2-CZ2 3.53Å; T82-W350 HydrophobicContact CG2-CZ3 4.39Å; Y83-W350 HydrophobicContact CD1-CB 4.36Å; L85-W350 HydrophobicContact CD2-CE3 3.37Å; L85-W350 HydrophobicContact CD2-CZ3 3.44Å; L85-W350 VanDerWaalsContact CD2-CZ3 3.44Å; Y321-W350 HydrophobicContact CE2-CZ2 4.25Å; Y321-W350 AromaticContact CE2-NE1 3.76Å; Y321-W350 AromaticContact CZ-NE1 3.53Å; Y321-W350 PolarHBondContact OH-NE1 2.83Å; Y321-W350 VanDerWaalsContact OH-NE1 3.12Å; M326-W350 HydrophobicContact CE-CH2 3.91Å; M326-W350 HydrophobicContact CE-CZ2 3.5Å; P348-W350 HydrophobicContact CG-CD2 4.25Å; P348-W350 HydrophobicContact CG-CG 4.49Å; P348-W350 HydrophobicContact CG-CZ2 3.97Å; P348-W350 PolarHBondContact O-N 3.34Å
351	C	85.3	Confident	86.6	Confident	6 Å²	6	52.7 Å²	52.7	4%	0.041	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-122	32.7	177.2	-73.8	0	0	0	0	113.8	L45 A347 P348 R349 F353 L354	L45-C351 HydrophobicContact CD2-CB 4.34Å; L45-C351 WeakPolarHBondContact CD2-SG 3.49Å; A347-C351 HydrophobicContact CB-CB 4.38Å; A347-C351 VanDerWaalsContact CB-O 3.27Å; A347-C351 WeakPolarHBondContact CB-O 3.35Å; P348-C351 HydrophobicContact CG-CB 4.02Å; P348-C351 CarbonylContact O-C 3.58Å; P348-C351 WeakPolarHBondContact O-CA 3.49Å; P348-C351 PolarHBondContact O-N 2.97Å; R349-C351 VanDerWaalsContact C-N 3.29Å; C351-F353 PolarHBondContact O-N 3.33Å; C351-L354 HydrophobicContact CB-CD1 3.9Å; C351-L354 HydrophobicContact CB-CG 4.14Å; C351-L354 WeakPolarHBondContact O-CB 3.23Å; C351-L354 PolarHBondContact O-N 2.8Å
352	S	85	Confident	85.9	Confident	82 Å²	82	56.9 Å²	56.9	57%	0.573	30%	0.298	S	S	*	.	H	α-helix	trans	-58.5	-22.8	177.3	64.1	0	0	0	0	113.5	P348 L354 D355	P348-S352 PolarHBondContact O-N 3.11Å; S352-L354 PolarHBondContact O-N 2.79Å; S352-D355 PolarHBondContact O-N 3.32Å
353	F	85.9	Confident	85.1	Confident	125 Å²	125	62.9 Å²	62.9	55%	0.548	32%	0.322	S	S	.	.	H	α-helix	trans	-64.1	-27	174.8	175.6	-116.9	0	0	0	113.4	C351 D355 S356 L357	C351-F353 PolarHBondContact O-N 3.33Å; F353-D355 VanDerWaalsContact C-N 3.3Å; F353-D355 PolarHBondContact O-N 3.19Å; F353-S356 PolarHBondContact O-N 2.86Å; F353-L357 HydrophobicContact CD1-CD1 3.63Å; F353-L357 HydrophobicContact CD1-CG 4.09Å; F353-L357 HydrophobicContact CD2-CG 4.26Å; F353-L357 HydrophobicContact CE1-CD1 3.1Å; F353-L357 HydrophobicContact CE1-CD2 4.17Å; F353-L357 HydrophobicContact CE1-CG 3.58Å; F353-L357 HydrophobicContact CE2-CD1 4.24Å; F353-L357 HydrophobicContact CE2-CD2 4.05Å; F353-L357 HydrophobicContact CE2-CG 3.74Å; F353-L357 HydrophobicContact CG-CD1 4.41Å; F353-L357 HydrophobicContact CG-CG 4.43Å; F353-L357 HydrophobicContact CZ-CD1 3.45Å; F353-L357 VanDerWaalsContact CZ-CD1 3.45Å; F353-L357 HydrophobicContact CZ-CD2 3.58Å; F353-L357 HydrophobicContact CZ-CG 3.38Å; F353-L357 PolarHBondContact O-N 2.79Å
354	L	86.3	Confident	83.9	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-38.1	176.8	-71.8	-179.8	0	0	0	111.7	L14 L45 M326 Y340 A347 C351 S352 L357 T358	L14-L354 HydrophobicContact CD1-CD1 4.18Å; L14-L354 HydrophobicContact CD2-CD2 3.72Å; L45-L354 HydrophobicContact CD1-CD1 3.79Å; L45-L354 HydrophobicContact CD1-CD2 4.23Å; L45-L354 HydrophobicContact CD2-CD1 3.76Å; L45-L354 HydrophobicContact CD2-CD2 4.04Å; L45-L354 HydrophobicContact CD2-CG 3.96Å; L45-L354 HydrophobicContact CG-CD1 4.37Å; L45-L354 HydrophobicContact CG-CD2 4.37Å; M326-L354 HydrophobicContact SD-CD1 4.28Å; Y340-L354 HydrophobicContact CD1-CB 4.44Å; Y340-L354 HydrophobicContact CE1-CB 4.36Å; A347-L354 HydrophobicContact CB-CB 4.12Å; C351-L354 HydrophobicContact CB-CD1 3.9Å; C351-L354 HydrophobicContact CB-CG 4.14Å; C351-L354 WeakPolarHBondContact O-CB 3.23Å; C351-L354 PolarHBondContact O-N 2.8Å; S352-L354 PolarHBondContact O-N 2.79Å; L354-L357 PolarHBondContact O-N 3.4Å; L354-T358 WeakPolarHBondContact O-CG2 3.25Å; L354-T358 PolarHBondContact O-N 3.38Å; L354-T358 PolarHBondContact O-OG1 2.83Å
355	D	87.8	Confident	82.5	Confident	36 Å²	36	68.1 Å²	68.1	19%	0.193	35%	0.353	C	S	.	.	H	α-helix	trans	-62.5	-49.2	178.4	-70.2	-13.9	0	0	0	110.5	Y340 A347 S352 F353 L357 T358 E359	Y340-D355 VanDerWaalsContact CZ-OD1 3.27Å; Y340-D355 PolarHBondContact OH-OD1 3.12Å; A347-D355 WeakPolarHBondContact CB-OD1 3.01Å; A347-D355 PolarHBondContact N-OD1 3.48Å; A347-D355 PolarHBondContact N-OD2 2.92Å; A347-D355 VanDerWaalsContact N-OD2 3.14Å; S352-D355 PolarHBondContact O-N 3.32Å; F353-D355 VanDerWaalsContact C-N 3.3Å; F353-D355 PolarHBondContact O-N 3.19Å; D355-L357 VanDerWaalsContact C-N 3.33Å; D355-L357 PolarHBondContact O-N 2.95Å; D355-T358 WeakPolarHBondContact CA-OG1 3.28Å; D355-T358 PolarHBondContact O-N 3.3Å; D355-T358 VanDerWaalsContact O-N 3.17Å; D355-T358 PolarHBondContact O-OG1 2.83Å; D355-E359 WeakPolarHBondContact O-CB 3.49Å; D355-E359 WeakPolarHBondContact O-CG 3.47Å; D355-E359 PolarHBondContact O-N 2.78Å
356	S	88.6	Confident	80.6	Confident	50 Å²	50	75.3 Å²	75.3	35%	0.35	38%	0.384	S	S	.	.	H	α-helix	trans	-57.5	-44	174.9	-173.9	0	0	0	0	112.2	F353 E359 E360	F353-S356 PolarHBondContact O-N 2.86Å; S356-E359 PolarHBondContact O-N 2.92Å; S356-E360 WeakPolarHBondContact O-CB 3.42Å; S356-E360 VanDerWaalsContact O-CG 3.27Å; S356-E360 WeakPolarHBondContact O-CG 3.47Å; S356-E360 PolarHBondContact O-N 2.95Å
357	L	84.9	Confident	79	Confident	33 Å²	33	76.2 Å²	76.2	17%	0.173	39%	0.392	C	S	.	.	H	α-helix	trans	-65.7	-40.7	177.7	-84.1	178.6	0	0	0	112.4	I43 F353 L354 D355 L361	I43-L357 HydrophobicContact CD1-CD1 3.72Å; F353-L357 HydrophobicContact CD1-CD1 3.63Å; F353-L357 HydrophobicContact CD1-CG 4.09Å; F353-L357 HydrophobicContact CD2-CG 4.26Å; F353-L357 HydrophobicContact CE1-CD1 3.1Å; F353-L357 HydrophobicContact CE1-CD2 4.17Å; F353-L357 HydrophobicContact CE1-CG 3.58Å; F353-L357 HydrophobicContact CE2-CD1 4.24Å; F353-L357 HydrophobicContact CE2-CD2 4.05Å; F353-L357 HydrophobicContact CE2-CG 3.74Å; F353-L357 HydrophobicContact CG-CD1 4.41Å; F353-L357 HydrophobicContact CG-CG 4.43Å; F353-L357 HydrophobicContact CZ-CD1 3.45Å; F353-L357 VanDerWaalsContact CZ-CD1 3.45Å; F353-L357 HydrophobicContact CZ-CD2 3.58Å; F353-L357 HydrophobicContact CZ-CG 3.38Å; F353-L357 PolarHBondContact O-N 2.79Å; L354-L357 PolarHBondContact O-N 3.4Å; D355-L357 VanDerWaalsContact C-N 3.33Å; D355-L357 PolarHBondContact O-N 2.95Å; L357-L361 VanDerWaalsContact O-CB 3.24Å; L357-L361 WeakPolarHBondContact O-CB 3.48Å; L357-L361 PolarHBondContact O-N 3.33Å
358	T	84.1	Confident	77.2	Confident	5 Å²	5	78.9 Å²	78.9	3%	0.031	41%	0.407	C	S	.	.	H	α-helix	trans	-67.1	-44	177.5	49.9	0	0	0	0	110	M1 Y12 Y340 P342 L354 D355 E360 L361 E362	M1-T358 HydrophobicContact CE-CG2 3.97Å; Y12-T358 HydrophobicContact CD1-CG2 4.33Å; Y12-T358 HydrophobicContact CD2-CG2 3.9Å; Y12-T358 HydrophobicContact CE1-CG2 4.14Å; Y12-T358 HydrophobicContact CE2-CG2 3.73Å; Y12-T358 HydrophobicContact CG-CG2 4.19Å; Y340-T358 HydrophobicContact CD1-CG2 4.06Å; Y340-T358 HydrophobicContact CE1-CG2 4.04Å; P342-T358 HydrophobicContact CG-CG2 4.4Å; L354-T358 WeakPolarHBondContact O-CG2 3.25Å; L354-T358 PolarHBondContact O-N 3.38Å; L354-T358 PolarHBondContact O-OG1 2.83Å; D355-T358 WeakPolarHBondContact CA-OG1 3.28Å; D355-T358 PolarHBondContact O-N 3.3Å; D355-T358 VanDerWaalsContact O-N 3.17Å; D355-T358 PolarHBondContact O-OG1 2.83Å; T358-E360 PolarHBondContact O-N 3.48Å; T358-L361 CarbonylContact O-C 3.56Å; T358-L361 PolarHBondContact O-N 2.83Å; T358-L361 VanDerWaalsContact O-N 3.1Å; T358-E362 WeakPolarHBondContact O-CB 3.5Å; T358-E362 WeakPolarHBondContact O-CG 3.48Å; T358-E362 PolarHBondContact O-N 2.86Å
359	E	83.8	Confident	75.7	Confident	118 Å²	118	84.2 Å²	84.2	55%	0.551	44%	0.439	S	S	*	.	H	α-helix	trans	-58.4	-47.1	175.1	-73.8	176	-178.3	0	0	111.6	D355 S356 L361 E362 E363	D355-E359 WeakPolarHBondContact O-CB 3.49Å; D355-E359 WeakPolarHBondContact O-CG 3.47Å; D355-E359 PolarHBondContact O-N 2.78Å; S356-E359 PolarHBondContact O-N 2.92Å; E359-L361 VanDerWaalsContact C-N 3.28Å; E359-L361 PolarHBondContact O-N 3.41Å; E359-E362 CarbonylContact O-C 3.42Å; E359-E362 PolarHBondContact O-N 2.83Å; E359-E362 VanDerWaalsContact O-N 3.1Å; E359-E363 WeakPolarHBondContact O-CG 3.28Å; E359-E363 PolarHBondContact O-N 2.98Å
360	E	83.3	Confident	74.2	Confident	107 Å²	107	78.5 Å²	78.5	50%	0.5	42%	0.419	S	S	.	.	H	α-helix	trans	-58.6	-39.9	174.4	-75.7	174.8	-166.7	0	0	112.2	S356 T358 E362 E363 S364	S356-E360 WeakPolarHBondContact O-CB 3.42Å; S356-E360 VanDerWaalsContact O-CG 3.27Å; S356-E360 WeakPolarHBondContact O-CG 3.47Å; S356-E360 PolarHBondContact O-N 2.95Å; T358-E360 PolarHBondContact O-N 3.48Å; E360-E362 VanDerWaalsContact C-N 3.34Å; E360-E363 PolarHBondContact O-N 3.25Å; E360-S364 WeakPolarHBondContact O-CB 3.22Å; E360-S364 PolarHBondContact O-N 3.45Å; E360-S364 PolarHBondContact O-OG 2.86Å
361	L	79	Confident	72.8	Confident	66 Å²	66	81.7 Å²	81.7	35%	0.346	44%	0.439	S	S	.	.	H	α-helix	trans	-75.5	-25.2	178.7	-161.6	62.8	0	0	0	112.3	M1 I3 Y12 L357 T358 E359 S364	M1-L361 HydrophobicContact SD-CD2 4.48Å; I3-L361 HydrophobicContact CD1-CD2 3.61Å; I3-L361 HydrophobicContact CD1-CG 4.07Å; I3-L361 HydrophobicContact CG1-CD2 4.29Å; Y12-L361 HydrophobicContact CE1-CD2 4.01Å; L357-L361 VanDerWaalsContact O-CB 3.24Å; L357-L361 WeakPolarHBondContact O-CB 3.48Å; L357-L361 PolarHBondContact O-N 3.33Å; T358-L361 CarbonylContact O-C 3.56Å; T358-L361 PolarHBondContact O-N 2.83Å; T358-L361 VanDerWaalsContact O-N 3.1Å; E359-L361 VanDerWaalsContact C-N 3.28Å; E359-L361 PolarHBondContact O-N 3.41Å; L361-S364 CarbonylContact O-C 3.55Å
362	E	74.7	Confident	72.4	Confident	88 Å²	88	86.4 Å²	86.4	41%	0.411	46%	0.463	S	S	.	.	H	α-helix	trans	-76.5	-33.1	170.9	-67.1	-156.3	135.1	0	0	112.4	K10 T358 E359 E360 P365	K10-E362 HydrophobicContact CD-CG 4.45Å; K10-E362 WeakPolarHBondContact CD-OE1 3.47Å; K10-E362 WeakPolarHBondContact CE-OE1 3.11Å; K10-E362 VanDerWaalsContact NZ-CD 3.27Å; K10-E362 VanDerWaalsContact NZ-CG 3.27Å; K10-E362 IonicContact NZ-OE1 2.96Å; K10-E362 PolarHBondContact NZ-OE1 3.28Å; T358-E362 WeakPolarHBondContact O-CB 3.5Å; T358-E362 WeakPolarHBondContact O-CG 3.48Å; T358-E362 PolarHBondContact O-N 2.86Å; E359-E362 CarbonylContact O-C 3.42Å; E359-E362 PolarHBondContact O-N 2.83Å; E359-E362 VanDerWaalsContact O-N 3.1Å; E360-E362 VanDerWaalsContact C-N 3.34Å; E362-P365 WeakPolarHBondContact O-CD 3.39Å
363	E	73.6	Confident	72.3	Confident	167 Å²	167	87.1 Å²	87.1	78%	0.78	45%	0.454	S	S	*	.	H	α-helix	trans	-73.7	-26.8	172.7	-72.5	-176.4	176.3	0	0	112.4	E359 E360 P365	E359-E363 WeakPolarHBondContact O-CG 3.28Å; E359-E363 PolarHBondContact O-N 2.98Å; E360-E363 PolarHBondContact O-N 3.25Å; E363-P365 WeakPolarHBondContact O-CD 3.38Å
364	S	62.9	Low	72.2	Confident	67 Å²	67	84.8 Å²	84.8	47%	0.469	44%	0.444	S	S	.	.			trans	-113.6	58.1	178.4	60.4	0	0	0	0	114	E360 L361 E366	E360-S364 WeakPolarHBondContact O-CB 3.22Å; E360-S364 PolarHBondContact O-N 3.45Å; E360-S364 PolarHBondContact O-OG 2.86Å; L361-S364 CarbonylContact O-C 3.55Å; S364-E366 PolarHBondContact O-N 3.08Å
365	P	58.7	Low	72.3	Confident	102 Å²	102	88 Å²	88	66%	0.662	46%	0.458	S	S	*	.			trans	-70.7	-13	177.7	31.7	-34	0	0	0	112.5	E362 E363 S367	E362-P365 WeakPolarHBondContact O-CD 3.39Å; E363-P365 WeakPolarHBondContact O-CD 3.38Å; P365-S367 VanDerWaalsContact C-N 3.31Å; P365-S367 PolarHBondContact O-N 3.46Å; P365-S367 VanDerWaalsContact O-N 3.12Å
366	E	48.5	Very low	72.2	Confident	161 Å²	161	86.3 Å²	86.3	75%	0.752	45%	0.449	S	S	*	.			trans	-84	73.8	172	-63.4	-170.7	-179	0	0	110.1	S364 T368	S364-E366 PolarHBondContact O-N 3.08Å; E366-T368 PolarHBondContact O-N 3.1Å
367	S	55	Low	72.3	Confident	97 Å²	97	86.1 Å²	86.1	68%	0.678	45%	0.446	S	S	*	.			trans	-69	81.2	154.2	67	0	0	0	0	107.1	P365 V369	P365-S367 VanDerWaalsContact C-N 3.31Å; P365-S367 PolarHBondContact O-N 3.46Å; P365-S367 VanDerWaalsContact O-N 3.12Å; S367-V369 PolarHBondContact O-N 2.77Å
368	T	51.2	Low	72.3	Confident	67 Å²	67	92 Å²	92	41%	0.411	47%	0.466	S	S	.	.			trans	-57.2	109	171.3	29.8	0	0	0	0	107.3	E366 Y370 D371	E366-T368 PolarHBondContact O-N 3.1Å; T368-Y370 PolarHBondContact O-N 2.91Å; T368-D371 PolarHBondContact O-N 3.28Å; T368-D371 VanDerWaalsContact O-N 3.1Å; T368-D371 PolarHBondContact OG1-OD1 3.44Å
369	V	56.2	Low	72.4	Confident	122 Å²	122	99.3 Å²	99.3	74%	0.739	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-1.2	174.4	178	0	0	0	0	112.3	S367	S367-V369 PolarHBondContact O-N 2.77Å
370	Y	56.1	Low	72.4	Confident	111 Å²	111	96.9 Å²	96.9	44%	0.435	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	17.3	-177.4	-57.2	-66.7	0	0	0	114.4	T368 D372 Y373	T368-Y370 PolarHBondContact O-N 2.91Å; Y370-D372 PolarHBondContact O-N 3.16Å; Y370-Y373 HydrophobicContact CD1-CD2 4.13Å; Y370-Y373 PolarHBondContact O-N 2.72Å; Y370-Y373 VanDerWaalsContact O-O 3.11Å
371	D	58.4	Low	72.5	Confident	104 Å²	104	91.9 Å²	91.9	56%	0.556	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.9	176.6	-75.7	-6.5	0	0	0	113.2	T368 Y373	T368-D371 PolarHBondContact O-N 3.28Å; T368-D371 VanDerWaalsContact O-N 3.1Å; T368-D371 PolarHBondContact OG1-OD1 3.44Å; D371-Y373 VanDerWaalsContact C-N 3.32Å
372	D	75.9	Confident	72.8	Confident	105 Å²	105	93.4 Å²	93.4	56%	0.561	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-2.4	178.7	-71.9	-36	0	0	0	113.5	Y370 I406	Y370-D372 PolarHBondContact O-N 3.16Å; D372-I406 WeakPolarHBondContact O-CB 3.41Å; D372-I406 PolarHBondContact O-N 2.82Å
373	Y	82.7	Confident	73.3	Confident	97 Å²	97	95.3 Å²	95.3	38%	0.38	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.4	-177.4	-74	-81.4	0	0	0	111.6	Y370 D371 F403 M404 D405	Y370-Y373 HydrophobicContact CD1-CD2 4.13Å; Y370-Y373 PolarHBondContact O-N 2.72Å; Y370-Y373 VanDerWaalsContact O-O 3.11Å; D371-Y373 VanDerWaalsContact C-N 3.32Å; Y373-F403 HydrophobicContact CD1-CB 4.1Å; Y373-F403 HydrophobicContact CG-CB 4.41Å; Y373-M404 CarbonylContact C-O 3.57Å; Y373-M404 WeakPolarHBondContact CA-O 3.3Å; Y373-D405 WeakPolarHBondContact CE1-OD1 3.38Å; Y373-D405 PolarHBondContact OH-OD1 3.48Å; Y373-D405 VanDerWaalsContact OH-OD1 3.11Å
374	K	84.8	Confident	73.8	Confident	76 Å²	76	88.5 Å²	88.5	33%	0.33	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	128.5	170.3	-175.8	166.4	-178.8	171.3	0	110.1	V376 M404 Y409	K374-V376 HydrophobicContact CG-CG2 4.29Å; K374-V376 PolarHBondContact O-N 2.93Å; K374-M404 PolarHBondContact N-O 3.23Å; K374-M404 PolarHBondContact O-N 2.73Å; K374-Y409 HydrophobicContact CD-CD1 3.55Å; K374-Y409 HydrophobicContact CD-CD2 3.87Å; K374-Y409 HydrophobicContact CD-CE1 3.54Å; K374-Y409 HydrophobicContact CD-CE2 3.85Å; K374-Y409 HydrophobicContact CD-CG 3.73Å; K374-Y409 PolarHBondContact NZ-OH 2.9Å
375	F	87.9	Confident	74.7	Confident	70 Å²	70	87.7 Å²	87.7	31%	0.307	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	124.5	167.1	-173.8	-104.3	0	0	0	109.8	T377 Y398 H400 F403	F375-T377 HydrophobicContact CE1-CG2 4.12Å; F375-Y398 HydrophobicContact CE2-CD1 4.41Å; F375-H400 AromaticContact CZ-CD2 3.82Å; F375-H400 AromaticContact CZ-NE2 3.88Å; F375-F403 HydrophobicContact CB-CD1 4.18Å; F375-F403 HydrophobicContact CB-CE1 3.85Å; F375-F403 HydrophobicContact CD2-CD1 4.44Å; F375-F403 HydrophobicContact CD2-CE1 4.17Å; F375-F403 HydrophobicContact CD2-CE2 4.35Å; F375-F403 HydrophobicContact CD2-CZ 4.12Å
376	V	86.9	Confident	75.8	Confident	0 Å²	0	83.9 Å²	83.9	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.5	-178.5	-176.8	0	0	0	0	107.7	K374 D380 L381 G401 F402 M404 Y409	K374-V376 HydrophobicContact CG-CG2 4.29Å; K374-V376 PolarHBondContact O-N 2.93Å; V376-D380 HydrophobicContact CG1-CB 3.59Å; V376-L381 HydrophobicContact CB-CD1 4.34Å; V376-L381 HydrophobicContact CG1-CB 4.05Å; V376-L381 HydrophobicContact CG1-CD1 3.94Å; V376-L381 HydrophobicContact CG1-CG 4.32Å; V376-G401 WeakPolarHBondContact O-CA 3.4Å; V376-F402 PolarHBondContact N-O 2.95Å; V376-F402 PolarHBondContact O-N 3.22Å; V376-M404 HydrophobicContact CG2-CB 4.24Å; V376-M404 HydrophobicContact CG2-CE 4.08Å; V376-Y409 HydrophobicContact CG2-CD2 3.78Å; V376-Y409 HydrophobicContact CG2-CE2 4.02Å
377	T	89.2	Confident	77.4	Confident	46 Å²	46	78.6 Å²	78.6	28%	0.282	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	160	175.6	69.5	0	0	0	0	110.3	F375 K379 D380 L381	F375-T377 HydrophobicContact CE1-CG2 4.12Å; T377-K379 PolarHBondContact O-N 2.74Å; T377-D380 PolarHBondContact N-OD2 3.38Å; T377-D380 PolarHBondContact O-N 3.15Å; T377-D380 VanDerWaalsContact O-N 3.09Å; T377-D380 PolarHBondContact OG1-N 3.34Å; T377-D380 PolarHBondContact OG1-OD2 2.92Å; T377-L381 PolarHBondContact O-N 3.49Å
378	R	85.1	Confident	78.8	Confident	157 Å²	157	82.3 Å²	82.3	59%	0.592	42%	0.415	S	S	*	.	H	α-helix	trans	-55.4	-37	176.6	-174.2	175	176.2	169.2	4.6	112.7	L381 E382	R378-L381 PolarHBondContact O-N 2.97Å; R378-E382 IonicContact NE-OE1 3.09Å; R378-E382 PolarHBondContact NE-OE1 3.44Å; R378-E382 WeakPolarHBondContact O-CG 3.46Å; R378-E382 PolarHBondContact O-N 3.2Å
379	K	86.8	Confident	80.2	Confident	158 Å²	158	81.8 Å²	81.8	69%	0.687	41%	0.409	S	S	*	.	H	α-helix	trans	-65	-42.6	176.8	-63.6	-177.1	179.1	-178.3	0	112.1	T377 L381 E382 N383	T377-K379 PolarHBondContact O-N 2.74Å; K379-L381 VanDerWaalsContact C-N 3.28Å; K379-L381 PolarHBondContact O-N 2.94Å; K379-E382 PolarHBondContact O-N 3.14Å; K379-N383 PolarHBondContact O-N 2.95Å; K379-N383 PolarHBondContact O-ND2 3.41Å
380	D	84.3	Confident	81.4	Confident	67 Å²	67	79.6 Å²	79.6	36%	0.358	39%	0.392	S	S	.	.	H	α-helix	trans	-66.8	-34.1	177.3	-61.6	-39.6	0	0	0	111.7	V376 T377 N383 L384	V376-D380 HydrophobicContact CG1-CB 3.59Å; T377-D380 PolarHBondContact N-OD2 3.38Å; T377-D380 PolarHBondContact O-N 3.15Å; T377-D380 VanDerWaalsContact O-N 3.09Å; T377-D380 PolarHBondContact OG1-N 3.34Å; T377-D380 PolarHBondContact OG1-OD2 2.92Å; D380-N383 PolarHBondContact O-N 3.14Å; D380-L384 WeakPolarHBondContact O-CB 3.41Å; D380-L384 WeakPolarHBondContact O-CD1 3.43Å; D380-L384 WeakPolarHBondContact O-CG 3.49Å; D380-L384 PolarHBondContact O-N 3.42Å
381	L	85.6	Confident	82.4	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.005	41%	0.409	C	S	.	.	H	α-helix	trans	-71.6	-35.1	179.4	-144.5	132.6	0	0	0	111.8	V376 T377 R378 K379 G385 L386 I390 L395 F402	V376-L381 HydrophobicContact CB-CD1 4.34Å; V376-L381 HydrophobicContact CG1-CB 4.05Å; V376-L381 HydrophobicContact CG1-CD1 3.94Å; V376-L381 HydrophobicContact CG1-CG 4.32Å; T377-L381 PolarHBondContact O-N 3.49Å; R378-L381 PolarHBondContact O-N 2.97Å; K379-L381 VanDerWaalsContact C-N 3.28Å; K379-L381 PolarHBondContact O-N 2.94Å; L381-G385 PolarHBondContact O-N 3.18Å; L381-L386 HydrophobicContact CD2-CB 3.71Å; L381-L386 WeakPolarHBondContact CD2-O 3.31Å; L381-L386 HydrophobicContact CG-CB 4Å; L381-L386 PolarHBondContact O-N 3.35Å; L381-I390 HydrophobicContact CD2-CD1 4.41Å; L381-I390 HydrophobicContact CD2-CG1 4.07Å; L381-L395 HydrophobicContact CD1-CD1 3.57Å; L381-L395 HydrophobicContact CD1-CD2 3.9Å; L381-L395 HydrophobicContact CD1-CG 4.39Å; L381-L395 HydrophobicContact CD2-CD1 3.8Å; L381-L395 HydrophobicContact CG-CD1 4.24Å; L381-F402 HydrophobicContact CD1-CB 3.97Å; L381-F402 HydrophobicContact CD1-CD2 3.75Å; L381-F402 HydrophobicContact CD1-CG 4.08Å
382	E	84.7	Confident	83.6	Confident	98 Å²	98	74.9 Å²	74.9	46%	0.458	40%	0.396	S	S	.	.	H	α-helix	trans	-67.9	-44.1	170.7	-73.6	167.5	-170.9	0	0	111.4	R378 K379 L384 G385	R378-E382 IonicContact NE-OE1 3.09Å; R378-E382 PolarHBondContact NE-OE1 3.44Å; R378-E382 WeakPolarHBondContact O-CG 3.46Å; R378-E382 PolarHBondContact O-N 3.2Å; K379-E382 PolarHBondContact O-N 3.14Å; E382-L384 VanDerWaalsContact C-N 3.25Å; E382-L384 PolarHBondContact O-N 2.78Å; E382-G385 PolarHBondContact O-N 3.24Å
383	N	84.6	Confident	83.8	Confident	129 Å²	129	76 Å²	76	69%	0.69	41%	0.412	S	S	*	.	H	α-helix	trans	-62.3	-31.8	175.3	-70.9	-18.5	0	0	0	113.1	K379 D380 G385	K379-N383 PolarHBondContact O-N 2.95Å; K379-N383 PolarHBondContact O-ND2 3.41Å; D380-N383 PolarHBondContact O-N 3.14Å; N383-G385 VanDerWaalsContact C-N 3.3Å
384	L	83.5	Confident	83.7	Confident	23 Å²	23	75.3 Å²	75.3	12%	0.12	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.1	175.8	-69.4	170.5	0	0	0	113.2	D380 E382 L386 Y409 V412 K413 A416	D380-L384 WeakPolarHBondContact O-CB 3.41Å; D380-L384 WeakPolarHBondContact O-CD1 3.43Å; D380-L384 WeakPolarHBondContact O-CG 3.49Å; D380-L384 PolarHBondContact O-N 3.42Å; E382-L384 VanDerWaalsContact C-N 3.25Å; E382-L384 PolarHBondContact O-N 2.78Å; L384-L386 VanDerWaalsContact C-N 3.31Å; L384-L386 HydrophobicContact CB-CD1 4.36Å; L384-L386 HydrophobicContact CB-CG 4.2Å; L384-L386 PolarHBondContact O-N 2.81Å; L384-Y409 HydrophobicContact CD1-CD2 3.98Å; L384-Y409 HydrophobicContact CD1-CE2 3.6Å; L384-V412 HydrophobicContact CB-CG1 3.91Å; L384-V412 HydrophobicContact CD2-CG1 4.19Å; L384-V412 WeakPolarHBondContact O-CG1 3.43Å; L384-K413 HydrophobicContact CD2-CB 4.34Å; L384-A416 HydrophobicContact CD2-CB 4.02Å
385	G	82.2	Confident	83.7	Confident	50 Å²	50	72.1 Å²	72.1	52%	0.515	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	21.2	-179.8	0	0	0	0	0	114.7	L381 E382 N383	L381-G385 PolarHBondContact O-N 3.18Å; E382-G385 PolarHBondContact O-N 3.24Å; N383-G385 VanDerWaalsContact C-N 3.3Å
386	L	81.6	Confident	83.5	Confident	23 Å²	23	77 Å²	77	12%	0.12	42%	0.417	C	S	.	.			trans	-100.5	13	-174.6	-63.1	-178.2	0	0	0	114.2	L381 L384 H388 L389 M404 V412	L381-L386 HydrophobicContact CD2-CB 3.71Å; L381-L386 WeakPolarHBondContact CD2-O 3.31Å; L381-L386 HydrophobicContact CG-CB 4Å; L381-L386 PolarHBondContact O-N 3.35Å; L384-L386 VanDerWaalsContact C-N 3.31Å; L384-L386 HydrophobicContact CB-CD1 4.36Å; L384-L386 HydrophobicContact CB-CG 4.2Å; L384-L386 PolarHBondContact O-N 2.81Å; L386-H388 PolarHBondContact O-N 3.17Å; L386-L389 HydrophobicContact CB-CD1 4.24Å; L386-L389 HydrophobicContact CD1-CD1 4.43Å; L386-L389 HydrophobicContact CD2-CD1 3.81Å; L386-L389 HydrophobicContact CG-CD1 4.38Å; L386-L389 WeakPolarHBondContact O-CB 3.36Å; L386-L389 PolarHBondContact O-N 3.19Å; L386-M404 HydrophobicContact CD1-CE 3.81Å; L386-M404 HydrophobicContact CD1-SD 3.66Å; L386-V412 HydrophobicContact CD1-CB 4.17Å; L386-V412 HydrophobicContact CD1-CG1 3.83Å; L386-V412 HydrophobicContact CD1-CG2 3.94Å; L386-V412 HydrophobicContact CD2-CG1 3.89Å; L386-V412 HydrophobicContact CD2-CG2 3.95Å; L386-V412 HydrophobicContact CG-CG1 3.83Å; L386-V412 HydrophobicContact CG-CG2 4.4Å
387	S	82.6	Confident	83.3	Confident	50 Å²	50	80.6 Å²	80.6	35%	0.35	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-54.9	-27.9	-177.2	56.3	0	0	0	0	113.5	L389 I390	S387-L389 VanDerWaalsContact C-N 3.25Å; S387-L389 PolarHBondContact O-N 3.32Å; S387-I390 WeakPolarHBondContact O-CD1 3.3Å; S387-I390 VanDerWaalsContact O-CG1 3.29Å; S387-I390 WeakPolarHBondContact O-CG1 3.38Å; S387-I390 PolarHBondContact O-N 3.43Å
388	H	83.4	Confident	83	Confident	175 Å²	175	84.3 Å²	84.3	81%	0.81	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-67.8	-17.6	175.9	-56	-58.3	0	0	0	114.7	L386 I390	L386-H388 PolarHBondContact O-N 3.17Å; H388-I390 VanDerWaalsContact C-N 3.33Å
389	L	81.1	Confident	82.9	Confident	56 Å²	56	84.4 Å²	84.4	29%	0.293	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-86.4	-4.1	-179.8	-67.2	177	0	0	0	113.3	L386 S387 G391 S392 L394 L395	L386-L389 HydrophobicContact CB-CD1 4.24Å; L386-L389 HydrophobicContact CD1-CD1 4.43Å; L386-L389 HydrophobicContact CD2-CD1 3.81Å; L386-L389 HydrophobicContact CG-CD1 4.38Å; L386-L389 WeakPolarHBondContact O-CB 3.36Å; L386-L389 PolarHBondContact O-N 3.19Å; S387-L389 VanDerWaalsContact C-N 3.25Å; S387-L389 PolarHBondContact O-N 3.32Å; L389-G391 PolarHBondContact O-N 3.45Å; L389-S392 WeakPolarHBondContact O-CB 3.25Å; L389-S392 PolarHBondContact O-N 3.07Å; L389-S392 PolarHBondContact O-OG 3.29Å; L389-L394 HydrophobicContact CD2-CD1 4.39Å; L389-L395 HydrophobicContact CB-CD1 3.61Å; L389-L395 HydrophobicContact CB-CG 4.22Å
390	I	82.1	Confident	82.5	Confident	75 Å²	75	84 Å²	84	39%	0.385	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	118	177.3	-62.7	171.9	0	0	0	108.7	L381 S387 H388 F402	L381-I390 HydrophobicContact CD2-CD1 4.41Å; L381-I390 HydrophobicContact CD2-CG1 4.07Å; S387-I390 WeakPolarHBondContact O-CD1 3.3Å; S387-I390 VanDerWaalsContact O-CG1 3.29Å; S387-I390 WeakPolarHBondContact O-CG1 3.38Å; S387-I390 PolarHBondContact O-N 3.43Å; H388-I390 VanDerWaalsContact C-N 3.33Å; I390-F402 HydrophobicContact CB-CZ 4.44Å; I390-F402 HydrophobicContact CD1-CE2 4.29Å; I390-F402 HydrophobicContact CD1-CZ 4.19Å; I390-F402 HydrophobicContact CG1-CE1 4.41Å; I390-F402 HydrophobicContact CG1-CE2 4.21Å; I390-F402 HydrophobicContact CG1-CZ 3.92Å; I390-F402 HydrophobicContact CG2-CE1 4.01Å; I390-F402 HydrophobicContact CG2-CZ 3.81Å
391	G	77.6	Confident	82.5	Confident	76 Å²	76	81.1 Å²	81.1	78%	0.784	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.1	-7.5	-176.4	0	0	0	0	0	114.8	L389	L389-G391 PolarHBondContact O-N 3.45Å
392	S	83.1	Confident	82.7	Confident	40 Å²	40	82.3 Å²	82.3	28%	0.28	46%	0.457	S	S	.	.	S	Bend	trans	-80.9	159	169.6	74.2	0	0	0	0	111.9	L389 L394 L395	L389-S392 WeakPolarHBondContact O-CB 3.25Å; L389-S392 PolarHBondContact O-N 3.07Å; L389-S392 PolarHBondContact O-OG 3.29Å; S392-L394 PolarHBondContact O-N 2.76Å; S392-L394 VanDerWaalsContact O-N 3.1Å; S392-L395 PolarHBondContact O-N 3.18Å
393	S	79.8	Confident	82.8	Confident	129 Å²	129	79 Å²	79	90%	0.902	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-10	176.5	55.2	0	0	0	0	114.5
394	L	80.4	Confident	82.9	Confident	83 Å²	83	73.1 Å²	73.1	44%	0.435	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-20.2	-179.6	-62.6	171	0	0	0	113.2	L389 S392 L408	L389-L394 HydrophobicContact CD2-CD1 4.39Å; S392-L394 PolarHBondContact O-N 2.76Å; S392-L394 VanDerWaalsContact O-N 3.1Å; L394-L408 HydrophobicContact CD2-CD1 4.1Å
395	L	84.8	Confident	83	Confident	9 Å²	9	74.7 Å²	74.7	5%	0.047	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	111.6	176.6	-69.5	-179.9	0	0	0	109.2	L381 L389 S392 F402 M404	L381-L395 HydrophobicContact CD1-CD1 3.57Å; L381-L395 HydrophobicContact CD1-CD2 3.9Å; L381-L395 HydrophobicContact CD1-CG 4.39Å; L381-L395 HydrophobicContact CD2-CD1 3.8Å; L381-L395 HydrophobicContact CG-CD1 4.24Å; L389-L395 HydrophobicContact CB-CD1 3.61Å; L389-L395 HydrophobicContact CB-CG 4.22Å; S392-L395 PolarHBondContact O-N 3.18Å; L395-F402 HydrophobicContact CB-CB 4.21Å; L395-F402 HydrophobicContact CB-CD1 4.14Å; L395-F402 HydrophobicContact CB-CG 4.43Å; L395-F402 HydrophobicContact CD2-CB 4.18Å; L395-M404 HydrophobicContact CD2-CB 3.57Å; L395-M404 HydrophobicContact CD2-CG 3.77Å; L395-M404 HydrophobicContact CD2-SD 3.84Å
396	R	83.6	Confident	83.1	Confident	173 Å²	173	75.1 Å²	75.1	65%	0.653	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	112.5	176.3	-171.9	174.2	-177.5	107.4	-0.8	109.3	Y398 F402 F403	R396-Y398 PolarHBondContact O-N 3.31Å; R396-F402 CarbonylContact O-C 3.56Å; R396-F402 WeakPolarHBondContact O-CA 3.47Å; R396-F403 HydrophobicContact CB-CB 4.28Å; R396-F403 PolarHBondContact N-O 3.49Å; R396-F403 PolarHBondContact O-N 2.97Å
397	A	82.6	Confident	83.3	Confident	74 Å²	74	83.3 Å²	83.3	61%	0.612	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	132.6	175.8	0	0	0	0	0	110.6	F402	A397-F402 HydrophobicContact CB-CD1 4.13Å; A397-F402 HydrophobicContact CB-CE1 4.07Å
398	Y	83.5	Confident	83.4	Confident	125 Å²	125	83.6 Å²	83.6	49%	0.49	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	120	174.8	-172.9	-99.9	0	0	0	110.6	F375 R396 H400 G401 F403	F375-Y398 HydrophobicContact CE2-CD1 4.41Å; R396-Y398 PolarHBondContact O-N 3.31Å; Y398-H400 VanDerWaalsContact C-N 3.35Å; Y398-H400 PolarHBondContact O-N 3.31Å; Y398-G401 PolarHBondContact N-O 3.31Å; Y398-G401 PolarHBondContact O-N 3.17Å; Y398-F403 AromaticContact CD1-CE2 3.64Å; Y398-F403 HydrophobicContact CD1-CE2 3.64Å; Y398-F403 HydrophobicContact CD1-CZ 4.29Å; Y398-F403 HydrophobicContact CD2-CE2 4.16Å; Y398-F403 HydrophobicContact CE1-CE2 4.36Å; Y398-F403 HydrophobicContact CG-CD2 4.08Å; Y398-F403 AromaticContact CG-CE2 3.52Å; Y398-F403 HydrophobicContact CG-CE2 3.52Å
399	M	83.8	Confident	83.5	Confident	159 Å²	159	76.4 Å²	76.4	78%	0.783	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	-84.6	-178.7	-63	-67.7	-147.2	0	0	114.2
400	H	77.8	Confident	83.7	Confident	150 Å²	150	78.7 Å²	78.7	69%	0.694	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.3	15.1	-174.3	47.4	-87.6	0	0	0	113.1	F375 Y398	F375-H400 AromaticContact CZ-CD2 3.82Å; F375-H400 AromaticContact CZ-NE2 3.88Å; Y398-H400 VanDerWaalsContact C-N 3.35Å; Y398-H400 PolarHBondContact O-N 3.31Å
401	G	85	Confident	83.7	Confident	5 Å²	5	81.5 Å²	81.5	5%	0.052	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	-162.7	177.4	0	0	0	0	0	112.3	V376 Y398	V376-G401 WeakPolarHBondContact O-CA 3.4Å; Y398-G401 PolarHBondContact N-O 3.31Å; Y398-G401 PolarHBondContact O-N 3.17Å
402	F	88.6	Confident	84.1	Confident	27 Å²	27	79.1 Å²	79.1	12%	0.118	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.9	-178.2	-57.4	-85.8	0	0	0	109.6	V376 L381 I390 L395 R396 A397	V376-F402 PolarHBondContact N-O 2.95Å; V376-F402 PolarHBondContact O-N 3.22Å; L381-F402 HydrophobicContact CD1-CB 3.97Å; L381-F402 HydrophobicContact CD1-CD2 3.75Å; L381-F402 HydrophobicContact CD1-CG 4.08Å; I390-F402 HydrophobicContact CB-CZ 4.44Å; I390-F402 HydrophobicContact CD1-CE2 4.29Å; I390-F402 HydrophobicContact CD1-CZ 4.19Å; I390-F402 HydrophobicContact CG1-CE1 4.41Å; I390-F402 HydrophobicContact CG1-CE2 4.21Å; I390-F402 HydrophobicContact CG1-CZ 3.92Å; I390-F402 HydrophobicContact CG2-CE1 4.01Å; I390-F402 HydrophobicContact CG2-CZ 3.81Å; L395-F402 HydrophobicContact CB-CB 4.21Å; L395-F402 HydrophobicContact CB-CD1 4.14Å; L395-F402 HydrophobicContact CB-CG 4.43Å; L395-F402 HydrophobicContact CD2-CB 4.18Å; R396-F402 CarbonylContact O-C 3.56Å; R396-F402 WeakPolarHBondContact O-CA 3.47Å; A397-F402 HydrophobicContact CB-CD1 4.13Å; A397-F402 HydrophobicContact CB-CE1 4.07Å
403	F	87.7	Confident	84.1	Confident	29 Å²	29	81.8 Å²	81.8	13%	0.127	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	125.1	163.9	-77.4	-70	0	0	0	109.1	Y373 F375 R396 Y398	Y373-F403 HydrophobicContact CD1-CB 4.1Å; Y373-F403 HydrophobicContact CG-CB 4.41Å; F375-F403 HydrophobicContact CB-CD1 4.18Å; F375-F403 HydrophobicContact CB-CE1 3.85Å; F375-F403 HydrophobicContact CD2-CD1 4.44Å; F375-F403 HydrophobicContact CD2-CE1 4.17Å; F375-F403 HydrophobicContact CD2-CE2 4.35Å; F375-F403 HydrophobicContact CD2-CZ 4.12Å; R396-F403 HydrophobicContact CB-CB 4.28Å; R396-F403 PolarHBondContact N-O 3.49Å; R396-F403 PolarHBondContact O-N 2.97Å; Y398-F403 AromaticContact CD1-CE2 3.64Å; Y398-F403 HydrophobicContact CD1-CE2 3.64Å; Y398-F403 HydrophobicContact CD1-CZ 4.29Å; Y398-F403 HydrophobicContact CD2-CE2 4.16Å; Y398-F403 HydrophobicContact CE1-CE2 4.36Å; Y398-F403 HydrophobicContact CG-CD2 4.08Å; Y398-F403 AromaticContact CG-CE2 3.52Å; Y398-F403 HydrophobicContact CG-CE2 3.52Å
404	M	85.9	Confident	84.1	Confident	4 Å²	4	80.4 Å²	80.4	2%	0.02	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.1	174.6	-174	164.6	51.4	0	0	109.5	Y373 K374 V376 L386 L395 I406 L408 Y409	Y373-M404 CarbonylContact C-O 3.57Å; Y373-M404 WeakPolarHBondContact CA-O 3.3Å; K374-M404 PolarHBondContact N-O 3.23Å; K374-M404 PolarHBondContact O-N 2.73Å; V376-M404 HydrophobicContact CG2-CB 4.24Å; V376-M404 HydrophobicContact CG2-CE 4.08Å; L386-M404 HydrophobicContact CD1-CE 3.81Å; L386-M404 HydrophobicContact CD1-SD 3.66Å; L395-M404 HydrophobicContact CD2-CB 3.57Å; L395-M404 HydrophobicContact CD2-CG 3.77Å; L395-M404 HydrophobicContact CD2-SD 3.84Å; M404-I406 PolarHBondContact O-N 3.03Å; M404-L408 HydrophobicContact CG-CB 4.07Å; M404-L408 HydrophobicContact SD-CB 4.19Å; M404-Y409 HydrophobicContact CE-CD2 3.53Å; M404-Y409 HydrophobicContact CE-CG 4.1Å
405	D	85.6	Confident	84.1	Confident	56 Å²	56	83.8 Å²	83.8	30%	0.299	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	133.8	173	-77.7	-18.8	0	0	0	110.7	Y373 R407 L408 Y409	Y373-D405 WeakPolarHBondContact CE1-OD1 3.38Å; Y373-D405 PolarHBondContact OH-OD1 3.48Å; Y373-D405 VanDerWaalsContact OH-OD1 3.11Å; D405-R407 PolarHBondContact O-N 3.14Å; D405-R407 VanDerWaalsContact O-N 3.15Å; D405-L408 HydrophobicContact CB-CB 4.38Å; D405-L408 HydrophobicContact CB-CD1 4.14Å; D405-L408 HydrophobicContact CB-CG 4.29Å; D405-L408 WeakPolarHBondContact O-CB 3.47Å; D405-L408 PolarHBondContact O-N 2.75Å; D405-Y409 PolarHBondContact O-N 3.18Å
406	I	84.9	Confident	83.8	Confident	59 Å²	59	85.3 Å²	85.3	30%	0.303	41%	0.411	S	S	.	.	H	α-helix	trans	-58.9	-33.3	-176.5	-157.8	162.1	0	0	0	111.8	D372 M404 Y409 H410	D372-I406 WeakPolarHBondContact O-CB 3.41Å; D372-I406 PolarHBondContact O-N 2.82Å; M404-I406 PolarHBondContact O-N 3.03Å; I406-Y409 PolarHBondContact O-N 3.23Å; I406-H410 PolarHBondContact O-CD2 2.93Å; I406-H410 PolarHBondContact O-N 3.18Å
407	R	85.9	Confident	83.3	Confident	196 Å²	196	81 Å²	81	74%	0.74	40%	0.401	S	S	*	.	H	α-helix	trans	-66.2	-39.6	176.5	-63.9	-179.3	179.7	178.7	1.8	112.3	D405 K411	D405-R407 PolarHBondContact O-N 3.14Å; D405-R407 VanDerWaalsContact O-N 3.15Å; R407-K411 WeakPolarHBondContact O-CG 3.48Å; R407-K411 PolarHBondContact O-N 3.1Å
408	L	84.6	Confident	82.9	Confident	56 Å²	56	82.2 Å²	82.2	29%	0.293	40%	0.402	S	S	.	.	H	α-helix	trans	-70.6	-44.5	176	-72.8	171.8	0	0	0	110.1	L394 M404 D405 H410 K411 V412	L394-L408 HydrophobicContact CD2-CD1 4.1Å; M404-L408 HydrophobicContact CG-CB 4.07Å; M404-L408 HydrophobicContact SD-CB 4.19Å; D405-L408 HydrophobicContact CB-CB 4.38Å; D405-L408 HydrophobicContact CB-CD1 4.14Å; D405-L408 HydrophobicContact CB-CG 4.29Å; D405-L408 WeakPolarHBondContact O-CB 3.47Å; D405-L408 PolarHBondContact O-N 2.75Å; L408-H410 VanDerWaalsContact C-N 3.32Å; L408-H410 PolarHBondContact O-N 2.87Å; L408-K411 PolarHBondContact O-N 2.99Å; L408-V412 WeakPolarHBondContact O-CG2 3.15Å; L408-V412 PolarHBondContact O-N 2.85Å
409	Y	86.1	Confident	82.4	Confident	23 Å²	23	82.5 Å²	82.5	9%	0.09	41%	0.406	C	S	.	.	H	α-helix	trans	-54.4	-47.2	175.6	-177.5	-95	0	0	0	112.3	K374 V376 L384 M404 D405 I406 V412 K413	K374-Y409 HydrophobicContact CD-CD1 3.55Å; K374-Y409 HydrophobicContact CD-CD2 3.87Å; K374-Y409 HydrophobicContact CD-CE1 3.54Å; K374-Y409 HydrophobicContact CD-CE2 3.85Å; K374-Y409 HydrophobicContact CD-CG 3.73Å; K374-Y409 PolarHBondContact NZ-OH 2.9Å; V376-Y409 HydrophobicContact CG2-CD2 3.78Å; V376-Y409 HydrophobicContact CG2-CE2 4.02Å; L384-Y409 HydrophobicContact CD1-CD2 3.98Å; L384-Y409 HydrophobicContact CD1-CE2 3.6Å; M404-Y409 HydrophobicContact CE-CD2 3.53Å; M404-Y409 HydrophobicContact CE-CG 4.1Å; D405-Y409 PolarHBondContact O-N 3.18Å; I406-Y409 PolarHBondContact O-N 3.23Å; Y409-V412 PolarHBondContact O-N 3.12Å; Y409-K413 HydrophobicContact CE1-CB 4.43Å; Y409-K413 HydrophobicContact CE1-CD 3.73Å; Y409-K413 VanDerWaalsContact O-CB 3.25Å; Y409-K413 WeakPolarHBondContact O-CB 3.4Å; Y409-K413 PolarHBondContact O-N 2.74Å
410	H	83.5	Confident	81.8	Confident	105 Å²	105	77.1 Å²	77.1	49%	0.486	39%	0.387	S	S	.	.	H	α-helix	trans	-64.8	-43.4	179.5	-78.2	-60.6	0	0	0	113	I406 L408 V412 K413 T414	I406-H410 PolarHBondContact O-CD2 2.93Å; I406-H410 PolarHBondContact O-N 3.18Å; L408-H410 VanDerWaalsContact C-N 3.32Å; L408-H410 PolarHBondContact O-N 2.87Å; H410-V412 VanDerWaalsContact C-N 3.34Å; H410-V412 PolarHBondContact O-N 2.96Å; H410-K413 PolarHBondContact O-N 2.88Å; H410-T414 WeakPolarHBondContact O-CG2 3.07Å; H410-T414 PolarHBondContact O-N 3.3Å; H410-T414 PolarHBondContact O-OG1 2.88Å; H410-T414 VanDerWaalsContact O-OG1 3.08Å
411	K	83.8	Confident	81.4	Confident	133 Å²	133	78.7 Å²	78.7	58%	0.578	39%	0.388	S	S	*	.	H	α-helix	trans	-59.8	-45.6	176.9	-74.4	176	180	-177.9	0	111.6	R407 L408 T414 M415	R407-K411 WeakPolarHBondContact O-CG 3.48Å; R407-K411 PolarHBondContact O-N 3.1Å; L408-K411 PolarHBondContact O-N 2.99Å; K411-T414 WeakPolarHBondContact CA-OG1 3.25Å; K411-T414 PolarHBondContact O-N 3.02Å; K411-T414 PolarHBondContact O-OG1 2.86Å; K411-M415 WeakPolarHBondContact O-CG 3.46Å; K411-M415 PolarHBondContact O-N 2.78Å; K411-M415 VanDerWaalsContact O-N 3.12Å
412	V	84.4	Confident	80.8	Confident	27 Å²	27	83.5 Å²	83.5	16%	0.164	41%	0.409	C	S	.	.	H	α-helix	trans	-69.3	-42.1	-179.7	179.9	0	0	0	0	110.5	L384 L386 L408 Y409 H410 T414 M415 A416	L384-V412 HydrophobicContact CB-CG1 3.91Å; L384-V412 HydrophobicContact CD2-CG1 4.19Å; L384-V412 WeakPolarHBondContact O-CG1 3.43Å; L386-V412 HydrophobicContact CD1-CB 4.17Å; L386-V412 HydrophobicContact CD1-CG1 3.83Å; L386-V412 HydrophobicContact CD1-CG2 3.94Å; L386-V412 HydrophobicContact CD2-CG1 3.89Å; L386-V412 HydrophobicContact CD2-CG2 3.95Å; L386-V412 HydrophobicContact CG-CG1 3.83Å; L386-V412 HydrophobicContact CG-CG2 4.4Å; L408-V412 WeakPolarHBondContact O-CG2 3.15Å; L408-V412 PolarHBondContact O-N 2.85Å; Y409-V412 PolarHBondContact O-N 3.12Å; H410-V412 VanDerWaalsContact C-N 3.34Å; H410-V412 PolarHBondContact O-N 2.96Å; V412-T414 VanDerWaalsContact C-N 3.3Å; V412-T414 PolarHBondContact O-N 2.86Å; V412-M415 PolarHBondContact O-N 2.94Å; V412-M415 VanDerWaalsContact O-N 3.09Å; V412-A416 WeakPolarHBondContact O-CB 3.44Å; V412-A416 PolarHBondContact O-N 2.83Å
413	K	83.5	Confident	80.2	Confident	96 Å²	96	87.7 Å²	87.7	42%	0.417	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-37.8	176.4	-171.7	171.4	-178.9	175.3	0	112.6	L384 Y409 H410 M415 N417	L384-K413 HydrophobicContact CD2-CB 4.34Å; Y409-K413 HydrophobicContact CE1-CB 4.43Å; Y409-K413 HydrophobicContact CE1-CD 3.73Å; Y409-K413 VanDerWaalsContact O-CB 3.25Å; Y409-K413 WeakPolarHBondContact O-CB 3.4Å; Y409-K413 PolarHBondContact O-N 2.74Å; H410-K413 PolarHBondContact O-N 2.88Å; K413-M415 VanDerWaalsContact C-N 3.34Å; K413-N417 PolarHBondContact O-N 2.81Å
414	T	80.8	Confident	79.7	Confident	100 Å²	100	92.8 Å²	92.8	61%	0.613	45%	0.449	S	S	*	.	H	α-helix	trans	-69.3	-30.7	175	50.8	0	0	0	0	113.3	H410 K411 V412	H410-T414 WeakPolarHBondContact O-CG2 3.07Å; H410-T414 PolarHBondContact O-N 3.3Å; H410-T414 PolarHBondContact O-OG1 2.88Å; H410-T414 VanDerWaalsContact O-OG1 3.08Å; K411-T414 WeakPolarHBondContact CA-OG1 3.25Å; K411-T414 PolarHBondContact O-N 3.02Å; K411-T414 PolarHBondContact O-OG1 2.86Å; V412-T414 VanDerWaalsContact C-N 3.3Å; V412-T414 PolarHBondContact O-N 2.86Å
415	M	79.9	Confident	79.4	Confident	154 Å²	154	100.6 Å²	100.6	76%	0.759	48%	0.478	S	S	*	.	H	α-helix	trans	-78.9	-38	176.2	-72.6	179.4	176.9	0	0	112.1	K411 V412 K413	K411-M415 WeakPolarHBondContact O-CG 3.46Å; K411-M415 PolarHBondContact O-N 2.78Å; K411-M415 VanDerWaalsContact O-N 3.12Å; V412-M415 PolarHBondContact O-N 2.94Å; V412-M415 VanDerWaalsContact O-N 3.09Å; K413-M415 VanDerWaalsContact C-N 3.34Å
416	A	78.3	Confident	79.3	Confident	40 Å²	40	103.9 Å²	103.9	33%	0.331	49%	0.49	S	S	.	.	H	α-helix	trans	-72	-38.5	-177	0	0	0	0	0	112.7	L384 V412 P418	L384-A416 HydrophobicContact CD2-CB 4.02Å; V412-A416 WeakPolarHBondContact O-CB 3.44Å; V412-A416 PolarHBondContact O-N 2.83Å; A416-P418 VanDerWaalsContact C-CD 3.49Å; A416-P418 VanDerWaalsContact O-CD 3.31Å; A416-P418 WeakPolarHBondContact O-CD 3.29Å
417	N	72.4	Confident	79.2	Confident	83 Å²	83	104.8 Å²	104.8	44%	0.444	50%	0.495	S	S	.	.			trans	-121.6	77	-176.5	-64.3	0.9	0	0	0	113.3	K413 F419 A420	K413-N417 PolarHBondContact O-N 2.81Å; N417-F419 PolarHBondContact O-N 2.9Å; N417-A420 HydrophobicContact CB-CB 4.19Å
418	P	74.6	Confident	79.1	Confident	99 Å²	99	100.4 Å²	100.4	64%	0.643	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.1	174.5	-23.1	34.2	0	0	0	114.6	A416	A416-P418 VanDerWaalsContact C-CD 3.49Å; A416-P418 VanDerWaalsContact O-CD 3.31Å; A416-P418 WeakPolarHBondContact O-CD 3.29Å
419	F	73.5	Confident	79	Confident	131 Å²	131	101.7 Å²	101.7	58%	0.575	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	5.3	-174.3	-62.7	-75.5	0	0	0	114.9	N417 Y421 E422 E423	N417-F419 PolarHBondContact O-N 2.9Å; F419-Y421 PolarHBondContact O-N 3.04Å; F419-E422 PolarHBondContact O-N 3.27Å; F419-E423 PolarHBondContact O-N 3.47Å; F419-E423 VanDerWaalsContact O-N 3.16Å
420	A	71.2	Confident	78.8	Confident	47 Å²	47	108.4 Å²	108.4	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-56.8	-27.5	-174.7	0	0	0	0	0	113.9	N417 Y424	N417-A420 HydrophobicContact CB-CB 4.19Å; A420-Y424 WeakPolarHBondContact O-CB 3.17Å; A420-Y424 PolarHBondContact O-N 3.3Å; A420-Y424 VanDerWaalsContact O-N 3.14Å
421	Y	68.7	Low	78.8	Confident	182 Å²	182	108.5 Å²	108.5	71%	0.714	51%	0.513	S	S	*	.	H	α-helix	trans	-73.4	-34.6	176.9	-172.8	-103.8	0	0	0	112.8	F419 R425	F419-Y421 PolarHBondContact O-N 3.04Å; Y421-R425 WeakPolarHBondContact O-CB 3.33Å; Y421-R425 PolarHBondContact O-N 2.9Å; Y421-R425 VanDerWaalsContact O-N 3.12Å
422	E	72.3	Confident	78.8	Confident	106 Å²	106	109 Å²	109	50%	0.495	52%	0.516	S	S	.	.	H	α-helix	trans	-76.6	-39.6	179.5	-64.6	-174.5	170.3	0	0	111.7	F419 R425 K426	F419-E422 PolarHBondContact O-N 3.27Å; E422-R425 PolarHBondContact O-N 3.15Å; E422-K426 WeakPolarHBondContact O-CG 3.41Å; E422-K426 PolarHBondContact O-N 2.85Å
423	E	77.4	Confident	78.6	Confident	115 Å²	115	111.2 Å²	111.2	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-64.4	-46.9	174.1	-68.5	179.6	161.5	0	0	111.3	F419 R425 K426 D427	F419-E423 PolarHBondContact O-N 3.47Å; F419-E423 VanDerWaalsContact O-N 3.16Å; E423-R425 PolarHBondContact O-N 3.36Å; E423-K426 WeakPolarHBondContact O-CB 3.44Å; E423-K426 PolarHBondContact O-N 3.18Å; E423-K426 VanDerWaalsContact O-N 3.08Å; E423-D427 PolarHBondContact O-N 3.35Å
424	Y	76.1	Confident	78	Confident	136 Å²	136	112.4 Å²	112.4	53%	0.533	53%	0.533	S	S	.	.	H	α-helix	trans	-59.5	-36.3	175.3	179.5	-107.6	0	0	0	112.5	A420 K428	A420-Y424 WeakPolarHBondContact O-CB 3.17Å; A420-Y424 PolarHBondContact O-N 3.3Å; A420-Y424 VanDerWaalsContact O-N 3.14Å; Y424-K428 HydrophobicContact CE1-CD 4.18Å; Y424-K428 PolarHBondContact O-N 3.47Å; Y424-K428 VanDerWaalsContact O-N 3.11Å; Y424-K428 WeakPolarHBondContact OH-CE 3.25Å; Y424-K428 PolarHBondContact OH-NZ 3.25Å
425	R	80.1	Confident	77.9	Confident	169 Å²	169	113.7 Å²	113.7	64%	0.638	53%	0.532	S	S	*	.	H	α-helix	trans	-67.8	-43	174.9	-173.9	179	175.3	-165.5	-2.1	111.5	Y421 E422 E423 K428 I429	Y421-R425 WeakPolarHBondContact O-CB 3.33Å; Y421-R425 PolarHBondContact O-N 2.9Å; Y421-R425 VanDerWaalsContact O-N 3.12Å; E422-R425 PolarHBondContact O-N 3.15Å; E423-R425 PolarHBondContact O-N 3.36Å; R425-K428 PolarHBondContact O-N 2.86Å; R425-I429 HydrophobicContact CG-CD1 4.01Å; R425-I429 WeakPolarHBondContact O-CD1 3.49Å; R425-I429 WeakPolarHBondContact O-CG1 3.43Å; R425-I429 PolarHBondContact O-N 2.83Å
426	K	84.1	Confident	77.5	Confident	124 Å²	124	109.6 Å²	109.6	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-62.3	-42	177	-74.1	172.4	-177.6	175.8	0	111.7	E422 E423 I429 R430	E422-K426 WeakPolarHBondContact O-CG 3.41Å; E422-K426 PolarHBondContact O-N 2.85Å; E423-K426 WeakPolarHBondContact O-CB 3.44Å; E423-K426 PolarHBondContact O-N 3.18Å; E423-K426 VanDerWaalsContact O-N 3.08Å; K426-I429 PolarHBondContact O-N 3.35Å; K426-R430 WeakPolarHBondContact O-CG 3.34Å; K426-R430 PolarHBondContact O-N 3.15Å
427	D	82.9	Confident	76.9	Confident	78 Å²	78	116.1 Å²	116.1	42%	0.417	53%	0.534	S	S	.	.	H	α-helix	trans	-69.3	-38.9	179.4	-71.6	-19.2	0	0	0	112.4	E423 I429 R430 Q431	E423-D427 PolarHBondContact O-N 3.35Å; D427-I429 VanDerWaalsContact C-N 3.28Å; D427-I429 PolarHBondContact O-N 3.34Å; D427-R430 PolarHBondContact O-N 3.4Å; D427-R430 IonicContact OD1-NH1 3.79Å; D427-Q431 WeakPolarHBondContact O-CG 3.38Å; D427-Q431 PolarHBondContact O-N 2.91Å
428	K	83.5	Confident	76.2	Confident	105 Å²	105	117.5 Å²	117.5	46%	0.457	55%	0.546	S	S	.	.	H	α-helix	trans	-65.4	-31.6	172.1	-86.3	-154.7	163	-178.4	0	113.6	Y424 R425 K432	Y424-K428 HydrophobicContact CE1-CD 4.18Å; Y424-K428 PolarHBondContact O-N 3.47Å; Y424-K428 VanDerWaalsContact O-N 3.11Å; Y424-K428 WeakPolarHBondContact OH-CE 3.25Å; Y424-K428 PolarHBondContact OH-NZ 3.25Å; R425-K428 PolarHBondContact O-N 2.86Å; K428-K432 PolarHBondContact O-N 3.28Å
429	I	83	Confident	75.3	Confident	83 Å²	83	121 Å²	121	43%	0.426	55%	0.554	S	S	.	*	H	α-helix	trans	-69.2	-44.5	173.9	-69.8	163.5	0	0	0	109.5	R425 K426 D427 K432 I433	R425-I429 HydrophobicContact CG-CD1 4.01Å; R425-I429 WeakPolarHBondContact O-CD1 3.49Å; R425-I429 WeakPolarHBondContact O-CG1 3.43Å; R425-I429 PolarHBondContact O-N 2.83Å; K426-I429 PolarHBondContact O-N 3.35Å; D427-I429 VanDerWaalsContact C-N 3.28Å; D427-I429 PolarHBondContact O-N 3.34Å; I429-K432 PolarHBondContact O-N 3.31Å; I429-I433 HydrophobicContact CG2-CD1 3.71Å; I429-I433 HydrophobicContact CG2-CG1 4.42Å; I429-I433 VanDerWaalsContact O-CG1 3.24Å; I429-I433 WeakPolarHBondContact O-CG1 3.31Å; I429-I433 PolarHBondContact O-N 2.77Å
430	R	81.4	Confident	74.4	Confident	163 Å²	163	125 Å²	125	62%	0.615	57%	0.565	S	S	*	*	H	α-helix	trans	-60.1	-46	175.6	-74.9	176	175.8	171.4	-5.6	112.8	K426 D427 K432 I433 E434	K426-R430 WeakPolarHBondContact O-CG 3.34Å; K426-R430 PolarHBondContact O-N 3.15Å; D427-R430 PolarHBondContact O-N 3.4Å; D427-R430 IonicContact OD1-NH1 3.79Å; R430-K432 VanDerWaalsContact C-N 3.34Å; R430-K432 PolarHBondContact O-N 3.3Å; R430-I433 CarbonylContact O-C 3.56Å; R430-I433 WeakPolarHBondContact O-CA 3.46Å; R430-I433 WeakPolarHBondContact O-CB 3.5Å; R430-I433 PolarHBondContact O-N 2.82Å; R430-I433 VanDerWaalsContact O-N 3.09Å; R430-E434 PolarHBondContact O-N 2.8Å
431	Q	83.1	Confident	73.2	Confident	107 Å²	107	129.2 Å²	129.2	50%	0.5	59%	0.586	S	S	.	*	H	α-helix	trans	-59.9	-42.9	176.8	-74.6	175.1	-0.4	0	0	111.8	D427 I433 E434 E435	D427-Q431 WeakPolarHBondContact O-CG 3.38Å; D427-Q431 PolarHBondContact O-N 2.91Å; Q431-I433 VanDerWaalsContact C-N 3.34Å; Q431-I433 PolarHBondContact O-N 3.11Å; Q431-E434 PolarHBondContact O-N 3.31Å; Q431-E435 WeakPolarHBondContact O-CB 3.3Å; Q431-E435 VanDerWaalsContact O-CG 3.31Å; Q431-E435 WeakPolarHBondContact O-CG 3.05Å; Q431-E435 PolarHBondContact O-N 3.23Å
432	K	84.1	Confident	72.3	Confident	145 Å²	145	129 Å²	129	63%	0.63	59%	0.591	S	S	*	*	H	α-helix	trans	-65.9	-34.5	174	-81.3	-175.8	175.8	-177.2	0	113.3	K428 I429 R430 S436	K428-K432 PolarHBondContact O-N 3.28Å; I429-K432 PolarHBondContact O-N 3.31Å; R430-K432 VanDerWaalsContact C-N 3.34Å; R430-K432 PolarHBondContact O-N 3.3Å; K432-S436 WeakPolarHBondContact O-CB 3.14Å; K432-S436 PolarHBondContact O-N 3.19Å; K432-S436 PolarHBondContact O-OG 3.37Å; K432-S436 VanDerWaalsContact O-OG 3.12Å
433	I	79	Confident	71.6	Confident	72 Å²	72	128.3 Å²	128.3	37%	0.369	59%	0.594	S	S	.	*	H	α-helix	trans	-66.5	-42.3	173.9	-69	165.2	0	0	0	109.9	I429 R430 Q431 S436 R437	I429-I433 HydrophobicContact CG2-CD1 3.71Å; I429-I433 HydrophobicContact CG2-CG1 4.42Å; I429-I433 VanDerWaalsContact O-CG1 3.24Å; I429-I433 WeakPolarHBondContact O-CG1 3.31Å; I429-I433 PolarHBondContact O-N 2.77Å; R430-I433 CarbonylContact O-C 3.56Å; R430-I433 WeakPolarHBondContact O-CA 3.46Å; R430-I433 WeakPolarHBondContact O-CB 3.5Å; R430-I433 PolarHBondContact O-N 2.82Å; R430-I433 VanDerWaalsContact O-N 3.09Å; Q431-I433 VanDerWaalsContact C-N 3.34Å; Q431-I433 PolarHBondContact O-N 3.11Å; I433-S436 WeakPolarHBondContact CA-OG 3.46Å; I433-S436 PolarHBondContact O-N 2.76Å; I433-S436 PolarHBondContact O-OG 3.42Å; I433-R437 WeakPolarHBondContact O-CB 3.37Å; I433-R437 VanDerWaalsContact O-CG 3.28Å; I433-R437 WeakPolarHBondContact O-CG 3.43Å; I433-R437 PolarHBondContact O-N 2.99Å
434	E	72.6	Confident	70.8	Confident	122 Å²	122	129.8 Å²	129.8	57%	0.57	60%	0.601	S	S	*	*	H	α-helix	trans	-66.1	-44.5	175.8	-83.1	171.6	163.5	0	0	112.3	R430 Q431 S436 R437 T438	R430-E434 PolarHBondContact O-N 2.8Å; Q431-E434 PolarHBondContact O-N 3.31Å; E434-S436 VanDerWaalsContact C-N 3.3Å; E434-S436 PolarHBondContact O-N 2.78Å; E434-R437 WeakPolarHBondContact O-CB 3.18Å; E434-R437 PolarHBondContact O-N 3.38Å; E434-T438 WeakPolarHBondContact O-CG2 3.5Å; E434-T438 PolarHBondContact O-N 3.05Å; E434-T438 VanDerWaalsContact O-N 3.07Å
435	E	78.3	Confident	70.1	Confident	126 Å²	126	132.5 Å²	132.5	59%	0.589	62%	0.615	S	S	*	*	H	α-helix	trans	-57.8	-43.2	173.3	-73.8	171	179.1	0	0	111.2	Q431 R437 T438	Q431-E435 WeakPolarHBondContact O-CB 3.3Å; Q431-E435 VanDerWaalsContact O-CG 3.31Å; Q431-E435 WeakPolarHBondContact O-CG 3.05Å; Q431-E435 PolarHBondContact O-N 3.23Å; E435-R437 VanDerWaalsContact C-N 3.34Å; E435-R437 PolarHBondContact O-N 3.44Å; E435-T438 PolarHBondContact O-N 2.83Å; E435-T438 PolarHBondContact O-OG1 3.01Å
436	S	71.5	Confident	69.5	Low	68 Å²	68	126.1 Å²	126.1	48%	0.476	59%	0.594	S	S	.	*	H	α-helix	trans	-69.6	-27.7	175.5	66.5	0	0	0	0	113.6	K432 I433 E434 Q439	K432-S436 WeakPolarHBondContact O-CB 3.14Å; K432-S436 PolarHBondContact O-N 3.19Å; K432-S436 PolarHBondContact O-OG 3.37Å; K432-S436 VanDerWaalsContact O-OG 3.12Å; I433-S436 WeakPolarHBondContact CA-OG 3.46Å; I433-S436 PolarHBondContact O-N 2.76Å; I433-S436 PolarHBondContact O-OG 3.42Å; E434-S436 VanDerWaalsContact C-N 3.3Å; E434-S436 PolarHBondContact O-N 2.78Å; S436-Q439 PolarHBondContact O-N 3.17Å
437	R	64.8	Low	68.9	Low	177 Å²	177	121.6 Å²	121.6	67%	0.668	58%	0.577	S	S	*	*	H	α-helix	trans	-70.4	-32	174.3	-77.7	172.6	175.7	-175	-3.2	112.6	I433 E434 E435 Q439 R440	I433-R437 WeakPolarHBondContact O-CB 3.37Å; I433-R437 VanDerWaalsContact O-CG 3.28Å; I433-R437 WeakPolarHBondContact O-CG 3.43Å; I433-R437 PolarHBondContact O-N 2.99Å; E434-R437 WeakPolarHBondContact O-CB 3.18Å; E434-R437 PolarHBondContact O-N 3.38Å; E435-R437 VanDerWaalsContact C-N 3.34Å; E435-R437 PolarHBondContact O-N 3.44Å; R437-Q439 PolarHBondContact O-N 2.82Å; R437-Q439 VanDerWaalsContact O-N 3.17Å; R437-R440 PolarHBondContact O-N 2.96Å
438	T	57.7	Low	68.4	Low	112 Å²	112	127.2 Å²	127.2	69%	0.687	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-16.3	175.7	65.9	0	0	0	0	114.3	E434 E435	E434-T438 WeakPolarHBondContact O-CG2 3.5Å; E434-T438 PolarHBondContact O-N 3.05Å; E434-T438 VanDerWaalsContact O-N 3.07Å; E435-T438 PolarHBondContact O-N 2.83Å; E435-T438 PolarHBondContact O-OG1 3.01Å
439	Q	55.3	Low	67.9	Low	172 Å²	172	123 Å²	123	80%	0.804	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-5.6	177.8	-67.8	-178.3	-5.4	0	0	114.1	S436 R437	S436-Q439 PolarHBondContact O-N 3.17Å; R437-Q439 PolarHBondContact O-N 2.82Å; R437-Q439 VanDerWaalsContact O-N 3.17Å
440	R	55.5	Low	67.4	Low	217 Å²	217	120 Å²	120	82%	0.819	57%	0.566	S	S	*	*	S	Bend	trans	-92.2	131.9	169.4	-82.9	-177.4	175	176.2	-1.4	109.8	R437 Q442	R437-R440 PolarHBondContact O-N 2.96Å; R440-Q442 PolarHBondContact O-N 3.14Å; R440-Q442 VanDerWaalsContact O-N 3.13Å
441	V	46.3	Very low	67.3	Low	135 Å²	135	116.4 Å²	116.4	82%	0.818	56%	0.555	S	S	*	*			trans	-31.4	107.7	-172.5	-178	0	0	0	0	113.1	V443	V441-V443 PolarHBondContact O-N 3.37Å
442	Q	50	Low	67	Low	177 Å²	177	114.5 Å²	114.5	83%	0.827	55%	0.546	S	S	*	.			trans	-72.8	105.8	167.2	-128.9	176.1	3.5	0	0	107.5	R440 Q444	R440-Q442 PolarHBondContact O-N 3.14Å; R440-Q442 VanDerWaalsContact O-N 3.13Å; Q442-Q444 PolarHBondContact O-N 3.31Å; Q442-Q444 VanDerWaalsContact O-N 3.16Å
443	V	57.2	Low	66.6	Low	92 Å²	92	110 Å²	110	56%	0.558	53%	0.528	S	S	*	.			trans	-65.8	113.5	170.8	-179.4	0	0	0	0	107.4	V441 K445	V441-V443 PolarHBondContact O-N 3.37Å; V443-K445 PolarHBondContact O-N 3.16Å
444	Q	59.2	Low	66.3	Low	146 Å²	146	106.6 Å²	106.6	68%	0.682	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-70.5	116.1	177.6	-66.6	-171	7.6	0	0	109.1	Q442 L446	Q442-Q444 PolarHBondContact O-N 3.31Å; Q442-Q444 VanDerWaalsContact O-N 3.16Å; Q444-L446 PolarHBondContact O-N 3.23Å
445	K	61.5	Low	66.5	Low	192 Å²	192	101.7 Å²	101.7	84%	0.835	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-71.7	117.8	178.7	-69.7	-178.3	178	-179.7	0	109.7	V443	V443-K445 PolarHBondContact O-N 3.16Å
446	L	67.8	Low	66.5	Low	35 Å²	35	99.7 Å²	99.7	18%	0.183	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-76.3	145.9	173.9	-70.4	166.5	0	0	0	110.7	Q444 L455 M458 L525	Q444-L446 PolarHBondContact O-N 3.23Å; L446-L455 HydrophobicContact CD1-CD2 4.08Å; L446-L455 HydrophobicContact CD1-CG 4.35Å; L446-L455 HydrophobicContact CD2-CD2 4.07Å; L446-L455 HydrophobicContact CD2-CG 4.31Å; L446-M458 HydrophobicContact CD2-CE 3.53Å; L446-M458 HydrophobicContact CD2-SD 3.57Å; L446-M458 VanDerWaalsContact CD2-SD 3.57Å; L446-L525 HydrophobicContact CD1-CD1 4.34Å
447	P	71.6	Confident	66.9	Low	30 Å²	30	97.7 Å²	97.7	20%	0.195	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-65	155.9	175.5	22.9	-30.1	0	0	0	112.8	K451 A454 L481 F490	P447-K451 WeakPolarHBondContact O-CG 3.32Å; P447-A454 HydrophobicContact CG-CB 3.67Å; P447-L481 HydrophobicContact CG-CD1 4.38Å; P447-F490 HydrophobicContact CB-CB 3.78Å; P447-F490 HydrophobicContact CB-CD1 4.42Å; P447-F490 HydrophobicContact CB-CG 4.41Å; P447-F490 HydrophobicContact CG-CB 4.17Å; P447-F490 HydrophobicContact CG-CD1 3.93Å; P447-F490 HydrophobicContact CG-CG 4.26Å
448	K	72.6	Confident	67.3	Low	195 Å²	195	91 Å²	91	85%	0.848	44%	0.438	S	S	*	.	S	Bend	trans	-72.8	-35.5	-174.6	-72.8	-178	178.3	178.9	0	113
449	V	72.4	Confident	68.2	Low	18 Å²	18	87.6 Å²	87.6	11%	0.109	42%	0.415	C	S	.	.	S	Bend	trans	-105.2	142	-178.9	-170.9	0	0	0	0	109.9	F490 E491 N492 Q496	V449-F490 WeakPolarHBondContact CB-O 3.06Å; V449-F490 PolarHBondContact N-O 2.94Å; V449-E491 WeakPolarHBondContact CG2-O 3.41Å; V449-N492 WeakPolarHBondContact CG1-O 3.39Å; V449-Q496 HydrophobicContact CG1-CB 4.39Å
450	N	74.3	Confident	69.1	Low	19 Å²	19	83 Å²	83	10%	0.102	39%	0.393	C	S	.	.			trans	58.4	46.4	179.3	-69.5	-30.6	0	0	0	115.2	E452 L453 A454 M489 F490 Y495 Q496 V497	N450-E452 VanDerWaalsContact C-N 3.26Å; N450-E452 PolarHBondContact O-N 3.26Å; N450-L453 HydrophobicContact CB-CB 4.1Å; N450-L453 PolarHBondContact O-N 2.78Å; N450-A454 PolarHBondContact O-N 3.31Å; N450-M489 PolarHBondContact ND2-O 3.39Å; N450-F490 HydrophobicContact CB-CD1 4.48Å; N450-Y495 PolarHBondContact ND2-O 3.41Å; N450-Q496 WeakPolarHBondContact OD1-CA 3.45Å; N450-V497 PolarHBondContact OD1-N 3.42Å; N450-V497 VanDerWaalsContact OD1-N 3.07Å
451	K	78.9	Confident	69.7	Low	87 Å²	87	73.8 Å²	73.8	38%	0.378	37%	0.366	S	S	.	.	H	α-helix	trans	-52.3	-39.4	178	-64.4	-175.8	179.9	-169.1	0	113.8	P447 L455 L522	P447-K451 WeakPolarHBondContact O-CG 3.32Å; K451-L455 WeakPolarHBondContact O-CB 3.21Å; K451-L455 WeakPolarHBondContact O-CG 3.31Å; K451-L455 PolarHBondContact O-N 3.22Å; K451-L522 HydrophobicContact CB-CD1 3.99Å; K451-L522 HydrophobicContact CD-CD2 4.41Å
452	E	76.5	Confident	70.7	Confident	68 Å²	68	72.7 Å²	72.7	32%	0.318	36%	0.355	S	S	.	.	H	α-helix	trans	-70.5	-32.6	179.9	-64.8	-167.1	-179.6	0	0	113.1	N450 K456 K519 L522	N450-E452 VanDerWaalsContact C-N 3.26Å; N450-E452 PolarHBondContact O-N 3.26Å; E452-K456 WeakPolarHBondContact O-CB 3.25Å; E452-K456 PolarHBondContact O-N 2.9Å; E452-K519 WeakPolarHBondContact OE1-CE 3.49Å; E452-K519 WeakPolarHBondContact OE1-CG 3.32Å; E452-L522 HydrophobicContact CG-CD1 3.55Å
453	L	75.6	Confident	71.6	Confident	50 Å²	50	70.3 Å²	70.3	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-76.6	-39.7	177.5	-170	145.2	0	0	0	111	N450 L455 K456 L457 M489 F490 V497	N450-L453 HydrophobicContact CB-CB 4.1Å; N450-L453 PolarHBondContact O-N 2.78Å; L453-L455 VanDerWaalsContact C-N 3.34Å; L453-L455 PolarHBondContact O-N 2.86Å; L453-K456 WeakPolarHBondContact O-CB 3.48Å; L453-K456 PolarHBondContact O-N 3.38Å; L453-L457 HydrophobicContact CD2-CD1 3.6Å; L453-L457 HydrophobicContact CD2-CG 4.2Å; L453-L457 WeakPolarHBondContact O-CG 3.25Å; L453-L457 PolarHBondContact O-N 2.91Å; L453-M489 HydrophobicContact CD1-CE 3.75Å; L453-M489 HydrophobicContact CD2-CE 4.09Å; L453-F490 HydrophobicContact CD2-CE1 3.65Å; L453-F490 HydrophobicContact CD2-CZ 3.71Å; L453-V497 HydrophobicContact CD1-CG2 4.37Å
454	A	73.6	Confident	72	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.6	-43.5	172.5	0	0	0	0	0	111.5	P447 N450 K456 L457 M458 L481 F490	P447-A454 HydrophobicContact CG-CB 3.67Å; N450-A454 PolarHBondContact O-N 3.31Å; A454-K456 VanDerWaalsContact C-N 3.33Å; A454-K456 PolarHBondContact O-N 3.06Å; A454-L457 PolarHBondContact O-N 3.35Å; A454-M458 VanDerWaalsContact O-CG 3.26Å; A454-M458 WeakPolarHBondContact O-CG 3.35Å; A454-M458 PolarHBondContact O-N 3.31Å; A454-L481 HydrophobicContact CB-CD1 4.24Å; A454-F490 HydrophobicContact CB-CD1 4.39Å; A454-F490 HydrophobicContact CB-CE1 4.06Å
455	L	76.8	Confident	72.2	Confident	19 Å²	19	67.9 Å²	67.9	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-63.4	-36.9	173.9	-76.4	170.1	0	0	0	112.7	L446 K451 L453 M458 E459 L522 L525	L446-L455 HydrophobicContact CD1-CD2 4.08Å; L446-L455 HydrophobicContact CD1-CG 4.35Å; L446-L455 HydrophobicContact CD2-CD2 4.07Å; L446-L455 HydrophobicContact CD2-CG 4.31Å; K451-L455 WeakPolarHBondContact O-CB 3.21Å; K451-L455 WeakPolarHBondContact O-CG 3.31Å; K451-L455 PolarHBondContact O-N 3.22Å; L453-L455 VanDerWaalsContact C-N 3.34Å; L453-L455 PolarHBondContact O-N 2.86Å; L455-M458 PolarHBondContact O-N 2.96Å; L455-E459 WeakPolarHBondContact O-CG 3.47Å; L455-E459 PolarHBondContact O-N 3.28Å; L455-L522 HydrophobicContact CD1-CB 4.18Å; L455-L522 HydrophobicContact CD1-CD1 3.87Å; L455-L522 HydrophobicContact CD1-CG 3.89Å; L455-L525 HydrophobicContact CD2-CD1 4.23Å
456	K	77.7	Confident	72.3	Confident	84 Å²	84	65 Å²	65	37%	0.365	33%	0.326	S	S	.	.	H	α-helix	trans	-65	-43.5	175.4	179.5	176.3	179.7	-175.4	0	111.7	E452 L453 A454 M458 E459 E460	E452-K456 WeakPolarHBondContact O-CB 3.25Å; E452-K456 PolarHBondContact O-N 2.9Å; L453-K456 WeakPolarHBondContact O-CB 3.48Å; L453-K456 PolarHBondContact O-N 3.38Å; A454-K456 VanDerWaalsContact C-N 3.33Å; A454-K456 PolarHBondContact O-N 3.06Å; K456-M458 VanDerWaalsContact C-N 3.34Å; K456-E459 PolarHBondContact O-N 3.44Å; K456-E460 WeakPolarHBondContact CE-OE1 3.42Å; K456-E460 WeakPolarHBondContact CG-OE1 3.44Å; K456-E460 IonicContact NZ-OE1 3.92Å; K456-E460 WeakPolarHBondContact O-CB 3.27Å; K456-E460 WeakPolarHBondContact O-CG 3.31Å; K456-E460 PolarHBondContact O-N 3.49Å
457	L	78.7	Confident	72	Confident	27 Å²	27	68.4 Å²	68.4	14%	0.141	34%	0.344	C	S	.	.	H	α-helix	trans	-69.7	-30.5	178	-69.8	174.2	0	0	0	112.9	L453 A454 G461 I480 F490	L453-L457 HydrophobicContact CD2-CD1 3.6Å; L453-L457 HydrophobicContact CD2-CG 4.2Å; L453-L457 WeakPolarHBondContact O-CG 3.25Å; L453-L457 PolarHBondContact O-N 2.91Å; A454-L457 PolarHBondContact O-N 3.35Å; L457-G461 PolarHBondContact O-N 3.19Å; L457-I480 HydrophobicContact CD1-CB 4.15Å; L457-I480 HydrophobicContact CD1-CG2 4.21Å; L457-I480 HydrophobicContact CD2-CD1 4.08Å; L457-F490 HydrophobicContact CD1-CZ 3.83Å
458	M	74.9	Confident	71.4	Confident	35 Å²	35	69.3 Å²	69.3	17%	0.172	35%	0.354	C	S	.	.	H	α-helix	trans	-69.1	-46.4	171	-70.8	170.6	170.1	0	0	111.3	L446 A454 L455 K456 E460 G461 D462 L481	L446-M458 HydrophobicContact CD2-CE 3.53Å; L446-M458 HydrophobicContact CD2-SD 3.57Å; L446-M458 VanDerWaalsContact CD2-SD 3.57Å; A454-M458 VanDerWaalsContact O-CG 3.26Å; A454-M458 WeakPolarHBondContact O-CG 3.35Å; A454-M458 PolarHBondContact O-N 3.31Å; L455-M458 PolarHBondContact O-N 2.96Å; K456-M458 VanDerWaalsContact C-N 3.34Å; M458-E460 PolarHBondContact O-N 3.24Å; M458-G461 PolarHBondContact O-N 2.85Å; M458-D462 WeakPolarHBondContact O-CB 3.35Å; M458-D462 VanDerWaalsContact O-CG 3.28Å; M458-D462 PolarHBondContact O-N 3.3Å; M458-L481 HydrophobicContact CE-CD2 3.27Å; M458-L481 HydrophobicContact CG-CD2 3.96Å; M458-L481 HydrophobicContact SD-CD2 4.45Å
459	E	75.8	Confident	70.8	Confident	41 Å²	41	64.4 Å²	64.4	19%	0.192	34%	0.344	C	S	.	.	H	α-helix	trans	-60.9	-43.7	175.6	-74.2	-179.6	161.4	0	0	111.7	L455 K456 D462 E463 R518 K521	L455-E459 WeakPolarHBondContact O-CG 3.47Å; L455-E459 PolarHBondContact O-N 3.28Å; K456-E459 PolarHBondContact O-N 3.44Å; E459-D462 PolarHBondContact O-N 3.46Å; E459-E463 WeakPolarHBondContact O-CB 3.28Å; E459-E463 VanDerWaalsContact O-CG 3.3Å; E459-E463 WeakPolarHBondContact O-CG 3.09Å; E459-E463 PolarHBondContact O-N 3.39Å; E459-R518 IonicContact OE2-CZ 2.95Å; E459-R518 VanDerWaalsContact OE2-CZ 3.31Å; E459-R518 IonicContact OE2-NE 3.96Å; E459-R518 PolarHBondContact OE2-NE 2.88Å; E459-R518 IonicContact OE2-NH2 2.7Å; E459-R518 PolarHBondContact OE2-NH2 3.15Å; E459-K521 IonicContact OE1-NZ 2.74Å; E459-K521 PolarHBondContact OE1-NZ 3.49Å
460	E	73.1	Confident	70.3	Confident	76 Å²	76	73.2 Å²	73.2	36%	0.355	38%	0.376	S	S	.	.	H	α-helix	trans	-67.4	-39	176.5	-74.3	170.6	-176.5	0	0	111.7	K456 M458 E463 E464	K456-E460 WeakPolarHBondContact CE-OE1 3.42Å; K456-E460 WeakPolarHBondContact CG-OE1 3.44Å; K456-E460 IonicContact NZ-OE1 3.92Å; K456-E460 WeakPolarHBondContact O-CB 3.27Å; K456-E460 WeakPolarHBondContact O-CG 3.31Å; K456-E460 PolarHBondContact O-N 3.49Å; M458-E460 PolarHBondContact O-N 3.24Å; E460-E463 PolarHBondContact O-N 3.17Å; E460-E464 WeakPolarHBondContact O-CB 3.25Å; E460-E464 WeakPolarHBondContact O-CG 3.34Å; E460-E464 PolarHBondContact O-N 3.32Å
461	G	68.9	Low	69.4	Low	23 Å²	23	80.2 Å²	80.2	24%	0.237	41%	0.405	C	S	.	.	H	α-helix	trans	-66.1	-37.8	175.1	0	0	0	0	0	113.6	L457 M458 A465	L457-G461 PolarHBondContact O-N 3.19Å; M458-G461 PolarHBondContact O-N 2.85Å; G461-A465 VanDerWaalsContact O-CB 3.23Å; G461-A465 WeakPolarHBondContact O-CB 3.43Å; G461-A465 PolarHBondContact O-N 3.39Å
462	D	68.3	Low	68.2	Low	113 Å²	113	85.8 Å²	85.8	60%	0.604	43%	0.429	S	S	*	.	H	α-helix	trans	-70	-41.8	175.3	-72.7	-22.8	0	0	0	111.1	M458 E459 A465 E466	M458-D462 WeakPolarHBondContact O-CB 3.35Å; M458-D462 VanDerWaalsContact O-CG 3.28Å; M458-D462 PolarHBondContact O-N 3.3Å; E459-D462 PolarHBondContact O-N 3.46Å; D462-A465 PolarHBondContact O-N 3.48Å; D462-E466 WeakPolarHBondContact O-CG 3.39Å; D462-E466 PolarHBondContact O-N 2.97Å
463	E	68.2	Low	66.8	Low	126 Å²	126	92.7 Å²	92.7	59%	0.589	46%	0.458	S	S	*	.	H	α-helix	trans	-63.8	-40.9	173.6	-74.4	178.5	-177.3	0	0	111.8	E459 E460 L467	E459-E463 WeakPolarHBondContact O-CB 3.28Å; E459-E463 VanDerWaalsContact O-CG 3.3Å; E459-E463 WeakPolarHBondContact O-CG 3.09Å; E459-E463 PolarHBondContact O-N 3.39Å; E460-E463 PolarHBondContact O-N 3.17Å; E463-L467 WeakPolarHBondContact O-CB 3.24Å; E463-L467 WeakPolarHBondContact O-CD1 3.31Å; E463-L467 VanDerWaalsContact O-CG 3.24Å; E463-L467 WeakPolarHBondContact O-CG 3.41Å; E463-L467 PolarHBondContact O-N 2.66Å
464	E	65.3	Low	65.2	Low	129 Å²	129	93.3 Å²	93.3	60%	0.603	48%	0.477	S	S	*	.	H	α-helix	trans	-66.7	-38.9	173.5	-79.6	-171.2	165.9	0	0	112.5	E460 L467 A468	E460-E464 WeakPolarHBondContact O-CB 3.25Å; E460-E464 WeakPolarHBondContact O-CG 3.34Å; E460-E464 PolarHBondContact O-N 3.32Å; E464-L467 PolarHBondContact O-N 3.35Å; E464-A468 VanDerWaalsContact O-CB 3.24Å; E464-A468 WeakPolarHBondContact O-CB 3.42Å; E464-A468 PolarHBondContact O-N 2.82Å
465	A	62.7	Low	63.8	Low	58 Å²	58	103.6 Å²	103.6	48%	0.479	52%	0.521	S	S	.	.	H	α-helix	trans	-66.6	-39.8	175.9	0	0	0	0	0	111.9	G461 D462 A468 S469	G461-A465 VanDerWaalsContact O-CB 3.23Å; G461-A465 WeakPolarHBondContact O-CB 3.43Å; G461-A465 PolarHBondContact O-N 3.39Å; D462-A465 PolarHBondContact O-N 3.48Å; A465-A468 PolarHBondContact O-N 2.81Å; A465-S469 PolarHBondContact O-N 2.9Å
466	E	64.3	Low	62.7	Low	132 Å²	132	107 Å²	107	62%	0.617	55%	0.553	S	S	*	*	H	α-helix	trans	-64.1	-41.6	172.1	-76.1	-160.8	166.5	0	0	111.8	D462 S469 R470	D462-E466 WeakPolarHBondContact O-CG 3.39Å; D462-E466 PolarHBondContact O-N 2.97Å; E466-S469 PolarHBondContact O-N 2.94Å; E466-S469 PolarHBondContact O-OG 2.8Å; E466-R470 PolarHBondContact O-N 2.88Å
467	L	62.1	Low	61.7	Low	106 Å²	106	110.1 Å²	110.1	56%	0.555	57%	0.572	S	S	*	*	H	α-helix	trans	-67.8	-36.9	175.9	-73.8	166.9	0	0	0	112.7	E463 E464 R470 K471	E463-L467 WeakPolarHBondContact O-CB 3.24Å; E463-L467 WeakPolarHBondContact O-CD1 3.31Å; E463-L467 VanDerWaalsContact O-CG 3.24Å; E463-L467 WeakPolarHBondContact O-CG 3.41Å; E463-L467 PolarHBondContact O-N 2.66Å; E464-L467 PolarHBondContact O-N 3.35Å; L467-R470 PolarHBondContact O-N 3Å; L467-K471 PolarHBondContact O-N 3.46Å; L467-K471 VanDerWaalsContact O-N 3.14Å
468	A	59.4	Low	60.8	Low	50 Å²	50	113.3 Å²	113.3	41%	0.413	60%	0.595	S	S	.	*	H	α-helix	trans	-68.9	-33.1	174.9	0	0	0	0	0	112.2	E464 A465 R470 K471	E464-A468 VanDerWaalsContact O-CB 3.24Å; E464-A468 WeakPolarHBondContact O-CB 3.42Å; E464-A468 PolarHBondContact O-N 2.82Å; A465-A468 PolarHBondContact O-N 2.81Å; A468-R470 VanDerWaalsContact C-N 3.27Å; A468-R470 PolarHBondContact O-N 2.9Å; A468-K471 CarbonylContact O-C 3.58Å; A468-K471 PolarHBondContact O-N 2.7Å
469	S	59.3	Low	60.4	Low	91 Å²	91	114.6 Å²	114.6	64%	0.636	61%	0.607	S	S	*	*	H	α-helix	trans	-64.9	-31.2	172.8	81.9	0	0	0	0	112.6	A465 E466	A465-S469 PolarHBondContact O-N 2.9Å; E466-S469 PolarHBondContact O-N 2.94Å; E466-S469 PolarHBondContact O-OG 2.8Å
470	R	62.6	Low	60.3	Low	204 Å²	204	116.1 Å²	116.1	77%	0.77	62%	0.616	S	S	*	*	H	α-helix	trans	-81.4	-26.1	177.6	-72.7	179.6	169.7	175.3	0.2	113.6	E466 L467 A468	E466-R470 PolarHBondContact O-N 2.88Å; L467-R470 PolarHBondContact O-N 3Å; A468-R470 VanDerWaalsContact C-N 3.27Å; A468-R470 PolarHBondContact O-N 2.9Å
471	K	54.1	Low	60.2	Low	166 Å²	166	115.5 Å²	115.5	72%	0.722	62%	0.615	S	S	*	*	S	Bend	trans	-110.9	92	175.4	-72.6	-178.2	179.1	176	0	110.4	L467 A468 K473	L467-K471 PolarHBondContact O-N 3.46Å; L467-K471 VanDerWaalsContact O-N 3.14Å; A468-K471 CarbonylContact O-C 3.58Å; A468-K471 PolarHBondContact O-N 2.7Å; K471-K473 PolarHBondContact O-N 2.9Å
472	K	53.7	Low	60.2	Low	203 Å²	203	117.6 Å²	117.6	88%	0.883	64%	0.636	S	S	*	*	S	Bend	trans	-58.8	109.8	172.2	-86.2	-179.1	175.4	176.2	0	110.3
473	K	47.6	Very low	60.7	Low	214 Å²	214	113.6 Å²	113.6	93%	0.93	62%	0.615	S	S	*	*			trans	103.3	80.8	174.9	-62.3	-177.8	176.1	-178.4	0	115.1	K471	K471-K473 PolarHBondContact O-N 2.9Å
474	G	41.3	Very low	61.2	Low	63 Å²	63	114.1 Å²	114.1	65%	0.649	62%	0.621	S	S	*	*			trans	-150.4	129.6	149.7	0	0	0	0	0	108.5	A476	G474-A476 PolarHBondContact O-N 3.3Å
475	K	44.9	Very low	61.7	Low	215 Å²	215	117 Å²	117	94%	0.935	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-63.8	125.7	172.4	-77.3	177.9	174.9	179.9	0	107.9	L477	K475-L477 PolarHBondContact O-N 2.85Å
476	A	53.2	Low	62.2	Low	92 Å²	92	118.4 Å²	118.4	76%	0.76	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-61.2	127.8	172.2	0	0	0	0	0	109.1	G474	G474-A476 PolarHBondContact O-N 3.3Å
477	L	56.7	Low	62.9	Low	148 Å²	148	117.4 Å²	117.4	78%	0.775	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-62.8	143	166.2	-73.6	159.6	0	0	0	107.8	K475 S479	K475-L477 PolarHBondContact O-N 2.85Å; L477-S479 PolarHBondContact O-N 3.18Å; L477-S479 VanDerWaalsContact O-N 3.16Å
478	P	60.3	Low	63.8	Low	95 Å²	95	115.8 Å²	115.8	62%	0.617	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-59.8	122.8	177	23.9	-31.4	0	0	0	109.2	I480	P478-I480 PolarHBondContact O-N 3.39Å
479	S	67	Low	64.7	Low	62 Å²	62	116.2 Å²	116.2	43%	0.434	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-57.7	131.1	174.3	177	0	0	0	0	109	L477 L481 G482 D483	L477-S479 PolarHBondContact O-N 3.18Å; L477-S479 VanDerWaalsContact O-N 3.16Å; S479-L481 PolarHBondContact O-N 3.39Å; S479-G482 PolarHBondContact O-N 2.86Å; S479-D483 PolarHBondContact O-N 2.7Å
480	I	73.7	Confident	65.7	Low	73 Å²	73	112.5 Å²	112.5	37%	0.374	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-56.3	-25.2	-176.2	-63	162.8	0	0	0	111.5	L457 P478 G482 F486	L457-I480 HydrophobicContact CD1-CB 4.15Å; L457-I480 HydrophobicContact CD1-CG2 4.21Å; L457-I480 HydrophobicContact CD2-CD1 4.08Å; P478-I480 PolarHBondContact O-N 3.39Å; I480-G482 VanDerWaalsContact C-N 3.3Å; I480-G482 PolarHBondContact O-N 2.99Å; I480-F486 HydrophobicContact CG2-CB 3.91Å; I480-F486 HydrophobicContact CG2-CD1 4.49Å; I480-F486 HydrophobicContact CG2-CD2 4.08Å; I480-F486 HydrophobicContact CG2-CG 3.91Å
481	L	71.7	Confident	66.5	Low	63 Å²	63	108.4 Å²	108.4	33%	0.33	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-69	-25.7	176.8	-167.5	71.8	0	0	0	113.4	P447 A454 M458 S479 F490	P447-L481 HydrophobicContact CG-CD1 4.38Å; A454-L481 HydrophobicContact CB-CD1 4.24Å; M458-L481 HydrophobicContact CE-CD2 3.27Å; M458-L481 HydrophobicContact CG-CD2 3.96Å; M458-L481 HydrophobicContact SD-CD2 4.45Å; S479-L481 PolarHBondContact O-N 3.39Å; L481-F490 HydrophobicContact CD1-CE2 4.5Å; L481-F490 HydrophobicContact CD1-CZ 4.46Å
482	G	67.7	Low	67.8	Low	66 Å²	66	103.7 Å²	103.7	68%	0.68	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-104.1	1.2	-179.6	0	0	0	0	0	114.8	S479 I480	S479-G482 PolarHBondContact O-N 2.86Å; I480-G482 VanDerWaalsContact C-N 3.3Å; I480-G482 PolarHBondContact O-N 2.99Å
483	D	79.1	Confident	68.9	Low	30 Å²	30	98 Å²	98	16%	0.16	53%	0.533	C	S	.	.			trans	-90.2	117.2	177.8	-174.3	-14.7	0	0	0	110	S479 R485 F486	S479-D483 PolarHBondContact O-N 2.7Å; D483-R485 PolarHBondContact O-N 3.39Å; D483-R485 WeakPolarHBondContact OD1-CB 3.21Å; D483-R485 WeakPolarHBondContact OD1-CG 3.04Å; D483-R485 PolarHBondContact OD1-N 3.31Å; D483-R485 IonicContact OD1-NE 3.37Å; D483-R485 PolarHBondContact OD1-NE 3.33Å; D483-R485 IonicContact OD2-CZ 3.31Å; D483-R485 IonicContact OD2-NE 2.73Å; D483-R485 PolarHBondContact OD2-NE 2.98Å; D483-R485 VanDerWaalsContact OD2-NE 3.16Å; D483-R485 IonicContact OD2-NH2 2.8Å; D483-R485 PolarHBondContact OD2-NH2 2.64Å; D483-F486 HydrophobicContact CB-CD2 4.04Å; D483-F486 PolarHBondContact O-N 3.33Å
484	D	77.8	Confident	70.4	Confident	136 Å²	136	94.8 Å²	94.8	73%	0.727	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-55.5	-24.4	-178.8	-75.3	-31.7	0	0	0	113.2	F486 K487	D484-F486 VanDerWaalsContact C-N 3.31Å; D484-F486 PolarHBondContact O-N 3.34Å; D484-K487 WeakPolarHBondContact O-CB 3.24Å
485	R	77.4	Confident	72	Confident	190 Å²	190	98.1 Å²	98.1	72%	0.717	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-68.9	-27.1	178	-62.4	-179.6	-64.1	163.4	3	113.5	D483	D483-R485 PolarHBondContact O-N 3.39Å; D483-R485 WeakPolarHBondContact OD1-CB 3.21Å; D483-R485 WeakPolarHBondContact OD1-CG 3.04Å; D483-R485 PolarHBondContact OD1-N 3.31Å; D483-R485 IonicContact OD1-NE 3.37Å; D483-R485 PolarHBondContact OD1-NE 3.33Å; D483-R485 IonicContact OD2-CZ 3.31Å; D483-R485 IonicContact OD2-NE 2.73Å; D483-R485 PolarHBondContact OD2-NE 2.98Å; D483-R485 VanDerWaalsContact OD2-NE 3.16Å; D483-R485 IonicContact OD2-NH2 2.8Å; D483-R485 PolarHBondContact OD2-NH2 2.64Å
486	F	71.9	Confident	73.6	Confident	88 Å²	88	93.8 Å²	93.8	39%	0.386	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-102.5	1.9	-177.2	-65.5	-76.2	0	0	0	113.5	I480 D483 D484 V488 M489 F490	I480-F486 HydrophobicContact CG2-CB 3.91Å; I480-F486 HydrophobicContact CG2-CD1 4.49Å; I480-F486 HydrophobicContact CG2-CD2 4.08Å; I480-F486 HydrophobicContact CG2-CG 3.91Å; D483-F486 HydrophobicContact CB-CD2 4.04Å; D483-F486 PolarHBondContact O-N 3.33Å; D484-F486 VanDerWaalsContact C-N 3.31Å; D484-F486 PolarHBondContact O-N 3.34Å; F486-V488 PolarHBondContact O-N 2.79Å; F486-M489 VanDerWaalsContact O-CB 3.3Å; F486-M489 WeakPolarHBondContact O-CB 3.42Å; F486-M489 PolarHBondContact O-N 3.05Å; F486-F490 WeakPolarHBondContact O-CD2 3.31Å
487	K	79.9	Confident	74.7	Confident	110 Å²	110	92.1 Å²	92.1	48%	0.478	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-35.8	176.8	-169.6	172.3	178.5	177.1	0	113.1	D484 M489 F490 E491	D484-K487 WeakPolarHBondContact O-CB 3.24Å; K487-M489 VanDerWaalsContact C-N 3.25Å; K487-M489 PolarHBondContact O-N 3.37Å; K487-F490 PolarHBondContact O-N 3.11Å; K487-F490 VanDerWaalsContact O-N 3.12Å; K487-E491 WeakPolarHBondContact CE-OE1 3.41Å; K487-E491 PolarHBondContact O-N 2.84Å
488	V	80.9	Confident	75.5	Confident	73 Å²	73	90.2 Å²	90.2	44%	0.442	47%	0.474	S	S	.	.	H	α-helix	trans	-60.2	-32.4	178.1	-177.4	0	0	0	0	112.4	F486 F490 N492 Y495	F486-V488 PolarHBondContact O-N 2.79Å; V488-F490 PolarHBondContact O-N 3.2Å; V488-N492 VanDerWaalsContact CG1-ND2 3.3Å; V488-N492 WeakPolarHBondContact CG1-ND2 3.12Å; V488-N492 WeakPolarHBondContact O-CB 3.45Å; V488-N492 PolarHBondContact O-N 2.88Å; V488-Y495 HydrophobicContact CG1-CE2 4.15Å
489	M	79	Confident	75.9	Confident	59 Å²	59	89.6 Å²	89.6	29%	0.291	46%	0.463	S	S	.	.	H	α-helix	trans	-68.3	-21.9	179.5	-169.7	-176.1	178.1	0	0	113.2	N450 L453 F486 K487	N450-M489 PolarHBondContact ND2-O 3.39Å; L453-M489 HydrophobicContact CD1-CE 3.75Å; L453-M489 HydrophobicContact CD2-CE 4.09Å; F486-M489 VanDerWaalsContact O-CB 3.3Å; F486-M489 WeakPolarHBondContact O-CB 3.42Å; F486-M489 PolarHBondContact O-N 3.05Å; K487-M489 VanDerWaalsContact C-N 3.25Å; K487-M489 PolarHBondContact O-N 3.37Å
490	F	79.3	Confident	76.1	Confident	12 Å²	12	94.8 Å²	94.8	5%	0.053	48%	0.48	C	S	.	.	H	α-helix	trans	-107	-7.5	-174.6	-65.5	-70.1	0	0	0	113.7	P447 V449 N450 L453 A454 L457 L481 F486 K487 V488	P447-F490 HydrophobicContact CB-CB 3.78Å; P447-F490 HydrophobicContact CB-CD1 4.42Å; P447-F490 HydrophobicContact CB-CG 4.41Å; P447-F490 HydrophobicContact CG-CB 4.17Å; P447-F490 HydrophobicContact CG-CD1 3.93Å; P447-F490 HydrophobicContact CG-CG 4.26Å; V449-F490 WeakPolarHBondContact CB-O 3.06Å; V449-F490 PolarHBondContact N-O 2.94Å; N450-F490 HydrophobicContact CB-CD1 4.48Å; L453-F490 HydrophobicContact CD2-CE1 3.65Å; L453-F490 HydrophobicContact CD2-CZ 3.71Å; A454-F490 HydrophobicContact CB-CD1 4.39Å; A454-F490 HydrophobicContact CB-CE1 4.06Å; L457-F490 HydrophobicContact CD1-CZ 3.83Å; L481-F490 HydrophobicContact CD1-CE2 4.5Å; L481-F490 HydrophobicContact CD1-CZ 4.46Å; F486-F490 WeakPolarHBondContact O-CD2 3.31Å; K487-F490 PolarHBondContact O-N 3.11Å; K487-F490 VanDerWaalsContact O-N 3.12Å; V488-F490 PolarHBondContact O-N 3.2Å
491	E	79.9	Confident	76.4	Confident	118 Å²	118	93.6 Å²	93.6	55%	0.551	48%	0.478	S	S	*	.	H	α-helix	trans	-108.4	-34.6	178.3	-69.5	-179.7	170.4	0	0	113	V449 K487	V449-E491 WeakPolarHBondContact CG2-O 3.41Å; K487-E491 WeakPolarHBondContact CE-OE1 3.41Å; K487-E491 PolarHBondContact O-N 2.84Å
492	N	80.5	Confident	76.2	Confident	68 Å²	68	98.1 Å²	98.1	36%	0.364	50%	0.498	S	S	.	.			trans	-89.8	126.9	-174.8	-78	-7.2	0	0	0	112.8	V449 V488 D494 Y495	V449-N492 WeakPolarHBondContact CG1-O 3.39Å; V488-N492 VanDerWaalsContact CG1-ND2 3.3Å; V488-N492 WeakPolarHBondContact CG1-ND2 3.12Å; V488-N492 WeakPolarHBondContact O-CB 3.45Å; V488-N492 PolarHBondContact O-N 2.88Å; N492-D494 VanDerWaalsContact C-N 3.26Å; N492-D494 PolarHBondContact O-N 2.93Å; N492-Y495 HydrophobicContact CB-CD2 3.76Å; N492-Y495 HydrophobicContact CB-CE2 4.19Å; N492-Y495 PolarHBondContact O-N 3.23Å
493	P	78	Confident	76.3	Confident	82 Å²	82	102.4 Å²	102.4	53%	0.532	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-66.9	-24.1	-177.5	28.5	-35.3	0	0	0	113.6	Y495 Q496	P493-Y495 PolarHBondContact O-N 2.89Å; P493-Q496 WeakPolarHBondContact O-CB 3.23Å; P493-Q496 PolarHBondContact O-N 2.89Å
494	D	77.8	Confident	75.9	Confident	147 Å²	147	103.8 Å²	103.8	79%	0.786	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-65.3	-19.3	180	-59.4	-22.6	0	0	0	113.3	N492 Q496	N492-D494 VanDerWaalsContact C-N 3.26Å; N492-D494 PolarHBondContact O-N 2.93Å; D494-Q496 VanDerWaalsContact C-N 3.31Å
495	Y	75.4	Confident	75.6	Confident	134 Å²	134	105.4 Å²	105.4	53%	0.525	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-92.2	11.6	176	-66.6	-81.3	0	0	0	112.8	N450 V488 N492 P493 V497	N450-Y495 PolarHBondContact ND2-O 3.41Å; V488-Y495 HydrophobicContact CG1-CE2 4.15Å; N492-Y495 HydrophobicContact CB-CD2 3.76Å; N492-Y495 HydrophobicContact CB-CE2 4.19Å; N492-Y495 PolarHBondContact O-N 3.23Å; P493-Y495 PolarHBondContact O-N 2.89Å; Y495-V497 PolarHBondContact O-N 3.09Å
496	Q	78.5	Confident	75.3	Confident	123 Å²	123	103 Å²	103	58%	0.575	50%	0.502	S	S	*	.			trans	-63.4	125.5	177.9	-177.3	167.4	-7.6	0	0	110.9	V449 N450 P493 D494 D498	V449-Q496 HydrophobicContact CG1-CB 4.39Å; N450-Q496 WeakPolarHBondContact OD1-CA 3.45Å; P493-Q496 WeakPolarHBondContact O-CB 3.23Å; P493-Q496 PolarHBondContact O-N 2.89Å; D494-Q496 VanDerWaalsContact C-N 3.31Å; Q496-D498 PolarHBondContact O-N 3.08Å
497	V	76.4	Confident	75	Confident	58 Å²	58	105.5 Å²	105.5	35%	0.352	52%	0.518	S	S	.	.			trans	-76.4	113	-179.8	-179.3	0	0	0	0	110.1	N450 L453 Y495 E499 F504	N450-V497 PolarHBondContact OD1-N 3.42Å; N450-V497 VanDerWaalsContact OD1-N 3.07Å; L453-V497 HydrophobicContact CD1-CG2 4.37Å; Y495-V497 PolarHBondContact O-N 3.09Å; V497-E499 PolarHBondContact O-N 3.06Å; V497-F504 HydrophobicContact CG1-CD2 3.74Å; V497-F504 HydrophobicContact CG1-CE2 3.56Å; V497-F504 HydrophobicContact CG1-CZ 4.27Å
498	D	74.1	Confident	74.2	Confident	108 Å²	108	103.8 Å²	103.8	58%	0.578	51%	0.514	S	S	*	.			trans	-84.2	106	176.9	-77.7	-25.9	0	0	0	112.1	Q496 Q500 S501	Q496-D498 PolarHBondContact O-N 3.08Å; D498-Q500 PolarHBondContact O-N 2.74Å; D498-Q500 VanDerWaalsContact O-N 3.08Å; D498-S501 PolarHBondContact O-N 3.25Å; D498-S501 PolarHBondContact O-OG 3.06Å
499	E	68.8	Low	73.3	Confident	82 Å²	82	105.6 Å²	105.6	38%	0.383	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.8	177.8	-62.3	-173.4	139.8	0	0	114.1	V497 F504 K519	V497-E499 PolarHBondContact O-N 3.06Å; E499-F504 HydrophobicContact CB-CD1 4.49Å; E499-F504 HydrophobicContact CB-CE1 4.31Å; E499-F504 HydrophobicContact CG-CE1 4.24Å; E499-K519 WeakPolarHBondContact OE1-CE 3.18Å; E499-K519 IonicContact OE1-NZ 3.75Å; E499-K519 PolarHBondContact OE1-NZ 3.12Å; E499-K519 IonicContact OE2-NZ 2.9Å; E499-K519 PolarHBondContact OE2-NZ 2.81Å
500	Q	70.3	Confident	72.3	Confident	170 Å²	170	110 Å²	110	79%	0.794	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-11.5	-178.3	-62.2	-163.8	-7.9	0	0	113.8	D498	D498-Q500 PolarHBondContact O-N 2.74Å; D498-Q500 VanDerWaalsContact O-N 3.08Å
501	S	80	Confident	71.3	Confident	48 Å²	48	112.5 Å²	112.5	34%	0.336	57%	0.567	S	S	.	*	S	Bend	trans	-65.4	141.6	177.8	62.2	0	0	0	0	111.8	D498 E503 F504 R505	D498-S501 PolarHBondContact O-N 3.25Å; D498-S501 PolarHBondContact O-OG 3.06Å; S501-E503 VanDerWaalsContact C-N 3.28Å; S501-E503 PolarHBondContact O-N 2.66Å; S501-F504 PolarHBondContact O-N 3.4Å; S501-F504 WeakPolarHBondContact OG-CB 3.28Å; S501-R505 PolarHBondContact O-N 2.6Å
502	E	67.1	Low	70.4	Confident	159 Å²	159	111 Å²	111	74%	0.743	57%	0.569	S	S	*	*	H	α-helix	trans	-64.6	-35.1	-179.7	-65	-171.3	158.5	0	0	111.7	R505 L506	E502-R505 PolarHBondContact O-N 3.2Å; E502-L506 WeakPolarHBondContact O-CB 3.38Å; E502-L506 WeakPolarHBondContact O-CD1 3.33Å; E502-L506 VanDerWaalsContact O-CG 3.31Å; E502-L506 WeakPolarHBondContact O-CG 3.42Å; E502-L506 PolarHBondContact O-N 2.83Å
503	E	70.1	Confident	69.6	Low	155 Å²	155	115.8 Å²	115.8	72%	0.724	59%	0.587	S	S	*	*	H	α-helix	trans	-62.4	-42.8	177.3	-60.8	-176	168.2	0	0	112.1	S501 L506 L507	S501-E503 VanDerWaalsContact C-N 3.28Å; S501-E503 PolarHBondContact O-N 2.66Å; E503-L506 PolarHBondContact O-N 3.09Å; E503-L507 PolarHBondContact O-N 2.74Å
504	F	70.1	Confident	69	Low	59 Å²	59	115.8 Å²	115.8	26%	0.259	59%	0.585	S	S	.	*	H	α-helix	trans	-68.1	-35.9	177.8	-175.6	-98.2	0	0	0	112.6	V497 E499 S501 N508	V497-F504 HydrophobicContact CG1-CD2 3.74Å; V497-F504 HydrophobicContact CG1-CE2 3.56Å; V497-F504 HydrophobicContact CG1-CZ 4.27Å; E499-F504 HydrophobicContact CB-CD1 4.49Å; E499-F504 HydrophobicContact CB-CE1 4.31Å; E499-F504 HydrophobicContact CG-CE1 4.24Å; S501-F504 PolarHBondContact O-N 3.4Å; S501-F504 WeakPolarHBondContact OG-CB 3.28Å; F504-N508 PolarHBondContact O-N 3.24Å
505	R	71.8	Confident	68.5	Low	170 Å²	170	109.5 Å²	109.5	64%	0.642	56%	0.555	S	S	*	*	H	α-helix	trans	-70.8	-36.2	176.9	-78	178.1	158.8	179.5	-5.2	112.9	S501 E502	S501-R505 PolarHBondContact O-N 2.6Å; E502-R505 PolarHBondContact O-N 3.2Å
506	L	71.9	Confident	68.2	Low	141 Å²	141	109 Å²	109	74%	0.738	56%	0.557	S	S	*	*	H	α-helix	trans	-70.1	-39.3	177.9	-76.6	164.1	0	0	0	112.3	E502 E503	E502-L506 WeakPolarHBondContact O-CB 3.38Å; E502-L506 WeakPolarHBondContact O-CD1 3.33Å; E502-L506 VanDerWaalsContact O-CG 3.31Å; E502-L506 WeakPolarHBondContact O-CG 3.42Å; E502-L506 PolarHBondContact O-N 2.83Å; E503-L506 PolarHBondContact O-N 3.09Å
507	L	65.5	Low	67.8	Low	139 Å²	139	110.7 Å²	110.7	73%	0.728	56%	0.563	S	S	*	*	H	α-helix	trans	-73.7	-27.1	-179.8	-81.8	158.5	0	0	0	113.4	E503 P509	E503-L507 PolarHBondContact O-N 2.74Å; L507-P509 WeakPolarHBondContact O-CD 3.1Å
508	N	63.6	Low	67.5	Low	75 Å²	75	110.1 Å²	110.1	40%	0.401	55%	0.554	S	S	.	*			trans	-127.2	77.8	-174.8	-68.6	-41.9	0	0	0	113.6	F504 I510 V511	F504-N508 PolarHBondContact O-N 3.24Å; N508-I510 VanDerWaalsContact C-N 3.33Å; N508-I510 PolarHBondContact O-N 3.18Å; N508-V511 HydrophobicContact CB-CG2 3.46Å; N508-V511 VanDerWaalsContact CB-CG2 3.46Å; N508-V511 WeakPolarHBondContact O-CG2 3.3Å
509	P	60.8	Low	67.3	Low	111 Å²	111	108.8 Å²	108.8	72%	0.721	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-5.6	-175.5	24.8	-31.9	0	0	0	116.5	L507	L507-P509 WeakPolarHBondContact O-CD 3.1Å
510	I	58.2	Low	67.7	Low	151 Å²	151	111.9 Å²	111.9	77%	0.774	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	13.2	-168.8	-55.3	170.2	0	0	0	113.9	N508 S512	N508-I510 VanDerWaalsContact C-N 3.33Å; N508-I510 PolarHBondContact O-N 3.18Å; I510-S512 VanDerWaalsContact C-N 3.3Å; I510-S512 PolarHBondContact O-N 3.07Å; I510-S512 VanDerWaalsContact O-N 3.1Å
511	V	58.4	Low	67.8	Low	65 Å²	65	109.1 Å²	109.1	39%	0.394	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9.9	-165.3	-172	0	0	0	0	115.7	N508 K513 G515	N508-V511 HydrophobicContact CB-CG2 3.46Å; N508-V511 VanDerWaalsContact CB-CG2 3.46Å; N508-V511 WeakPolarHBondContact O-CG2 3.3Å; V511-K513 PolarHBondContact O-N 2.9Å; V511-G515 PolarHBondContact O-N 3.1Å; V511-G515 VanDerWaalsContact O-N 3.09Å
512	S	61.7	Low	67.3	Low	87 Å²	87	108.6 Å²	108.6	61%	0.608	53%	0.534	S	S	*	.	H	α-helix	trans	-64.1	-33.3	-165.3	65.3	0	0	0	0	115.4	I510 Q516	I510-S512 VanDerWaalsContact C-N 3.3Å; I510-S512 PolarHBondContact O-N 3.07Å; I510-S512 VanDerWaalsContact O-N 3.1Å; S512-Q516 VanDerWaalsContact O-CD 3.29Å; S512-Q516 WeakPolarHBondContact O-CG 3.26Å
513	K	63.8	Low	67.6	Low	167 Å²	167	110.4 Å²	110.4	73%	0.726	53%	0.534	S	S	*	.	H	α-helix	trans	-93	-35.1	-176.5	-67.6	-175	-179.3	178.1	0	114.5	V511	V511-K513 PolarHBondContact O-N 2.9Å
514	V	65.8	Low	67.8	Low	83 Å²	83	107.8 Å²	107.8	50%	0.503	53%	0.525	S	S	.	.	H	α-helix	trans	-79.9	-38.7	-179.6	-178.5	0	0	0	0	110.8	Q516 K517 R518	V514-Q516 VanDerWaalsContact C-N 3.33Å; V514-Q516 PolarHBondContact O-N 3.44Å; V514-K517 PolarHBondContact O-N 2.91Å; V514-R518 PolarHBondContact O-N 3.33Å
515	G	66.4	Low	67.6	Low	14 Å²	14	107.8 Å²	107.8	14%	0.144	53%	0.527	C	S	.	.	H	α-helix	trans	-62.1	-36.7	174.8	0	0	0	0	0	113.1	V511 K517 R518 K519	V511-G515 PolarHBondContact O-N 3.1Å; V511-G515 VanDerWaalsContact O-N 3.09Å; G515-K517 PolarHBondContact O-N 3.39Å; G515-R518 PolarHBondContact O-N 3.22Å; G515-K519 WeakPolarHBondContact O-CG 3.42Å; G515-K519 PolarHBondContact O-N 2.87Å
516	Q	68.5	Low	67.4	Low	125 Å²	125	101.9 Å²	101.9	58%	0.584	51%	0.514	S	S	*	.	H	α-helix	trans	-64.6	-35.3	176	-78.5	179.8	4.1	0	0	113.3	S512 V514 K520	S512-Q516 VanDerWaalsContact O-CD 3.29Å; S512-Q516 WeakPolarHBondContact O-CG 3.26Å; V514-Q516 VanDerWaalsContact C-N 3.33Å; V514-Q516 PolarHBondContact O-N 3.44Å; Q516-K520 WeakPolarHBondContact O-CG 3.2Å; Q516-K520 PolarHBondContact O-N 3.13Å
517	K	71.4	Confident	67.3	Low	157 Å²	157	101 Å²	101	68%	0.683	51%	0.507	S	S	*	.	H	α-helix	trans	-68.2	-41.2	175	-72.3	-175.1	178.2	-177.3	0	111.4	V514 G515 K520 K521	V514-K517 PolarHBondContact O-N 2.91Å; G515-K517 PolarHBondContact O-N 3.39Å; K517-K520 PolarHBondContact O-N 3.23Å; K517-K521 PolarHBondContact O-N 2.97Å; K517-K521 VanDerWaalsContact O-N 3.07Å
518	R	68.4	Low	67.2	Low	47 Å²	47	99.6 Å²	99.6	18%	0.177	50%	0.496	C	S	.	.	H	α-helix	trans	-65.7	-44.6	177.6	-70.4	179.7	173.8	162.1	-1.8	112.2	E459 V514 G515 K520 K521 L522	E459-R518 IonicContact OE2-CZ 2.95Å; E459-R518 VanDerWaalsContact OE2-CZ 3.31Å; E459-R518 IonicContact OE2-NE 3.96Å; E459-R518 PolarHBondContact OE2-NE 2.88Å; E459-R518 IonicContact OE2-NH2 2.7Å; E459-R518 PolarHBondContact OE2-NH2 3.15Å; V514-R518 PolarHBondContact O-N 3.33Å; G515-R518 PolarHBondContact O-N 3.22Å; R518-K520 VanDerWaalsContact C-N 3.28Å; R518-K520 PolarHBondContact O-N 3.24Å; R518-K521 PolarHBondContact O-N 3.49Å; R518-K521 VanDerWaalsContact O-N 3.15Å; R518-L522 WeakPolarHBondContact O-CB 3.46Å; R518-L522 PolarHBondContact O-N 3.15Å
519	K	71.4	Confident	67	Low	79 Å²	79	99.3 Å²	99.3	34%	0.343	49%	0.493	S	S	.	.	H	α-helix	trans	-60.1	-34.8	173.9	-74.7	-179	178.9	178.1	0	112.9	E452 E499 G515 R523	E452-K519 WeakPolarHBondContact OE1-CE 3.49Å; E452-K519 WeakPolarHBondContact OE1-CG 3.32Å; E499-K519 WeakPolarHBondContact OE1-CE 3.18Å; E499-K519 IonicContact OE1-NZ 3.75Å; E499-K519 PolarHBondContact OE1-NZ 3.12Å; E499-K519 IonicContact OE2-NZ 2.9Å; E499-K519 PolarHBondContact OE2-NZ 2.81Å; G515-K519 WeakPolarHBondContact O-CG 3.42Å; G515-K519 PolarHBondContact O-N 2.87Å; K519-R523 WeakPolarHBondContact O-CG 3.44Å; K519-R523 PolarHBondContact O-N 3.44Å
520	K	76.2	Confident	67	Low	148 Å²	148	96 Å²	96	64%	0.643	48%	0.475	S	S	*	.	H	α-helix	trans	-67.8	-44.5	173.1	-75.9	178.2	-179.4	-174.6	0	112.5	Q516 K517 R518 L522 R523 L524	Q516-K520 WeakPolarHBondContact O-CG 3.2Å; Q516-K520 PolarHBondContact O-N 3.13Å; K517-K520 PolarHBondContact O-N 3.23Å; R518-K520 VanDerWaalsContact C-N 3.28Å; R518-K520 PolarHBondContact O-N 3.24Å; K520-L522 VanDerWaalsContact C-N 3.34Å; K520-R523 PolarHBondContact O-N 2.75Å; K520-L524 PolarHBondContact O-N 2.88Å
521	K	72.2	Confident	67	Low	112 Å²	112	93.7 Å²	93.7	49%	0.487	46%	0.464	S	S	.	.	H	α-helix	trans	-61.5	-41.7	175.2	-76.5	-174.3	178.6	179.3	0	112	E459 K517 R518 R523 L524 L525	E459-K521 IonicContact OE1-NZ 2.74Å; E459-K521 PolarHBondContact OE1-NZ 3.49Å; K517-K521 PolarHBondContact O-N 2.97Å; K517-K521 VanDerWaalsContact O-N 3.07Å; R518-K521 PolarHBondContact O-N 3.49Å; R518-K521 VanDerWaalsContact O-N 3.15Å; K521-R523 PolarHBondContact O-N 2.84Å; K521-L524 WeakPolarHBondContact O-CB 3.45Å; K521-L524 PolarHBondContact O-N 2.84Å; K521-L524 VanDerWaalsContact O-N 3.16Å; K521-L525 PolarHBondContact O-N 2.99Å
522	L	69.1	Low	67	Low	37 Å²	37	95 Å²	95	19%	0.194	47%	0.472	C	S	.	.	H	α-helix	trans	-63.5	-39.6	179.8	-150.6	161	0	0	0	111.8	K451 E452 L455 R518 K520 L524 A526	K451-L522 HydrophobicContact CB-CD1 3.99Å; K451-L522 HydrophobicContact CD-CD2 4.41Å; E452-L522 HydrophobicContact CG-CD1 3.55Å; L455-L522 HydrophobicContact CD1-CB 4.18Å; L455-L522 HydrophobicContact CD1-CD1 3.87Å; L455-L522 HydrophobicContact CD1-CG 3.89Å; R518-L522 WeakPolarHBondContact O-CB 3.46Å; R518-L522 PolarHBondContact O-N 3.15Å; K520-L522 VanDerWaalsContact C-N 3.34Å; L522-L524 VanDerWaalsContact C-N 3.33Å; L522-L524 PolarHBondContact O-N 2.96Å; L522-A526 WeakPolarHBondContact O-CB 3.43Å; L522-A526 PolarHBondContact O-N 3.37Å
523	R	74.6	Confident	66.6	Low	196 Å²	196	97.1 Å²	97.1	74%	0.74	47%	0.472	S	S	*	.	H	α-helix	trans	-62.8	-37.2	172.9	-76.4	-179	179.1	-175.8	-1	113.2	K519 K520 K521 Q527	K519-R523 WeakPolarHBondContact O-CG 3.44Å; K519-R523 PolarHBondContact O-N 3.44Å; K520-R523 PolarHBondContact O-N 2.75Å; K521-R523 PolarHBondContact O-N 2.84Å; R523-Q527 WeakPolarHBondContact O-CG 3.45Å; R523-Q527 PolarHBondContact O-N 3.24Å; R523-Q527 VanDerWaalsContact O-N 3.12Å
524	L	73.8	Confident	65.7	Low	101 Å²	101	95.4 Å²	95.4	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-72.1	-40.8	-179.1	-131.1	159.2	0	0	0	111.5	K520 K521 L522 Q527 Q528	K520-L524 PolarHBondContact O-N 2.88Å; K521-L524 WeakPolarHBondContact O-CB 3.45Å; K521-L524 PolarHBondContact O-N 2.84Å; K521-L524 VanDerWaalsContact O-N 3.16Å; L522-L524 VanDerWaalsContact C-N 3.33Å; L522-L524 PolarHBondContact O-N 2.96Å; L524-Q527 PolarHBondContact O-N 3.31Å; L524-Q528 PolarHBondContact O-N 2.78Å; L524-Q528 VanDerWaalsContact O-N 3.14Å
525	L	66.6	Low	65	Low	59 Å²	59	94.4 Å²	94.4	31%	0.309	47%	0.467	S	S	.	.	H	α-helix	trans	-66.9	-39.6	173.4	-84.2	158.7	0	0	0	112.3	L446 L455 K521 Q527 Q528 E529	L446-L525 HydrophobicContact CD1-CD1 4.34Å; L455-L525 HydrophobicContact CD2-CD1 4.23Å; K521-L525 PolarHBondContact O-N 2.99Å; L525-Q527 VanDerWaalsContact C-N 3.29Å; L525-Q527 PolarHBondContact O-N 2.87Å; L525-Q528 PolarHBondContact O-N 2.92Å; L525-E529 PolarHBondContact O-N 3.32Å
526	A	67.9	Low	64	Low	45 Å²	45	96.8 Å²	96.8	37%	0.372	49%	0.485	S	S	.	.	H	α-helix	trans	-64.9	-33	175.7	0	0	0	0	0	112.6	L522 A530	L522-A526 WeakPolarHBondContact O-CB 3.43Å; L522-A526 PolarHBondContact O-N 3.37Å; A526-A530 WeakPolarHBondContact O-CB 2.91Å; A526-A530 PolarHBondContact O-N 3.09Å
527	Q	68.2	Low	62.6	Low	124 Å²	124	97.6 Å²	97.6	58%	0.579	49%	0.494	S	S	*	.	H	α-helix	trans	-66.7	-42.6	171.7	-77.6	174.7	-26	0	0	111.5	R523 L524 L525 A530 D531	R523-Q527 WeakPolarHBondContact O-CG 3.45Å; R523-Q527 PolarHBondContact O-N 3.24Å; R523-Q527 VanDerWaalsContact O-N 3.12Å; L524-Q527 PolarHBondContact O-N 3.31Å; L525-Q527 VanDerWaalsContact C-N 3.29Å; L525-Q527 PolarHBondContact O-N 2.87Å; Q527-A530 PolarHBondContact O-N 3.43Å; Q527-D531 VanDerWaalsContact O-CG 3.26Å; Q527-D531 PolarHBondContact O-N 3.43Å
528	Q	63.5	Low	61	Low	109 Å²	109	98.4 Å²	98.4	51%	0.509	50%	0.5	S	S	.	.	H	α-helix	trans	-65.6	-38.4	176.1	-71.8	177.9	-10.9	0	0	113	L524 L525 V532	L524-Q528 PolarHBondContact O-N 2.78Å; L524-Q528 VanDerWaalsContact O-N 3.14Å; L525-Q528 PolarHBondContact O-N 2.92Å; Q528-V532 VanDerWaalsContact O-CG2 3.24Å; Q528-V532 WeakPolarHBondContact O-CG2 3.37Å; Q528-V532 PolarHBondContact O-N 2.92Å; Q528-V532 VanDerWaalsContact O-N 3.08Å
529	E	59.6	Low	59.6	Low	69 Å²	69	103.1 Å²	103.1	32%	0.322	53%	0.529	S	S	.	.	H	α-helix	trans	-66	-38.5	174.1	-76.6	-177.2	158.2	0	0	111.8	L525 V532 Q533	L525-E529 PolarHBondContact O-N 3.32Å; E529-V532 PolarHBondContact O-N 2.97Å; E529-Q533 WeakPolarHBondContact O-CB 3.36Å; E529-Q533 WeakPolarHBondContact O-CG 3.18Å; E529-Q533 PolarHBondContact O-N 2.74Å
530	A	60.9	Low	57.9	Low	42 Å²	42	108 Å²	108	35%	0.347	55%	0.552	S	S	.	*	H	α-helix	trans	-66.7	-40.9	176.2	0	0	0	0	0	112.2	A526 Q527 V532 Q533 Q534	A526-A530 WeakPolarHBondContact O-CB 2.91Å; A526-A530 PolarHBondContact O-N 3.09Å; Q527-A530 PolarHBondContact O-N 3.43Å; A530-V532 VanDerWaalsContact C-N 3.33Å; A530-V532 PolarHBondContact O-N 2.86Å; A530-Q533 PolarHBondContact O-N 2.74Å; A530-Q534 WeakPolarHBondContact O-CB 3.24Å; A530-Q534 WeakPolarHBondContact O-CG 3.39Å; A530-Q534 PolarHBondContact O-N 2.84Å
531	D	58.8	Low	55.8	Low	102 Å²	102	109.7 Å²	109.7	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-66.1	-35	176.6	-68.7	-17.1	0	0	0	111.7	Q527 A535	Q527-D531 VanDerWaalsContact O-CG 3.26Å; Q527-D531 PolarHBondContact O-N 3.43Å; D531-A535 WeakPolarHBondContact O-CB 3.09Å; D531-A535 PolarHBondContact O-N 2.71Å; D531-A535 VanDerWaalsContact O-N 3.13Å
532	V	57.4	Low	54.3	Low	92 Å²	92	109.6 Å²	109.6	56%	0.558	57%	0.574	S	S	*	*	H	α-helix	trans	-75.3	-33.9	176.4	172.6	0	0	0	0	112.1	Q528 E529 A530 A535 A536	Q528-V532 VanDerWaalsContact O-CG2 3.24Å; Q528-V532 WeakPolarHBondContact O-CG2 3.37Å; Q528-V532 PolarHBondContact O-N 2.92Å; Q528-V532 VanDerWaalsContact O-N 3.08Å; E529-V532 PolarHBondContact O-N 2.97Å; A530-V532 VanDerWaalsContact C-N 3.33Å; A530-V532 PolarHBondContact O-N 2.86Å; V532-A535 PolarHBondContact O-N 3.27Å; V532-A536 WeakPolarHBondContact O-CB 3.16Å; V532-A536 PolarHBondContact O-N 2.91Å; V532-A536 VanDerWaalsContact O-N 3.11Å
533	Q	53	Low	52.5	Low	131 Å²	131	117.5 Å²	117.5	61%	0.612	61%	0.609	S	S	*	*	H	α-helix	trans	-70.5	-38.6	173.6	-78.1	174.1	-38.3	0	0	111.8	E529 A530 A535 A536 D537	E529-Q533 WeakPolarHBondContact O-CB 3.36Å; E529-Q533 WeakPolarHBondContact O-CG 3.18Å; E529-Q533 PolarHBondContact O-N 2.74Å; A530-Q533 PolarHBondContact O-N 2.74Å; Q533-A535 VanDerWaalsContact C-N 3.3Å; Q533-A535 PolarHBondContact O-N 2.91Å; Q533-A536 PolarHBondContact O-N 2.79Å; Q533-A536 VanDerWaalsContact O-N 3.12Å; Q533-D537 PolarHBondContact O-N 2.87Å; Q533-D537 VanDerWaalsContact O-N 3.08Å
534	Q	46.6	Very low	50.6	Low	132 Å²	132	111.8 Å²	111.8	62%	0.617	61%	0.612	S	S	*	*	H	α-helix	trans	-63.9	-35.1	172.7	-76.3	178.5	-9.2	0	0	112.4	A530 A536	A530-Q534 WeakPolarHBondContact O-CB 3.24Å; A530-Q534 WeakPolarHBondContact O-CG 3.39Å; A530-Q534 PolarHBondContact O-N 2.84Å; Q534-A536 VanDerWaalsContact C-N 3.32Å
535	A	49.8	Very low	48.4	Very low	62 Å²	62	119.2 Å²	119.2	51%	0.512	63%	0.633	S	S	.	*	H	α-helix	trans	-75.5	-16.3	173.6	0	0	0	0	0	114.1	D531 V532 Q533	D531-A535 WeakPolarHBondContact O-CB 3.09Å; D531-A535 PolarHBondContact O-N 2.71Å; D531-A535 VanDerWaalsContact O-N 3.13Å; V532-A535 PolarHBondContact O-N 3.27Å; Q533-A535 VanDerWaalsContact C-N 3.3Å; Q533-A535 PolarHBondContact O-N 2.91Å
536	A	45.6	Very low	47	Very low	63 Å²	63	121.3 Å²	121.3	52%	0.521	66%	0.659	S	S	.	*	H	α-helix	trans	-91.4	-25.8	177.6	0	0	0	0	0	112.9	V532 Q533 Q534	V532-A536 WeakPolarHBondContact O-CB 3.16Å; V532-A536 PolarHBondContact O-N 2.91Å; V532-A536 VanDerWaalsContact O-N 3.11Å; Q533-A536 PolarHBondContact O-N 2.79Å; Q533-A536 VanDerWaalsContact O-N 3.12Å; Q534-A536 VanDerWaalsContact C-N 3.32Å
537	D	39.9	Very low	45.1	Very low	143 Å²	143	124.3 Å²	124.3	77%	0.765	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-10.6	176.2	-78.5	-15.1	0	0	0	113.2	Q533	Q533-D537 PolarHBondContact O-N 2.87Å; Q533-D537 VanDerWaalsContact O-N 3.08Å
538	E	37.4	Very low	43.1	Very low	174 Å²	174	123.3 Å²	123.3	81%	0.813	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-2.3	174.6	-76.6	-172	162.6	0	0	114.2
539	D	38.1	Very low	41.5	Very low	146 Å²	146	127.2 Å²	127.2	78%	0.781	70%	0.702	S	S	*	*			trans	-105.8	22.1	-178.4	-92	-18.1	0	0	0	113.9
540	E	36.5	Very low	40	Very low	181 Å²	181	133 Å²	133	85%	0.846	73%	0.729	S	S	*	*			trans	-98.6	95.4	164.6	-80.8	-165.2	162.9	0	0	111.2
541	E	32.7	Very low	38.6	Very low	184 Å²	184	140.5 Å²	140.5	86%	0.86	76%	0.757	S	S	*	*			trans	158.7	157.9	136.6	-89.6	-159.5	-170.7	0	0	111.4
542	P	40.2	Very low	37	Very low	110 Å²	110	141.4 Å²	141.4	71%	0.714	77%	0.771	S	S	*	*			cis	-130.6	166.7	-49.8	32.1	-13.5	0	0	0	111.1
543	E	31.7	Very low	35.8	Very low	202 Å²	202	142.1 Å²	142.1	94%	0.944	78%	0.78	S	S	*	*			trans	-59.7	136.7	173.5	-65.2	-175	148.6	0	0	112.7
544	G	34.8	Very low	34.9	Very low	77 Å²	77	142.5 Å²	142.5	79%	0.794	79%	0.786	S	S	*	*			trans	112	93.1	152.4	0	0	0	0	0	116.8
545	R	27.4	Very low	34.4	Very low	256 Å²	256	143.4 Å²	143.4	97%	0.966	80%	0.795	S	S	*	*			trans	-148.6	122.7	144.8	-130.4	173.9	-178.3	169.4	0.5	111.1
546	A	37.1	Very low	34.1	Very low	104 Å²	104	147.6 Å²	147.6	86%	0.86	81%	0.81	S	S	*	*			trans	-83.4	136.9	172	0	0	0	0	0	110.5
547	S	27.2	Very low	34.5	Very low	108 Å²	108	152.3 Å²	152.3	76%	0.755	82%	0.818	S	S	*	*			trans	-170.6	103.1	160.1	-165	0	0	0	0	106.3
548	S	26.1	Very low	34.8	Very low	102 Å²	102	149.5 Å²	149.5	71%	0.713	81%	0.81	S	S	*	*				99.2	119.2	91.9	67	0	0	0	0	110.6
549	E	31.3	Very low	35.1	Very low	191 Å²	191	150.1 Å²	150.1	89%	0.893	81%	0.805	S	S	*	*			trans	-49.3	133.5	167.6	-67.2	162.9	138	0	0	110.9
550	E	26.5	Very low	35.8	Very low	190 Å²	190	147.1 Å²	147.1	89%	0.888	79%	0.792	S	S	*	*			trans	-170.5	140.9	133.6	-104.5	173.8	-160.3	0	0	110.5
551	E	32.1	Very low	36.5	Very low	200 Å²	200	145.2 Å²	145.2	94%	0.935	78%	0.783	S	S	*	*			trans	-52.2	130.4	-177.1	-69.1	169.2	124.8	0	0	112.7
552	S	26.1	Very low	37.4	Very low	122 Å²	122	141.3 Å²	141.3	85%	0.853	77%	0.765	S	S	*	*			trans	-132.4	118.6	166.1	-161.9	0	0	0	0	110.9
553	S	32.3	Very low	38.3	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	74%	0.744	S	S	*	*			trans	-65.5	131.4	-177.5	175.1	0	0	0	0	112.1	D555	S553-D555 PolarHBondContact O-N 2.99Å
554	D	34.3	Very low	39.4	Very low	138 Å²	138	137.7 Å²	137.7	74%	0.738	73%	0.733	S	S	*	*			trans	-20.1	112.4	152.9	-162.5	11.8	0	0	0	115
555	D	35.1	Very low	40.4	Very low	151 Å²	151	140.3 Å²	140.3	81%	0.807	73%	0.725	S	S	*	*			trans	-152.7	64.3	159.1	-132.9	-6.6	0	0	0	111.6	S553 K557	S553-D555 PolarHBondContact O-N 2.99Å; D555-K557 PolarHBondContact O-N 3.26Å
556	D	44.4	Very low	41.6	Very low	151 Å²	151	134 Å²	134	81%	0.807	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	73.7	177.9	-89.1	-22.7	0	0	0	112.9
557	K	53.3	Low	42.6	Very low	161 Å²	161	136.9 Å²	136.9	70%	0.7	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.1	10.8	165.3	-71.4	-168.1	-176.4	154.6	0	118.2	D555 W559	D555-K557 PolarHBondContact O-N 3.26Å; K557-W559 PolarHBondContact O-N 2.62Å
558	S	45.7	Very low	44.3	Very low	84 Å²	84	140.2 Å²	140.2	59%	0.587	69%	0.69	S	S	*	*	H	α-helix	trans	-61.1	-37	-179.2	53.3	0	0	0	0	114.5	V560 E561 E562	S558-V560 PolarHBondContact O-N 3.16Å; S558-E561 PolarHBondContact O-N 2.99Å; S558-E562 PolarHBondContact O-N 2.84Å
559	W	44.4	Very low	46	Very low	187 Å²	187	140.1 Å²	140.1	71%	0.708	68%	0.682	S	S	*	*	H	α-helix	trans	-71.3	-26.7	-173.7	-153.1	71.5	0	0	0	114.5	K557 V563	K557-W559 PolarHBondContact O-N 2.62Å; W559-V563 HydrophobicContact CD2-CG2 3.82Å; W559-V563 HydrophobicContact CE3-CG2 3.68Å; W559-V563 HydrophobicContact CH2-CG2 3.82Å; W559-V563 HydrophobicContact CZ2-CG2 3.95Å; W559-V563 HydrophobicContact CZ3-CG2 3.69Å; W559-V563 WeakPolarHBondContact O-CB 3.12Å; W559-V563 WeakPolarHBondContact O-CG2 3.47Å; W559-V563 PolarHBondContact O-N 2.64Å
560	V	53.1	Low	47.3	Very low	84 Å²	84	136.1 Å²	136.1	51%	0.509	67%	0.666	S	S	.	*	H	α-helix	trans	-75.6	-30.2	-178.6	178.6	0	0	0	0	111.4	S558 R564	S558-V560 PolarHBondContact O-N 3.16Å; V560-R564 PolarHBondContact O-N 2.69Å
561	E	50.3	Low	48.9	Very low	140 Å²	140	135.1 Å²	135.1	65%	0.654	65%	0.654	S	S	*	*	H	α-helix	trans	-75.9	-43.9	174.9	-67.8	-173	158.5	0	0	110.8	S558 V563 R564 E565	S558-E561 PolarHBondContact O-N 2.99Å; E561-V563 PolarHBondContact O-N 2.92Å; E561-R564 WeakPolarHBondContact O-CB 3.21Å; E561-R564 PolarHBondContact O-N 3.27Å; E561-R564 VanDerWaalsContact O-N 3.13Å; E561-E565 PolarHBondContact O-N 3.08Å
562	E	52.3	Low	50	Low	103 Å²	103	130.3 Å²	130.3	48%	0.481	63%	0.631	S	S	.	*	H	α-helix	trans	-59.8	-43.3	174.1	-74.3	178.2	165.1	0	0	112.6	S558 R564 E565 Q566	S558-E562 PolarHBondContact O-N 2.84Å; E562-R564 VanDerWaalsContact C-N 3.31Å; E562-R564 PolarHBondContact O-N 3.2Å; E562-E565 PolarHBondContact O-N 3.46Å; E562-Q566 WeakPolarHBondContact O-CB 3.48Å; E562-Q566 WeakPolarHBondContact O-CG 3.5Å; E562-Q566 PolarHBondContact O-N 3Å
563	V	58.3	Low	51.5	Low	45 Å²	45	130.8 Å²	130.8	27%	0.273	62%	0.62	S	S	.	*	H	α-helix	trans	-67.9	-30.9	177.4	171.1	0	0	0	0	112	W559 E561 R567	W559-V563 HydrophobicContact CD2-CG2 3.82Å; W559-V563 HydrophobicContact CE3-CG2 3.68Å; W559-V563 HydrophobicContact CH2-CG2 3.82Å; W559-V563 HydrophobicContact CZ2-CG2 3.95Å; W559-V563 HydrophobicContact CZ3-CG2 3.69Å; W559-V563 WeakPolarHBondContact O-CB 3.12Å; W559-V563 WeakPolarHBondContact O-CG2 3.47Å; W559-V563 PolarHBondContact O-N 2.64Å; E561-V563 PolarHBondContact O-N 2.92Å; V563-R567 WeakPolarHBondContact O-CB 3.3Å; V563-R567 PolarHBondContact O-N 3.25Å
564	R	54.8	Low	52.8	Low	190 Å²	190	128.5 Å²	128.5	72%	0.717	60%	0.6	S	S	*	*	H	α-helix	trans	-71.5	-40.3	173.8	-91	-178.6	-179.9	169.3	2.3	111.8	V560 E561 E562 R568	V560-R564 PolarHBondContact O-N 2.69Å; E561-R564 WeakPolarHBondContact O-CB 3.21Å; E561-R564 PolarHBondContact O-N 3.27Å; E561-R564 VanDerWaalsContact O-N 3.13Å; E562-R564 VanDerWaalsContact C-N 3.31Å; E562-R564 PolarHBondContact O-N 3.2Å; R564-R568 WeakPolarHBondContact O-CB 3.19Å; R564-R568 PolarHBondContact O-N 2.96Å
565	E	57	Low	54.1	Low	133 Å²	133	131 Å²	131	62%	0.621	60%	0.598	S	S	*	*	H	α-helix	trans	-67.5	-44.5	175.7	-71.7	-165.1	156.1	0	0	111.6	E561 E562 R567 R568 L569	E561-E565 PolarHBondContact O-N 3.08Å; E562-E565 PolarHBondContact O-N 3.46Å; E565-R567 PolarHBondContact O-N 3.38Å; E565-R568 WeakPolarHBondContact O-CA 3.2Å; E565-R568 WeakPolarHBondContact O-CB 3.28Å; E565-R568 PolarHBondContact O-N 3.07Å; E565-L569 WeakPolarHBondContact O-CG 3.38Å; E565-L569 PolarHBondContact O-N 3.49Å
566	Q	52.4	Low	55.3	Low	123 Å²	123	127.5 Å²	127.5	58%	0.575	58%	0.58	S	S	*	*	H	α-helix	trans	-61.7	-41.7	174.2	-74.3	-177	-3.4	0	0	112.2	E562 R568 L569 L570	E562-Q566 WeakPolarHBondContact O-CB 3.48Å; E562-Q566 WeakPolarHBondContact O-CG 3.5Å; E562-Q566 PolarHBondContact O-N 3Å; Q566-R568 VanDerWaalsContact C-N 3.26Å; Q566-R568 PolarHBondContact O-N 2.7Å; Q566-L569 PolarHBondContact O-N 2.85Å; Q566-L570 WeakPolarHBondContact O-CB 3.5Å; Q566-L570 PolarHBondContact O-N 3.44Å
567	R	56.6	Low	56.2	Low	165 Å²	165	126.3 Å²	126.3	62%	0.623	56%	0.564	S	S	*	*	H	α-helix	trans	-66.5	-26.4	173.1	-100.8	-177.3	178.9	-175.4	1.3	113.6	V563 E565 R571	V563-R567 WeakPolarHBondContact O-CB 3.3Å; V563-R567 PolarHBondContact O-N 3.25Å; E565-R567 PolarHBondContact O-N 3.38Å; R567-R571 WeakPolarHBondContact O-CB 3.12Å; R567-R571 VanDerWaalsContact O-CG 3.32Å; R567-R571 WeakPolarHBondContact O-CG 3.24Å; R567-R571 PolarHBondContact O-N 3.1Å
568	R	62.9	Low	56.6	Low	177 Å²	177	125.9 Å²	125.9	67%	0.668	56%	0.558	S	S	*	*	H	α-helix	trans	-77.8	-41.5	177.2	-169.1	178.5	-177.1	-177.3	-0.1	110.4	R564 E565 Q566 R571 Q572	R564-R568 WeakPolarHBondContact O-CB 3.19Å; R564-R568 PolarHBondContact O-N 2.96Å; E565-R568 WeakPolarHBondContact O-CA 3.2Å; E565-R568 WeakPolarHBondContact O-CB 3.28Å; E565-R568 PolarHBondContact O-N 3.07Å; Q566-R568 VanDerWaalsContact C-N 3.26Å; Q566-R568 PolarHBondContact O-N 2.7Å; R568-R571 PolarHBondContact O-N 3.28Å; R568-Q572 PolarHBondContact O-N 3.33Å
569	L	63	Low	57.1	Low	101 Å²	101	130.1 Å²	130.1	53%	0.529	56%	0.561	S	S	.	*	H	α-helix	trans	-63.4	-47.8	173.1	-76.4	163.8	0	0	0	111.5	E565 Q566 R571 Q572 E573	E565-L569 WeakPolarHBondContact O-CG 3.38Å; E565-L569 PolarHBondContact O-N 3.49Å; Q566-L569 PolarHBondContact O-N 2.85Å; L569-R571 VanDerWaalsContact C-N 3.29Å; L569-R571 PolarHBondContact O-N 3.33Å; L569-Q572 CarbonylContact O-C 3.56Å; L569-Q572 WeakPolarHBondContact O-CA 3.22Å; L569-Q572 WeakPolarHBondContact O-CB 3.43Å; L569-Q572 PolarHBondContact O-N 3.43Å; L569-E573 PolarHBondContact O-N 3.45Å
570	L	57.8	Low	57.6	Low	107 Å²	107	127 Å²	127	56%	0.56	55%	0.554	S	S	*	*	H	α-helix	trans	-59.6	-37.2	174.9	-97.7	148.2	0	0	0	112.8	Q566 D574	Q566-L570 WeakPolarHBondContact O-CB 3.5Å; Q566-L570 PolarHBondContact O-N 3.44Å; L570-D574 WeakPolarHBondContact O-CB 3.41Å; L570-D574 PolarHBondContact O-N 3.05Å
571	R	59.7	Low	57.6	Low	168 Å²	168	128.1 Å²	128.1	63%	0.634	55%	0.554	S	S	*	*	H	α-helix	trans	-74.1	-27.7	174.7	-79	-170.4	-123.5	-140.5	4	113.3	R567 R568 L569 R575	R567-R571 WeakPolarHBondContact O-CB 3.12Å; R567-R571 VanDerWaalsContact O-CG 3.32Å; R567-R571 WeakPolarHBondContact O-CG 3.24Å; R567-R571 PolarHBondContact O-N 3.1Å; R568-R571 PolarHBondContact O-N 3.28Å; L569-R571 VanDerWaalsContact C-N 3.29Å; L569-R571 PolarHBondContact O-N 3.33Å; R571-R575 WeakPolarHBondContact O-CB 3.36Å; R571-R575 PolarHBondContact O-N 3.01Å; R571-R575 VanDerWaalsContact O-N 3.15Å
572	Q	56.7	Low	57.7	Low	100 Å²	100	130.2 Å²	130.2	47%	0.467	56%	0.556	S	S	.	*	H	α-helix	trans	-72.3	-46.9	171.3	-85.2	177.6	-25.8	0	0	110.3	R568 L569 D574 R575 D576	R568-Q572 PolarHBondContact O-N 3.33Å; L569-Q572 CarbonylContact O-C 3.56Å; L569-Q572 WeakPolarHBondContact O-CA 3.22Å; L569-Q572 WeakPolarHBondContact O-CB 3.43Å; L569-Q572 PolarHBondContact O-N 3.43Å; Q572-D574 PolarHBondContact O-N 3.1Å; Q572-R575 CarbonylContact O-C 3.57Å; Q572-R575 WeakPolarHBondContact O-CA 3.4Å; Q572-R575 WeakPolarHBondContact O-CB 3.47Å; Q572-R575 PolarHBondContact O-N 3.4Å; Q572-R575 VanDerWaalsContact O-N 3.09Å; Q572-D576 WeakPolarHBondContact O-CB 3.34Å; Q572-D576 PolarHBondContact O-N 2.71Å
573	E	57.6	Low	57.5	Low	131 Å²	131	134.3 Å²	134.3	61%	0.612	57%	0.567	S	S	*	*	H	α-helix	trans	-58.4	-44.7	172.6	-88.5	-174.1	141.7	0	0	112.3	L569 R575 D576 R577	L569-E573 PolarHBondContact O-N 3.45Å; E573-R575 VanDerWaalsContact C-N 3.27Å; E573-R575 PolarHBondContact O-N 2.96Å; E573-D576 PolarHBondContact O-N 2.73Å; E573-R577 WeakPolarHBondContact O-CB 3.25Å; E573-R577 PolarHBondContact O-N 3.39Å
574	D	59.4	Low	57	Low	60 Å²	60	136.3 Å²	136.3	32%	0.321	58%	0.577	S	S	.	*	H	α-helix	trans	-65.6	-32	176.4	-115.3	11.8	0	0	0	111.9	L570 Q572 R577 R578	L570-D574 WeakPolarHBondContact O-CB 3.41Å; L570-D574 PolarHBondContact O-N 3.05Å; Q572-D574 PolarHBondContact O-N 3.1Å; D574-R577 IonicContact OD1-CZ 2.73Å; D574-R577 IonicContact OD1-NH1 3.16Å; D574-R577 PolarHBondContact OD1-NH1 3.04Å; D574-R577 IonicContact OD1-NH2 3.22Å; D574-R577 PolarHBondContact OD1-NH2 3.26Å; D574-R578 WeakPolarHBondContact O-CB 3.11Å; D574-R578 WeakPolarHBondContact O-CG 3.37Å; D574-R578 PolarHBondContact O-N 3.24Å; D574-R578 VanDerWaalsContact O-N 3.12Å
575	R	61.8	Low	56.7	Low	189 Å²	189	130.1 Å²	130.1	71%	0.713	57%	0.566	S	S	*	*	H	α-helix	trans	-73.3	-39.2	174.4	-95.6	-176.7	167.9	-176.4	-2.7	112.1	R571 Q572 E573 R579	R571-R575 WeakPolarHBondContact O-CB 3.36Å; R571-R575 PolarHBondContact O-N 3.01Å; R571-R575 VanDerWaalsContact O-N 3.15Å; Q572-R575 CarbonylContact O-C 3.57Å; Q572-R575 WeakPolarHBondContact O-CA 3.4Å; Q572-R575 WeakPolarHBondContact O-CB 3.47Å; Q572-R575 PolarHBondContact O-N 3.4Å; Q572-R575 VanDerWaalsContact O-N 3.09Å; E573-R575 VanDerWaalsContact C-N 3.27Å; E573-R575 PolarHBondContact O-N 2.96Å; R575-R579 WeakPolarHBondContact O-CB 3.25Å; R575-R579 WeakPolarHBondContact O-CG 3.35Å; R575-R579 PolarHBondContact O-N 3.22Å
576	D	59.7	Low	56.1	Low	78 Å²	78	129.4 Å²	129.4	42%	0.417	57%	0.566	S	S	.	*	H	α-helix	trans	-76.5	-35.5	-179.2	-71.4	-27.3	0	0	0	111.2	Q572 E573 R579 Q580	Q572-D576 WeakPolarHBondContact O-CB 3.34Å; Q572-D576 PolarHBondContact O-N 2.71Å; E573-D576 PolarHBondContact O-N 2.73Å; D576-R579 CarbonylContact O-C 3.52Å; D576-R579 WeakPolarHBondContact O-CB 3.43Å; D576-R579 PolarHBondContact O-N 3.44Å; D576-R579 VanDerWaalsContact O-N 3.17Å; D576-Q580 WeakPolarHBondContact O-CB 3.13Å; D576-Q580 PolarHBondContact O-N 2.93Å
577	R	63.4	Low	55.7	Low	127 Å²	127	132.7 Å²	132.7	48%	0.479	57%	0.573	S	S	.	*	H	α-helix	trans	-61.7	-46.1	168.1	-166.4	176.5	79	-128.6	-9.2	111.1	E573 D574 R579 Q580 E581	E573-R577 WeakPolarHBondContact O-CB 3.25Å; E573-R577 PolarHBondContact O-N 3.39Å; D574-R577 IonicContact OD1-CZ 2.73Å; D574-R577 IonicContact OD1-NH1 3.16Å; D574-R577 PolarHBondContact OD1-NH1 3.04Å; D574-R577 IonicContact OD1-NH2 3.22Å; D574-R577 PolarHBondContact OD1-NH2 3.26Å; R577-R579 VanDerWaalsContact C-N 3.26Å; R577-R579 PolarHBondContact O-N 2.84Å; R577-Q580 PolarHBondContact O-N 3.02Å; R577-E581 IonicContact NE-OE1 2.74Å; R577-E581 WeakPolarHBondContact O-CB 3.23Å; R577-E581 WeakPolarHBondContact O-CG 3.49Å; R577-E581 PolarHBondContact O-N 3.45Å
578	R	61.8	Low	55.1	Low	152 Å²	152	131.8 Å²	131.8	57%	0.574	58%	0.581	S	S	*	*	H	α-helix	trans	-65	-27.2	173.7	-76.4	176.2	-177.4	-164.8	2.5	113.3	D574 R582	D574-R578 WeakPolarHBondContact O-CB 3.11Å; D574-R578 WeakPolarHBondContact O-CG 3.37Å; D574-R578 PolarHBondContact O-N 3.24Å; D574-R578 VanDerWaalsContact O-N 3.12Å; R578-R582 WeakPolarHBondContact O-CB 3.34Å; R578-R582 WeakPolarHBondContact O-CG 3.22Å; R578-R582 PolarHBondContact O-N 2.77Å
579	R	56.7	Low	54.1	Low	172 Å²	172	128.4 Å²	128.4	65%	0.649	58%	0.58	S	S	*	*	H	α-helix	trans	-77.8	-36.2	173.3	-83.8	175.3	167.9	-174.3	-5.7	112.1	R575 D576 R577 R583	R575-R579 WeakPolarHBondContact O-CB 3.25Å; R575-R579 WeakPolarHBondContact O-CG 3.35Å; R575-R579 PolarHBondContact O-N 3.22Å; D576-R579 CarbonylContact O-C 3.52Å; D576-R579 WeakPolarHBondContact O-CB 3.43Å; D576-R579 PolarHBondContact O-N 3.44Å; D576-R579 VanDerWaalsContact O-N 3.17Å; R577-R579 VanDerWaalsContact C-N 3.26Å; R577-R579 PolarHBondContact O-N 2.84Å; R579-R583 WeakPolarHBondContact O-CB 3.32Å; R579-R583 WeakPolarHBondContact O-CG 3.36Å; R579-R583 PolarHBondContact O-N 2.99Å
580	Q	53.8	Low	52.8	Low	121 Å²	121	129.2 Å²	129.2	57%	0.565	59%	0.589	S	S	*	*	H	α-helix	trans	-67	-45.9	172.2	-81	170.6	-25.1	0	0	110.8	D576 R577 R582 R583 D584	D576-Q580 WeakPolarHBondContact O-CB 3.13Å; D576-Q580 PolarHBondContact O-N 2.93Å; R577-Q580 PolarHBondContact O-N 3.02Å; Q580-R582 VanDerWaalsContact C-N 3.29Å; Q580-R582 PolarHBondContact O-N 2.8Å; Q580-R583 CarbonylContact O-C 3.51Å; Q580-R583 PolarHBondContact O-N 2.96Å; Q580-D584 WeakPolarHBondContact O-CB 3.28Å; Q580-D584 VanDerWaalsContact O-CG 3.3Å; Q580-D584 PolarHBondContact O-N 3Å
581	E	53.2	Low	51.7	Low	109 Å²	109	132.1 Å²	132.1	51%	0.509	60%	0.604	S	S	.	*	H	α-helix	trans	-60	-36.7	174.2	-74.1	169.4	-178.2	0	0	112.5	R577 A585	R577-E581 IonicContact NE-OE1 2.74Å; R577-E581 WeakPolarHBondContact O-CB 3.23Å; R577-E581 WeakPolarHBondContact O-CG 3.49Å; R577-E581 PolarHBondContact O-N 3.45Å; E581-A585 VanDerWaalsContact O-CB 3.29Å; E581-A585 WeakPolarHBondContact O-CB 3.21Å; E581-A585 PolarHBondContact O-N 2.73Å
582	R	53.1	Low	50.4	Low	183 Å²	183	131.5 Å²	131.5	69%	0.691	61%	0.612	S	S	*	*	H	α-helix	trans	-71.4	-40	172.1	-75.1	175.6	-176.6	-158.7	-1.3	112.7	R578 Q580 D584 A585 D586	R578-R582 WeakPolarHBondContact O-CB 3.34Å; R578-R582 WeakPolarHBondContact O-CG 3.22Å; R578-R582 PolarHBondContact O-N 2.77Å; Q580-R582 VanDerWaalsContact C-N 3.29Å; Q580-R582 PolarHBondContact O-N 2.8Å; R582-D584 VanDerWaalsContact C-N 3.33Å; R582-D584 PolarHBondContact O-N 2.93Å; R582-A585 PolarHBondContact O-N 2.89Å; R582-D586 WeakPolarHBondContact O-CB 3.44Å; R582-D586 PolarHBondContact O-N 2.7Å
583	R	47.5	Very low	49.1	Very low	190 Å²	190	135.6 Å²	135.6	72%	0.717	63%	0.632	S	S	*	*	H	α-helix	trans	-65.4	-34	175.4	-86.3	179.5	164.9	-174.8	-4.7	112.8	R579 Q580 R587	R579-R583 WeakPolarHBondContact O-CB 3.32Å; R579-R583 WeakPolarHBondContact O-CG 3.36Å; R579-R583 PolarHBondContact O-N 2.99Å; Q580-R583 CarbonylContact O-C 3.51Å; Q580-R583 PolarHBondContact O-N 2.96Å; R583-R587 WeakPolarHBondContact O-CB 3.3Å; R583-R587 PolarHBondContact O-N 2.84Å; R583-R587 VanDerWaalsContact O-N 3.08Å
584	D	48.9	Very low	47.6	Very low	87 Å²	87	139.8 Å²	139.8	47%	0.465	64%	0.642	S	S	.	*	H	α-helix	trans	-80.3	-28.2	177.9	-66.7	-29.3	0	0	0	111.7	Q580 R582	Q580-D584 WeakPolarHBondContact O-CB 3.28Å; Q580-D584 VanDerWaalsContact O-CG 3.3Å; Q580-D584 PolarHBondContact O-N 3Å; R582-D584 VanDerWaalsContact C-N 3.33Å; R582-D584 PolarHBondContact O-N 2.93Å
585	A	48.2	Very low	46	Very low	59 Å²	59	144 Å²	144	49%	0.488	66%	0.659	S	S	.	*	H	α-helix	trans	-72.9	-37.7	169.6	0	0	0	0	0	112.9	E581 R582 R587	E581-A585 VanDerWaalsContact O-CB 3.29Å; E581-A585 WeakPolarHBondContact O-CB 3.21Å; E581-A585 PolarHBondContact O-N 2.73Å; R582-A585 PolarHBondContact O-N 2.89Å; A585-R587 VanDerWaalsContact C-N 3.34Å
586	D	44.5	Very low	44.3	Very low	118 Å²	118	144.1 Å²	144.1	63%	0.631	67%	0.668	S	S	*	*	H	α-helix	trans	-74.9	-22.9	175.4	-72.1	-20.9	0	0	0	112.3	R582 N588	R582-D586 WeakPolarHBondContact O-CB 3.44Å; R582-D586 PolarHBondContact O-N 2.7Å; D586-N588 VanDerWaalsContact C-N 3.33Å; D586-N588 PolarHBondContact O-N 3.36Å
587	R	43.3	Very low	42.6	Very low	192 Å²	192	144.1 Å²	144.1	73%	0.725	69%	0.687	S	S	*	*	H	α-helix	trans	-71.2	-22.9	176.1	-114.4	176.7	166.5	178.2	-5.8	114.4	R583 A585	R583-R587 WeakPolarHBondContact O-CB 3.3Å; R583-R587 PolarHBondContact O-N 2.84Å; R583-R587 VanDerWaalsContact O-N 3.08Å; A585-R587 VanDerWaalsContact C-N 3.34Å
588	N	44	Very low	40.8	Very low	147 Å²	147	150.4 Å²	150.4	79%	0.786	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	6.9	-174.9	-81.1	-13.7	0	0	0	114.3	D586	D586-N588 VanDerWaalsContact C-N 3.33Å; D586-N588 PolarHBondContact O-N 3.36Å
589	T	41.6	Very low	39	Very low	106 Å²	106	147 Å²	147	65%	0.65	72%	0.723	S	S	*	*	S	Bend	trans	-127.4	7.6	-176.6	49.4	0	0	0	0	116.1
590	V	35.8	Very low	37.5	Very low	117 Å²	117	146.2 Å²	146.2	71%	0.709	73%	0.732	S	S	*	*			trans	-141.9	76.9	171.7	-169.3	0	0	0	0	110.9
591	L	34.7	Very low	36.3	Very low	168 Å²	168	148 Å²	148	88%	0.88	74%	0.74	S	S	*	*			trans	-125.7	75.2	158.9	-101.5	168.5	0	0	0	107.2
592	L	33.4	Very low	35	Very low	155 Å²	155	148.4 Å²	148.4	81%	0.812	75%	0.75	S	S	*	*			trans	-162.7	125.4	159.2	-102.4	146.9	0	0	0	107.2
593	E	28.9	Very low	33.9	Very low	186 Å²	186	149 Å²	149	87%	0.869	76%	0.76	S	S	*	*			trans	74.6	140.6	179.2	-52.7	-177.3	164.3	0	0	116.5
594	R	26.2	Very low	33	Very low	219 Å²	219	144.8 Å²	144.8	83%	0.826	76%	0.76	S	S	*	*			cis	-170.9	150.5	-22	-170.7	172	-179.5	175.9	0.6	105.4
595	E	26.3	Very low	32.1	Very low	148 Å²	148	150.7 Å²	150.7	69%	0.692	78%	0.782	S	S	*	*			trans	-21.1	158.5	172.5	-54.4	169.7	124.4	0	0	122.6
596	Q	25.6	Very low	31.3	Very low	192 Å²	192	157.6 Å²	157.6	90%	0.897	80%	0.801	S	S	*	*			trans	91	128.6	153.3	-69.5	175.6	12.4	0	0	120.8
597	G	24.6	Very low	30.6	Very low	78 Å²	78	158.7 Å²	158.7	80%	0.804	81%	0.812	S	S	*	*			trans	124.7	89.9	139.4	0	0	0	0	0	119.8
598	R	24.2	Very low	30.1	Very low	259 Å²	259	155.2 Å²	155.2	98%	0.977	82%	0.817	S	S	*	*			trans	-10.1	137.9	143.1	-159.1	-178.9	-166.1	-172.7	3	118.5
599	G	24.5	Very low	29.5	Very low	81 Å²	81	156.8 Å²	156.8	84%	0.835	82%	0.82	S	S	*	*			trans	164	145.7	160.6	0	0	0	0	0	114.6
600	D	26.3	Very low	29.2	Very low	156 Å²	156	157.4 Å²	157.4	83%	0.834	83%	0.825	S	S	*	*			trans	-107.7	176.3	-156.8	-163.8	4.6	0	0	0	113.3
601	E	27.1	Very low	29.4	Very low	157 Å²	157	160 Å²	160	73%	0.734	83%	0.83	S	S	*	*			trans	104.8	105.6	154.3	-62	-166.4	168.6	0	0	122.2
602	T	27.6	Very low	29.3	Very low	119 Å²	119	161.8 Å²	161.8	73%	0.73	83%	0.831	S	S	*	*				52.8	127.7	128.3	63.2	0	0	0	0	122.4
603	E	29.3	Very low	29.9	Very low	194 Å²	194	164.6 Å²	164.6	91%	0.907	83%	0.832	S	S	*	*				-166.3	142	113.5	-106.2	-175.4	-167.8	0	0	113.8
604	S	29.1	Very low	30.5	Very low	102 Å²	102	165.1 Å²	165.1	71%	0.713	83%	0.834	S	S	*	*			trans	-82.3	146	-167.9	54.6	0	0	0	0	115.8
605	K	29.8	Very low	31.6	Very low	211 Å²	211	160.8 Å²	160.8	92%	0.917	83%	0.827	S	S	*	*			trans	-138.4	122.3	149.8	-83.8	-172.6	178.7	167.8	0	112.7
606	K	30.8	Very low	32.6	Very low	205 Å²	205	163 Å²	163	89%	0.891	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-68.1	136.1	-176.7	-66.4	170.1	175.1	175.7	0	112.4
607	T	29.4	Very low	33.4	Very low	140 Å²	140	159.4 Å²	159.4	86%	0.859	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-90.2	118	161.9	48.6	0	0	0	0	109.2
608	S	32.8	Very low	35	Very low	119 Å²	119	159.5 Å²	159.5	83%	0.832	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-87	126.2	174.4	64.6	0	0	0	0	110.9
609	Q	32.1	Very low	36.2	Very low	181 Å²	181	155.5 Å²	155.5	85%	0.846	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-79.8	148.1	166.4	-66.9	-176	-11.9	0	0	110.7
610	P	35.8	Very low	37.5	Very low	118 Å²	118	159.6 Å²	159.6	77%	0.766	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-85.1	146.9	178.2	32.3	-31.3	0	0	0	112.8
611	Q	39.3	Very low	38.3	Very low	173 Å²	173	157.8 Å²	157.8	81%	0.808	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-96.4	146.4	169.9	-71.2	-165.1	-13.6	0	0	111.2
612	F	31.5	Very low	39.5	Very low	204 Å²	204	159.2 Å²	159.2	90%	0.895	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-91.4	142.3	177.3	-84.4	-90.4	0	0	0	112.1
613	Y	47.6	Very low	40.8	Very low	214 Å²	214	156.5 Å²	156.5	84%	0.839	80%	0.798	S	S	*	*			trans	-112	138.6	168.2	-73.8	-82.4	0	0	0	110.6
614	Q	40.5	Very low	41.8	Very low	197 Å²	197	155.8 Å²	155.8	92%	0.921	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-98.6	122.9	-179.1	-158.9	174	18	0	0	110.4
615	L	49.7	Very low	43.2	Very low	129 Å²	129	153.2 Å²	153.2	68%	0.675	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-74	138.5	175.7	-73	153.7	0	0	0	110.5	F621	L615-F621 HydrophobicContact CD2-CD2 4.26Å
616	K	46.8	Very low	44.3	Very low	195 Å²	195	147.3 Å²	147.3	85%	0.848	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-87.1	145	167.9	-75.9	-173.8	177.8	-179.2	0	109.9	G618	K616-G618 PolarHBondContact O-N 2.78Å
617	A	42	Very low	45.4	Very low	115 Å²	115	141.2 Å²	141.2	95%	0.95	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	127.8	-172.4	0	0	0	0	0	112.8
618	G	58.9	Low	46.7	Very low	80 Å²	80	136.9 Å²	136.9	83%	0.825	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	131.3	-9.3	169.8	0	0	0	0	0	116.3	K616	K616-G618 PolarHBondContact O-N 2.78Å
619	E	50	Low	47.8	Very low	176 Å²	176	136.7 Å²	136.7	82%	0.822	70%	0.704	S	S	*	*			trans	-121.3	127.1	176.6	-70.3	-174.8	158.3	0	0	111
620	E	50.3	Low	49	Very low	167 Å²	167	135.2 Å²	135.2	78%	0.78	69%	0.694	S	S	*	*			trans	-81.2	128	173.7	-71.5	-177.7	173.8	0	0	111.1	R622	E620-R622 PolarHBondContact O-N 3.28Å
621	F	44.6	Very low	50.3	Low	117 Å²	117	135 Å²	135	51%	0.513	68%	0.683	S	S	.	*			trans	-73	110.8	-179.6	-170.9	-96.3	0	0	0	110.8	L615 F624	L615-F621 HydrophobicContact CD2-CD2 4.26Å; F621-F624 HydrophobicContact CE1-CD2 4.31Å; F621-F624 HydrophobicContact CE1-CE2 4.03Å; F621-F624 HydrophobicContact CE1-CZ 4.22Å; F621-F624 HydrophobicContact CE2-CE1 4.46Å; F621-F624 AromaticContact CZ-CD1 4Å; F621-F624 HydrophobicContact CZ-CD1 4Å; F621-F624 HydrophobicContact CZ-CD2 4.13Å; F621-F624 AromaticContact CZ-CE1 3.71Å; F621-F624 HydrophobicContact CZ-CE1 3.71Å; F621-F624 AromaticContact CZ-CE2 3.84Å; F621-F624 HydrophobicContact CZ-CE2 3.84Å; F621-F624 HydrophobicContact CZ-CG 4.21Å; F621-F624 AromaticContact CZ-CZ 3.62Å; F621-F624 HydrophobicContact CZ-CZ 3.62Å
622	R	52.5	Low	51.3	Low	187 Å²	187	134.2 Å²	134.2	71%	0.706	68%	0.677	S	S	*	*			trans	-114	94.3	171.3	-66.9	-171	-176.3	-172.7	0.4	110.4	E620	E620-R622 PolarHBondContact O-N 3.28Å
623	S	54.9	Low	52.5	Low	63 Å²	63	127.5 Å²	127.5	44%	0.441	65%	0.65	S	S	.	*			trans	53.2	147.8	169.1	89.5	0	0	0	0	118.6	G625	S623-G625 PolarHBondContact O-N 2.9Å
624	F	50.3	Low	53.3	Low	179 Å²	179	124.6 Å²	124.6	79%	0.785	64%	0.644	S	S	*	*	H	α-helix	trans	-67.5	-14.5	177.1	-69.3	-81.2	0	0	0	113.9	F621	F621-F624 HydrophobicContact CE1-CD2 4.31Å; F621-F624 HydrophobicContact CE1-CE2 4.03Å; F621-F624 HydrophobicContact CE1-CZ 4.22Å; F621-F624 HydrophobicContact CE2-CE1 4.46Å; F621-F624 AromaticContact CZ-CD1 4Å; F621-F624 HydrophobicContact CZ-CD1 4Å; F621-F624 HydrophobicContact CZ-CD2 4.13Å; F621-F624 AromaticContact CZ-CE1 3.71Å; F621-F624 HydrophobicContact CZ-CE1 3.71Å; F621-F624 AromaticContact CZ-CE2 3.84Å; F621-F624 HydrophobicContact CZ-CE2 3.84Å; F621-F624 HydrophobicContact CZ-CG 4.21Å; F621-F624 AromaticContact CZ-CZ 3.62Å; F621-F624 HydrophobicContact CZ-CZ 3.62Å
625	G	57	Low	54.5	Low	47 Å²	47	123.8 Å²	123.8	49%	0.485	64%	0.637	S	S	.	*	H	α-helix	trans	-78.9	-37.5	-178.4	0	0	0	0	0	114.2	S623 V627 A628 H629	S623-G625 PolarHBondContact O-N 2.9Å; G625-V627 PolarHBondContact O-N 2.91Å; G625-A628 PolarHBondContact O-N 2.87Å; G625-H629 PolarHBondContact O-N 2.96Å; G625-H629 VanDerWaalsContact O-N 3.13Å
626	D	53.1	Low	55.7	Low	88 Å²	88	119.1 Å²	119.1	47%	0.471	62%	0.618	S	S	.	*	H	α-helix	trans	-74.4	-29.4	-173.5	-80.4	-27.1	0	0	0	113.2	H629 K630	D626-H629 PolarHBondContact O-N 2.78Å; D626-K630 WeakPolarHBondContact O-CB 3.45Å; D626-K630 PolarHBondContact O-N 3Å
627	V	55.3	Low	57	Low	77 Å²	77	112.8 Å²	112.8	47%	0.467	60%	0.598	S	S	.	*	H	α-helix	trans	-68.8	-38.3	176	-170.5	0	0	0	0	110.6	G625 Q631	G625-V627 PolarHBondContact O-N 2.91Å; V627-Q631 WeakPolarHBondContact O-CG 3.33Å; V627-Q631 PolarHBondContact O-N 3.04Å; V627-Q631 VanDerWaalsContact O-N 3.13Å
628	A	55.9	Low	57.6	Low	48 Å²	48	113.6 Å²	113.6	40%	0.397	59%	0.586	S	S	.	*	H	α-helix	trans	-70.4	-34.6	175.6	0	0	0	0	0	112.3	G625 K632	G625-A628 PolarHBondContact O-N 2.87Å; A628-K632 WeakPolarHBondContact O-CG 3.09Å; A628-K632 PolarHBondContact O-N 2.79Å; A628-K632 VanDerWaalsContact O-N 3.14Å
629	H	54.9	Low	57.7	Low	116 Å²	116	115.8 Å²	115.8	54%	0.537	57%	0.574	S	S	.	*	H	α-helix	trans	-71.2	-42.1	177	-163	-91.6	0	0	0	112	G625 D626 K632 L633	G625-H629 PolarHBondContact O-N 2.96Å; G625-H629 VanDerWaalsContact O-N 3.13Å; D626-H629 PolarHBondContact O-N 2.78Å; H629-K632 PolarHBondContact O-N 2.72Å; H629-L633 WeakPolarHBondContact ND1-CD1 3.45Å; H629-L633 PolarHBondContact O-N 2.8Å
630	K	58	Low	58.4	Low	150 Å²	150	112.6 Å²	112.6	65%	0.652	56%	0.56	S	S	*	*	H	α-helix	trans	-63.1	-40.8	174.1	-83.2	-178.7	176.1	176	0	112.8	D626 K632 L633 Q634	D626-K630 WeakPolarHBondContact O-CB 3.45Å; D626-K630 PolarHBondContact O-N 3Å; K630-K632 VanDerWaalsContact C-N 3.35Å; K630-K632 PolarHBondContact O-N 3.48Å; K630-L633 PolarHBondContact O-N 3.18Å; K630-Q634 WeakPolarHBondContact O-CG 3.39Å; K630-Q634 PolarHBondContact O-N 2.8Å; K630-Q634 VanDerWaalsContact O-N 3.07Å
631	Q	62.9	Low	59.1	Low	113 Å²	113	109.3 Å²	109.3	53%	0.528	54%	0.54	S	S	.	.	H	α-helix	trans	-68.5	-31.4	176.5	-73.3	-178.9	10.4	0	0	113.1	V627 K635	V627-Q631 WeakPolarHBondContact O-CG 3.33Å; V627-Q631 PolarHBondContact O-N 3.04Å; V627-Q631 VanDerWaalsContact O-N 3.13Å; Q631-K635 WeakPolarHBondContact O-CG 3.39Å
632	K	61.5	Low	59.7	Low	157 Å²	157	108 Å²	108	68%	0.683	54%	0.538	S	S	*	.	H	α-helix	trans	-70.9	-42.3	173.2	-79.2	178.1	178.9	180	0	112.2	A628 H629 K630 Q634 K635 A636	A628-K632 WeakPolarHBondContact O-CG 3.09Å; A628-K632 PolarHBondContact O-N 2.79Å; A628-K632 VanDerWaalsContact O-N 3.14Å; H629-K632 PolarHBondContact O-N 2.72Å; K630-K632 VanDerWaalsContact C-N 3.35Å; K630-K632 PolarHBondContact O-N 3.48Å; K632-Q634 VanDerWaalsContact C-N 3.34Å; K632-Q634 PolarHBondContact O-N 3.06Å; K632-K635 PolarHBondContact O-N 3.43Å; K632-A636 PolarHBondContact O-N 3.31Å
633	L	56.6	Low	60.2	Low	62 Å²	62	104.8 Å²	104.8	33%	0.325	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-38.2	176.9	-79.3	165.1	0	0	0	112.2	H629 K630 K635 A636 R641 L644	H629-L633 WeakPolarHBondContact ND1-CD1 3.45Å; H629-L633 PolarHBondContact O-N 2.8Å; K630-L633 PolarHBondContact O-N 3.18Å; L633-K635 PolarHBondContact O-N 3.15Å; L633-A636 PolarHBondContact O-N 3.27Å; L633-R641 PolarHBondContact O-NE 2.86Å; L633-R641 PolarHBondContact O-NH2 2.83Å; L633-L644 HydrophobicContact CD2-CD1 4.29Å
634	Q	63.4	Low	60.2	Low	153 Å²	153	106.7 Å²	106.7	72%	0.715	53%	0.534	S	S	*	.	H	α-helix	trans	-67.4	-21.3	176.9	-76.2	-177.4	-5.4	0	0	113.9	K630 K632 R641	K630-Q634 WeakPolarHBondContact O-CG 3.39Å; K630-Q634 PolarHBondContact O-N 2.8Å; K630-Q634 VanDerWaalsContact O-N 3.07Å; K632-Q634 VanDerWaalsContact C-N 3.34Å; K632-Q634 PolarHBondContact O-N 3.06Å; Q634-R641 PolarHBondContact O-NH2 3.45Å
635	K	66.4	Low	60.4	Low	180 Å²	180	104.6 Å²	104.6	78%	0.783	53%	0.526	S	S	*	.	H	α-helix	trans	-94.7	-11.6	178.4	-70	178.4	179.3	-179.7	0	114.5	Q631 K632 L633	Q631-K635 WeakPolarHBondContact O-CG 3.39Å; K632-K635 PolarHBondContact O-N 3.43Å; L633-K635 PolarHBondContact O-N 3.15Å
636	A	73.9	Confident	60	Low	32 Å²	32	109.7 Å²	109.7	26%	0.264	54%	0.537	S	S	.	.	S	Bend	trans	-83	153.4	179.3	0	0	0	0	0	113.1	K632 L633 R641	K632-A636 PolarHBondContact O-N 3.31Å; L633-A636 PolarHBondContact O-N 3.27Å; A636-R641 PolarHBondContact O-NH2 2.96Å
637	S	73.6	Confident	59.9	Low	62 Å²	62	110 Å²	110	43%	0.434	55%	0.547	S	S	.	.			trans	-70	156.7	-179.3	67.9	0	0	0	0	112.7	E639 E640 R641	S637-E639 PolarHBondContact O-N 3.5Å; S637-E640 PolarHBondContact O-N 2.88Å; S637-E640 VanDerWaalsContact O-N 3.16Å; S637-E640 PolarHBondContact OG-OE2 2.8Å; S637-R641 PolarHBondContact O-N 2.88Å
638	L	55.9	Low	59.6	Low	131 Å²	131	110.1 Å²	110.1	69%	0.686	55%	0.551	S	S	*	*	H	α-helix	trans	-58.5	-34.2	-176.8	-164.2	102.7	0	0	0	112.6	R641 L642	L638-R641 PolarHBondContact O-N 2.86Å; L638-L642 HydrophobicContact CD2-CD1 4.37Å; L638-L642 PolarHBondContact O-N 3.2Å
639	E	61	Low	58.9	Low	126 Å²	126	110.6 Å²	110.6	59%	0.589	56%	0.561	S	S	*	*	H	α-helix	trans	-70.3	-35.4	179.8	-162	-173.4	147.2	0	0	112.5	S637 K643	S637-E639 PolarHBondContact O-N 3.5Å; E639-K643 WeakPolarHBondContact O-CG 3.35Å; E639-K643 PolarHBondContact O-N 2.78Å; E639-K643 IonicContact OE1-NZ 3.24Å; E639-K643 PolarHBondContact OE1-NZ 2.73Å
640	E	64.6	Low	58.6	Low	110 Å²	110	110.5 Å²	110.5	51%	0.514	56%	0.563	S	S	.	*	H	α-helix	trans	-72.2	-30	175	-77.3	175.6	140.9	0	0	112.4	S637 L644	S637-E640 PolarHBondContact O-N 2.88Å; S637-E640 VanDerWaalsContact O-N 3.16Å; S637-E640 PolarHBondContact OG-OE2 2.8Å; E640-L644 PolarHBondContact O-N 2.96Å
641	R	63.9	Low	57.8	Low	98 Å²	98	107.4 Å²	107.4	37%	0.37	56%	0.56	S	S	.	*	H	α-helix	trans	-68.2	-42	174.1	-67.8	-175.6	-175.7	156.2	10.9	112	L633 Q634 A636 S637 L638 L644 E645	L633-R641 PolarHBondContact O-NE 2.86Å; L633-R641 PolarHBondContact O-NH2 2.83Å; Q634-R641 PolarHBondContact O-NH2 3.45Å; A636-R641 PolarHBondContact O-NH2 2.96Å; S637-R641 PolarHBondContact O-N 2.88Å; L638-R641 PolarHBondContact O-N 2.86Å; R641-L644 PolarHBondContact O-N 3.09Å; R641-E645 PolarHBondContact O-N 3Å
642	L	58.7	Low	56.8	Low	89 Å²	89	106 Å²	106	47%	0.466	56%	0.563	S	S	.	*	H	α-helix	trans	-65.2	-39.6	177.9	-94.7	157.3	0	0	0	112.7	L638 L644 E645 E646	L638-L642 HydrophobicContact CD2-CD1 4.37Å; L638-L642 PolarHBondContact O-N 3.2Å; L642-L644 VanDerWaalsContact C-N 3.33Å; L642-L644 PolarHBondContact O-N 2.83Å; L642-E645 PolarHBondContact O-N 2.81Å; L642-E646 WeakPolarHBondContact O-CG 3.24Å; L642-E646 PolarHBondContact O-N 2.85Å
643	K	62.1	Low	56	Low	120 Å²	120	103.1 Å²	103.1	52%	0.522	56%	0.559	S	S	.	*	H	α-helix	trans	-66.5	-33.1	176.8	-72.3	174.9	-173.7	163.8	0	112.9	E639 S647	E639-K643 WeakPolarHBondContact O-CG 3.35Å; E639-K643 PolarHBondContact O-N 2.78Å; E639-K643 IonicContact OE1-NZ 3.24Å; E639-K643 PolarHBondContact OE1-NZ 2.73Å; K643-S647 PolarHBondContact O-N 2.87Å
644	L	55.8	Low	55.5	Low	102 Å²	102	104.1 Å²	104.1	53%	0.534	58%	0.576	S	S	.	*	H	α-helix	trans	-72.4	-39	174.4	-80.7	161.7	0	0	0	111.6	L633 E640 R641 L642 S647 S648	L633-L644 HydrophobicContact CD2-CD1 4.29Å; E640-L644 PolarHBondContact O-N 2.96Å; R641-L644 PolarHBondContact O-N 3.09Å; L642-L644 VanDerWaalsContact C-N 3.33Å; L642-L644 PolarHBondContact O-N 2.83Å; L644-S647 PolarHBondContact O-N 2.86Å; L644-S647 PolarHBondContact O-OG 2.86Å; L644-S648 PolarHBondContact O-N 2.99Å; L644-S648 VanDerWaalsContact O-N 3.17Å
645	E	53.3	Low	54.5	Low	136 Å²	136	100.8 Å²	100.8	64%	0.636	58%	0.583	S	S	*	*	H	α-helix	trans	-63.3	-44.2	172.4	-92.4	-174.9	155	0	0	112.3	R641 L642 S647 S648 G649	R641-E645 PolarHBondContact O-N 3Å; L642-E645 PolarHBondContact O-N 2.81Å; E645-S647 VanDerWaalsContact C-N 3.26Å; E645-S647 PolarHBondContact O-N 2.91Å; E645-S648 WeakPolarHBondContact CA-OG 3.31Å; E645-S648 PolarHBondContact O-N 3.43Å; E645-S648 PolarHBondContact O-OG 3.17Å; E645-G649 PolarHBondContact O-N 3.07Å
646	E	48.6	Very low	53.7	Low	153 Å²	153	97.1 Å²	97.1	72%	0.715	58%	0.575	S	S	*	*	H	α-helix	trans	-59.8	-35.2	175	-77.6	-176.5	164.4	0	0	112.4	L642 S648	L642-E646 WeakPolarHBondContact O-CG 3.24Å; L642-E646 PolarHBondContact O-N 2.85Å; E646-S648 VanDerWaalsContact C-N 3.31Å; E646-S648 PolarHBondContact O-N 2.9Å
647	S	51.7	Low	52.5	Low	95 Å²	95	100.9 Å²	100.9	66%	0.664	61%	0.606	S	S	*	*	H	α-helix	trans	-75.5	-18.1	176.6	77.2	0	0	0	0	114.2	K643 L644 E645	K643-S647 PolarHBondContact O-N 2.87Å; L644-S647 PolarHBondContact O-N 2.86Å; L644-S647 PolarHBondContact O-OG 2.86Å; E645-S647 VanDerWaalsContact C-N 3.26Å; E645-S647 PolarHBondContact O-N 2.91Å
648	S	48.3	Very low	51.3	Low	79 Å²	79	104 Å²	104	55%	0.552	62%	0.623	S	S	*	*	H	α-helix	trans	-93.4	-5.5	179.3	72.7	0	0	0	0	113.9	L644 E645 E646 I650	L644-S648 PolarHBondContact O-N 2.99Å; L644-S648 VanDerWaalsContact O-N 3.17Å; E645-S648 WeakPolarHBondContact CA-OG 3.31Å; E645-S648 PolarHBondContact O-N 3.43Å; E645-S648 PolarHBondContact O-OG 3.17Å; E646-S648 VanDerWaalsContact C-N 3.31Å; E646-S648 PolarHBondContact O-N 2.9Å; S648-I650 PolarHBondContact O-N 2.84Å
649	G	42	Very low	51.1	Low	59 Å²	59	102.2 Å²	102.2	61%	0.608	64%	0.636	S	S	*	*			trans	-70.6	89.9	-179.3	0	0	0	0	0	113.6	E645 S651	E645-G649 PolarHBondContact O-N 3.07Å; G649-S651 PolarHBondContact O-N 2.71Å
650	I	47.9	Very low	50.4	Low	114 Å²	114	99.8 Å²	99.8	59%	0.585	63%	0.632	S	S	*	*			trans	-81	-0.3	170.7	-73.3	164.9	0	0	0	112.2	S648	S648-I650 PolarHBondContact O-N 2.84Å
651	S	40.8	Very low	50	Low	84 Å²	84	102.8 Å²	102.8	59%	0.587	64%	0.644	S	S	*	*			trans	-140.8	105.2	-177.2	-62.3	0	0	0	0	112	G649	G649-S651 PolarHBondContact O-N 2.71Å
652	S	43.6	Very low	49.2	Very low	84 Å²	84	105.6 Å²	105.6	59%	0.587	66%	0.661	S	S	*	*			trans	-88.5	103.8	163	63.4	0	0	0	0	109.3
653	T	44.8	Very low	48.8	Very low	97 Å²	97	107.3 Å²	107.3	60%	0.595	67%	0.67	S	S	*	*			trans	-90.8	104.9	171.2	51.7	0	0	0	0	109.6
654	A	46.1	Very low	48.1	Very low	83 Å²	83	106.1 Å²	106.1	69%	0.686	67%	0.673	S	S	*	*			trans	-94.9	115.7	166.9	0	0	0	0	0	108.9
655	G	41.2	Very low	47.6	Very low	83 Å²	83	108.4 Å²	108.4	86%	0.856	68%	0.679	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.1	115.4	176.7	0	0	0	0	0	111.6
656	T	49.1	Very low	47.6	Very low	103 Å²	103	107.5 Å²	107.5	63%	0.632	68%	0.683	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.3	134.1	159.7	27.2	0	0	0	0	109.4	V658	T656-V658 PolarHBondContact O-N 2.62Å
657	A	48.8	Very low	48	Very low	110 Å²	110	106.3 Å²	106.3	91%	0.909	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	13.8	-164.6	0	0	0	0	0	117.1
658	V	49.6	Very low	48.1	Very low	129 Å²	129	110.8 Å²	110.8	78%	0.782	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138	81.9	177.8	-170.1	0	0	0	0	110	T656 S660	T656-V658 PolarHBondContact O-N 2.62Å; V658-S660 VanDerWaalsContact C-N 3.3Å; V658-S660 PolarHBondContact O-N 3.4Å
659	G	51.4	Low	49.3	Very low	93 Å²	93	111.8 Å²	111.8	96%	0.959	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	63	8.1	150.2	0	0	0	0	0	120
660	S	45.1	Very low	51	Low	74 Å²	74	111.8 Å²	111.8	52%	0.517	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.9	126.7	175.2	52.7	0	0	0	0	111.4	V658	V658-S660 VanDerWaalsContact C-N 3.3Å; V658-S660 PolarHBondContact O-N 3.4Å
661	K	57.7	Low	52.1	Low	173 Å²	173	114 Å²	114	75%	0.752	68%	0.681	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.6	114.6	-179.3	-161	174.1	-174.1	178.6	0	108.3
662	Q	46.4	Very low	53.6	Low	157 Å²	157	117.3 Å²	117.3	73%	0.734	69%	0.687	S	S	*	*			trans	-98.8	128.2	171.4	-73.9	-175.4	-16	0	0	109.7
663	L	51.2	Low	55	Low	126 Å²	126	118.2 Å²	118.2	66%	0.66	68%	0.682	S	S	*	*			trans	-108.5	124.8	171	-76.2	160	0	0	0	107.4
664	T	46.4	Very low	56.5	Low	94 Å²	94	121.1 Å²	121.1	58%	0.577	68%	0.682	S	S	*	*			trans	-109.8	119.6	170.9	44	0	0	0	0	108.6
665	F	45.1	Very low	58.1	Low	150 Å²	150	124.1 Å²	124.1	66%	0.658	68%	0.68	S	S	*	*			trans	-96.2	126.9	178.6	163.9	-117.3	0	0	0	109.1	L667	F665-L667 HydrophobicContact CD1-CG 4.11Å; F665-L667 HydrophobicContact CE1-CB 4.43Å; F665-L667 HydrophobicContact CE1-CD1 3.87Å; F665-L667 HydrophobicContact CE1-CD2 3.4Å; F665-L667 HydrophobicContact CE1-CG 3.23Å; F665-L667 HydrophobicContact CE2-CD2 4.24Å; F665-L667 HydrophobicContact CE2-CG 4.39Å; F665-L667 HydrophobicContact CZ-CB 4.4Å; F665-L667 HydrophobicContact CZ-CD1 4.46Å; F665-L667 HydrophobicContact CZ-CD2 3.14Å; F665-L667 HydrophobicContact CZ-CG 3.42Å; F665-L667 VanDerWaalsContact CZ-CG 3.42Å
666	T	54	Low	60	Low	118 Å²	118	126.6 Å²	126.6	72%	0.724	67%	0.669	S	S	*	*			trans	-111	114.5	170.4	56.3	0	0	0	0	109.1
667	L	57.2	Low	61.4	Low	128 Å²	128	125.2 Å²	125.2	67%	0.67	66%	0.656	S	S	*	*			trans	-64.3	134.8	174.6	-78.6	156	0	0	0	110.2	F665 K669	F665-L667 HydrophobicContact CD1-CG 4.11Å; F665-L667 HydrophobicContact CE1-CB 4.43Å; F665-L667 HydrophobicContact CE1-CD1 3.87Å; F665-L667 HydrophobicContact CE1-CD2 3.4Å; F665-L667 HydrophobicContact CE1-CG 3.23Å; F665-L667 HydrophobicContact CE2-CD2 4.24Å; F665-L667 HydrophobicContact CE2-CG 4.39Å; F665-L667 HydrophobicContact CZ-CB 4.4Å; F665-L667 HydrophobicContact CZ-CD1 4.46Å; F665-L667 HydrophobicContact CZ-CD2 3.14Å; F665-L667 HydrophobicContact CZ-CG 3.42Å; F665-L667 VanDerWaalsContact CZ-CG 3.42Å; L667-K669 PolarHBondContact O-N 2.99Å
668	K	54.1	Low	62.9	Low	189 Å²	189	124.9 Å²	124.9	82%	0.822	64%	0.635	S	S	*	*			trans	-62.9	110.2	166.7	-76.4	-175.4	179.2	177.3	0	108.6
669	K	73.7	Confident	64.5	Low	99 Å²	99	121.2 Å²	121.2	43%	0.43	62%	0.618	S	S	.	*			trans	-70.6	143.2	174.7	-62.3	-176.6	-176.6	-177.4	0	110.1	L667 Q673 R674 Q677	L667-K669 PolarHBondContact O-N 2.99Å; K669-Q673 HydrophobicContact CB-CB 4.28Å; K669-R674 HydrophobicContact CB-CG 4.26Å; K669-Q677 VanDerWaalsContact NZ-CD 3.3Å
670	S	76.3	Confident	65.9	Low	60 Å²	60	123 Å²	123	42%	0.42	60%	0.602	S	S	.	*			trans	-63.7	156.1	176.2	86.6	0	0	0	0	111.2	Q672 Q673 R674	S670-Q672 PolarHBondContact O-N 2.99Å; S670-Q672 PolarHBondContact OG-N 3.21Å; S670-Q673 PolarHBondContact O-N 3.41Å; S670-Q673 PolarHBondContact OG-N 3.47Å; S670-R674 PolarHBondContact O-N 2.92Å
671	E	71.6	Confident	67.7	Low	159 Å²	159	127.6 Å²	127.6	74%	0.743	61%	0.608	S	S	*	*	H	α-helix	trans	-58.2	-32.3	178.4	-67.8	-167.9	158.3	0	0	112.7	R674 K675	E671-R674 PolarHBondContact O-N 3.13Å; E671-K675 WeakPolarHBondContact O-CG 3.45Å; E671-K675 PolarHBondContact O-N 3.38Å
672	Q	72.4	Confident	69	Low	155 Å²	155	125.1 Å²	125.1	72%	0.724	60%	0.599	S	S	*	*	H	α-helix	trans	-67.3	-41.7	175.1	-73.6	-179.5	-13.2	0	0	112.1	S670 R674 K675 Q676	S670-Q672 PolarHBondContact O-N 2.99Å; S670-Q672 PolarHBondContact OG-N 3.21Å; Q672-R674 VanDerWaalsContact C-N 3.35Å; Q672-K675 PolarHBondContact O-N 2.9Å; Q672-Q676 PolarHBondContact O-N 2.89Å
673	Q	72.5	Confident	70.6	Confident	103 Å²	103	122.4 Å²	122.4	48%	0.481	59%	0.586	S	S	.	*	H	α-helix	trans	-68	-33.7	175.5	-81	-179.7	-14.1	0	0	112.4	K669 S670 Q677	K669-Q673 HydrophobicContact CB-CB 4.28Å; S670-Q673 PolarHBondContact O-N 3.41Å; S670-Q673 PolarHBondContact OG-N 3.47Å; Q673-Q677 PolarHBondContact O-N 3.22Å
674	R	76.4	Confident	71.8	Confident	158 Å²	158	121.6 Å²	121.6	60%	0.596	58%	0.578	S	S	*	*	H	α-helix	trans	-66.3	-42.1	172.9	-72.1	-178.3	83.7	-175.7	6.5	111.4	K669 S670 E671 Q672 Q677 Q678	K669-R674 HydrophobicContact CB-CG 4.26Å; S670-R674 PolarHBondContact O-N 2.92Å; E671-R674 PolarHBondContact O-N 3.13Å; Q672-R674 VanDerWaalsContact C-N 3.35Å; R674-Q677 PolarHBondContact O-N 3.16Å; R674-Q678 WeakPolarHBondContact O-CB 3.3Å; R674-Q678 WeakPolarHBondContact O-CG 3.32Å; R674-Q678 PolarHBondContact O-N 3.36Å
675	K	80.9	Confident	73.4	Confident	146 Å²	146	122.7 Å²	122.7	64%	0.635	58%	0.577	S	S	*	*	H	α-helix	trans	-64.2	-41	175.2	-76.3	-179.3	179.8	-179.7	0	112.4	E671 Q672 Q678 A679	E671-K675 WeakPolarHBondContact O-CG 3.45Å; E671-K675 PolarHBondContact O-N 3.38Å; Q672-K675 PolarHBondContact O-N 2.9Å; K675-Q678 PolarHBondContact O-N 3.36Å; K675-A679 WeakPolarHBondContact O-CB 3.38Å; K675-A679 PolarHBondContact O-N 2.88Å
676	Q	80.5	Confident	75	Confident	134 Å²	134	121.2 Å²	121.2	63%	0.626	57%	0.572	S	S	*	*	H	α-helix	trans	-62.9	-44.8	173.8	-88.8	179.7	-14.8	0	0	112.3	Q672 Q678 A679 E680	Q672-Q676 PolarHBondContact O-N 2.89Å; Q676-Q678 VanDerWaalsContact C-N 3.32Å; Q676-Q678 PolarHBondContact O-N 3.28Å; Q676-A679 PolarHBondContact O-N 3.33Å; Q676-E680 WeakPolarHBondContact O-CB 3.35Å; Q676-E680 WeakPolarHBondContact O-CG 3.37Å; Q676-E680 PolarHBondContact O-N 2.85Å
677	Q	78.6	Confident	76	Confident	75 Å²	75	123.4 Å²	123.4	35%	0.35	57%	0.567	S	S	.	*	H	α-helix	trans	-67.3	-32.4	176.8	-77.8	-162.1	-30.4	0	0	113.3	K669 Q673 R674 R681	K669-Q677 VanDerWaalsContact NZ-CD 3.3Å; Q673-Q677 PolarHBondContact O-N 3.22Å; R674-Q677 PolarHBondContact O-N 3.16Å; Q677-R681 WeakPolarHBondContact O-CB 3.33Å; Q677-R681 VanDerWaalsContact O-CG 3.24Å; Q677-R681 WeakPolarHBondContact O-CG 3.43Å; Q677-R681 PolarHBondContact O-N 3.48Å
678	Q	79.8	Confident	76.7	Confident	103 Å²	103	123.9 Å²	123.9	48%	0.481	56%	0.564	S	S	.	*	H	α-helix	trans	-66.7	-46.9	172.7	-78.4	173.3	-25.3	0	0	110.6	R674 K675 Q676 E680 R681 E682	R674-Q678 WeakPolarHBondContact O-CB 3.3Å; R674-Q678 WeakPolarHBondContact O-CG 3.32Å; R674-Q678 PolarHBondContact O-N 3.36Å; K675-Q678 PolarHBondContact O-N 3.36Å; Q676-Q678 VanDerWaalsContact C-N 3.32Å; Q676-Q678 PolarHBondContact O-N 3.28Å; Q678-E680 VanDerWaalsContact C-N 3.34Å; Q678-E680 PolarHBondContact O-N 2.98Å; Q678-R681 PolarHBondContact O-N 3.26Å; Q678-R681 VanDerWaalsContact O-N 3.14Å; Q678-E682 WeakPolarHBondContact O-CB 3.48Å; Q678-E682 WeakPolarHBondContact O-CG 3.29Å; Q678-E682 PolarHBondContact O-N 2.96Å
679	A	83.4	Confident	77.5	Confident	51 Å²	51	121.7 Å²	121.7	42%	0.421	56%	0.561	S	S	.	*	H	α-helix	trans	-61.6	-38.9	175.6	0	0	0	0	0	112.6	K675 Q676 H683	K675-A679 WeakPolarHBondContact O-CB 3.38Å; K675-A679 PolarHBondContact O-N 2.88Å; Q676-A679 PolarHBondContact O-N 3.33Å; A679-H683 WeakPolarHBondContact O-CB 3.43Å; A679-H683 PolarHBondContact O-N 3.12Å
680	E	81.7	Confident	77.3	Confident	132 Å²	132	123.8 Å²	123.8	62%	0.617	58%	0.576	S	S	*	*	H	α-helix	trans	-66.5	-37.2	174.5	-79.2	179.9	165	0	0	112.5	Q676 Q678 H684	Q676-E680 WeakPolarHBondContact O-CB 3.35Å; Q676-E680 WeakPolarHBondContact O-CG 3.37Å; Q676-E680 PolarHBondContact O-N 2.85Å; Q678-E680 VanDerWaalsContact C-N 3.34Å; Q678-E680 PolarHBondContact O-N 2.98Å; E680-H684 VanDerWaalsContact O-CB 3.22Å; E680-H684 WeakPolarHBondContact O-CB 3.38Å; E680-H684 PolarHBondContact O-N 2.83Å
681	R	82.4	Confident	76.3	Confident	170 Å²	170	130.8 Å²	130.8	64%	0.642	59%	0.594	S	S	*	*	H	α-helix	trans	-69.1	-45	175.8	-78.5	175.6	-179.5	-167.6	-0.3	111.5	Q677 Q678 H684 E685	Q677-R681 WeakPolarHBondContact O-CB 3.33Å; Q677-R681 VanDerWaalsContact O-CG 3.24Å; Q677-R681 WeakPolarHBondContact O-CG 3.43Å; Q677-R681 PolarHBondContact O-N 3.48Å; Q678-R681 PolarHBondContact O-N 3.26Å; Q678-R681 VanDerWaalsContact O-N 3.14Å; R681-H684 CarbonylContact O-C 3.56Å; R681-H684 PolarHBondContact O-N 2.77Å; R681-H684 VanDerWaalsContact O-N 3.17Å; R681-E685 WeakPolarHBondContact O-CB 3.41Å; R681-E685 WeakPolarHBondContact O-CG 3.46Å; R681-E685 PolarHBondContact O-N 3.48Å
682	E	84.1	Confident	75.7	Confident	120 Å²	120	134.8 Å²	134.8	56%	0.561	60%	0.602	S	S	*	*	H	α-helix	trans	-60.8	-45.8	175.2	-73	169.4	-176.6	0	0	110.4	Q678 H684 E685 E686	Q678-E682 WeakPolarHBondContact O-CB 3.48Å; Q678-E682 WeakPolarHBondContact O-CG 3.29Å; Q678-E682 PolarHBondContact O-N 2.96Å; E682-H684 VanDerWaalsContact C-N 3.31Å; E682-H684 PolarHBondContact O-N 2.8Å; E682-E685 PolarHBondContact O-N 2.81Å; E682-E686 WeakPolarHBondContact O-CB 3.37Å; E682-E686 WeakPolarHBondContact O-CG 3.26Å; E682-E686 PolarHBondContact O-N 3.15Å
683	H	80	Confident	74.8	Confident	100 Å²	100	132.7 Å²	132.7	46%	0.463	60%	0.604	S	S	.	*	H	α-helix	trans	-63	-34.7	174.7	-180	-109.2	0	0	0	112.8	A679 R687	A679-H683 WeakPolarHBondContact O-CB 3.43Å; A679-H683 PolarHBondContact O-N 3.12Å; H683-R687 WeakPolarHBondContact O-CB 3.44Å; H683-R687 PolarHBondContact O-N 3.41Å
684	H	76.6	Confident	74	Confident	109 Å²	109	131.3 Å²	131.3	51%	0.505	61%	0.611	S	S	.	*	H	α-helix	trans	-73.8	-33.6	175.4	-171.7	-83.5	0	0	0	112.6	E680 R681 E682 K688	E680-H684 VanDerWaalsContact O-CB 3.22Å; E680-H684 WeakPolarHBondContact O-CB 3.38Å; E680-H684 PolarHBondContact O-N 2.83Å; R681-H684 CarbonylContact O-C 3.56Å; R681-H684 PolarHBondContact O-N 2.77Å; R681-H684 VanDerWaalsContact O-N 3.17Å; E682-H684 VanDerWaalsContact C-N 3.31Å; E682-H684 PolarHBondContact O-N 2.8Å; H684-K688 WeakPolarHBondContact O-CB 3.34Å; H684-K688 PolarHBondContact O-N 3.4Å
685	E	79.7	Confident	73	Confident	117 Å²	117	126.3 Å²	126.3	55%	0.547	61%	0.608	S	S	.	*	H	α-helix	trans	-72.2	-40.4	173.3	-76.1	177.6	-176.7	0	0	111.7	R681 E682 R687 K688 N689	R681-E685 WeakPolarHBondContact O-CB 3.41Å; R681-E685 WeakPolarHBondContact O-CG 3.46Å; R681-E685 PolarHBondContact O-N 3.48Å; E682-E685 PolarHBondContact O-N 2.81Å; E685-R687 VanDerWaalsContact C-N 3.35Å; E685-R687 PolarHBondContact O-N 3.08Å; E685-K688 CarbonylContact O-C 3.58Å; E685-K688 WeakPolarHBondContact O-CB 3.25Å; E685-K688 PolarHBondContact O-N 2.84Å; E685-K688 VanDerWaalsContact O-N 3.14Å; E685-N689 WeakPolarHBondContact O-CB 3.39Å; E685-N689 PolarHBondContact O-N 3.14Å
686	E	79.8	Confident	71.5	Confident	119 Å²	119	128.5 Å²	128.5	56%	0.556	62%	0.62	S	S	*	*	H	α-helix	trans	-59.1	-45	169.3	-76.9	-178.1	165.2	0	0	111.1	E682 K688 N689 L690	E682-E686 WeakPolarHBondContact O-CB 3.37Å; E682-E686 WeakPolarHBondContact O-CG 3.26Å; E682-E686 PolarHBondContact O-N 3.15Å; E686-K688 VanDerWaalsContact C-N 3.31Å; E686-K688 PolarHBondContact O-N 2.84Å; E686-N689 PolarHBondContact O-N 2.86Å; E686-L690 VanDerWaalsContact O-CB 3.32Å; E686-L690 WeakPolarHBondContact O-CB 3.3Å; E686-L690 PolarHBondContact O-N 3.31Å
687	R	75.3	Confident	70.3	Confident	164 Å²	164	129.7 Å²	129.7	62%	0.619	63%	0.63	S	S	*	*	H	α-helix	trans	-62.7	-35	173.4	-88.3	-175.8	163	-162.8	-3.6	113.2	H683 E685 R691	H683-R687 WeakPolarHBondContact O-CB 3.44Å; H683-R687 PolarHBondContact O-N 3.41Å; E685-R687 VanDerWaalsContact C-N 3.35Å; E685-R687 PolarHBondContact O-N 3.08Å; R687-R691 WeakPolarHBondContact O-CG 3.19Å; R687-R691 PolarHBondContact O-N 2.87Å
688	K	70.4	Confident	68.9	Low	139 Å²	139	131 Å²	131	60%	0.604	65%	0.647	S	S	*	*	H	α-helix	trans	-70.6	-38	174.6	-89.8	-179.4	169.5	175.5	0	112	H684 E685 E686	H684-K688 WeakPolarHBondContact O-CB 3.34Å; H684-K688 PolarHBondContact O-N 3.4Å; E685-K688 CarbonylContact O-C 3.58Å; E685-K688 WeakPolarHBondContact O-CB 3.25Å; E685-K688 PolarHBondContact O-N 2.84Å; E685-K688 VanDerWaalsContact O-N 3.14Å; E686-K688 VanDerWaalsContact C-N 3.31Å; E686-K688 PolarHBondContact O-N 2.84Å
689	N	71.1	Confident	66.9	Low	143 Å²	143	131.4 Å²	131.4	77%	0.765	66%	0.661	S	S	*	*	H	α-helix	trans	-74.2	-33.2	177.9	-73.5	-15.1	0	0	0	112.4	E685 E686	E685-N689 WeakPolarHBondContact O-CB 3.39Å; E685-N689 PolarHBondContact O-N 3.14Å; E686-N689 PolarHBondContact O-N 2.86Å
690	L	68.9	Low	65	Low	143 Å²	143	133.6 Å²	133.6	75%	0.749	68%	0.679	S	S	*	*	H	α-helix	trans	-73.8	-24.6	174	-88	154.8	0	0	0	113.2	E686 R692	E686-L690 VanDerWaalsContact O-CB 3.32Å; E686-L690 WeakPolarHBondContact O-CB 3.3Å; E686-L690 PolarHBondContact O-N 3.31Å; L690-R692 PolarHBondContact O-N 2.74Å
691	R	56.3	Low	63.1	Low	207 Å²	207	139.3 Å²	139.3	78%	0.781	70%	0.696	S	S	*	*	S	Bend	trans	-71.3	100.7	169.9	-85.7	-174.2	166	-158.3	-3	109.1	R687 S693	R687-R691 WeakPolarHBondContact O-CG 3.19Å; R687-R691 PolarHBondContact O-N 2.87Å; R691-S693 PolarHBondContact O-N 3.07Å
692	R	58.3	Low	61	Low	243 Å²	243	135.1 Å²	135.1	92%	0.917	71%	0.705	S	S	*	*			trans	-51.6	113.5	162.8	-68.3	-177.1	-177.6	176.7	0.8	108.2	L690 A694	L690-R692 PolarHBondContact O-N 2.74Å; R692-A694 PolarHBondContact O-N 3.04Å
693	S	53.8	Low	58.9	Low	110 Å²	110	141.6 Å²	141.6	77%	0.769	72%	0.724	S	S	*	*			trans	-65.8	117.1	175.3	52.3	0	0	0	0	108.4	R691 G695	R691-S693 PolarHBondContact O-N 3.07Å; S693-G695 PolarHBondContact O-N 2.93Å
694	A	55.1	Low	56.8	Low	75 Å²	75	140.4 Å²	140.4	62%	0.62	74%	0.74	S	S	*	*			trans	-73	43.4	170.5	0	0	0	0	0	111.4	R692 H696 L697	R692-A694 PolarHBondContact O-N 3.04Å; A694-H696 PolarHBondContact O-N 3.5Å; A694-L697 HydrophobicContact CB-CD1 4.46Å; A694-L697 PolarHBondContact O-N 3.31Å
695	G	55.5	Low	54.9	Low	52 Å²	52	147.3 Å²	147.3	54%	0.536	76%	0.761	S	S	.	*	G	3₁₀ helix	trans	-72.2	-11.6	-178.7	0	0	0	0	0	113.8	S693	S693-G695 PolarHBondContact O-N 2.93Å
696	H	51.1	Low	52.8	Low	193 Å²	193	145.6 Å²	145.6	89%	0.894	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-86.2	-1.5	174.1	-72.9	-41.4	0	0	0	114.3	A694	A694-H696 PolarHBondContact O-N 3.5Å
697	L	55	Low	50.7	Low	158 Å²	158	151.5 Å²	151.5	83%	0.827	79%	0.792	S	S	*	*	G	3₁₀ helix	trans	-101.3	4.2	178.6	-77.3	166.4	0	0	0	114.5	A694	A694-L697 HydrophobicContact CB-CD1 4.46Å; A694-L697 PolarHBondContact O-N 3.31Å
698	S	48.4	Very low	48.7	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	80%	0.799	S	S	*	*			trans	-125.4	72.2	173	72.5	0	0	0	0	112.1
699	S	38.8	Very low	47.1	Very low	111 Å²	111	152.4 Å²	152.4	78%	0.776	81%	0.814	S	S	*	*			trans	-99.1	132.1	157.8	64.8	0	0	0	0	110.4
700	A	43.5	Very low	45.4	Very low	97 Å²	97	149.2 Å²	149.2	80%	0.802	82%	0.815	S	S	*	*			trans	76.9	84.7	160.2	0	0	0	0	0	118.5
701	R	40.8	Very low	44	Very low	253 Å²	253	154.1 Å²	154.1	96%	0.955	82%	0.824	S	S	*	*			trans	-145.1	120	130.4	-105	174.9	-171.2	-178.6	2.2	109.7
702	G	39.5	Very low	43	Very low	82 Å²	82	147.4 Å²	147.4	85%	0.845	82%	0.819	S	S	*	*			trans	-62.9	135.7	-165	0	0	0	0	0	114.7	G704	G702-G704 PolarHBondContact O-N 3.36Å
703	R	38.2	Very low	42.2	Very low	255 Å²	255	148.3 Å²	148.3	96%	0.962	82%	0.823	S	S	*	*			trans	-76.2	103.9	163.1	-84.4	-178.3	170.1	-173.2	-2.9	109.1	R705	R703-R705 PolarHBondContact O-N 3.3Å
704	G	35.9	Very low	41.2	Very low	76 Å²	76	146.5 Å²	146.5	78%	0.784	82%	0.821	S	S	*	*			trans	-66.6	124.4	163.6	0	0	0	0	0	110.6	G702 G706	G702-G704 PolarHBondContact O-N 3.36Å; G704-G706 PolarHBondContact O-N 2.91Å
705	R	37.8	Very low	40.7	Very low	253 Å²	253	154.1 Å²	154.1	96%	0.955	83%	0.834	S	S	*	*			trans	-70	106.6	167.6	-77.2	177	167.3	-174.9	-3.2	109	R703	R703-R705 PolarHBondContact O-N 3.3Å
706	G	35.9	Very low	39.8	Very low	81 Å²	81	165.2 Å²	165.2	84%	0.835	87%	0.868	S	S	*	*			trans	-98.1	89.9	167.2	0	0	0	0	0	110.8	G704	G704-G706 PolarHBondContact O-N 2.91Å
707	R	35.7	Very low	39.3	Very low	244 Å²	244	163.8 Å²	163.8	92%	0.921	87%	0.866	S	S	*	*			trans	-66.4	138.8	165	-89.2	-179.1	168.7	-174.5	-3.2	109
708	G	32.8	Very low	38.4	Very low	73 Å²	73	164.1 Å²	164.1	75%	0.753	87%	0.869	S	S	*	*			trans	-61.4	151.8	177	0	0	0	0	0	113.8
709	R	37	Very low	37.9	Very low	249 Å²	249	167.5 Å²	167.5	94%	0.94	88%	0.877	S	S	*	*			trans	-158.5	112.1	146.4	-107.3	176.6	-177.9	-162.7	0	107.7
710	G	35.7	Very low	37.8	Very low	76 Å²	76	170.8 Å²	170.8	78%	0.784	88%	0.883	S	S	*	*			trans	-64.9	142	163.9	0	0	0	0	0	110.2
711	R	39.3	Very low	37.5	Very low	245 Å²	245	175.4 Å²	175.4	93%	0.925	89%	0.888	S	S	*	*			trans	-152.3	119	152.8	-98.5	-176	179.5	-168.7	-1.9	107.4
712	G	35.8	Very low	37.3	Very low	67 Å²	67	170.3 Å²	170.3	69%	0.691	88%	0.883	S	S	*	*			trans	-75.5	-169.1	163.9	0	0	0	0	0	112.2
713	R	39.8	Very low	37.1	Very low	262 Å²	262	176.6 Å²	176.6	99%	0.989	89%	0.886	S	S	*	*			trans	83.4	130.5	-163.3	-56.9	178.5	173.4	-156.2	-2	111
714	G	34	Very low	37	Very low	71 Å²	71	170.5 Å²	170.5	73%	0.732	88%	0.88	S	S	*	*			cis	162	151.5	10.2	0	0	0	0	0	106.2
715	R	43.6	Very low	37.1	Very low	236 Å²	236	178.4 Å²	178.4	89%	0.891	89%	0.888	S	S	*	*			trans	-30.3	133.3	175.5	-67	173.7	171.5	-176.1	-4.6	114.7
716	F	38	Very low	37.1	Very low	284 Å²	284	171.6 Å²	171.6	100%	1.246	88%	0.882	S	S	*	*				-144.7	0	106.4	-94.4	-77.8	0	0	0	108.9

Retrieved 716 of 716 residues in 208.2 ms (Link to these results)

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