A0A5K4FEA5_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FEA5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 311 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	33.3	Very low	35.6	Very low	158 Å²	158	54.5 Å²	54.5	78%	0.778	32%	0.318	S	S	*	.				0	145.5	0	-83	174.9	146.2	0	0	108.3	G3	M1-G3 PolarHBondContact O-N 3.36Å
2	P	33.4	Very low	35.6	Very low	30 Å²	30	51.4 Å²	51.4	20%	0.195	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	128.9	166.7	3.1	0.3	0	0	0	109.2	I37 S38 F39 I44	P2-I37 HydrophobicContact CB-CG2 4.45Å; P2-S38 CarbonylContact C-O 3.56Å; P2-S38 WeakPolarHBondContact CA-O 3.38Å; P2-S38 VanDerWaalsContact CB-O 3.24Å; P2-S38 WeakPolarHBondContact CB-O 3.41Å; P2-F39 HydrophobicContact CB-CB 4.33Å; P2-F39 HydrophobicContact CB-CD2 3.84Å; P2-F39 HydrophobicContact CG-CD2 3.98Å; P2-I44 HydrophobicContact CB-CD1 4.25Å
3	G	33.9	Very low	35.8	Very low	34 Å²	34	49.6 Å²	49.6	35%	0.351	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	121.4	171.9	0	0	0	0	0	108.9	M1 I5 S38	M1-G3 PolarHBondContact O-N 3.36Å; G3-I5 PolarHBondContact O-N 3.02Å; G3-S38 CarbonylContact C-O 3.6Å; G3-S38 PolarHBondContact N-O 3.35Å; G3-S38 CarbonylContact O-C 3.4Å; G3-S38 VanDerWaalsContact O-CA 3.3Å; G3-S38 WeakPolarHBondContact O-CA 3.17Å; G3-S38 WeakPolarHBondContact O-CB 3.39Å; G3-S38 PolarHBondContact O-N 3.19Å; G3-S38 PolarHBondContact O-OG 3.28Å
4	I	35.8	Very low	36	Very low	32 Å²	32	49.3 Å²	49.3	16%	0.164	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	117.8	172.9	-54.1	-178.5	0	0	0	108.1	V6 I23 I25 V35 I37 T68	I4-V6 HydrophobicContact CG2-CG2 3.86Å; I4-I23 HydrophobicContact CB-CD1 4.42Å; I4-I23 HydrophobicContact CD1-CB 3.82Å; I4-I23 HydrophobicContact CD1-CD1 3.63Å; I4-I23 HydrophobicContact CD1-CG1 4.25Å; I4-I23 HydrophobicContact CD1-CG2 4.13Å; I4-I23 HydrophobicContact CG1-CD1 3.93Å; I4-I25 HydrophobicContact CG2-CD1 3.98Å; I4-V35 HydrophobicContact CG2-CG1 4.46Å; I4-I37 HydrophobicContact CG1-CG2 4.42Å; I4-T68 HydrophobicContact CD1-CG2 3.47Å; I4-T68 VanDerWaalsContact CD1-CG2 3.47Å
5	I	37.6	Very low	36.3	Very low	77 Å²	77	53.5 Å²	53.5	40%	0.395	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	120.7	169.8	-58.1	174.9	0	0	0	105.8	G3 Q36 M43	G3-I5 PolarHBondContact O-N 3.02Å; I5-Q36 CarbonylContact C-O 3.53Å; I5-Q36 VanDerWaalsContact CA-O 3.31Å; I5-Q36 WeakPolarHBondContact CA-O 3.49Å; I5-Q36 HydrophobicContact CB-CB 4.07Å; I5-Q36 WeakPolarHBondContact CB-O 3.28Å; I5-Q36 HydrophobicContact CG2-CB 4.37Å; I5-Q36 PolarHBondContact N-O 3.29Å; I5-Q36 CarbonylContact O-C 3.48Å; I5-Q36 WeakPolarHBondContact O-CA 3.45Å; I5-Q36 WeakPolarHBondContact O-CB 3.37Å; I5-Q36 PolarHBondContact O-N 3.38Å; I5-M43 HydrophobicContact CD1-SD 4.37Å
6	V	37.4	Very low	36.3	Very low	31 Å²	31	55.5 Å²	55.5	19%	0.188	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	113.2	173	-167.7	0	0	0	0	107.3	I4 V13 I25	I4-V6 HydrophobicContact CG2-CG2 3.86Å; V6-V13 HydrophobicContact CB-CB 4.43Å; V6-V13 HydrophobicContact CB-CG1 4Å; V6-V13 HydrophobicContact CB-CG2 4.05Å; V6-V13 HydrophobicContact CG1-CB 4.37Å; V6-V13 HydrophobicContact CG1-CG1 4.21Å; V6-V13 HydrophobicContact CG1-CG2 3.49Å; V6-V13 VanDerWaalsContact CG1-CG2 3.49Å; V6-V13 HydrophobicContact CG2-CG1 4.05Å; V6-I25 HydrophobicContact CB-CG2 4.41Å; V6-I25 HydrophobicContact CG1-CG2 3.83Å; V6-I25 HydrophobicContact CG2-CD1 3.7Å; V6-I25 HydrophobicContact CG2-CG1 3.9Å; V6-I25 HydrophobicContact CG2-CG2 3.88Å
7	N	37.6	Very low	36.5	Very low	44 Å²	44	59 Å²	59	24%	0.235	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	86.8	-178	-150.1	-16.9	0	0	0	107.9	S9 I34 Q36	N7-S9 PolarHBondContact O-N 3.27Å; N7-I34 CarbonylContact C-O 3.47Å; N7-I34 HydrophobicContact CB-CB 4.46Å; N7-I34 PolarHBondContact N-O 2.95Å; N7-I34 WeakPolarHBondContact O-CA 3.46Å; N7-I34 VanDerWaalsContact O-CB 3.28Å; N7-I34 WeakPolarHBondContact O-CB 3.5Å; N7-I34 PolarHBondContact O-N 3.39Å; N7-I34 VanDerWaalsContact O-N 3.08Å; N7-Q36 HydrophobicContact CB-CG 4.47Å; N7-Q36 PolarHBondContact ND2-OE1 3.3Å; N7-Q36 VanDerWaalsContact ND2-OE1 3.13Å
8	N	38.6	Very low	36.7	Very low	27 Å²	27	59.9 Å²	59.9	14%	0.144	36%	0.356	C	S	.	.			trans	-87.6	103.2	-176.4	46.6	8	0	0	0	109.8	L10 G11 V13 I241	N8-L10 PolarHBondContact O-N 3.5Å; N8-G11 WeakPolarHBondContact CB-O 3.31Å; N8-G11 PolarHBondContact ND2-O 3.19Å; N8-V13 HydrophobicContact CB-CG2 4.12Å; N8-V13 WeakPolarHBondContact ND2-CG2 3.21Å; N8-I241 WeakPolarHBondContact O-CD1 3.49Å
9	S	35.6	Very low	36.8	Very low	64 Å²	64	60.7 Å²	60.7	45%	0.448	37%	0.366	S	S	.	.	S	Bend	trans	-61.4	-25.3	171.7	48.4	0	0	0	0	112.2	N7 P32	N7-S9 PolarHBondContact O-N 3.27Å; S9-P32 PolarHBondContact OG-O 3.23Å
10	L	35.9	Very low	37	Very low	91 Å²	91	65.4 Å²	65.4	48%	0.476	39%	0.388	S	S	.	.	S	Bend	trans	-157.5	27.9	-172.8	-65.8	168.8	0	0	0	115.9	N8 Y29 K31	N8-L10 PolarHBondContact O-N 3.5Å; L10-Y29 WeakPolarHBondContact O-CD2 3.13Å; L10-K31 HydrophobicContact CB-CB 3.59Å; L10-K31 HydrophobicContact CB-CD 3.49Å; L10-K31 VanDerWaalsContact CB-CD 3.49Å; L10-K31 HydrophobicContact CB-CG 4.18Å; L10-K31 HydrophobicContact CD1-CB 4.19Å; L10-K31 HydrophobicContact CD1-CD 3.82Å; L10-K31 HydrophobicContact CD1-CG 4.42Å; L10-K31 HydrophobicContact CD2-CD 4.45Å; L10-K31 HydrophobicContact CG-CD 4.08Å
11	G	32.6	Very low	37.2	Very low	12 Å²	12	64.9 Å²	64.9	12%	0.124	38%	0.384	C	S	.	.			trans	-138.7	137.8	-171.1	0	0	0	0	0	114.3	N8 V13	N8-G11 WeakPolarHBondContact CB-O 3.31Å; N8-G11 PolarHBondContact ND2-O 3.19Å; G11-V13 PolarHBondContact O-N 3.06Å
12	H	36.2	Very low	37.2	Very low	17 Å²	17	60.2 Å²	60.2	8%	0.079	36%	0.362	C	S	.	.			trans	-72.6	127.8	170.7	-69.7	-71.9	0	0	0	110.6	F14 H26 A27 I28 Y29 V234	H12-F14 HydrophobicContact CB-CE2 4.25Å; H12-F14 HydrophobicContact CB-CZ 4.06Å; H12-H26 CarbonylContact O-C 3.56Å; H12-H26 VanDerWaalsContact O-C 3.27Å; H12-A27 WeakPolarHBondContact O-CA 2.98Å; H12-I28 HydrophobicContact CB-CB 4.16Å; H12-I28 HydrophobicContact CB-CD1 3.43Å; H12-I28 VanDerWaalsContact CB-CD1 3.43Å; H12-I28 HydrophobicContact CB-CG1 3.92Å; H12-Y29 AromaticContact CD2-CE2 3.27Å; H12-Y29 WeakPolarHBondContact CD2-CE2 3Å; H12-Y29 AromaticContact CD2-CZ 3.75Å; H12-Y29 AromaticContact NE2-CE2 3.6Å; H12-Y29 AromaticContact NE2-CZ 3.91Å; H12-Y29 PolarHBondContact NE2-OH 2.76Å; H12-V234 WeakPolarHBondContact CE1-CG1 3.11Å; H12-V234 WeakPolarHBondContact NE2-CG1 2.88Å
13	V	37.1	Very low	37.7	Very low	28 Å²	28	60.1 Å²	60.1	17%	0.17	36%	0.359	C	S	.	.			trans	-113.4	117.4	172.5	177.9	0	0	0	0	109.5	V6 N8 G11 I25 H26	V6-V13 HydrophobicContact CB-CB 4.43Å; V6-V13 HydrophobicContact CB-CG1 4Å; V6-V13 HydrophobicContact CB-CG2 4.05Å; V6-V13 HydrophobicContact CG1-CB 4.37Å; V6-V13 HydrophobicContact CG1-CG1 4.21Å; V6-V13 HydrophobicContact CG1-CG2 3.49Å; V6-V13 VanDerWaalsContact CG1-CG2 3.49Å; V6-V13 HydrophobicContact CG2-CG1 4.05Å; N8-V13 HydrophobicContact CB-CG2 4.12Å; N8-V13 WeakPolarHBondContact ND2-CG2 3.21Å; G11-V13 PolarHBondContact O-N 3.06Å; V13-I25 HydrophobicContact CG1-CB 4.38Å; V13-I25 HydrophobicContact CG1-CG2 3.68Å; V13-I25 HydrophobicContact CG2-CG2 4.08Å; V13-H26 WeakPolarHBondContact CA-O 3.39Å; V13-H26 WeakPolarHBondContact CG2-O 3.46Å
14	F	38.8	Very low	37.8	Very low	45 Å²	45	59.2 Å²	59.2	20%	0.197	35%	0.347	C	S	.	.			trans	-105.8	129.8	170.4	-57	-56.3	0	0	0	108.8	H12 H26 I28 H237	H12-F14 HydrophobicContact CB-CE2 4.25Å; H12-F14 HydrophobicContact CB-CZ 4.06Å; F14-H26 HydrophobicContact CB-CB 4.5Å; F14-H26 HydrophobicContact CD2-CB 4.31Å; F14-I28 HydrophobicContact CD2-CD1 4.23Å; F14-I28 HydrophobicContact CE2-CD1 3.37Å; F14-I28 HydrophobicContact CE2-CG1 4.47Å; F14-I28 HydrophobicContact CZ-CD1 4.03Å; F14-H237 AromaticContact CD1-CD2 3.9Å; F14-H237 HydrophobicContact CE1-CB 3.92Å; F14-H237 AromaticContact CE1-CD2 3Å; F14-H237 WeakPolarHBondContact CE1-CD2 3.34Å; F14-H237 AromaticContact CE1-CG 3.54Å; F14-H237 AromaticContact CE1-NE2 3.72Å; F14-H237 HydrophobicContact CZ-CB 4.45Å; F14-H237 AromaticContact CZ-CD2 3.34Å; F14-H237 WeakPolarHBondContact CZ-CD2 3.24Å
15	N	40.7	Very low	38.1	Very low	113 Å²	113	57.8 Å²	57.8	60%	0.604	34%	0.34	S	S	*	.			trans	-90.2	101.1	167.4	-166.8	0.4	0	0	0	106.5
16	L	37	Very low	38.1	Very low	85 Å²	85	55.1 Å²	55.1	45%	0.445	33%	0.326	S	S	.	.			trans	-74	151.1	169.1	-64.3	157.3	0	0	0	108.6	A18 P24 H26	L16-A18 PolarHBondContact O-N 2.98Å; L16-A18 VanDerWaalsContact O-N 3.17Å; L16-P24 HydrophobicContact CB-CG 3.58Å; L16-P24 HydrophobicContact CD1-CG 4.33Å; L16-P24 HydrophobicContact CG-CG 4.38Å; L16-H26 VanDerWaalsContact CD1-NE2 3.29Å; L16-H26 WeakPolarHBondContact CD1-NE2 3.26Å
17	S	38.6	Very low	38.2	Very low	115 Å²	115	53.8 Å²	53.8	80%	0.804	32%	0.318	S	S	*	.			trans	-35.6	119.3	178.8	33.4	0	0	0	0	112.1	S19	S17-S19 PolarHBondContact O-N 3.1Å
18	A	40.4	Very low	38.3	Very low	75 Å²	75	52.8 Å²	52.8	62%	0.62	31%	0.312	S	S	*	.			trans	-62.1	104.9	-180	0	0	0	0	0	109.6	L16	L16-A18 PolarHBondContact O-N 2.98Å; L16-A18 VanDerWaalsContact O-N 3.17Å
19	S	39	Very low	38.4	Very low	76 Å²	76	55.4 Å²	55.4	53%	0.531	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-89.3	127.3	164.4	66.9	0	0	0	0	108.4	S17 N21 I22	S17-S19 PolarHBondContact O-N 3.1Å; S19-N21 PolarHBondContact O-N 3.45Å; S19-N21 VanDerWaalsContact O-N 3.13Å; S19-I22 PolarHBondContact O-N 3.32Å
20	N	41.5	Very low	38.6	Very low	153 Å²	153	52.9 Å²	52.9	82%	0.818	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	32.3	69.1	162.5	-66.3	-13.6	0	0	0	114.7	I22	N20-I22 PolarHBondContact O-N 3.35Å
21	N	40.8	Very low	38.9	Very low	56 Å²	56	52.9 Å²	52.9	30%	0.299	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	17.6	171.2	-54.4	-33.8	0	0	0	116.7	S19 N70 E71	S19-N21 PolarHBondContact O-N 3.45Å; S19-N21 VanDerWaalsContact O-N 3.13Å; N21-N70 HydrophobicContact CB-CB 4.33Å; N21-N70 WeakPolarHBondContact O-CB 3.38Å; N21-N70 PolarHBondContact O-N 3.11Å; N21-E71 HydrophobicContact CB-CG 4.06Å; N21-E71 PolarHBondContact ND2-OE1 3.3Å
22	I	33.9	Very low	39.2	Very low	60 Å²	60	54.4 Å²	54.4	31%	0.308	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	128.1	176	-56.8	176.2	0	0	0	111	S19 N20 L67 T68	S19-I22 PolarHBondContact O-N 3.32Å; N20-I22 PolarHBondContact O-N 3.35Å; I22-L67 HydrophobicContact CG2-CB 3.81Å; I22-L67 HydrophobicContact CG2-CD1 4.43Å; I22-L67 HydrophobicContact CG2-CD2 3.99Å; I22-L67 HydrophobicContact CG2-CG 4.29Å; I22-T68 WeakPolarHBondContact CA-O 3.27Å
23	I	42.5	Very low	39.6	Very low	27 Å²	27	53.8 Å²	53.8	14%	0.138	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	113.2	170	-67.8	168.7	0	0	0	108.7	I4 I25 T68	I4-I23 HydrophobicContact CB-CD1 4.42Å; I4-I23 HydrophobicContact CD1-CB 3.82Å; I4-I23 HydrophobicContact CD1-CD1 3.63Å; I4-I23 HydrophobicContact CD1-CG1 4.25Å; I4-I23 HydrophobicContact CD1-CG2 4.13Å; I4-I23 HydrophobicContact CG1-CD1 3.93Å; I23-I25 HydrophobicContact CG2-CG1 4.33Å; I23-T68 PolarHBondContact N-O 3.15Å; I23-T68 VanDerWaalsContact N-O 3.1Å; I23-T68 PolarHBondContact O-N 3.44Å
24	P	37.1	Very low	39.9	Very low	16 Å²	16	54.6 Å²	54.6	10%	0.104	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	132.6	170.6	28.2	-28	0	0	0	110.7	L16 A66 L67	L16-P24 HydrophobicContact CB-CG 3.58Å; L16-P24 HydrophobicContact CD1-CG 4.33Å; L16-P24 HydrophobicContact CG-CG 4.38Å; P24-A66 CarbonylContact C-O 3.5Å; P24-L67 HydrophobicContact CB-CD2 3.56Å
25	I	40.8	Very low	40.2	Very low	2 Å²	2	52.7 Å²	52.7	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	94.9	178.6	-59.3	170.4	0	0	0	106	I4 V6 V13 I23 V35 Y65 A66	I4-I25 HydrophobicContact CG2-CD1 3.98Å; V6-I25 HydrophobicContact CB-CG2 4.41Å; V6-I25 HydrophobicContact CG1-CG2 3.83Å; V6-I25 HydrophobicContact CG2-CD1 3.7Å; V6-I25 HydrophobicContact CG2-CG1 3.9Å; V6-I25 HydrophobicContact CG2-CG2 3.88Å; V13-I25 HydrophobicContact CG1-CB 4.38Å; V13-I25 HydrophobicContact CG1-CG2 3.68Å; V13-I25 HydrophobicContact CG2-CG2 4.08Å; I23-I25 HydrophobicContact CG2-CG1 4.33Å; I25-V35 HydrophobicContact CD1-CG1 3.97Å; I25-Y65 CarbonylContact O-C 3.51Å; I25-Y65 WeakPolarHBondContact O-CA 2.78Å; I25-Y65 VanDerWaalsContact O-CB 3.29Å; I25-Y65 WeakPolarHBondContact O-CB 3.41Å; I25-A66 HydrophobicContact CB-CB 4.23Å; I25-A66 WeakPolarHBondContact CB-O 3.44Å; I25-A66 PolarHBondContact N-O 3.24Å; I25-A66 PolarHBondContact O-N 3.07Å
26	H	39.3	Very low	40.4	Very low	21 Å²	21	49.2 Å²	49.2	10%	0.097	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	148.6	170.7	-73	-91.6	0	0	0	110.4	H12 V13 F14 L16 Y65 Y134	H12-H26 CarbonylContact O-C 3.56Å; H12-H26 VanDerWaalsContact O-C 3.27Å; V13-H26 WeakPolarHBondContact CA-O 3.39Å; V13-H26 WeakPolarHBondContact CG2-O 3.46Å; F14-H26 HydrophobicContact CB-CB 4.5Å; F14-H26 HydrophobicContact CD2-CB 4.31Å; L16-H26 VanDerWaalsContact CD1-NE2 3.29Å; L16-H26 WeakPolarHBondContact CD1-NE2 3.26Å; H26-Y65 AromaticContact CE1-CD1 3.94Å; H26-Y65 AromaticContact CE1-CG 3.79Å; H26-Y134 AromaticContact CE1-CE2 3.94Å; H26-Y134 PolarHBondContact CE1-OH 3.3Å
27	A	38.9	Very low	40.5	Very low	2 Å²	2	45.6 Å²	45.6	2%	0.017	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	103.4	171.7	0	0	0	0	0	107.1	H12 Y29 F33 Q64	H12-A27 WeakPolarHBondContact O-CA 2.98Å; A27-Y29 PolarHBondContact O-N 3Å; A27-F33 HydrophobicContact CB-CD1 4.04Å; A27-F33 HydrophobicContact CB-CE1 3.95Å; A27-F33 HydrophobicContact CB-CG 4.48Å; A27-F33 HydrophobicContact CB-CZ 4.32Å; A27-Q64 CarbonylContact C-O 3.58Å; A27-Q64 HydrophobicContact CB-CB 4.33Å; A27-Q64 PolarHBondContact N-O 2.89Å; A27-Q64 PolarHBondContact O-N 3.15Å
28	I	39.1	Very low	40.4	Very low	24 Å²	24	40.5 Å²	40.5	12%	0.123	22%	0.224	C	C	.	.			trans	-76.2	-8.8	-169.9	-65.1	172.3	0	0	0	113.2	H12 F14	H12-I28 HydrophobicContact CB-CB 4.16Å; H12-I28 HydrophobicContact CB-CD1 3.43Å; H12-I28 VanDerWaalsContact CB-CD1 3.43Å; H12-I28 HydrophobicContact CB-CG1 3.92Å; F14-I28 HydrophobicContact CD2-CD1 4.23Å; F14-I28 HydrophobicContact CE2-CD1 3.37Å; F14-I28 HydrophobicContact CE2-CG1 4.47Å; F14-I28 HydrophobicContact CZ-CD1 4.03Å
29	Y	40.9	Very low	40.2	Very low	82 Å²	82	41.4 Å²	41.4	32%	0.322	21%	0.214	S	C	.	.	S	Bend	trans	-127.7	142.7	-174.7	-56.8	-64	0	0	0	112.1	L10 H12 A27 K31	L10-Y29 WeakPolarHBondContact O-CD2 3.13Å; H12-Y29 AromaticContact CD2-CE2 3.27Å; H12-Y29 WeakPolarHBondContact CD2-CE2 3Å; H12-Y29 AromaticContact CD2-CZ 3.75Å; H12-Y29 AromaticContact NE2-CE2 3.6Å; H12-Y29 AromaticContact NE2-CZ 3.91Å; H12-Y29 PolarHBondContact NE2-OH 2.76Å; A27-Y29 PolarHBondContact O-N 3Å; Y29-K31 PolarHBondContact O-N 3.01Å
30	C	39.2	Very low	40	Very low	11 Å²	11	44.3 Å²	44.3	7%	0.074	22%	0.224	C	C	.	.	S	Bend	trans	-68.6	54.3	165.1	-74	0	0	0	0	111.3	P53 W62	C30-P53 HydrophobicContact CB-CG 4.43Å; C30-W62 WeakPolarHBondContact SG-CB 3.5Å
31	K	42.3	Very low	39.6	Very low	90 Å²	90	40.2 Å²	40.2	39%	0.391	22%	0.218	S	C	.	.	S	Bend	trans	-125.1	150	176.8	-67.3	-175.2	174.5	-177.2	0	108.8	L10 Y29 F33	L10-K31 HydrophobicContact CB-CB 3.59Å; L10-K31 HydrophobicContact CB-CD 3.49Å; L10-K31 VanDerWaalsContact CB-CD 3.49Å; L10-K31 HydrophobicContact CB-CG 4.18Å; L10-K31 HydrophobicContact CD1-CB 4.19Å; L10-K31 HydrophobicContact CD1-CD 3.82Å; L10-K31 HydrophobicContact CD1-CG 4.42Å; L10-K31 HydrophobicContact CD2-CD 4.45Å; L10-K31 HydrophobicContact CG-CD 4.08Å; Y29-K31 PolarHBondContact O-N 3.01Å; K31-F33 PolarHBondContact O-N 3.21Å
32	P	40.1	Very low	39.3	Very low	44 Å²	44	42 Å²	42	29%	0.286	23%	0.231	S	C	.	.			trans	-57.6	136	-178.4	-21.3	30	0	0	0	111	S9 F49 N50	S9-P32 PolarHBondContact OG-O 3.23Å; P32-F49 CarbonylContact C-O 3.55Å; P32-F49 WeakPolarHBondContact CA-O 3.43Å; P32-F49 WeakPolarHBondContact CB-O 2.85Å; P32-N50 HydrophobicContact CB-CB 4.39Å; P32-N50 HydrophobicContact CG-CB 4.28Å
33	F	43.8	Very low	39.7	Very low	4 Å²	4	42.6 Å²	42.6	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	150.4	173.5	63.4	-89.1	0	0	0	109.9	A27 K31 V35 F49	A27-F33 HydrophobicContact CB-CD1 4.04Å; A27-F33 HydrophobicContact CB-CE1 3.95Å; A27-F33 HydrophobicContact CB-CG 4.48Å; A27-F33 HydrophobicContact CB-CZ 4.32Å; K31-F33 PolarHBondContact O-N 3.21Å; F33-V35 HydrophobicContact CD2-CG2 3.72Å; F33-V35 HydrophobicContact CE2-CG2 3.58Å; F33-F49 HydrophobicContact CD1-CB 4.28Å; F33-F49 HydrophobicContact CD2-CB 4.49Å; F33-F49 HydrophobicContact CD2-CD2 4.09Å; F33-F49 HydrophobicContact CE1-CB 3.93Å; F33-F49 HydrophobicContact CE2-CB 4.17Å; F33-F49 AromaticContact CE2-CD2 3.64Å; F33-F49 HydrophobicContact CE2-CD2 3.64Å; F33-F49 HydrophobicContact CE2-CE2 4.4Å; F33-F49 HydrophobicContact CE2-CG 4.13Å; F33-F49 HydrophobicContact CZ-CB 3.87Å; F33-F49 HydrophobicContact CZ-CD2 4.08Å; F33-F49 HydrophobicContact CZ-CG 4.09Å; F33-F49 PolarHBondContact N-O 3.17Å; F33-F49 VanDerWaalsContact N-O 3.09Å; F33-F49 PolarHBondContact O-N 3.17Å
34	I	42.7	Very low	39.5	Very low	46 Å²	46	46 Å²	46	24%	0.236	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	118.9	-179.5	-47.9	-177.2	0	0	0	107.4	N7 Q36 T46 S47 I48	N7-I34 CarbonylContact C-O 3.47Å; N7-I34 HydrophobicContact CB-CB 4.46Å; N7-I34 PolarHBondContact N-O 2.95Å; N7-I34 WeakPolarHBondContact O-CA 3.46Å; N7-I34 VanDerWaalsContact O-CB 3.28Å; N7-I34 WeakPolarHBondContact O-CB 3.5Å; N7-I34 PolarHBondContact O-N 3.39Å; N7-I34 VanDerWaalsContact O-N 3.08Å; I34-Q36 HydrophobicContact CG2-CG 4Å; I34-T46 HydrophobicContact CG2-CG2 3.4Å; I34-S47 WeakPolarHBondContact CA-O 3.4Å; I34-I48 HydrophobicContact CD1-CG1 4.44Å; I34-I48 HydrophobicContact CG1-CG1 4.2Å; I34-I48 HydrophobicContact CG2-CG1 4.36Å
35	V	45.1	Very low	39.6	Very low	4 Å²	4	48.5 Å²	48.5	2%	0.024	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	123.4	170.2	-177.1	0	0	0	0	107.7	I4 I25 F33 I37 T46 S47 F49	I4-V35 HydrophobicContact CG2-CG1 4.46Å; I25-V35 HydrophobicContact CD1-CG1 3.97Å; F33-V35 HydrophobicContact CD2-CG2 3.72Å; F33-V35 HydrophobicContact CE2-CG2 3.58Å; V35-I37 HydrophobicContact CG1-CG1 4.42Å; V35-T46 CarbonylContact O-C 3.27Å; V35-T46 WeakPolarHBondContact O-CA 3.31Å; V35-S47 PolarHBondContact N-O 3.31Å; V35-S47 PolarHBondContact O-N 3.07Å; V35-F49 HydrophobicContact CB-CE2 4.08Å; V35-F49 HydrophobicContact CG2-CD2 4.01Å; V35-F49 HydrophobicContact CG2-CE2 3.74Å
36	Q	44.6	Very low	39.5	Very low	41 Å²	41	51.8 Å²	51.8	19%	0.192	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	98.3	-176.4	-85.2	-170.1	-38.8	0	0	110	I5 N7 I34 M43 N45 T46	I5-Q36 CarbonylContact C-O 3.53Å; I5-Q36 VanDerWaalsContact CA-O 3.31Å; I5-Q36 WeakPolarHBondContact CA-O 3.49Å; I5-Q36 HydrophobicContact CB-CB 4.07Å; I5-Q36 WeakPolarHBondContact CB-O 3.28Å; I5-Q36 HydrophobicContact CG2-CB 4.37Å; I5-Q36 PolarHBondContact N-O 3.29Å; I5-Q36 CarbonylContact O-C 3.48Å; I5-Q36 WeakPolarHBondContact O-CA 3.45Å; I5-Q36 WeakPolarHBondContact O-CB 3.37Å; I5-Q36 PolarHBondContact O-N 3.38Å; N7-Q36 HydrophobicContact CB-CG 4.47Å; N7-Q36 PolarHBondContact ND2-OE1 3.3Å; N7-Q36 VanDerWaalsContact ND2-OE1 3.13Å; I34-Q36 HydrophobicContact CG2-CG 4Å; Q36-M43 VanDerWaalsContact CA-CE 3.47Å; Q36-M43 HydrophobicContact CB-CE 3.27Å; Q36-M43 HydrophobicContact CB-SD 3.84Å; Q36-M43 HydrophobicContact CG-CE 3.46Å; Q36-M43 VanDerWaalsContact CG-CE 3.46Å; Q36-M43 HydrophobicContact CG-SD 4.25Å; Q36-N45 CarbonylContact C-O 3.37Å; Q36-N45 WeakPolarHBondContact CA-O 3.45Å; Q36-T46 HydrophobicContact CG-CG2 3.94Å
37	I	39.5	Very low	39.7	Very low	9 Å²	9	52.4 Å²	52.4	5%	0.046	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	127.7	175.3	-47.1	-179.4	0	0	0	108.1	P2 I4 V35 M43 I44 N45 T68 V75	P2-I37 HydrophobicContact CB-CG2 4.45Å; I4-I37 HydrophobicContact CG1-CG2 4.42Å; V35-I37 HydrophobicContact CG1-CG1 4.42Å; I37-M43 WeakPolarHBondContact O-CE 3.02Å; I37-I44 HydrophobicContact CB-CD1 4.36Å; I37-I44 HydrophobicContact CB-CG1 3.87Å; I37-I44 HydrophobicContact CG2-CD1 3.58Å; I37-I44 HydrophobicContact CG2-CG1 3.61Å; I37-I44 VanDerWaalsContact O-CG1 3.23Å; I37-I44 WeakPolarHBondContact O-CG1 3.48Å; I37-I44 PolarHBondContact O-N 3.04Å; I37-N45 HydrophobicContact CB-CB 4.06Å; I37-N45 HydrophobicContact CD1-CB 4.11Å; I37-N45 HydrophobicContact CG1-CB 4.19Å; I37-N45 PolarHBondContact N-O 3.46Å; I37-N45 PolarHBondContact O-N 3.13Å; I37-N45 VanDerWaalsContact O-N 3.09Å; I37-T68 HydrophobicContact CD1-CG2 4.27Å; I37-V75 HydrophobicContact CD1-CG2 3.98Å
38	S	37.5	Very low	39.8	Very low	7 Å²	7	58.2 Å²	58.2	5%	0.049	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	158.4	176	78.7	0	0	0	0	111.9	P2 G3 T42	P2-S38 CarbonylContact C-O 3.56Å; P2-S38 WeakPolarHBondContact CA-O 3.38Å; P2-S38 VanDerWaalsContact CB-O 3.24Å; P2-S38 WeakPolarHBondContact CB-O 3.41Å; G3-S38 CarbonylContact C-O 3.6Å; G3-S38 PolarHBondContact N-O 3.35Å; G3-S38 CarbonylContact O-C 3.4Å; G3-S38 VanDerWaalsContact O-CA 3.3Å; G3-S38 WeakPolarHBondContact O-CA 3.17Å; G3-S38 WeakPolarHBondContact O-CB 3.39Å; G3-S38 PolarHBondContact O-N 3.19Å; G3-S38 PolarHBondContact O-OG 3.28Å; S38-T42 CarbonylContact C-O 3.35Å; S38-T42 WeakPolarHBondContact CA-O 3.46Å; S38-T42 WeakPolarHBondContact CB-O 2.96Å
39	F	35.4	Very low	39.9	Very low	95 Å²	95	60.3 Å²	60.3	42%	0.417	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	119.1	170.9	-174.3	-91.1	0	0	0	108.3	P2 G41 T42 I44	P2-F39 HydrophobicContact CB-CB 4.33Å; P2-F39 HydrophobicContact CB-CD2 3.84Å; P2-F39 HydrophobicContact CG-CD2 3.98Å; F39-G41 PolarHBondContact O-N 3.15Å; F39-T42 PolarHBondContact N-O 3.38Å; F39-T42 WeakPolarHBondContact O-CB 3.47Å; F39-T42 PolarHBondContact O-N 3.45Å; F39-I44 HydrophobicContact CB-CD1 4.4Å; F39-I44 HydrophobicContact CB-CG2 3.97Å
40	N	35.1	Very low	40	Very low	137 Å²	137	60.3 Å²	60.3	73%	0.733	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	43.6	-173.4	-67.4	-11.8	0	0	0	113.3	T42	N40-T42 PolarHBondContact O-N 3.43Å
41	G	32.2	Very low	40.1	Very low	67 Å²	67	60.3 Å²	60.3	69%	0.691	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	-5.6	-178.1	0	0	0	0	0	115.1	F39	F39-G41 PolarHBondContact O-N 3.15Å
42	T	35.6	Very low	40.2	Very low	94 Å²	94	61 Å²	61	58%	0.577	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	121.1	173.6	-55.5	0	0	0	0	109.8	S38 F39 N40 I44	S38-T42 CarbonylContact C-O 3.35Å; S38-T42 WeakPolarHBondContact CA-O 3.46Å; S38-T42 WeakPolarHBondContact CB-O 2.96Å; F39-T42 PolarHBondContact N-O 3.38Å; F39-T42 WeakPolarHBondContact O-CB 3.47Å; F39-T42 PolarHBondContact O-N 3.45Å; N40-T42 PolarHBondContact O-N 3.43Å; T42-I44 PolarHBondContact O-N 3.2Å
43	M	41.8	Very low	40.1	Very low	72 Å²	72	59.9 Å²	59.9	36%	0.355	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	116.5	173.1	-76.1	-55.2	-49.5	0	0	111.1	I5 Q36 I37 N45 T46	I5-M43 HydrophobicContact CD1-SD 4.37Å; Q36-M43 VanDerWaalsContact CA-CE 3.47Å; Q36-M43 HydrophobicContact CB-CE 3.27Å; Q36-M43 HydrophobicContact CB-SD 3.84Å; Q36-M43 HydrophobicContact CG-CE 3.46Å; Q36-M43 VanDerWaalsContact CG-CE 3.46Å; Q36-M43 HydrophobicContact CG-SD 4.25Å; I37-M43 WeakPolarHBondContact O-CE 3.02Å; M43-N45 VanDerWaalsContact CE-O 3.29Å; M43-N45 WeakPolarHBondContact CE-O 3.31Å; M43-T46 WeakPolarHBondContact CE-OG1 3.36Å
44	I	39.1	Very low	39.9	Very low	99 Å²	99	65.9 Å²	65.9	51%	0.508	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-25.6	179.3	59.2	168	0	0	0	113.1	P2 I37 F39 T42	P2-I44 HydrophobicContact CB-CD1 4.25Å; I37-I44 HydrophobicContact CB-CD1 4.36Å; I37-I44 HydrophobicContact CB-CG1 3.87Å; I37-I44 HydrophobicContact CG2-CD1 3.58Å; I37-I44 HydrophobicContact CG2-CG1 3.61Å; I37-I44 VanDerWaalsContact O-CG1 3.23Å; I37-I44 WeakPolarHBondContact O-CG1 3.48Å; I37-I44 PolarHBondContact O-N 3.04Å; F39-I44 HydrophobicContact CB-CD1 4.4Å; F39-I44 HydrophobicContact CB-CG2 3.97Å; T42-I44 PolarHBondContact O-N 3.2Å
45	N	39.2	Very low	39.8	Very low	67 Å²	67	67 Å²	67	36%	0.358	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	140.4	175.4	-166.7	-3.9	0	0	0	110.7	Q36 I37 M43	Q36-N45 CarbonylContact C-O 3.37Å; Q36-N45 WeakPolarHBondContact CA-O 3.45Å; I37-N45 HydrophobicContact CB-CB 4.06Å; I37-N45 HydrophobicContact CD1-CB 4.11Å; I37-N45 HydrophobicContact CG1-CB 4.19Å; I37-N45 PolarHBondContact N-O 3.46Å; I37-N45 PolarHBondContact O-N 3.13Å; I37-N45 VanDerWaalsContact O-N 3.09Å; M43-N45 VanDerWaalsContact CE-O 3.29Å; M43-N45 WeakPolarHBondContact CE-O 3.31Å
46	T	39	Very low	39.5	Very low	72 Å²	72	69.4 Å²	69.4	44%	0.442	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.4	171	-58.5	0	0	0	0	108.5	I34 V35 Q36 M43	I34-T46 HydrophobicContact CG2-CG2 3.4Å; V35-T46 CarbonylContact O-C 3.27Å; V35-T46 WeakPolarHBondContact O-CA 3.31Å; Q36-T46 HydrophobicContact CG-CG2 3.94Å; M43-T46 WeakPolarHBondContact CE-OG1 3.36Å
47	S	43.2	Very low	39.3	Very low	34 Å²	34	76.9 Å²	76.9	24%	0.238	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	125	176.6	-68.5	0	0	0	0	110	I34 V35 F49	I34-S47 WeakPolarHBondContact CA-O 3.4Å; V35-S47 PolarHBondContact N-O 3.31Å; V35-S47 PolarHBondContact O-N 3.07Å; S47-F49 WeakPolarHBondContact O-CD2 3.26Å
48	I	40.7	Very low	39.4	Very low	124 Å²	124	77.7 Å²	77.7	64%	0.636	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	123.6	174.8	-56.8	176.4	0	0	0	107.6	I34	I34-I48 HydrophobicContact CD1-CG1 4.44Å; I34-I48 HydrophobicContact CG1-CG1 4.2Å; I34-I48 HydrophobicContact CG2-CG1 4.36Å
49	F	41.5	Very low	39.7	Very low	68 Å²	68	82.7 Å²	82.7	30%	0.298	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.9	176.5	-62	-79.8	0	0	0	108.7	P32 F33 V35 S47	P32-F49 CarbonylContact C-O 3.55Å; P32-F49 WeakPolarHBondContact CA-O 3.43Å; P32-F49 WeakPolarHBondContact CB-O 2.85Å; F33-F49 HydrophobicContact CD1-CB 4.28Å; F33-F49 HydrophobicContact CD2-CB 4.49Å; F33-F49 HydrophobicContact CD2-CD2 4.09Å; F33-F49 HydrophobicContact CE1-CB 3.93Å; F33-F49 HydrophobicContact CE2-CB 4.17Å; F33-F49 AromaticContact CE2-CD2 3.64Å; F33-F49 HydrophobicContact CE2-CD2 3.64Å; F33-F49 HydrophobicContact CE2-CE2 4.4Å; F33-F49 HydrophobicContact CE2-CG 4.13Å; F33-F49 HydrophobicContact CZ-CB 3.87Å; F33-F49 HydrophobicContact CZ-CD2 4.08Å; F33-F49 HydrophobicContact CZ-CG 4.09Å; F33-F49 PolarHBondContact N-O 3.17Å; F33-F49 VanDerWaalsContact N-O 3.09Å; F33-F49 PolarHBondContact O-N 3.17Å; V35-F49 HydrophobicContact CB-CE2 4.08Å; V35-F49 HydrophobicContact CG2-CD2 4.01Å; V35-F49 HydrophobicContact CG2-CE2 3.74Å; S47-F49 WeakPolarHBondContact O-CD2 3.26Å
50	N	42.1	Very low	40.1	Very low	81 Å²	81	81.6 Å²	81.6	43%	0.433	47%	0.472	S	S	.	.			trans	-133	116.8	174.9	-173.9	3.4	0	0	0	108.4	P32 T52	P32-N50 HydrophobicContact CB-CB 4.39Å; P32-N50 HydrophobicContact CG-CB 4.28Å; N50-T52 PolarHBondContact OD1-OG1 3.27Å
51	I	41.1	Very low	40.5	Very low	11 Å²	11	76.6 Å²	76.6	6%	0.056	45%	0.447	C	S	.	.			trans	-118.2	113.2	170	-70.9	172.7	0	0	0	106.6	C104	I51-C104 HydrophobicContact CD1-CB 4.26Å; I51-C104 HydrophobicContact CG1-CB 4.11Å
52	T	43.9	Very low	41.3	Very low	104 Å²	104	74.5 Å²	74.5	64%	0.638	42%	0.419	S	S	*	.			trans	-105.4	107.4	171.6	-45.1	0	0	0	0	106.6	N50 E54	N50-T52 PolarHBondContact OD1-OG1 3.27Å; T52-E54 PolarHBondContact O-N 2.95Å
53	P	38.9	Very low	42	Very low	22 Å²	22	72.7 Å²	72.7	14%	0.143	40%	0.403	C	S	.	.			trans	-61.3	134.4	170.3	24.5	-29.9	0	0	0	108.7	C30 D55 L58 E59	C30-P53 HydrophobicContact CB-CG 4.43Å; P53-D55 PolarHBondContact O-N 3.35Å; P53-L58 HydrophobicContact CB-CB 4.15Å; P53-L58 HydrophobicContact CB-CD1 4.45Å; P53-E59 HydrophobicContact CG-CG 4.45Å
54	E	39.5	Very low	42.3	Very low	130 Å²	130	69.4 Å²	69.4	61%	0.607	39%	0.387	S	S	*	.	S	Bend	trans	-61.8	-24.1	175	-76.9	-175.4	164.2	0	0	111.4	T52	T52-E54 PolarHBondContact O-N 2.95Å
55	D	41.7	Very low	42.7	Very low	68 Å²	68	65 Å²	65	36%	0.364	36%	0.364	S	S	.	.	S	Bend	trans	-113.3	112.8	175.2	-92.5	-38.6	0	0	0	111.3	P53 K57 L58	P53-D55 PolarHBondContact O-N 3.35Å; D55-K57 PolarHBondContact O-N 2.71Å; D55-L58 HydrophobicContact CB-CD1 4.29Å; D55-L58 WeakPolarHBondContact O-CB 3.06Å; D55-L58 PolarHBondContact O-N 3.31Å
56	G	38.8	Very low	43.1	Very low	56 Å²	56	62 Å²	62	58%	0.577	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-61.2	-7.7	177.2	0	0	0	0	0	115.3	L58	G56-L58 PolarHBondContact O-N 2.82Å
57	K	39.8	Very low	43.5	Very low	197 Å²	197	60.6 Å²	60.6	86%	0.857	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-70.4	-9.5	174	-68.5	-175.1	178.1	-179.8	0	113.7	D55	D55-K57 PolarHBondContact O-N 2.71Å
58	L	41.5	Very low	43.7	Very low	26 Å²	26	59.1 Å²	59.1	14%	0.136	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-100.8	-3.4	-173.4	-68.1	175.5	0	0	0	113.9	P53 D55 G56 G60 S61 W62 F117	P53-L58 HydrophobicContact CB-CB 4.15Å; P53-L58 HydrophobicContact CB-CD1 4.45Å; D55-L58 HydrophobicContact CB-CD1 4.29Å; D55-L58 WeakPolarHBondContact O-CB 3.06Å; D55-L58 PolarHBondContact O-N 3.31Å; G56-L58 PolarHBondContact O-N 2.82Å; L58-G60 PolarHBondContact O-N 3.42Å; L58-S61 PolarHBondContact O-N 2.03Å; L58-S61 PolarHBondContact O-OG 3.2Å; L58-W62 HydrophobicContact CD1-CZ2 3.96Å; L58-F117 HydrophobicContact CD1-CD1 4.3Å; L58-F117 HydrophobicContact CD1-CE1 3.71Å; L58-F117 HydrophobicContact CD1-CE2 4.04Å; L58-F117 HydrophobicContact CD1-CZ 3.59Å; L58-F117 HydrophobicContact CD2-CE2 4.35Å
59	E	43.7	Very low	44.2	Very low	113 Å²	113	55.6 Å²	55.6	53%	0.528	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-16.9	-175.8	-72.3	-172.2	163.5	0	0	114.8	P53	P53-E59 HydrophobicContact CG-CG 4.45Å
60	G	44	Very low	44.6	Very low	71 Å²	71	53.6 Å²	53.6	73%	0.732	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-9.7	179.4	0	0	0	0	0	116.4	L58	L58-G60 PolarHBondContact O-N 3.42Å
61	S	43.3	Very low	44.9	Very low	32 Å²	32	56.4 Å²	56.4	22%	0.224	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	2.8	-174.4	36.2	0	0	0	0	113.7	L58 F81 E82	L58-S61 PolarHBondContact O-N 2.03Å; L58-S61 PolarHBondContact O-OG 3.2Å; S61-F81 WeakPolarHBondContact O-CA 3.36Å; S61-E82 PolarHBondContact O-N 3.12Å
62	W	49.2	Very low	45.5	Very low	24 Å²	24	60 Å²	60	9%	0.091	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	118.6	-172.5	-68.7	54.6	0	0	0	109.1	C30 L58 N80 Y106 F117	C30-W62 WeakPolarHBondContact SG-CB 3.5Å; L58-W62 HydrophobicContact CD1-CZ2 3.96Å; W62-N80 WeakPolarHBondContact CA-O 3.27Å; W62-Y106 AromaticContact CH2-CD2 3.77Å; W62-Y106 HydrophobicContact CH2-CD2 3.77Å; W62-Y106 HydrophobicContact CH2-CE2 4.35Å; W62-Y106 AromaticContact CH2-CG 3.87Å; W62-Y106 HydrophobicContact CH2-CG 3.87Å; W62-Y106 AromaticContact CZ3-CD2 3.6Å; W62-Y106 HydrophobicContact CZ3-CD2 3.6Å; W62-Y106 AromaticContact CZ3-CE2 3.79Å; W62-Y106 HydrophobicContact CZ3-CE2 3.79Å; W62-Y106 HydrophobicContact CZ3-CG 4.15Å; W62-F117 HydrophobicContact CH2-CB 4.18Å; W62-F117 HydrophobicContact CZ2-CB 4.15Å; W62-F117 HydrophobicContact CZ2-CD1 4.45Å; W62-F117 HydrophobicContact CZ2-CG 4.13Å
63	K	49.2	Very low	45.4	Very low	55 Å²	55	56.7 Å²	56.7	24%	0.239	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130.7	166.8	-58.2	-174.1	-179.3	-162.6	0	108.1	N80	K63-N80 HydrophobicContact CB-CB 4.14Å; K63-N80 PolarHBondContact N-O 3.11Å; K63-N80 WeakPolarHBondContact O-CA 3.19Å; K63-N80 WeakPolarHBondContact O-CB 3.42Å; K63-N80 PolarHBondContact O-N 3.07Å
64	Q	48.7	Very low	45.8	Very low	3 Å²	3	59 Å²	59	1%	0.014	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	151.4	176.1	-61.4	178	25.2	0	0	108.7	A27 H77 H78	A27-Q64 CarbonylContact C-O 3.58Å; A27-Q64 HydrophobicContact CB-CB 4.33Å; A27-Q64 PolarHBondContact N-O 2.89Å; A27-Q64 PolarHBondContact O-N 3.15Å; Q64-H77 PolarHBondContact OE1-NE2 2.85Å; Q64-H78 CarbonylContact C-O 3.59Å; Q64-H78 VanDerWaalsContact CA-O 3.28Å; Q64-H78 WeakPolarHBondContact CA-O 3.46Å
65	Y	47.8	Very low	46.1	Very low	7 Å²	7	54.5 Å²	54.5	3%	0.027	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	158.8	163.3	63.8	-84.2	0	0	0	111	I25 H26 L67 H78 N80 Q127 Y134	I25-Y65 CarbonylContact O-C 3.51Å; I25-Y65 WeakPolarHBondContact O-CA 2.78Å; I25-Y65 VanDerWaalsContact O-CB 3.29Å; I25-Y65 WeakPolarHBondContact O-CB 3.41Å; H26-Y65 AromaticContact CE1-CD1 3.94Å; H26-Y65 AromaticContact CE1-CG 3.79Å; Y65-L67 HydrophobicContact CD2-CD2 4.03Å; Y65-L67 HydrophobicContact CD2-CG 4.19Å; Y65-L67 HydrophobicContact CE2-CD1 4.39Å; Y65-L67 HydrophobicContact CE2-CD2 4.14Å; Y65-L67 HydrophobicContact CE2-CG 4.1Å; Y65-H78 HydrophobicContact CD1-CB 3.51Å; Y65-H78 HydrophobicContact CD2-CB 3.69Å; Y65-H78 AromaticContact CD2-CD2 3.58Å; Y65-H78 AromaticContact CD2-CG 3.63Å; Y65-H78 HydrophobicContact CE1-CB 3.23Å; Y65-H78 AromaticContact CE1-CG 3.82Å; Y65-H78 HydrophobicContact CE2-CB 3.46Å; Y65-H78 VanDerWaalsContact CE2-CB 3.46Å; Y65-H78 AromaticContact CE2-CD2 3.28Å; Y65-H78 WeakPolarHBondContact CE2-CD2 3.43Å; Y65-H78 AromaticContact CE2-CE1 3.71Å; Y65-H78 AromaticContact CE2-CG 3.09Å; Y65-H78 AromaticContact CE2-ND1 3.35Å; Y65-H78 WeakPolarHBondContact CE2-ND1 3.43Å; Y65-H78 AromaticContact CE2-NE2 3.7Å; Y65-H78 HydrophobicContact CG-CB 3.71Å; Y65-H78 AromaticContact CZ-CD2 3.9Å; Y65-H78 AromaticContact CZ-CE1 3.99Å; Y65-H78 AromaticContact CZ-CG 3.18Å; Y65-H78 AromaticContact CZ-ND1 3.24Å; Y65-H78 PolarHBondContact N-O 3.13Å; Y65-H78 WeakPolarHBondContact O-CB 3.3Å; Y65-H78 PolarHBondContact O-N 3.29Å; Y65-H78 PolarHBondContact OH-ND1 2.86Å; Y65-N80 WeakPolarHBondContact CE1-ND2 3.27Å; Y65-N80 WeakPolarHBondContact CE1-OD1 3.37Å; Y65-Q127 PolarHBondContact OH-OE1 2.95Å; Y65-Y134 HydrophobicContact CE1-CE1 4.44Å
66	A	46.9	Very low	46.4	Very low	3 Å²	3	53.8 Å²	53.8	3%	0.025	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.9	174.8	0	0	0	0	0	109.5	P24 I25 V75 T76	P24-A66 CarbonylContact C-O 3.5Å; I25-A66 HydrophobicContact CB-CB 4.23Å; I25-A66 WeakPolarHBondContact CB-O 3.44Å; I25-A66 PolarHBondContact N-O 3.24Å; I25-A66 PolarHBondContact O-N 3.07Å; A66-V75 HydrophobicContact CB-CG1 3.83Å; A66-T76 CarbonylContact C-O 3.58Å; A66-T76 WeakPolarHBondContact CA-O 3.37Å
67	L	48.6	Very low	46.9	Very low	44 Å²	44	52.5 Å²	52.5	23%	0.23	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.4	171.7	-61.8	-176	0	0	0	108	I22 P24 Y65 V75 T76 H78	I22-L67 HydrophobicContact CG2-CB 3.81Å; I22-L67 HydrophobicContact CG2-CD1 4.43Å; I22-L67 HydrophobicContact CG2-CD2 3.99Å; I22-L67 HydrophobicContact CG2-CG 4.29Å; P24-L67 HydrophobicContact CB-CD2 3.56Å; Y65-L67 HydrophobicContact CD2-CD2 4.03Å; Y65-L67 HydrophobicContact CD2-CG 4.19Å; Y65-L67 HydrophobicContact CE2-CD1 4.39Å; Y65-L67 HydrophobicContact CE2-CD2 4.14Å; Y65-L67 HydrophobicContact CE2-CG 4.1Å; L67-V75 CarbonylContact O-C 3.21Å; L67-V75 WeakPolarHBondContact O-CA 3.2Å; L67-T76 PolarHBondContact N-O 2.75Å; L67-T76 PolarHBondContact O-N 3.03Å; L67-H78 VanDerWaalsContact CD1-NE2 3.26Å; L67-H78 WeakPolarHBondContact CD1-NE2 3.49Å; L67-H78 WeakPolarHBondContact CG-NE2 3.48Å
68	T	47.2	Very low	47.4	Very low	2 Å²	2	43.5 Å²	43.5	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.4	173.1	-53.2	0	0	0	0	109.9	I4 I22 I23 I37 N70 T74 V75	I4-T68 HydrophobicContact CD1-CG2 3.47Å; I4-T68 VanDerWaalsContact CD1-CG2 3.47Å; I22-T68 WeakPolarHBondContact CA-O 3.27Å; I23-T68 PolarHBondContact N-O 3.15Å; I23-T68 VanDerWaalsContact N-O 3.1Å; I23-T68 PolarHBondContact O-N 3.44Å; I37-T68 HydrophobicContact CD1-CG2 4.27Å; T68-N70 PolarHBondContact O-N 3.29Å; T68-T74 CarbonylContact C-O 3.56Å; T68-T74 WeakPolarHBondContact CA-O 3.48Å; T68-V75 HydrophobicContact CG2-CG2 4.11Å
69	N	51.1	Low	47.7	Very low	51 Å²	51	43 Å²	43	27%	0.273	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	110.6	168.4	177.8	-49.8	0	0	0	108.7	E71 T72 G73 T74	N69-E71 VanDerWaalsContact C-N 3.26Å; N69-E71 PolarHBondContact O-N 3.21Å; N69-E71 WeakPolarHBondContact OD1-CB 3.42Å; N69-E71 PolarHBondContact OD1-N 2.88Å; N69-T72 WeakPolarHBondContact CB-OG1 3.05Å; N69-T72 PolarHBondContact O-N 3.23Å; N69-T72 PolarHBondContact OD1-N 3Å; N69-T72 PolarHBondContact OD1-OG1 3.43Å; N69-G73 VanDerWaalsContact O-CA 3.3Å; N69-G73 WeakPolarHBondContact O-CA 3.47Å; N69-G73 PolarHBondContact O-N 3.33Å; N69-T74 PolarHBondContact N-O 3.2Å
70	N	49.2	Very low	47.9	Very low	26 Å²	26	38.2 Å²	38.2	14%	0.139	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-20.7	-174.9	-69.3	-20.6	0	0	0	113.8	N21 T68	N21-N70 HydrophobicContact CB-CB 4.33Å; N21-N70 WeakPolarHBondContact O-CB 3.38Å; N21-N70 PolarHBondContact O-N 3.11Å; T68-N70 PolarHBondContact O-N 3.29Å
71	E	47.8	Very low	48.1	Very low	140 Å²	140	35.8 Å²	35.8	65%	0.654	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-41.3	178.4	-63	177.8	173.5	0	0	111.6	N21 N69	N21-E71 HydrophobicContact CB-CG 4.06Å; N21-E71 PolarHBondContact ND2-OE1 3.3Å; N69-E71 VanDerWaalsContact C-N 3.26Å; N69-E71 PolarHBondContact O-N 3.21Å; N69-E71 WeakPolarHBondContact OD1-CB 3.42Å; N69-E71 PolarHBondContact OD1-N 2.88Å
72	T	53.6	Low	48.1	Very low	87 Å²	87	37.8 Å²	37.8	53%	0.534	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-16.7	-173.5	59.6	0	0	0	0	113.2	N69 T74	N69-T72 WeakPolarHBondContact CB-OG1 3.05Å; N69-T72 PolarHBondContact O-N 3.23Å; N69-T72 PolarHBondContact OD1-N 3Å; N69-T72 PolarHBondContact OD1-OG1 3.43Å; T72-T74 WeakPolarHBondContact CB-OG1 3.13Å; T72-T74 PolarHBondContact O-N 2.03Å; T72-T74 VanDerWaalsContact OG1-CB 3.28Å; T72-T74 WeakPolarHBondContact OG1-CB 3.37Å; T72-T74 PolarHBondContact OG1-N 3.32Å; T72-T74 PolarHBondContact OG1-OG1 2.97Å
73	G	43.6	Very low	47.7	Very low	34 Å²	34	37.5 Å²	37.5	35%	0.351	21%	0.207	S	C	.	.			trans	70.5	9.1	-167.6	0	0	0	0	0	113.6	N69	N69-G73 VanDerWaalsContact O-CA 3.3Å; N69-G73 WeakPolarHBondContact O-CA 3.47Å; N69-G73 PolarHBondContact O-N 3.33Å
74	T	46.2	Very low	47	Very low	70 Å²	70	43.9 Å²	43.9	43%	0.429	24%	0.243	S	C	.	.			trans	-71.5	132.2	-179.9	-52.5	0	0	0	0	110.1	T68 N69 T72	T68-T74 CarbonylContact C-O 3.56Å; T68-T74 WeakPolarHBondContact CA-O 3.48Å; N69-T74 PolarHBondContact N-O 3.2Å; T72-T74 WeakPolarHBondContact CB-OG1 3.13Å; T72-T74 PolarHBondContact O-N 2.03Å; T72-T74 VanDerWaalsContact OG1-CB 3.28Å; T72-T74 WeakPolarHBondContact OG1-CB 3.37Å; T72-T74 PolarHBondContact OG1-N 3.32Å; T72-T74 PolarHBondContact OG1-OG1 2.97Å
75	V	45.8	Very low	46.5	Very low	36 Å²	36	47.5 Å²	47.5	22%	0.218	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118.9	175.3	-177.3	0	0	0	0	108.7	I37 A66 L67 T68	I37-V75 HydrophobicContact CD1-CG2 3.98Å; A66-V75 HydrophobicContact CB-CG1 3.83Å; L67-V75 CarbonylContact O-C 3.21Å; L67-V75 WeakPolarHBondContact O-CA 3.2Å; T68-V75 HydrophobicContact CG2-CG2 4.11Å
76	T	49.1	Very low	45.8	Very low	52 Å²	52	48.6 Å²	48.6	32%	0.319	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.5	174.7	-53.7	0	0	0	0	109.2	A66 L67	A66-T76 CarbonylContact C-O 3.58Å; A66-T76 WeakPolarHBondContact CA-O 3.37Å; L67-T76 PolarHBondContact N-O 2.75Å; L67-T76 PolarHBondContact O-N 3.03Å
77	H	49.3	Very low	45	Very low	29 Å²	29	53.5 Å²	53.5	13%	0.134	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147.6	-177.3	-176.7	-103.5	0	0	0	111.7	Q64 C79	Q64-H77 PolarHBondContact OE1-NE2 2.85Å; H77-C79 PolarHBondContact CE1-SG 3.25Å
78	H	48.6	Very low	44.4	Very low	9 Å²	9	56.3 Å²	56.3	4%	0.042	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.2	-178.2	-60	-108	0	0	0	110	Q64 Y65 L67 V94	Q64-H78 CarbonylContact C-O 3.59Å; Q64-H78 VanDerWaalsContact CA-O 3.28Å; Q64-H78 WeakPolarHBondContact CA-O 3.46Å; Y65-H78 HydrophobicContact CD1-CB 3.51Å; Y65-H78 HydrophobicContact CD2-CB 3.69Å; Y65-H78 AromaticContact CD2-CD2 3.58Å; Y65-H78 AromaticContact CD2-CG 3.63Å; Y65-H78 HydrophobicContact CE1-CB 3.23Å; Y65-H78 AromaticContact CE1-CG 3.82Å; Y65-H78 HydrophobicContact CE2-CB 3.46Å; Y65-H78 VanDerWaalsContact CE2-CB 3.46Å; Y65-H78 AromaticContact CE2-CD2 3.28Å; Y65-H78 WeakPolarHBondContact CE2-CD2 3.43Å; Y65-H78 AromaticContact CE2-CE1 3.71Å; Y65-H78 AromaticContact CE2-CG 3.09Å; Y65-H78 AromaticContact CE2-ND1 3.35Å; Y65-H78 WeakPolarHBondContact CE2-ND1 3.43Å; Y65-H78 AromaticContact CE2-NE2 3.7Å; Y65-H78 HydrophobicContact CG-CB 3.71Å; Y65-H78 AromaticContact CZ-CD2 3.9Å; Y65-H78 AromaticContact CZ-CE1 3.99Å; Y65-H78 AromaticContact CZ-CG 3.18Å; Y65-H78 AromaticContact CZ-ND1 3.24Å; Y65-H78 PolarHBondContact N-O 3.13Å; Y65-H78 WeakPolarHBondContact O-CB 3.3Å; Y65-H78 PolarHBondContact O-N 3.29Å; Y65-H78 PolarHBondContact OH-ND1 2.86Å; L67-H78 VanDerWaalsContact CD1-NE2 3.26Å; L67-H78 WeakPolarHBondContact CD1-NE2 3.49Å; L67-H78 WeakPolarHBondContact CG-NE2 3.48Å; H78-V94 VanDerWaalsContact CE1-CG1 3.45Å; H78-V94 WeakPolarHBondContact CE1-CG1 3.03Å; H78-V94 VanDerWaalsContact ND1-CG1 3.3Å; H78-V94 WeakPolarHBondContact ND1-CG1 3.46Å; H78-V94 WeakPolarHBondContact ND1-CG2 3.36Å
79	C	48.1	Very low	43.7	Very low	16 Å²	16	57.2 Å²	57.2	11%	0.108	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	114.3	175.4	-76.9	0	0	0	0	109.6	H77 V93 Y106	H77-C79 PolarHBondContact CE1-SG 3.25Å; C79-V93 PolarHBondContact O-N 3.41Å; C79-Y106 PolarHBondContact SG-OH 2.77Å
80	N	48.5	Very low	43.2	Very low	12 Å²	12	58.9 Å²	58.9	6%	0.064	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	138.8	174.8	-56.1	-5.5	0	0	0	108.8	W62 K63 Y65 S92 Y134	W62-N80 WeakPolarHBondContact CA-O 3.27Å; K63-N80 HydrophobicContact CB-CB 4.14Å; K63-N80 PolarHBondContact N-O 3.11Å; K63-N80 WeakPolarHBondContact O-CA 3.19Å; K63-N80 WeakPolarHBondContact O-CB 3.42Å; K63-N80 PolarHBondContact O-N 3.07Å; Y65-N80 WeakPolarHBondContact CE1-ND2 3.27Å; Y65-N80 WeakPolarHBondContact CE1-OD1 3.37Å; N80-S92 VanDerWaalsContact CG-CB 3.42Å; N80-S92 PolarHBondContact ND2-OG 3.07Å; N80-S92 VanDerWaalsContact ND2-OG 3.11Å; N80-S92 WeakPolarHBondContact OD1-CB 3.25Å; N80-S92 PolarHBondContact OD1-OG 3.14Å; N80-Y134 PolarHBondContact ND2-OH 3.45Å
81	F	48.3	Very low	42.6	Very low	20 Å²	20	57.9 Å²	57.9	9%	0.088	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	133.7	171.2	43.3	-109.2	0	0	0	109.1	S61 T83 L91 V93 L115 L118	S61-F81 WeakPolarHBondContact O-CA 3.36Å; F81-T83 HydrophobicContact CD2-CG2 3.54Å; F81-T83 HydrophobicContact CE2-CG2 3.66Å; F81-T83 PolarHBondContact O-N 2.77Å; F81-L91 HydrophobicContact CD2-CB 4.45Å; F81-L91 WeakPolarHBondContact CD2-O 3.07Å; F81-L91 HydrophobicContact CE2-CB 3.94Å; F81-V93 HydrophobicContact CD1-CB 4.12Å; F81-V93 HydrophobicContact CD1-CG2 4.41Å; F81-V93 HydrophobicContact CE1-CB 3.24Å; F81-V93 HydrophobicContact CE1-CG1 4.1Å; F81-V93 HydrophobicContact CE1-CG2 3.22Å; F81-V93 HydrophobicContact CE2-CG2 4.15Å; F81-V93 HydrophobicContact CZ-CB 3.66Å; F81-V93 HydrophobicContact CZ-CG2 3.04Å; F81-L115 HydrophobicContact CE1-CD2 4.38Å; F81-L115 HydrophobicContact CE2-CD2 4.01Å; F81-L115 HydrophobicContact CZ-CD2 3.61Å; F81-L118 HydrophobicContact CE1-CD1 4.41Å; F81-L118 HydrophobicContact CE1-CD2 3.99Å; F81-L118 HydrophobicContact CE1-CG 4.48Å
82	E	44	Very low	42.2	Very low	74 Å²	74	51.3 Å²	51.3	35%	0.346	30%	0.304	S	S	.	.			trans	-79	111.3	167.6	-67.7	-173	165.5	0	0	107.9	S61 K90	S61-E82 PolarHBondContact O-N 3.12Å; E82-K90 HydrophobicContact CG-CD 4.37Å; E82-K90 WeakPolarHBondContact OE1-CE 3.35Å; E82-K90 IonicContact OE1-NZ 2.75Å; E82-K90 PolarHBondContact OE1-NZ 3.03Å
83	T	39.2	Very low	41.7	Very low	18 Å²	18	47.3 Å²	47.3	11%	0.11	28%	0.279	C	S	.	.			trans	-84	134.1	169.4	65.9	0	0	0	0	109.3	F81 T85 L91	F81-T83 HydrophobicContact CD2-CG2 3.54Å; F81-T83 HydrophobicContact CE2-CG2 3.66Å; F81-T83 PolarHBondContact O-N 2.77Å; T83-T85 PolarHBondContact O-N 3.21Å; T83-T85 VanDerWaalsContact O-N 3.07Å; T83-L91 HydrophobicContact CG2-CB 4.31Å; T83-L91 HydrophobicContact CG2-CD1 3.74Å; T83-L91 WeakPolarHBondContact OG1-CD1 3.04Å
84	L	35.3	Very low	41.6	Very low	188 Å²	188	46.2 Å²	46.2	98%	0.984	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	1.6	175.2	-74.6	159.9	0	0	0	114
85	T	37.5	Very low	41.3	Very low	79 Å²	79	43.1 Å²	43.1	49%	0.485	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	11.1	-163.1	47.8	0	0	0	0	115.7	T83	T83-T85 PolarHBondContact O-N 3.21Å; T83-T85 VanDerWaalsContact O-N 3.07Å
86	G	34.2	Very low	40.8	Very low	31 Å²	31	45.6 Å²	45.6	32%	0.32	27%	0.267	S	S	.	.			trans	-143.2	115.7	172.6	0	0	0	0	0	109.9	D88	G86-D88 PolarHBondContact O-N 3.09Å
87	S	30.5	Very low	40.4	Very low	105 Å²	105	47 Å²	47	73%	0.734	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.3	-172.6	44	0	0	0	0	113.8
88	D	36.1	Very low	39.6	Very low	103 Å²	103	54.7 Å²	54.7	55%	0.551	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.7	13.9	-168.9	-49.2	-69.7	0	0	0	114.5	G86 L161	G86-D88 PolarHBondContact O-N 3.09Å; D88-L161 HydrophobicContact CB-CD1 3.76Å; D88-L161 HydrophobicContact CB-CD2 3.88Å; D88-L161 HydrophobicContact CB-CG 4.29Å
89	C	30.9	Very low	38.5	Very low	22 Å²	22	61.1 Å²	61.1	15%	0.149	34%	0.338	C	S	.	.			trans	-140.1	117.1	178.6	-177.7	0	0	0	0	112.1	L91 C128 L161	C89-L91 PolarHBondContact O-N 2.9Å; C89-C128 WeakPolarHBondContact CB-SG 3.27Å; C89-C128 WeakPolarHBondContact SG-CA 3.48Å; C89-C128 WeakPolarHBondContact SG-CB 3.25Å; C89-C128 CovalentContact SG-SG 2.03Å; C89-C128 PolarHBondContact SG-SG 2.86Å; C89-L161 HydrophobicContact CB-CD2 3.97Å
90	K	40.5	Very low	37.7	Very low	86 Å²	86	65.3 Å²	65.3	37%	0.374	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	103.7	172.4	-62.5	-171.7	-178.5	-163.9	0	109.6	E82 S92 Q127 L129	E82-K90 HydrophobicContact CG-CD 4.37Å; E82-K90 WeakPolarHBondContact OE1-CE 3.35Å; E82-K90 IonicContact OE1-NZ 2.75Å; E82-K90 PolarHBondContact OE1-NZ 3.03Å; K90-S92 PolarHBondContact O-N 2.71Å; K90-Q127 VanDerWaalsContact O-O 3.12Å; K90-L129 HydrophobicContact CB-CB 4.3Å; K90-L129 PolarHBondContact O-N 3.14Å
91	L	36.5	Very low	36.6	Very low	4 Å²	4	70.4 Å²	70.4	2%	0.021	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	117.4	176.2	-70	151.3	0	0	0	111.3	F81 T83 C89 L126 L156	F81-L91 HydrophobicContact CD2-CB 4.45Å; F81-L91 WeakPolarHBondContact CD2-O 3.07Å; F81-L91 HydrophobicContact CE2-CB 3.94Å; T83-L91 HydrophobicContact CG2-CB 4.31Å; T83-L91 HydrophobicContact CG2-CD1 3.74Å; T83-L91 WeakPolarHBondContact OG1-CD1 3.04Å; C89-L91 PolarHBondContact O-N 2.9Å; L91-L126 HydrophobicContact CD2-CD2 4.09Å; L91-L156 HydrophobicContact CD1-CD1 3.38Å; L91-L156 HydrophobicContact CD1-CD2 3.34Å; L91-L156 HydrophobicContact CD1-CG 3.87Å; L91-L156 HydrophobicContact CD2-CD1 3.66Å; L91-L156 HydrophobicContact CD2-CD2 3.82Å; L91-L156 HydrophobicContact CD2-CG 3.87Å; L91-L156 HydrophobicContact CG-CD1 4.11Å; L91-L156 HydrophobicContact CG-CD2 3.91Å; L91-L156 HydrophobicContact CG-CG 4.4Å
92	S	40.2	Very low	35.8	Very low	2 Å²	2	72.3 Å²	72.3	1%	0.014	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.1	173.8	-60.9	0	0	0	0	109.1	N80 K90 T125 L126 Q127	N80-S92 VanDerWaalsContact CG-CB 3.42Å; N80-S92 PolarHBondContact ND2-OG 3.07Å; N80-S92 VanDerWaalsContact ND2-OG 3.11Å; N80-S92 WeakPolarHBondContact OD1-CB 3.25Å; N80-S92 PolarHBondContact OD1-OG 3.14Å; K90-S92 PolarHBondContact O-N 2.71Å; S92-T125 VanDerWaalsContact O-O 3.08Å; S92-L126 WeakPolarHBondContact O-CA 3.15Å; S92-Q127 PolarHBondContact N-O 3.45Å; S92-Q127 PolarHBondContact O-N 3.28Å
93	V	43.5	Very low	35.2	Very low	4 Å²	4	77.1 Å²	77.1	2%	0.024	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	114	174.4	157.6	0	0	0	0	110.2	C79 F81 G95 L118 Y124 T125 L126	C79-V93 PolarHBondContact O-N 3.41Å; F81-V93 HydrophobicContact CD1-CB 4.12Å; F81-V93 HydrophobicContact CD1-CG2 4.41Å; F81-V93 HydrophobicContact CE1-CB 3.24Å; F81-V93 HydrophobicContact CE1-CG1 4.1Å; F81-V93 HydrophobicContact CE1-CG2 3.22Å; F81-V93 HydrophobicContact CE2-CG2 4.15Å; F81-V93 HydrophobicContact CZ-CB 3.66Å; F81-V93 HydrophobicContact CZ-CG2 3.04Å; V93-G95 PolarHBondContact O-N 2.81Å; V93-L118 HydrophobicContact CB-CD2 4.37Å; V93-L118 HydrophobicContact CG1-CD2 3.66Å; V93-Y124 HydrophobicContact CB-CD1 4.43Å; V93-Y124 HydrophobicContact CG1-CD1 2.97Å; V93-Y124 HydrophobicContact CG1-CD2 4.21Å; V93-Y124 HydrophobicContact CG1-CE1 3.56Å; V93-Y124 HydrophobicContact CG1-CG 3.32Å; V93-T125 WeakPolarHBondContact CA-O 3.38Å; V93-L126 HydrophobicContact CG2-CD2 3.73Å
94	V	42.2	Very low	34.9	Very low	10 Å²	10	78.3 Å²	78.3	6%	0.061	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	112.8	178.3	-177.5	0	0	0	0	109.3	H78 Y124 T125 Q127	H78-V94 VanDerWaalsContact CE1-CG1 3.45Å; H78-V94 WeakPolarHBondContact CE1-CG1 3.03Å; H78-V94 VanDerWaalsContact ND1-CG1 3.3Å; H78-V94 WeakPolarHBondContact ND1-CG1 3.46Å; H78-V94 WeakPolarHBondContact ND1-CG2 3.36Å; V94-Y124 WeakPolarHBondContact O-CA 3.05Å; V94-T125 PolarHBondContact N-O 3.25Å; V94-T125 PolarHBondContact O-N 2.93Å; V94-Q127 HydrophobicContact CG2-CG 4.18Å
95	G	38.7	Very low	34.8	Very low	6 Å²	6	74.5 Å²	74.5	6%	0.062	44%	0.444	C	S	.	.			trans	-102.8	121.2	167.1	0	0	0	0	0	110.2	V93 Y97	V93-G95 PolarHBondContact O-N 2.81Å; G95-Y97 WeakPolarHBondContact O-CD2 3.27Å
96	S	36.5	Very low	34.9	Very low	87 Å²	87	72.4 Å²	72.4	61%	0.608	43%	0.428	S	S	*	.			trans	-86.2	121.4	174.8	-30.6	0	0	0	0	109.9
97	Y	39.6	Very low	34.9	Very low	81 Å²	81	78.1 Å²	78.1	32%	0.318	44%	0.444	S	S	.	.			trans	-122.7	132.6	176.9	-56.2	-75	0	0	0	111.2	G95 K119	G95-Y97 WeakPolarHBondContact O-CD2 3.27Å; Y97-K119 HydrophobicContact CE1-CD 4.33Å
98	Q	32.2	Very low	35.1	Very low	191 Å²	191	79.3 Å²	79.3	89%	0.893	43%	0.432	S	S	*	.			trans	-87	133.3	175.3	-70.6	-173.6	-17.5	0	0	111.2	S100	Q98-S100 PolarHBondContact O-N 3.48Å
99	N	27.2	Very low	35.4	Very low	145 Å²	145	75.9 Å²	75.9	78%	0.775	42%	0.421	S	S	*	.	S	Bend	trans	-35.5	114.8	-179.9	-103.8	-22.1	0	0	0	115.6
100	S	29.5	Very low	35.9	Very low	103 Å²	103	82.7 Å²	82.7	72%	0.72	45%	0.454	S	S	*	.	S	Bend	trans	-171.9	78.7	151.6	44.3	0	0	0	0	111.3	Q98 G102	Q98-S100 PolarHBondContact O-N 3.48Å; S100-G102 WeakPolarHBondContact O-CA 3.23Å; S100-G102 PolarHBondContact O-N 3.47Å
101	A	26.8	Very low	36.1	Very low	120 Å²	120	80.1 Å²	80.1	99%	0.992	45%	0.452	S	S	*	.			trans	40.5	32.6	159.2	0	0	0	0	0	117.7
102	G	30.5	Very low	36.3	Very low	59 Å²	59	87.3 Å²	87.3	61%	0.608	49%	0.491	S	S	*	.			trans	-102.8	122	-162.9	0	0	0	0	0	111.4	S100 C104	S100-G102 WeakPolarHBondContact O-CA 3.23Å; S100-G102 PolarHBondContact O-N 3.47Å; G102-C104 PolarHBondContact O-N 2.91Å
103	R	30.8	Very low	36.4	Very low	175 Å²	175	89.3 Å²	89.3	66%	0.66	51%	0.505	S	S	*	.			trans	-55.3	120.2	167.4	-80.3	176.1	167.9	-174.2	-8.8	109.6	T105 I297	R103-T105 PolarHBondContact O-N 3Å; R103-I297 VanDerWaalsContact NH2-CG1 3.31Å
104	C	34.3	Very low	36.4	Very low	44 Å²	44	91 Å²	91	30%	0.297	52%	0.516	S	S	.	.			trans	-72.1	109.7	164.5	-68.2	0	0	0	0	107.9	I51 G102 Y106	I51-C104 HydrophobicContact CD1-CB 4.26Å; I51-C104 HydrophobicContact CG1-CB 4.11Å; G102-C104 PolarHBondContact O-N 2.91Å; C104-Y106 HydrophobicContact CB-CD2 4.48Å; C104-Y106 HydrophobicContact CB-CE2 3.93Å
105	T	32.4	Very low	36.6	Very low	108 Å²	108	90.9 Å²	90.9	66%	0.663	52%	0.516	S	S	*	.			trans	-108.7	107.3	171.8	16.9	0	0	0	0	107.7	R103	R103-T105 PolarHBondContact O-N 3Å
106	Y	38.9	Very low	37	Very low	35 Å²	35	91 Å²	91	14%	0.137	51%	0.514	C	S	.	.			trans	-93.5	119	173	-64.8	-73.4	0	0	0	108.1	W62 C79 C104 F117	W62-Y106 AromaticContact CH2-CD2 3.77Å; W62-Y106 HydrophobicContact CH2-CD2 3.77Å; W62-Y106 HydrophobicContact CH2-CE2 4.35Å; W62-Y106 AromaticContact CH2-CG 3.87Å; W62-Y106 HydrophobicContact CH2-CG 3.87Å; W62-Y106 AromaticContact CZ3-CD2 3.6Å; W62-Y106 HydrophobicContact CZ3-CD2 3.6Å; W62-Y106 AromaticContact CZ3-CE2 3.79Å; W62-Y106 HydrophobicContact CZ3-CE2 3.79Å; W62-Y106 HydrophobicContact CZ3-CG 4.15Å; C79-Y106 PolarHBondContact SG-OH 2.77Å; C104-Y106 HydrophobicContact CB-CD2 4.48Å; C104-Y106 HydrophobicContact CB-CE2 3.93Å; Y106-F117 WeakPolarHBondContact CD1-O 3.28Å
107	K	34.6	Very low	37.4	Very low	151 Å²	151	88.2 Å²	88.2	66%	0.657	49%	0.492	S	S	*	.			trans	-101.1	139.4	174	-73.7	-172.4	174.7	-176.1	0	109.4	G109	K107-G109 PolarHBondContact O-N 3.27Å
108	R	36.2	Very low	37.9	Very low	130 Å²	130	85.7 Å²	85.7	49%	0.491	48%	0.483	S	S	.	.			trans	-66.3	114.7	172.9	-172.4	173.4	177.2	-177.3	-2.1	109.8	G111 D112 F117	R108-G111 PolarHBondContact NE-O 3.11Å; R108-G111 PolarHBondContact NH2-O 3.02Å; R108-D112 IonicContact NH2-OD1 3.02Å; R108-D112 PolarHBondContact NH2-OD1 2.82Å; R108-F117 HydrophobicContact CB-CD1 4.35Å; R108-F117 HydrophobicContact CB-CE1 3.62Å; R108-F117 HydrophobicContact CB-CZ 4.05Å; R108-F117 HydrophobicContact CG-CE1 3.97Å; R108-F117 HydrophobicContact CG-CZ 3.88Å
109	G	41.7	Very low	38.6	Very low	31 Å²	31	82.1 Å²	82.1	32%	0.32	47%	0.465	S	S	.	.			trans	-68.8	169.4	164.9	0	0	0	0	0	112.5	K107 G111 N116	K107-G109 PolarHBondContact O-N 3.27Å; G109-G111 PolarHBondContact O-N 3.42Å; G109-N116 PolarHBondContact N-O 2.72Å
110	I	40.3	Very low	39.7	Very low	164 Å²	164	77.7 Å²	77.7	84%	0.841	45%	0.445	S	S	*	.	S	Bend	trans	-67	121.6	179.3	-59.1	171	0	0	0	109.8	N116 R149	I110-N116 PolarHBondContact O-ND2 3.04Å; I110-R149 PolarHBondContact O-NH1 3.21Å
111	G	45.3	Very low	40.7	Very low	32 Å²	32	78.3 Å²	78.3	33%	0.33	44%	0.441	S	S	.	.	S	Bend	trans	127	179.9	173.9	0	0	0	0	0	115	R108 G109 N116	R108-G111 PolarHBondContact NE-O 3.11Å; R108-G111 PolarHBondContact NH2-O 3.02Å; G109-G111 PolarHBondContact O-N 3.42Å; G111-N116 WeakPolarHBondContact CA-ND2 3.45Å; G111-N116 PolarHBondContact N-ND2 3.21Å; G111-N116 PolarHBondContact O-ND2 3.24Å
112	D	40.3	Very low	41.7	Very low	156 Å²	156	73.4 Å²	73.4	83%	0.834	40%	0.399	S	S	*	.	S	Bend	trans	-101.3	6.6	-174.9	-65.4	-35.4	0	0	0	114.6	R108	R108-D112 IonicContact NH2-OD1 3.02Å; R108-D112 PolarHBondContact NH2-OD1 2.82Å
113	S	43.9	Very low	42.5	Very low	44 Å²	44	74.1 Å²	74.1	31%	0.308	40%	0.395	S	S	.	.			trans	-84.4	140	177.5	-178.9	0	0	0	0	111.9	L115 N116	S113-L115 PolarHBondContact O-N 2.89Å; S113-L115 WeakPolarHBondContact OG-CB 3.45Å; S113-L115 WeakPolarHBondContact OG-CD1 3.5Å; S113-L115 VanDerWaalsContact OG-CG 3.31Å; S113-L115 WeakPolarHBondContact OG-CG 3.46Å; S113-L115 PolarHBondContact OG-N 2.82Å; S113-L115 VanDerWaalsContact OG-N 3.13Å; S113-N116 WeakPolarHBondContact O-CB 3.46Å; S113-N116 PolarHBondContact O-N 3.3Å; S113-N116 PolarHBondContact O-ND2 3.02Å
114	S	43.2	Very low	43.3	Very low	39 Å²	39	66.3 Å²	66.3	27%	0.273	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-61.7	-18	168.5	51.1	0	0	0	0	112.8	N116 F117	S114-N116 PolarHBondContact O-N 3.35Å; S114-F117 VanDerWaalsContact O-CD2 3.28Å; S114-F117 WeakPolarHBondContact O-CD2 3.29Å; S114-F117 PolarHBondContact O-N 2.74Å
115	L	46.7	Very low	43.9	Very low	8 Å²	8	65.8 Å²	65.8	4%	0.042	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-68.7	-18.5	173.5	-55.7	169.1	0	0	0	112.4	F81 S113 F117 L118 F152	F81-L115 HydrophobicContact CE1-CD2 4.38Å; F81-L115 HydrophobicContact CE2-CD2 4.01Å; F81-L115 HydrophobicContact CZ-CD2 3.61Å; S113-L115 PolarHBondContact O-N 2.89Å; S113-L115 WeakPolarHBondContact OG-CB 3.45Å; S113-L115 WeakPolarHBondContact OG-CD1 3.5Å; S113-L115 VanDerWaalsContact OG-CG 3.31Å; S113-L115 WeakPolarHBondContact OG-CG 3.46Å; S113-L115 PolarHBondContact OG-N 2.82Å; S113-L115 VanDerWaalsContact OG-N 3.13Å; L115-F117 PolarHBondContact O-N 2.82Å; L115-F117 VanDerWaalsContact O-N 3.11Å; L115-L118 HydrophobicContact CB-CD1 4.4Å; L115-L118 HydrophobicContact CD2-CD1 3.98Å; L115-L118 VanDerWaalsContact O-CB 3.31Å; L115-L118 WeakPolarHBondContact O-CB 3.45Å; L115-L118 WeakPolarHBondContact O-CG 3.3Å; L115-L118 PolarHBondContact O-N 3.41Å; L115-F152 HydrophobicContact CD1-CD1 3.25Å; L115-F152 HydrophobicContact CD1-CE1 3.18Å; L115-F152 HydrophobicContact CD1-CE2 4.49Å; L115-F152 HydrophobicContact CD1-CG 4.02Å; L115-F152 HydrophobicContact CD1-CZ 3.86Å; L115-F152 HydrophobicContact CD2-CD1 4.35Å; L115-F152 HydrophobicContact CD2-CE1 3.5Å; L115-F152 HydrophobicContact CD2-CE2 4.03Å; L115-F152 HydrophobicContact CD2-CZ 3.31Å; L115-F152 HydrophobicContact CG-CD1 4.4Å; L115-F152 HydrophobicContact CG-CE1 3.91Å; L115-F152 HydrophobicContact CG-CZ 4.2Å
116	N	45.7	Very low	44.3	Very low	7 Å²	7	61 Å²	61	4%	0.037	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-66.5	-9.9	175.8	-68.7	-23.7	0	0	0	113.5	G109 I110 G111 S113 S114 R149	G109-N116 PolarHBondContact N-O 2.72Å; I110-N116 PolarHBondContact O-ND2 3.04Å; G111-N116 WeakPolarHBondContact CA-ND2 3.45Å; G111-N116 PolarHBondContact N-ND2 3.21Å; G111-N116 PolarHBondContact O-ND2 3.24Å; S113-N116 WeakPolarHBondContact O-CB 3.46Å; S113-N116 PolarHBondContact O-N 3.3Å; S113-N116 PolarHBondContact O-ND2 3.02Å; S114-N116 PolarHBondContact O-N 3.35Å; N116-R149 PolarHBondContact OD1-NH1 3.22Å; N116-R149 PolarHBondContact OD1-NH2 3.46Å
117	F	45.4	Very low	44.5	Very low	29 Å²	29	60.9 Å²	60.9	13%	0.127	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-89.3	-3.4	173.4	-61.4	-76.3	0	0	0	112.5	L58 W62 Y106 R108 S114 L115	L58-F117 HydrophobicContact CD1-CD1 4.3Å; L58-F117 HydrophobicContact CD1-CE1 3.71Å; L58-F117 HydrophobicContact CD1-CE2 4.04Å; L58-F117 HydrophobicContact CD1-CZ 3.59Å; L58-F117 HydrophobicContact CD2-CE2 4.35Å; W62-F117 HydrophobicContact CH2-CB 4.18Å; W62-F117 HydrophobicContact CZ2-CB 4.15Å; W62-F117 HydrophobicContact CZ2-CD1 4.45Å; W62-F117 HydrophobicContact CZ2-CG 4.13Å; Y106-F117 WeakPolarHBondContact CD1-O 3.28Å; R108-F117 HydrophobicContact CB-CD1 4.35Å; R108-F117 HydrophobicContact CB-CE1 3.62Å; R108-F117 HydrophobicContact CB-CZ 4.05Å; R108-F117 HydrophobicContact CG-CE1 3.97Å; R108-F117 HydrophobicContact CG-CZ 3.88Å; S114-F117 VanDerWaalsContact O-CD2 3.28Å; S114-F117 WeakPolarHBondContact O-CD2 3.29Å; S114-F117 PolarHBondContact O-N 2.74Å; L115-F117 PolarHBondContact O-N 2.82Å; L115-F117 VanDerWaalsContact O-N 3.11Å
118	L	49.9	Very low	44.7	Very low	28 Å²	28	54.3 Å²	54.3	15%	0.147	31%	0.305	C	S	.	.	S	Bend	trans	-73.2	139.7	177.1	-66.4	-179.6	0	0	0	111.7	F81 V93 L115 S120 Y124	F81-L118 HydrophobicContact CE1-CD1 4.41Å; F81-L118 HydrophobicContact CE1-CD2 3.99Å; F81-L118 HydrophobicContact CE1-CG 4.48Å; V93-L118 HydrophobicContact CB-CD2 4.37Å; V93-L118 HydrophobicContact CG1-CD2 3.66Å; L115-L118 HydrophobicContact CB-CD1 4.4Å; L115-L118 HydrophobicContact CD2-CD1 3.98Å; L115-L118 VanDerWaalsContact O-CB 3.31Å; L115-L118 WeakPolarHBondContact O-CB 3.45Å; L115-L118 WeakPolarHBondContact O-CG 3.3Å; L115-L118 PolarHBondContact O-N 3.41Å; L118-S120 PolarHBondContact O-N 3.3Å; L118-Y124 HydrophobicContact CB-CE2 3.76Å; L118-Y124 HydrophobicContact CD1-CD2 4.01Å; L118-Y124 HydrophobicContact CD1-CE2 3.9Å; L118-Y124 HydrophobicContact CD2-CE1 4.01Å; L118-Y124 HydrophobicContact CD2-CE2 4.07Å; L118-Y124 HydrophobicContact CG-CE2 4.12Å
119	K	47.4	Very low	44.9	Very low	117 Å²	117	51 Å²	51	51%	0.509	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-66.2	129.7	173	-172.5	-174.2	171	-170.3	0	108.7	Y97 S122 Y124	Y97-K119 HydrophobicContact CE1-CD 4.33Å; K119-S122 PolarHBondContact O-OG 3.15Å; K119-Y124 WeakPolarHBondContact CA-OH 2.99Å; K119-Y124 WeakPolarHBondContact CB-OH 3.33Å; K119-Y124 PolarHBondContact N-OH 3.33Å; K119-Y124 PolarHBondContact O-OH 2.96Å
120	S	49.5	Very low	44.7	Very low	52 Å²	52	51.8 Å²	51.8	36%	0.364	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	154.1	172.8	59.6	0	0	0	0	111.3	L118 S122	L118-S120 PolarHBondContact O-N 3.3Å; S120-S122 PolarHBondContact O-N 3.28Å; S120-S122 PolarHBondContact O-OG 3.07Å
121	D	51.6	Low	44.5	Very low	116 Å²	116	52 Å²	52	62%	0.62	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	33.1	171.4	-42.9	-50.8	0	0	0	113.2	H142	D121-H142 PolarHBondContact N-O 2.78Å
122	S	47.9	Very low	43.8	Very low	17 Å²	17	56 Å²	56	12%	0.119	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	143.2	179.5	-58.5	0	0	0	0	110.2	K119 S120 H142	K119-S122 PolarHBondContact O-OG 3.15Å; S120-S122 PolarHBondContact O-N 3.28Å; S120-S122 PolarHBondContact O-OG 3.07Å; S122-H142 PolarHBondContact O-N 2.79Å; S122-H142 VanDerWaalsContact O-N 3.14Å
123	S	46.7	Very low	43.5	Very low	73 Å²	73	49.7 Å²	49.7	51%	0.51	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	137.7	171.9	65.3	0	0	0	0	109.9
124	Y	48.1	Very low	43.4	Very low	11 Å²	11	51 Å²	51	4%	0.043	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.4	179.2	-64.4	-57.4	0	0	0	111	V93 V94 L118 K119 S139 I140 H142	V93-Y124 HydrophobicContact CB-CD1 4.43Å; V93-Y124 HydrophobicContact CG1-CD1 2.97Å; V93-Y124 HydrophobicContact CG1-CD2 4.21Å; V93-Y124 HydrophobicContact CG1-CE1 3.56Å; V93-Y124 HydrophobicContact CG1-CG 3.32Å; V94-Y124 WeakPolarHBondContact O-CA 3.05Å; L118-Y124 HydrophobicContact CB-CE2 3.76Å; L118-Y124 HydrophobicContact CD1-CD2 4.01Å; L118-Y124 HydrophobicContact CD1-CE2 3.9Å; L118-Y124 HydrophobicContact CD2-CE1 4.01Å; L118-Y124 HydrophobicContact CD2-CE2 4.07Å; L118-Y124 HydrophobicContact CG-CE2 4.12Å; K119-Y124 WeakPolarHBondContact CA-OH 2.99Å; K119-Y124 WeakPolarHBondContact CB-OH 3.33Å; K119-Y124 PolarHBondContact N-OH 3.33Å; K119-Y124 PolarHBondContact O-OH 2.96Å; Y124-S139 WeakPolarHBondContact O-CA 3.35Å; Y124-I140 PolarHBondContact N-O 2.97Å; Y124-I140 PolarHBondContact O-N 3.43Å; Y124-H142 HydrophobicContact CD2-CB 3.57Å; Y124-H142 HydrophobicContact CE2-CB 3.48Å; Y124-H142 VanDerWaalsContact CE2-CB 3.48Å; Y124-H142 AromaticContact CE2-CG 3.98Å
125	T	45.6	Very low	43.2	Very low	33 Å²	33	52.4 Å²	52.4	20%	0.202	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	125.5	166.6	-50.3	0	0	0	0	108.4	S92 V93 V94 Q127 E136	S92-T125 VanDerWaalsContact O-O 3.08Å; V93-T125 WeakPolarHBondContact CA-O 3.38Å; V94-T125 PolarHBondContact N-O 3.25Å; V94-T125 PolarHBondContact O-N 2.93Å; T125-Q127 HydrophobicContact CG2-CG 4.24Å; T125-E136 HydrophobicContact CG2-CB 4.41Å; T125-E136 HydrophobicContact CG2-CG 3.52Å; T125-E136 WeakPolarHBondContact CG2-OE1 3.41Å
126	L	42.1	Very low	43.1	Very low	7 Å²	7	57.5 Å²	57.5	4%	0.037	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	122.3	172.6	-67.1	165.6	0	0	0	108.5	L91 S92 V93 V137 S138 I140 F152	L91-L126 HydrophobicContact CD2-CD2 4.09Å; S92-L126 WeakPolarHBondContact O-CA 3.15Å; V93-L126 HydrophobicContact CG2-CD2 3.73Å; L126-V137 HydrophobicContact CB-CB 4.47Å; L126-V137 PolarHBondContact O-N 3.46Å; L126-S138 WeakPolarHBondContact CB-O 3.26Å; L126-S138 PolarHBondContact N-O 3.5Å; L126-I140 HydrophobicContact CD1-CD1 3.46Å; L126-I140 VanDerWaalsContact CD1-CD1 3.46Å; L126-I140 HydrophobicContact CD1-CG1 3.97Å; L126-F152 HydrophobicContact CD1-CE2 4.04Å; L126-F152 HydrophobicContact CD2-CE2 3.82Å; L126-F152 HydrophobicContact CD2-CZ 3.89Å; L126-F152 HydrophobicContact CG-CE2 4.46Å
127	Q	43	Very low	43	Very low	33 Å²	33	60.3 Å²	60.3	15%	0.154	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.7	173.1	-57.5	-179.2	-32.6	0	0	109.4	Y65 K90 S92 V94 T125 Y134 T135	Y65-Q127 PolarHBondContact OH-OE1 2.95Å; K90-Q127 VanDerWaalsContact O-O 3.12Å; S92-Q127 PolarHBondContact N-O 3.45Å; S92-Q127 PolarHBondContact O-N 3.28Å; V94-Q127 HydrophobicContact CG2-CG 4.18Å; T125-Q127 HydrophobicContact CG2-CG 4.24Å; Q127-Y134 HydrophobicContact CB-CD1 4.01Å; Q127-T135 CarbonylContact C-O 3.58Å; Q127-T135 VanDerWaalsContact CA-O 3.3Å; Q127-T135 WeakPolarHBondContact CA-O 3.29Å
128	C	39.4	Very low	42.9	Very low	14 Å²	14	61 Å²	61	10%	0.095	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.8	167.7	-164.2	0	0	0	0	108	C89 Y134 T135 V137	C89-C128 WeakPolarHBondContact CB-SG 3.27Å; C89-C128 WeakPolarHBondContact SG-CA 3.48Å; C89-C128 WeakPolarHBondContact SG-CB 3.25Å; C89-C128 CovalentContact SG-SG 2.03Å; C89-C128 PolarHBondContact SG-SG 2.86Å; C128-Y134 CarbonylContact O-C 3.58Å; C128-Y134 WeakPolarHBondContact O-CA 3.2Å; C128-T135 PolarHBondContact N-O 2.86Å; C128-T135 PolarHBondContact O-N 2.73Å; C128-V137 HydrophobicContact CB-CG2 3.53Å
129	L	39.6	Very low	42.5	Very low	60 Å²	60	63.8 Å²	63.8	31%	0.314	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	110	166.2	-178.5	65.6	0	0	0	108.4	K90 G133 Y134	K90-L129 HydrophobicContact CB-CB 4.3Å; K90-L129 PolarHBondContact O-N 3.14Å; L129-G133 WeakPolarHBondContact CA-O 3.34Å; L129-Y134 HydrophobicContact CB-CD1 4.28Å; L129-Y134 HydrophobicContact CB-CE1 4.1Å; L129-Y134 HydrophobicContact CD1-CD1 4.27Å; L129-Y134 HydrophobicContact CD1-CD2 4.07Å; L129-Y134 HydrophobicContact CD1-CE1 4.14Å; L129-Y134 HydrophobicContact CD1-CE2 3.92Å; L129-Y134 HydrophobicContact CD1-CG 4.23Å
130	D	37.7	Very low	42.4	Very low	47 Å²	47	60.3 Å²	60.3	25%	0.251	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	-174.5	170.3	64.9	35.9	0	0	0	110.3	S132 G133 T135	D130-S132 PolarHBondContact O-N 3Å; D130-S132 VanDerWaalsContact O-N 3.15Å; D130-S132 VanDerWaalsContact OD1-CA 3.27Å; D130-S132 WeakPolarHBondContact OD1-CA 3Å; D130-S132 WeakPolarHBondContact OD1-CB 3.37Å; D130-S132 PolarHBondContact OD1-N 3.44Å; D130-G133 PolarHBondContact N-O 3.02Å; D130-G133 PolarHBondContact O-N 3.03Å; D130-G133 PolarHBondContact OD1-N 2.85Å; D130-T135 PolarHBondContact OD2-OG1 3.05Å
131	Q	34.9	Very low	42.3	Very low	170 Å²	170	63 Å²	63	79%	0.794	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.2	179.7	-55.9	179	3.1	0	0	113.5
132	S	31.2	Very low	41.9	Very low	114 Å²	114	59 Å²	59	80%	0.797	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-6.6	177.7	-51.9	0	0	0	0	113.2	D130	D130-S132 PolarHBondContact O-N 3Å; D130-S132 VanDerWaalsContact O-N 3.15Å; D130-S132 VanDerWaalsContact OD1-CA 3.27Å; D130-S132 WeakPolarHBondContact OD1-CA 3Å; D130-S132 WeakPolarHBondContact OD1-CB 3.37Å; D130-S132 PolarHBondContact OD1-N 3.44Å
133	G	34.3	Very low	41.8	Very low	25 Å²	25	61.8 Å²	61.8	26%	0.258	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	113.2	-154.8	-178.9	0	0	0	0	0	113.2	L129 D130 T135	L129-G133 WeakPolarHBondContact CA-O 3.34Å; D130-G133 PolarHBondContact N-O 3.02Å; D130-G133 PolarHBondContact O-N 3.03Å; D130-G133 PolarHBondContact OD1-N 2.85Å; G133-T135 PolarHBondContact O-N 2.78Å
134	Y	42.4	Very low	41.7	Very low	70 Å²	70	63.4 Å²	63.4	28%	0.275	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	113.6	179.5	-68.9	-85.7	0	0	0	110.5	H26 Y65 N80 Q127 C128 L129	H26-Y134 AromaticContact CE1-CE2 3.94Å; H26-Y134 PolarHBondContact CE1-OH 3.3Å; Y65-Y134 HydrophobicContact CE1-CE1 4.44Å; N80-Y134 PolarHBondContact ND2-OH 3.45Å; Q127-Y134 HydrophobicContact CB-CD1 4.01Å; C128-Y134 CarbonylContact O-C 3.58Å; C128-Y134 WeakPolarHBondContact O-CA 3.2Å; L129-Y134 HydrophobicContact CB-CD1 4.28Å; L129-Y134 HydrophobicContact CB-CE1 4.1Å; L129-Y134 HydrophobicContact CD1-CD1 4.27Å; L129-Y134 HydrophobicContact CD1-CD2 4.07Å; L129-Y134 HydrophobicContact CD1-CE1 4.14Å; L129-Y134 HydrophobicContact CD1-CE2 3.92Å; L129-Y134 HydrophobicContact CD1-CG 4.23Å
135	T	38.4	Very low	41.5	Very low	69 Å²	69	65.2 Å²	65.2	42%	0.423	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121.5	172.5	-56.9	0	0	0	0	108.8	Q127 C128 D130 G133 V137	Q127-T135 CarbonylContact C-O 3.58Å; Q127-T135 VanDerWaalsContact CA-O 3.3Å; Q127-T135 WeakPolarHBondContact CA-O 3.29Å; C128-T135 PolarHBondContact N-O 2.86Å; C128-T135 PolarHBondContact O-N 2.73Å; D130-T135 PolarHBondContact OD2-OG1 3.05Å; G133-T135 PolarHBondContact O-N 2.78Å; T135-V137 PolarHBondContact O-N 3.29Å
136	E	45.4	Very low	41.4	Very low	115 Å²	115	67.6 Å²	67.6	54%	0.537	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	120.4	172.9	178.8	170.6	170.7	0	0	109.8	T125	T125-E136 HydrophobicContact CG2-CB 4.41Å; T125-E136 HydrophobicContact CG2-CG 3.52Å; T125-E136 WeakPolarHBondContact CG2-OE1 3.41Å
137	V	42	Very low	41.3	Very low	66 Å²	66	72.7 Å²	72.7	40%	0.4	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-39.6	-178.5	-173	0	0	0	0	110.5	L126 C128 T135	L126-V137 HydrophobicContact CB-CB 4.47Å; L126-V137 PolarHBondContact O-N 3.46Å; C128-V137 HydrophobicContact CB-CG2 3.53Å; T135-V137 PolarHBondContact O-N 3.29Å
138	S	43.7	Very low	41.2	Very low	44 Å²	44	75 Å²	75	31%	0.308	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	153.5	-175.6	-176.9	0	0	0	0	111.5	L126	L126-S138 WeakPolarHBondContact CB-O 3.26Å; L126-S138 PolarHBondContact N-O 3.5Å
139	S	41.5	Very low	41.1	Very low	86 Å²	86	79 Å²	79	60%	0.601	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	125.3	165	29.5	0	0	0	0	109.5	Y124	Y124-S139 WeakPolarHBondContact O-CA 3.35Å
140	I	46.4	Very low	40.7	Very low	44 Å²	44	81 Å²	81	23%	0.226	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.3	-177.1	-54.3	-176.5	0	0	0	109.7	Y124 L126 F152	Y124-I140 PolarHBondContact N-O 2.97Å; Y124-I140 PolarHBondContact O-N 3.43Å; L126-I140 HydrophobicContact CD1-CD1 3.46Å; L126-I140 VanDerWaalsContact CD1-CD1 3.46Å; L126-I140 HydrophobicContact CD1-CG1 3.97Å; I140-F152 HydrophobicContact CD1-CD2 3.98Å; I140-F152 HydrophobicContact CD1-CE2 4.49Å
141	L	45.6	Very low	40.7	Very low	109 Å²	109	83.1 Å²	83.1	57%	0.571	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	117.1	169.1	-165	82.9	0	0	0	108.7	N143 Q148	L141-N143 PolarHBondContact O-N 3.02Å; L141-Q148 PolarHBondContact O-OE1 2.88Å
142	H	45.2	Very low	40.8	Very low	33 Å²	33	76.2 Å²	76.2	15%	0.153	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	89.5	177.1	-176.8	-59.2	0	0	0	110.4	D121 S122 Y124	D121-H142 PolarHBondContact N-O 2.78Å; S122-H142 PolarHBondContact O-N 2.79Å; S122-H142 VanDerWaalsContact O-N 3.14Å; Y124-H142 HydrophobicContact CD2-CB 3.57Å; Y124-H142 HydrophobicContact CE2-CB 3.48Å; Y124-H142 VanDerWaalsContact CE2-CB 3.48Å; Y124-H142 AromaticContact CE2-CG 3.98Å
143	N	43.9	Very low	40.9	Very low	75 Å²	75	74 Å²	74	40%	0.401	41%	0.411	S	S	.	.			trans	-92.9	141.4	172.3	-136.2	-16.3	0	0	0	110.5	L141 A145	L141-N143 PolarHBondContact O-N 3.02Å; N143-A145 PolarHBondContact O-N 3.05Å
144	T	45.7	Very low	40.9	Very low	106 Å²	106	79 Å²	79	65%	0.65	43%	0.427	S	S	*	.	S	Bend	trans	-69.6	7.3	-170	38.5	0	0	0	0	115.6
145	A	43.9	Very low	40.7	Very low	49 Å²	49	80.1 Å²	80.1	41%	0.405	44%	0.439	S	S	.	.			trans	-77.3	129.9	177.3	0	0	0	0	0	111.1	N143 D147 Q148	N143-A145 PolarHBondContact O-N 3.05Å; A145-D147 PolarHBondContact O-N 3.23Å; A145-Q148 PolarHBondContact O-N 2.85Å; A145-Q148 VanDerWaalsContact O-N 3.1Å
146	S	42.8	Very low	40.7	Very low	83 Å²	83	78.8 Å²	78.8	58%	0.58	43%	0.429	S	S	*	.	H	α-helix	trans	-46.8	-32.3	176.8	46.5	0	0	0	0	113.7	Q148 R149	S146-Q148 VanDerWaalsContact C-N 3.33Å; S146-Q148 PolarHBondContact O-N 2.85Å; S146-R149 PolarHBondContact O-N 3.19Å
147	D	39.7	Very low	40.1	Very low	114 Å²	114	79.7 Å²	79.7	61%	0.61	43%	0.432	S	S	*	.	H	α-helix	trans	-75	-25.4	-170.8	-53.8	-8.9	0	0	0	111.7	A145	A145-D147 PolarHBondContact O-N 3.23Å
148	Q	41.1	Very low	39.8	Very low	82 Å²	82	82.6 Å²	82.6	38%	0.383	45%	0.446	S	S	.	.	H	α-helix	trans	-79.6	-20.1	176.2	-67.1	-162.2	-24.8	0	0	113.4	L141 A145 S146 N150 F152	L141-Q148 PolarHBondContact O-OE1 2.88Å; A145-Q148 PolarHBondContact O-N 2.85Å; A145-Q148 VanDerWaalsContact O-N 3.1Å; S146-Q148 VanDerWaalsContact C-N 3.33Å; S146-Q148 PolarHBondContact O-N 2.85Å; Q148-N150 VanDerWaalsContact C-N 3.33Å; Q148-F152 WeakPolarHBondContact O-CB 3.21Å; Q148-F152 PolarHBondContact O-N 2.95Å
149	R	37.9	Very low	39.2	Very low	97 Å²	97	83.2 Å²	83.2	37%	0.366	45%	0.45	S	S	.	.	H	α-helix	trans	-66.9	-33.5	172.6	-80.9	-176.7	-173	-178.4	-1.5	112.7	I110 N116 S146 F152 L153	I110-R149 PolarHBondContact O-NH1 3.21Å; N116-R149 PolarHBondContact OD1-NH1 3.22Å; N116-R149 PolarHBondContact OD1-NH2 3.46Å; S146-R149 PolarHBondContact O-N 3.19Å; R149-F152 WeakPolarHBondContact O-CB 3.45Å; R149-L153 PolarHBondContact O-N 2.88Å
150	N	32.1	Very low	38.6	Very low	104 Å²	104	85.1 Å²	85.1	56%	0.556	46%	0.46	S	S	*	.	H	α-helix	trans	-75.5	-39.4	179.4	-69.4	-18	0	0	0	110.9	Q148 F152 L153 E154	Q148-N150 VanDerWaalsContact C-N 3.33Å; N150-F152 PolarHBondContact O-N 3.36Å; N150-L153 PolarHBondContact O-N 2.94Å; N150-L153 VanDerWaalsContact O-N 3.15Å; N150-E154 PolarHBondContact O-N 3.2Å
151	I	37.6	Very low	37.7	Very low	91 Å²	91	86.8 Å²	86.8	47%	0.467	47%	0.469	S	S	.	.	H	α-helix	trans	-59.2	-38.9	172.4	-61.1	171.2	0	0	0	110.8	L153 N155	I151-L153 VanDerWaalsContact C-N 3.34Å; I151-L153 PolarHBondContact O-N 3.48Å; I151-N155 PolarHBondContact O-N 3.38Å
152	F	35.8	Very low	36.8	Very low	24 Å²	24	86.3 Å²	86.3	11%	0.105	47%	0.473	C	S	.	.	H	α-helix	trans	-58	-43.2	175.8	-179.7	-81.1	0	0	0	112.6	L115 L126 I140 Q148 R149 N150 L156	L115-F152 HydrophobicContact CD1-CD1 3.25Å; L115-F152 HydrophobicContact CD1-CE1 3.18Å; L115-F152 HydrophobicContact CD1-CE2 4.49Å; L115-F152 HydrophobicContact CD1-CG 4.02Å; L115-F152 HydrophobicContact CD1-CZ 3.86Å; L115-F152 HydrophobicContact CD2-CD1 4.35Å; L115-F152 HydrophobicContact CD2-CE1 3.5Å; L115-F152 HydrophobicContact CD2-CE2 4.03Å; L115-F152 HydrophobicContact CD2-CZ 3.31Å; L115-F152 HydrophobicContact CG-CD1 4.4Å; L115-F152 HydrophobicContact CG-CE1 3.91Å; L115-F152 HydrophobicContact CG-CZ 4.2Å; L126-F152 HydrophobicContact CD1-CE2 4.04Å; L126-F152 HydrophobicContact CD2-CE2 3.82Å; L126-F152 HydrophobicContact CD2-CZ 3.89Å; L126-F152 HydrophobicContact CG-CE2 4.46Å; I140-F152 HydrophobicContact CD1-CD2 3.98Å; I140-F152 HydrophobicContact CD1-CE2 4.49Å; Q148-F152 WeakPolarHBondContact O-CB 3.21Å; Q148-F152 PolarHBondContact O-N 2.95Å; R149-F152 WeakPolarHBondContact O-CB 3.45Å; N150-F152 PolarHBondContact O-N 3.36Å; F152-L156 HydrophobicContact CD1-CD1 4.17Å; F152-L156 HydrophobicContact CE1-CD1 3.59Å; F152-L156 HydrophobicContact CZ-CD1 4Å
153	L	33.8	Very low	36.1	Very low	67 Å²	67	93.4 Å²	93.4	35%	0.351	51%	0.506	S	S	.	.	H	α-helix	trans	-78.4	-37.9	-178.4	-67.9	170.3	0	0	0	112.6	R149 N150 I151 L156 H157	R149-L153 PolarHBondContact O-N 2.88Å; N150-L153 PolarHBondContact O-N 2.94Å; N150-L153 VanDerWaalsContact O-N 3.15Å; I151-L153 VanDerWaalsContact C-N 3.34Å; I151-L153 PolarHBondContact O-N 3.48Å; L153-L156 WeakPolarHBondContact O-CB 3.45Å; L153-L156 PolarHBondContact O-N 2.95Å; L153-H157 PolarHBondContact O-CD2 3.48Å; L153-H157 PolarHBondContact O-N 3.42Å
154	E	33.9	Very low	35.4	Very low	130 Å²	130	95 Å²	95	61%	0.607	52%	0.52	S	S	*	.	H	α-helix	trans	-64.3	-43.7	-179.9	-83.1	-174.9	152.9	0	0	112.9	N150 L156 H157 N158	N150-E154 PolarHBondContact O-N 3.2Å; E154-L156 PolarHBondContact O-N 2.72Å; E154-H157 PolarHBondContact O-N 3.32Å; E154-N158 PolarHBondContact O-N 2.91Å; E154-N158 PolarHBondContact O-ND2 3.04Å; E154-N158 VanDerWaalsContact O-ND2 3.15Å
155	N	39.2	Very low	35	Very low	95 Å²	95	97.2 Å²	97.2	51%	0.508	53%	0.528	S	S	.	.	H	α-helix	trans	-65.3	-28.4	178.2	-74.9	-22.8	0	0	0	112.3	I151	I151-N155 PolarHBondContact O-N 3.38Å
156	L	36.7	Very low	34.5	Very low	41 Å²	41	104 Å²	104	22%	0.215	55%	0.551	C	S	.	*	H	α-helix	trans	-73.5	-38.6	-179.7	-128	146.3	0	0	0	112.8	L91 F152 L153 E154 N158	L91-L156 HydrophobicContact CD1-CD1 3.38Å; L91-L156 HydrophobicContact CD1-CD2 3.34Å; L91-L156 HydrophobicContact CD1-CG 3.87Å; L91-L156 HydrophobicContact CD2-CD1 3.66Å; L91-L156 HydrophobicContact CD2-CD2 3.82Å; L91-L156 HydrophobicContact CD2-CG 3.87Å; L91-L156 HydrophobicContact CG-CD1 4.11Å; L91-L156 HydrophobicContact CG-CD2 3.91Å; L91-L156 HydrophobicContact CG-CG 4.4Å; F152-L156 HydrophobicContact CD1-CD1 4.17Å; F152-L156 HydrophobicContact CE1-CD1 3.59Å; F152-L156 HydrophobicContact CZ-CD1 4Å; L153-L156 WeakPolarHBondContact O-CB 3.45Å; L153-L156 PolarHBondContact O-N 2.95Å; E154-L156 PolarHBondContact O-N 2.72Å; L156-N158 VanDerWaalsContact C-N 3.27Å; L156-N158 PolarHBondContact O-N 3.41Å
157	H	34.7	Very low	34.3	Very low	133 Å²	133	107.7 Å²	107.7	62%	0.616	56%	0.559	S	S	*	*	H	α-helix	trans	-70.8	-21	176.8	-84.2	-62.6	0	0	0	113.8	L153 E154	L153-H157 PolarHBondContact O-CD2 3.48Å; L153-H157 PolarHBondContact O-N 3.42Å; E154-H157 PolarHBondContact O-N 3.32Å
158	N	35.1	Very low	34.6	Very low	128 Å²	128	108.9 Å²	108.9	68%	0.684	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	1.8	-175	-69.7	-34.2	0	0	0	114.3	E154 L156 P160	E154-N158 PolarHBondContact O-N 2.91Å; E154-N158 PolarHBondContact O-ND2 3.04Å; E154-N158 VanDerWaalsContact O-ND2 3.15Å; L156-N158 VanDerWaalsContact C-N 3.27Å; L156-N158 PolarHBondContact O-N 3.41Å; N158-P160 WeakPolarHBondContact O-CD 2.87Å
159	S	31.2	Very low	35.3	Very low	56 Å²	56	115 Å²	115	39%	0.392	59%	0.585	S	S	.	*	S	Bend	trans	-78.1	122.7	175.2	-96.3	0	0	0	0	111	L161	S159-L161 PolarHBondContact O-N 3.32Å
160	P	29.2	Very low	36.3	Very low	127 Å²	127	112.3 Å²	112.3	83%	0.825	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-67.7	130.6	174.9	26.4	-31.4	0	0	0	110.6	N158	N158-P160 WeakPolarHBondContact O-CD 2.87Å
161	L	26.8	Very low	37.6	Very low	79 Å²	79	107.5 Å²	107.5	41%	0.414	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-92.1	144.3	175.4	-69.6	158.4	0	0	0	110.2	D88 C89 S159	D88-L161 HydrophobicContact CB-CD1 3.76Å; D88-L161 HydrophobicContact CB-CD2 3.88Å; D88-L161 HydrophobicContact CB-CG 4.29Å; C89-L161 HydrophobicContact CB-CD2 3.97Å; S159-L161 PolarHBondContact O-N 3.32Å
162	P	27.5	Very low	38.7	Very low	98 Å²	98	106 Å²	106	64%	0.636	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-70.7	143.8	170.8	27.9	-30.7	0	0	0	111.2
163	E	29.5	Very low	39.8	Very low	183 Å²	183	113 Å²	113	86%	0.855	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-70.9	141.5	177.3	-70	-169.2	164.9	0	0	111.7
164	P	30	Very low	40.9	Very low	107 Å²	107	117.7 Å²	117.7	70%	0.695	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-77.3	126	178.3	28.9	-31.9	0	0	0	112.2
165	D	36.1	Very low	42	Very low	154 Å²	154	115.7 Å²	115.7	82%	0.824	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-73.5	133.3	170.3	-80.9	-31.9	0	0	0	111.5	E167	D165-E167 PolarHBondContact O-N 3.4Å
166	E	34.3	Very low	42.9	Very low	191 Å²	191	113.2 Å²	113.2	89%	0.893	59%	0.585	S	S	*	*	S	Bend	trans	-71.6	107.3	179.5	-67.9	-173	151.1	0	0	112.3
167	E	39.1	Very low	44	Very low	160 Å²	160	116.5 Å²	116.5	75%	0.748	60%	0.601	S	S	*	*			trans	-167.7	53.4	147.2	-111.8	-175.4	-154.9	0	0	115.7	D165 R169	D165-E167 PolarHBondContact O-N 3.4Å; E167-R169 PolarHBondContact O-N 3.06Å
168	D	44.1	Very low	45.4	Very low	139 Å²	139	113.5 Å²	113.5	74%	0.743	59%	0.587	S	S	*	*			trans	-83.4	95.5	170.2	-78.4	-33.6	0	0	0	112.3
169	R	57	Low	46.9	Very low	210 Å²	210	107.5 Å²	107.5	79%	0.792	56%	0.555	S	S	*	*			trans	-131.9	117.9	164.9	-67.2	-172.3	-176.5	-179.7	4.3	111.8	E167	E167-R169 PolarHBondContact O-N 3.06Å
170	C	58.6	Low	48.7	Very low	41 Å²	41	108.5 Å²	108.5	28%	0.277	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-50.4	152.1	167.2	-65.7	0	0	0	0	112.1	C207	C170-C207 WeakPolarHBondContact CA-SG 3.35Å; C170-C207 HydrophobicContact CB-CB 3.68Å; C170-C207 WeakPolarHBondContact CB-SG 3.26Å; C170-C207 WeakPolarHBondContact SG-CB 3.25Å; C170-C207 CovalentContact SG-SG 2.03Å; C170-C207 PolarHBondContact SG-SG 3.08Å
171	P	59.4	Low	50.9	Low	4 Å²	4	104.2 Å²	104.2	3%	0.026	54%	0.536	C	S	.	.	P	Polyproline II helix	trans	-61.6	151.6	-173.8	23.2	-24	0	0	0	110.5	D175 F176 F204 F259 I263	P171-D175 HydrophobicContact CB-CB 3.89Å; P171-F176 HydrophobicContact CB-CD2 4.4Å; P171-F204 HydrophobicContact CB-CD1 3.69Å; P171-F204 HydrophobicContact CB-CE1 3.58Å; P171-F204 HydrophobicContact CB-CG 4.31Å; P171-F204 HydrophobicContact CB-CZ 4.23Å; P171-F204 HydrophobicContact CG-CB 4.43Å; P171-F204 HydrophobicContact CG-CD1 3.71Å; P171-F204 HydrophobicContact CG-CE1 4.15Å; P171-F204 HydrophobicContact CG-CG 4.14Å; P171-F259 HydrophobicContact CG-CD1 4.08Å; P171-F259 HydrophobicContact CG-CE1 4.23Å; P171-F259 HydrophobicContact CG-CG 4.28Å; P171-I263 WeakPolarHBondContact O-CD1 3.24Å
172	S	61.2	Low	53.3	Low	58 Å²	58	101.2 Å²	101.2	41%	0.406	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-84.5	165	163.3	73	0	0	0	0	109.6	Q174 D175	S172-Q174 PolarHBondContact O-N 2.62Å; S172-D175 WeakPolarHBondContact CB-OD2 3.43Å; S172-D175 PolarHBondContact N-OD2 3.19Å; S172-D175 PolarHBondContact O-N 3.49Å; S172-D175 PolarHBondContact OG-OD2 3.15Å
173	E	58.3	Low	55.8	Low	171 Å²	171	100.1 Å²	100.1	80%	0.799	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-17.4	-178.8	-73.6	-171.9	157.6	0	0	114.2	I263	E173-I263 HydrophobicContact CG-CG1 4.23Å
174	Q	57.4	Low	58	Low	167 Å²	167	92.3 Å²	92.3	78%	0.78	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-18.2	-178.7	-64	-179.8	-1.6	0	0	113.6	S172	S172-Q174 PolarHBondContact O-N 2.62Å
175	D	56.1	Low	60.2	Low	87 Å²	87	91.3 Å²	91.3	47%	0.465	47%	0.468	S	S	.	.	S	Bend	trans	-86.8	-17.4	-165.1	-62.6	-48.2	0	0	0	114.3	P171 S172	P171-D175 HydrophobicContact CB-CB 3.89Å; S172-D175 WeakPolarHBondContact CB-OD2 3.43Å; S172-D175 PolarHBondContact N-OD2 3.19Å; S172-D175 PolarHBondContact O-N 3.49Å; S172-D175 PolarHBondContact OG-OD2 3.15Å
176	F	59.5	Low	61.9	Low	44 Å²	44	85.5 Å²	85.5	19%	0.193	44%	0.442	C	S	.	.			trans	-142.8	90.3	179.6	-89.2	-94.8	0	0	0	112.2	P171 F204 T265	P171-F176 HydrophobicContact CB-CD2 4.4Å; F176-F204 AromaticContact CD2-CD2 3.96Å; F176-F204 HydrophobicContact CD2-CD2 3.96Å; F176-F204 HydrophobicContact CD2-CE2 4.03Å; F176-F204 AromaticContact CE2-CD2 3.16Å; F176-F204 HydrophobicContact CE2-CD2 3.16Å; F176-F204 AromaticContact CE2-CE2 3.18Å; F176-F204 HydrophobicContact CE2-CE2 3.18Å; F176-F204 HydrophobicContact CE2-CG 4.13Å; F176-F204 HydrophobicContact CE2-CZ 4.06Å; F176-F204 AromaticContact CZ-CD2 3.7Å; F176-F204 HydrophobicContact CZ-CD2 3.7Å; F176-F204 AromaticContact CZ-CE2 3.96Å; F176-F204 HydrophobicContact CZ-CE2 3.96Å; F176-T265 HydrophobicContact CB-CG2 4.28Å
177	I	58.6	Low	63.2	Low	109 Å²	109	78.3 Å²	78.3	56%	0.559	41%	0.409	S	S	*	.	S	Bend	trans	-78.6	-35.3	178.9	-57.8	175.2	0	0	0	111	Q266	I177-Q266 VanDerWaalsContact O-CB 3.23Å; I177-Q266 WeakPolarHBondContact O-CB 3.38Å; I177-Q266 VanDerWaalsContact O-CG 3.27Å; I177-Q266 WeakPolarHBondContact O-CG 3.47Å; I177-Q266 PolarHBondContact O-N 3.43Å
178	E	63.8	Low	64	Low	71 Å²	71	72.6 Å²	72.6	33%	0.332	39%	0.389	S	S	.	.			trans	-142	158.2	-172.8	-162.1	168.1	175	0	0	113.7	D180 E269	E178-D180 WeakPolarHBondContact CG-OD1 3.26Å; E178-E269 PolarHBondContact OE1-N 3.18Å
179	V	68	Low	64.4	Low	2 Å²	2	73.1 Å²	73.1	1%	0.012	39%	0.387	C	S	.	.			trans	-106.5	89.9	179.5	169.5	0	0	0	0	107.6	W197 V255 A257 T265 S268	V179-W197 HydrophobicContact CB-CH2 4.43Å; V179-W197 HydrophobicContact CB-CZ2 3.95Å; V179-W197 HydrophobicContact CG1-CD2 3.76Å; V179-W197 HydrophobicContact CG1-CE3 4.27Å; V179-W197 HydrophobicContact CG1-CG 4.34Å; V179-W197 HydrophobicContact CG1-CH2 3.73Å; V179-W197 HydrophobicContact CG1-CZ2 3.3Å; V179-W197 HydrophobicContact CG1-CZ3 4.23Å; V179-W197 HydrophobicContact CG2-CH2 4.16Å; V179-W197 HydrophobicContact CG2-CZ2 4.14Å; V179-V255 HydrophobicContact CG1-CB 4.39Å; V179-V255 HydrophobicContact CG1-CG1 3.41Å; V179-V255 VanDerWaalsContact CG1-CG1 3.41Å; V179-V255 HydrophobicContact CG1-CG2 4.33Å; V179-A257 HydrophobicContact CG2-CB 3.89Å; V179-T265 HydrophobicContact CG2-CG2 3.62Å; V179-T265 WeakPolarHBondContact CG2-OG1 3.19Å; V179-S268 VanDerWaalsContact O-CA 3.25Å; V179-S268 WeakPolarHBondContact O-CA 3.23Å; V179-S268 WeakPolarHBondContact O-CB 3.24Å
180	D	69	Low	64.3	Low	76 Å²	76	64.9 Å²	64.9	41%	0.406	37%	0.367	S	S	.	.			trans	-91.3	149.2	-171.7	-67.6	-21.5	0	0	0	113.6	E178 W197 K199	E178-D180 WeakPolarHBondContact CG-OD1 3.26Å; D180-W197 PolarHBondContact O-NE1 2.83Å; D180-K199 HydrophobicContact CB-CD 4.46Å; D180-K199 VanDerWaalsContact O-CD 3.26Å; D180-K199 WeakPolarHBondContact O-CD 3.48Å
181	G	73.6	Confident	64.6	Low	38 Å²	38	63.3 Å²	63.3	39%	0.392	36%	0.357	S	S	.	.			trans	85.5	31.1	170.4	0	0	0	0	0	114.8	T183	G181-T183 PolarHBondContact O-N 3.39Å
182	L	78.8	Confident	64.6	Low	15 Å²	15	65 Å²	65	8%	0.079	37%	0.365	C	S	.	.			trans	-61.6	127.7	164.4	177.4	67.2	0	0	0	107.9	V184 W197 L238 V255 V271	L182-V184 HydrophobicContact CD2-CG2 4.48Å; L182-V184 HydrophobicContact CG-CG2 4.31Å; L182-W197 HydrophobicContact CD1-CB 4.17Å; L182-L238 HydrophobicContact CD1-CD2 4.44Å; L182-V255 HydrophobicContact CB-CG1 4.08Å; L182-V255 HydrophobicContact CD1-CG1 4.05Å; L182-V255 HydrophobicContact CD2-CG1 4.15Å; L182-V255 HydrophobicContact CG-CG1 4.31Å; L182-V271 HydrophobicContact CB-CG2 4.12Å; L182-V271 HydrophobicContact CD2-CB 4.5Å; L182-V271 HydrophobicContact CD2-CG2 3.96Å; L182-V271 HydrophobicContact CG-CG2 4Å; L182-V271 WeakPolarHBondContact O-CG2 3.38Å
183	T	79.7	Confident	65.1	Low	76 Å²	76	62.2 Å²	62.2	47%	0.466	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.7	175.1	56.8	0	0	0	0	109.3	G181 L195 S196	G181-T183 PolarHBondContact O-N 3.39Å; T183-L195 WeakPolarHBondContact O-CA 3.42Å; T183-S196 PolarHBondContact N-O 3.43Å; T183-S196 PolarHBondContact O-N 2.73Å; T183-S196 WeakPolarHBondContact OG1-CB 3.24Å; T183-S196 PolarHBondContact OG1-O 2.68Å
184	V	76.1	Confident	65.2	Low	19 Å²	19	56.8 Å²	56.8	12%	0.115	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	131.3	175.7	-169.3	0	0	0	0	108.8	L182 H193 L194 L195 Y253 V271 I273	L182-V184 HydrophobicContact CD2-CG2 4.48Å; L182-V184 HydrophobicContact CG-CG2 4.31Å; V184-H193 HydrophobicContact CG1-CB 4.1Å; V184-L194 CarbonylContact C-O 3.51Å; V184-L194 VanDerWaalsContact CA-O 3.24Å; V184-L194 WeakPolarHBondContact CA-O 3.4Å; V184-L195 HydrophobicContact CG1-CG 4.13Å; V184-L195 HydrophobicContact CG2-CD2 4.09Å; V184-L195 HydrophobicContact CG2-CG 4.02Å; V184-Y253 HydrophobicContact CB-CD2 4.48Å; V184-Y253 HydrophobicContact CG1-CD2 3.91Å; V184-Y253 HydrophobicContact CG1-CE2 4.04Å; V184-Y253 HydrophobicContact CG2-CD2 4Å; V184-Y253 HydrophobicContact CG2-CG 4.16Å; V184-V271 HydrophobicContact CB-CG1 3.79Å; V184-V271 HydrophobicContact CG2-CB 3.89Å; V184-V271 HydrophobicContact CG2-CG1 3.67Å; V184-V271 HydrophobicContact CG2-CG2 4.4Å; V184-I273 HydrophobicContact CB-CD1 4.22Å; V184-I273 HydrophobicContact CG1-CB 4.46Å; V184-I273 HydrophobicContact CG1-CD1 3.75Å; V184-I273 HydrophobicContact CG1-CG2 3.9Å
185	T	76.2	Confident	65.7	Low	85 Å²	85	49 Å²	49	52%	0.521	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.7	-179.6	-53.7	0	0	0	0	109.7	H193 L194	T185-H193 CarbonylContact O-C 3.32Å; T185-H193 WeakPolarHBondContact O-CA 3.35Å; T185-L194 PolarHBondContact N-O 3.06Å; T185-L194 PolarHBondContact O-N 2.78Å
186	A	70.6	Confident	66.2	Low	33 Å²	33	46.8 Å²	46.8	27%	0.273	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	141.1	178.4	0	0	0	0	0	111.4	I192 I273 P276	A186-I192 CarbonylContact C-O 3.43Å; A186-I192 WeakPolarHBondContact CA-O 3.18Å; A186-I273 HydrophobicContact CB-CD1 3.7Å; A186-I273 HydrophobicContact CB-CG1 4.17Å; A186-P276 HydrophobicContact CB-CG 4.24Å
187	I	61.9	Low	66.6	Low	40 Å²	40	44.9 Å²	44.9	21%	0.205	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.5	175.7	-48.1	179.6	0	0	0	108.8	E189 I192 L194	I187-E189 VanDerWaalsContact C-N 3.31Å; I187-E189 HydrophobicContact CG2-CB 4.29Å; I187-E189 PolarHBondContact O-N 2.77Å; I187-I192 HydrophobicContact CB-CB 4.13Å; I187-I192 HydrophobicContact CD1-CB 4.23Å; I187-I192 HydrophobicContact CD1-CG2 4.15Å; I187-I192 HydrophobicContact CG1-CB 4.34Å; I187-I192 PolarHBondContact N-O 2.93Å; I187-L194 HydrophobicContact CD1-CD1 3.86Å; I187-L194 HydrophobicContact CD1-CD2 4.11Å; I187-L194 HydrophobicContact CD1-CG 3.87Å; I187-L194 HydrophobicContact CG1-CD1 4.29Å; I187-L194 HydrophobicContact CG1-CG 4.24Å
188	A	56.7	Low	66.7	Low	39 Å²	39	44.1 Å²	44.1	32%	0.322	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-21	-176.8	0	0	0	0	0	114.7	G190 P276 A278 V279	A188-G190 VanDerWaalsContact C-N 3.29Å; A188-G190 PolarHBondContact O-N 3.43Å; A188-P276 VanDerWaalsContact CA-CG 3.45Å; A188-P276 HydrophobicContact CB-CB 4.03Å; A188-P276 HydrophobicContact CB-CG 4.01Å; A188-A278 WeakPolarHBondContact O-CA 3.28Å; A188-V279 HydrophobicContact CB-CG2 4.28Å; A188-V279 PolarHBondContact O-N 2.73Å
189	E	52.8	Low	66.7	Low	150 Å²	150	46.7 Å²	46.7	70%	0.701	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-11.6	-174.9	-65.7	177.6	175.2	0	0	113.9	I187	I187-E189 VanDerWaalsContact C-N 3.31Å; I187-E189 HydrophobicContact CG2-CB 4.29Å; I187-E189 PolarHBondContact O-N 2.77Å
190	G	53.1	Low	66.5	Low	37 Å²	37	47.1 Å²	47.1	38%	0.381	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-162.7	21	-173.9	0	0	0	0	0	117.2	A188 I192	A188-G190 VanDerWaalsContact C-N 3.29Å; A188-G190 PolarHBondContact O-N 3.43Å; G190-I192 VanDerWaalsContact O-CG1 3.31Å; G190-I192 WeakPolarHBondContact O-CG1 3.49Å; G190-I192 PolarHBondContact O-N 3.45Å
191	S	65.8	Low	66.2	Low	9 Å²	9	46.2 Å²	46.2	6%	0.063	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	60.1	-176.3	-55.1	0	0	0	0	110.7	I245 E247	S191-I245 VanDerWaalsContact O-CD1 3.27Å; S191-I245 WeakPolarHBondContact O-CD1 3.38Å; S191-I245 WeakPolarHBondContact O-CG1 3.41Å; S191-E247 WeakPolarHBondContact OG-CG 3.38Å
192	I	60.2	Low	65.5	Low	39 Å²	39	52.7 Å²	52.7	20%	0.2	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	135	-175.5	-52.6	-179.3	0	0	0	109.1	A186 I187 G190 L194 I241 I242 T243	A186-I192 CarbonylContact C-O 3.43Å; A186-I192 WeakPolarHBondContact CA-O 3.18Å; I187-I192 HydrophobicContact CB-CB 4.13Å; I187-I192 HydrophobicContact CD1-CB 4.23Å; I187-I192 HydrophobicContact CD1-CG2 4.15Å; I187-I192 HydrophobicContact CG1-CB 4.34Å; I187-I192 PolarHBondContact N-O 2.93Å; G190-I192 VanDerWaalsContact O-CG1 3.31Å; G190-I192 WeakPolarHBondContact O-CG1 3.49Å; G190-I192 PolarHBondContact O-N 3.45Å; I192-L194 HydrophobicContact CG2-CD2 4.36Å; I192-I241 HydrophobicContact CG2-CG2 3.38Å; I192-I242 WeakPolarHBondContact CA-O 3.32Å; I192-T243 HydrophobicContact CD1-CG2 4.29Å; I192-T243 HydrophobicContact CG1-CG2 4.11Å; I192-T243 HydrophobicContact CG2-CG2 4.17Å
193	H	70.2	Confident	64.6	Low	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.4	164.8	-65.9	167.6	0	0	0	110.8	V184 T185 L195 I242 I245 Y251 Y253 I273 T275	V184-H193 HydrophobicContact CG1-CB 4.1Å; T185-H193 CarbonylContact O-C 3.32Å; T185-H193 WeakPolarHBondContact O-CA 3.35Å; H193-L195 HydrophobicContact CB-CD1 4.42Å; H193-I242 HydrophobicContact CB-CB 4.41Å; H193-I242 PolarHBondContact N-O 3.49Å; H193-I242 PolarHBondContact O-N 3.17Å; H193-I245 HydrophobicContact CB-CD1 4.16Å; H193-I245 WeakPolarHBondContact CD2-CD1 3.45Å; H193-I245 VanDerWaalsContact CG-CD1 3.43Å; H193-I245 WeakPolarHBondContact NE2-CD1 3.46Å; H193-Y251 AromaticContact CE1-CD2 3.69Å; H193-Y253 AromaticContact ND1-CE2 3.42Å; H193-Y253 WeakPolarHBondContact ND1-CE2 3.39Å; H193-Y253 AromaticContact ND1-CZ 3.63Å; H193-Y253 PolarHBondContact ND1-OH 3.2Å; H193-Y253 VanDerWaalsContact ND1-OH 3.12Å; H193-I273 VanDerWaalsContact CE1-CG2 3.44Å; H193-I273 WeakPolarHBondContact CE1-CG2 3.15Å; H193-T275 PolarHBondContact CE1-OG1 2.8Å; H193-T275 PolarHBondContact NE2-OG1 2.89Å
194	L	61.3	Low	63.8	Low	57 Å²	57	54.9 Å²	54.9	30%	0.298	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.8	168.8	-59	-179.1	0	0	0	108.8	V184 T185 I187 I192 I241	V184-L194 CarbonylContact C-O 3.51Å; V184-L194 VanDerWaalsContact CA-O 3.24Å; V184-L194 WeakPolarHBondContact CA-O 3.4Å; T185-L194 PolarHBondContact N-O 3.06Å; T185-L194 PolarHBondContact O-N 2.78Å; I187-L194 HydrophobicContact CD1-CD1 3.86Å; I187-L194 HydrophobicContact CD1-CD2 4.11Å; I187-L194 HydrophobicContact CD1-CG 3.87Å; I187-L194 HydrophobicContact CG1-CD1 4.29Å; I187-L194 HydrophobicContact CG1-CG 4.24Å; I192-L194 HydrophobicContact CG2-CD2 4.36Å; L194-I241 HydrophobicContact CD2-CB 4.35Å; L194-I241 HydrophobicContact CD2-CD1 3.95Å; L194-I241 HydrophobicContact CD2-CG1 3.7Å; L194-I241 HydrophobicContact CD2-CG2 4.1Å
195	L	67.7	Low	63.3	Low	4 Å²	4	55.7 Å²	55.7	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	133.4	174.6	-65	92.6	0	0	0	109.8	T183 V184 H193 L213 N239 N240 I242 Y253	T183-L195 WeakPolarHBondContact O-CA 3.42Å; V184-L195 HydrophobicContact CG1-CG 4.13Å; V184-L195 HydrophobicContact CG2-CD2 4.09Å; V184-L195 HydrophobicContact CG2-CG 4.02Å; H193-L195 HydrophobicContact CB-CD1 4.42Å; L195-L213 HydrophobicContact CD2-CD1 3.58Å; L195-L213 HydrophobicContact CD2-CD2 3.78Å; L195-L213 HydrophobicContact CD2-CG 4.29Å; L195-N239 WeakPolarHBondContact O-CA 2.91Å; L195-N240 HydrophobicContact CB-CB 4.48Å; L195-N240 PolarHBondContact N-O 2.91Å; L195-N240 PolarHBondContact O-N 2.82Å; L195-I242 HydrophobicContact CD1-CB 4.34Å; L195-I242 HydrophobicContact CD1-CD1 4.37Å; L195-I242 HydrophobicContact CD1-CG1 3.36Å; L195-Y253 HydrophobicContact CD1-CE1 4.23Å; L195-Y253 HydrophobicContact CD2-CD1 3.46Å; L195-Y253 VanDerWaalsContact CD2-CD1 3.46Å; L195-Y253 HydrophobicContact CD2-CE1 3.94Å; L195-Y253 HydrophobicContact CD2-CG 3.77Å; L195-Y253 HydrophobicContact CG-CD1 4.47Å
196	S	67	Low	62.6	Low	40 Å²	40	57.6 Å²	57.6	28%	0.28	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	138.1	172.7	-170.4	0	0	0	0	111.5	T183 L238 N239	T183-S196 PolarHBondContact N-O 3.43Å; T183-S196 PolarHBondContact O-N 2.73Å; T183-S196 WeakPolarHBondContact OG1-CB 3.24Å; T183-S196 PolarHBondContact OG1-O 2.68Å; S196-L238 CarbonylContact C-O 3.56Å; S196-L238 VanDerWaalsContact CA-O 3.26Å; S196-L238 WeakPolarHBondContact CA-O 3.36Å; S196-N239 WeakPolarHBondContact CB-OD1 3.46Å; S196-N239 PolarHBondContact OG-OD1 2.9Å
197	W	67.7	Low	62.4	Low	4 Å²	4	56.5 Å²	56.5	2%	0.015	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	122.5	168.8	-177.3	73.6	0	0	0	110.1	V179 D180 L182 K199 I200 Y211 L238 V255	V179-W197 HydrophobicContact CB-CH2 4.43Å; V179-W197 HydrophobicContact CB-CZ2 3.95Å; V179-W197 HydrophobicContact CG1-CD2 3.76Å; V179-W197 HydrophobicContact CG1-CE3 4.27Å; V179-W197 HydrophobicContact CG1-CG 4.34Å; V179-W197 HydrophobicContact CG1-CH2 3.73Å; V179-W197 HydrophobicContact CG1-CZ2 3.3Å; V179-W197 HydrophobicContact CG1-CZ3 4.23Å; V179-W197 HydrophobicContact CG2-CH2 4.16Å; V179-W197 HydrophobicContact CG2-CZ2 4.14Å; D180-W197 PolarHBondContact O-NE1 2.83Å; L182-W197 HydrophobicContact CD1-CB 4.17Å; W197-K199 HydrophobicContact CZ2-CB 4.1Å; W197-I200 HydrophobicContact CH2-CB 4.4Å; W197-I200 HydrophobicContact CH2-CD1 3.68Å; W197-I200 HydrophobicContact CH2-CG1 3.11Å; W197-I200 HydrophobicContact CZ2-CG1 4.16Å; W197-I200 HydrophobicContact CZ3-CD1 3.61Å; W197-I200 HydrophobicContact CZ3-CG1 3.32Å; W197-Y211 HydrophobicContact CE3-CD1 4.36Å; W197-Y211 AromaticContact CE3-CE1 3.68Å; W197-Y211 HydrophobicContact CE3-CE1 3.68Å; W197-Y211 AromaticContact CE3-CZ 3.81Å; W197-Y211 HydrophobicContact CH2-CE1 4.17Å; W197-Y211 HydrophobicContact CZ3-CD1 4.14Å; W197-Y211 AromaticContact CZ3-CE1 3.18Å; W197-Y211 HydrophobicContact CZ3-CE1 3.18Å; W197-Y211 AromaticContact CZ3-CZ 3.49Å; W197-Y211 VanDerWaalsContact CZ3-CZ 3.49Å; W197-Y211 VanDerWaalsContact CZ3-OH 3.25Å; W197-Y211 WeakPolarHBondContact CZ3-OH 3.42Å; W197-L238 HydrophobicContact CB-CB 4.07Å; W197-L238 HydrophobicContact CB-CD2 4.49Å; W197-L238 PolarHBondContact N-O 2.91Å; W197-L238 PolarHBondContact O-N 3.13Å; W197-V255 HydrophobicContact CG-CG1 4.48Å
198	N	60.9	Low	62.7	Low	92 Å²	92	55.2 Å²	55.2	49%	0.492	29%	0.293	S	S	.	.			trans	-144.3	77	-178.3	177.8	2	0	0	0	109.3	H237	N198-H237 PolarHBondContact ND2-CE1 3.1Å; N198-H237 PolarHBondContact ND2-ND1 2.79Å; N198-H237 PolarHBondContact OD1-CE1 3.04Å; N198-H237 PolarHBondContact OD1-ND1 2.99Å
199	K	64.4	Low	63	Low	125 Å²	125	55.2 Å²	55.2	54%	0.543	29%	0.291	S	S	.	.			trans	-137	13.1	174.1	-75.1	-152.8	-169	172.8	0	114.7	D180 W197 S201	D180-K199 HydrophobicContact CB-CD 4.46Å; D180-K199 VanDerWaalsContact O-CD 3.26Å; D180-K199 WeakPolarHBondContact O-CD 3.48Å; W197-K199 HydrophobicContact CZ2-CB 4.1Å; K199-S201 PolarHBondContact O-N 3.11Å
200	I	62.9	Low	63.6	Low	12 Å²	12	49.5 Å²	49.5	6%	0.062	26%	0.264	C	S	.	.			trans	-72	122.7	168.7	-63.5	-165.7	0	0	0	107.9	W197 E202 F204 L208 Y211 F259	W197-I200 HydrophobicContact CH2-CB 4.4Å; W197-I200 HydrophobicContact CH2-CD1 3.68Å; W197-I200 HydrophobicContact CH2-CG1 3.11Å; W197-I200 HydrophobicContact CZ2-CG1 4.16Å; W197-I200 HydrophobicContact CZ3-CD1 3.61Å; W197-I200 HydrophobicContact CZ3-CG1 3.32Å; I200-E202 PolarHBondContact O-N 3.04Å; I200-F204 HydrophobicContact CG2-CB 3.99Å; I200-L208 HydrophobicContact CD1-CB 4.45Å; I200-L208 HydrophobicContact CD1-CD1 3.63Å; I200-L208 HydrophobicContact CD1-CD2 3.95Å; I200-L208 HydrophobicContact CD1-CG 4.21Å; I200-Y211 HydrophobicContact CD1-CE1 3.93Å; I200-Y211 WeakPolarHBondContact CD1-OH 3.47Å; I200-F259 HydrophobicContact CD1-CE1 4.35Å; I200-F259 HydrophobicContact CD1-CZ 4.19Å
201	S	62.1	Low	64.1	Low	57 Å²	57	47.7 Å²	47.7	40%	0.399	25%	0.246	S	C	.	.			trans	-55.7	135.8	169	168.6	0	0	0	0	109	K199 K203 F204	K199-S201 PolarHBondContact O-N 3.11Å; S201-K203 PolarHBondContact O-N 3.41Å; S201-F204 PolarHBondContact O-N 3.27Å
202	E	59.7	Low	64	Low	174 Å²	174	48.9 Å²	48.9	81%	0.813	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-48	-35.6	179.5	-69.7	177	169.3	0	0	112.2	I200 F204 S205	I200-E202 PolarHBondContact O-N 3.04Å; E202-F204 PolarHBondContact O-N 3.4Å; E202-S205 WeakPolarHBondContact O-CB 3.38Å; E202-S205 PolarHBondContact O-N 2.97Å; E202-S205 VanDerWaalsContact O-N 3.07Å; E202-S205 PolarHBondContact O-OG 2.77Å
203	K	58.8	Low	64.4	Low	118 Å²	118	47 Å²	47	51%	0.513	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-49.8	-30.1	174	-176.1	171.8	-179.2	167.4	0	114.5	S201	S201-K203 PolarHBondContact O-N 3.41Å
204	F	64.3	Low	64.2	Low	18 Å²	18	47.3 Å²	47.3	8%	0.079	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-113.2	1.9	-175.7	-49.9	-63	0	0	0	113.5	P171 F176 I200 S201 E202 E206 C207 L208 F259	P171-F204 HydrophobicContact CB-CD1 3.69Å; P171-F204 HydrophobicContact CB-CE1 3.58Å; P171-F204 HydrophobicContact CB-CG 4.31Å; P171-F204 HydrophobicContact CB-CZ 4.23Å; P171-F204 HydrophobicContact CG-CB 4.43Å; P171-F204 HydrophobicContact CG-CD1 3.71Å; P171-F204 HydrophobicContact CG-CE1 4.15Å; P171-F204 HydrophobicContact CG-CG 4.14Å; F176-F204 AromaticContact CD2-CD2 3.96Å; F176-F204 HydrophobicContact CD2-CD2 3.96Å; F176-F204 HydrophobicContact CD2-CE2 4.03Å; F176-F204 AromaticContact CE2-CD2 3.16Å; F176-F204 HydrophobicContact CE2-CD2 3.16Å; F176-F204 AromaticContact CE2-CE2 3.18Å; F176-F204 HydrophobicContact CE2-CE2 3.18Å; F176-F204 HydrophobicContact CE2-CG 4.13Å; F176-F204 HydrophobicContact CE2-CZ 4.06Å; F176-F204 AromaticContact CZ-CD2 3.7Å; F176-F204 HydrophobicContact CZ-CD2 3.7Å; F176-F204 AromaticContact CZ-CE2 3.96Å; F176-F204 HydrophobicContact CZ-CE2 3.96Å; I200-F204 HydrophobicContact CG2-CB 3.99Å; S201-F204 PolarHBondContact O-N 3.27Å; E202-F204 PolarHBondContact O-N 3.4Å; F204-E206 VanDerWaalsContact C-N 3.31Å; F204-E206 PolarHBondContact O-N 2.92Å; F204-C207 PolarHBondContact O-N 2.72Å; F204-C207 VanDerWaalsContact O-N 3.13Å; F204-L208 PolarHBondContact O-N 3.45Å; F204-F259 HydrophobicContact CB-CE1 3.99Å
205	S	65	Low	64.8	Low	37 Å²	37	45 Å²	45	26%	0.259	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-58.5	-43.5	-179.6	64.7	0	0	0	0	111.5	E202 C207 L208	E202-S205 WeakPolarHBondContact O-CB 3.38Å; E202-S205 PolarHBondContact O-N 2.97Å; E202-S205 VanDerWaalsContact O-N 3.07Å; E202-S205 PolarHBondContact O-OG 2.77Å; S205-C207 PolarHBondContact O-N 2.76Å; S205-L208 WeakPolarHBondContact O-CB 3.36Å; S205-L208 PolarHBondContact O-N 2.76Å
206	E	62.2	Low	64.9	Low	124 Å²	124	45.9 Å²	45.9	58%	0.579	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-68.9	-22.5	179.3	-56.7	-158.5	161.6	0	0	113.8	F204 K260	F204-E206 VanDerWaalsContact C-N 3.31Å; F204-E206 PolarHBondContact O-N 2.92Å; E206-K260 VanDerWaalsContact O-CE 3.24Å; E206-K260 WeakPolarHBondContact O-CE 3.3Å; E206-K260 PolarHBondContact O-NZ 3.47Å
207	C	65.9	Low	64.9	Low	11 Å²	11	44.7 Å²	44.7	7%	0.074	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-89.2	-14.1	-179.9	-65.6	0	0	0	0	112.9	C170 F204 S205 S209 F259 K260	C170-C207 WeakPolarHBondContact CA-SG 3.35Å; C170-C207 HydrophobicContact CB-CB 3.68Å; C170-C207 WeakPolarHBondContact CB-SG 3.26Å; C170-C207 WeakPolarHBondContact SG-CB 3.25Å; C170-C207 CovalentContact SG-SG 2.03Å; C170-C207 PolarHBondContact SG-SG 3.08Å; F204-C207 PolarHBondContact O-N 2.72Å; F204-C207 VanDerWaalsContact O-N 3.13Å; S205-C207 PolarHBondContact O-N 2.76Å; C207-S209 PolarHBondContact O-N 3.09Å; C207-F259 HydrophobicContact CB-CD1 4.08Å; C207-F259 CarbonylContact O-C 3.56Å; C207-F259 VanDerWaalsContact O-CA 3.26Å; C207-F259 WeakPolarHBondContact O-CA 3.5Å; C207-F259 WeakPolarHBondContact O-CB 3.42Å; C207-K260 PolarHBondContact O-N 2.74Å
208	L	67.4	Low	64.6	Low	12 Å²	12	50.2 Å²	50.2	6%	0.063	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	130	177.9	-179.3	72.1	0	0	0	110.4	I200 F204 S205 Y211 V234 A257 F259	I200-L208 HydrophobicContact CD1-CB 4.45Å; I200-L208 HydrophobicContact CD1-CD1 3.63Å; I200-L208 HydrophobicContact CD1-CD2 3.95Å; I200-L208 HydrophobicContact CD1-CG 4.21Å; F204-L208 PolarHBondContact O-N 3.45Å; S205-L208 WeakPolarHBondContact O-CB 3.36Å; S205-L208 PolarHBondContact O-N 2.76Å; L208-Y211 HydrophobicContact CD1-CD1 4.41Å; L208-Y211 HydrophobicContact CD1-CE1 3.73Å; L208-Y211 HydrophobicContact CD2-CE1 3.98Å; L208-Y211 HydrophobicContact CD2-CE2 3.64Å; L208-Y211 WeakPolarHBondContact CD2-OH 3.37Å; L208-Y211 HydrophobicContact CG-CE1 4.47Å; L208-V234 VanDerWaalsContact CD2-O 3.31Å; L208-V234 WeakPolarHBondContact CD2-O 3.32Å; L208-A257 HydrophobicContact CD1-CB 4.1Å; L208-F259 HydrophobicContact CB-CD1 4.45Å; L208-F259 HydrophobicContact CB-CE1 4.42Å; L208-F259 HydrophobicContact CD1-CE1 4.34Å
209	S	63.4	Low	64.2	Low	40 Å²	40	54.6 Å²	54.6	28%	0.28	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-53.3	174.6	179.7	0	0	0	0	111.3	C207 Y258	C207-S209 PolarHBondContact O-N 3.09Å; S209-Y258 WeakPolarHBondContact CA-O 3.25Å; S209-Y258 VanDerWaalsContact CB-O 3.27Å; S209-Y258 WeakPolarHBondContact CB-O 3.44Å; S209-Y258 PolarHBondContact N-O 2.8Å
210	H	64.6	Low	63	Low	29 Å²	29	57.1 Å²	57.1	13%	0.134	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.7	164.8	-179.5	56.8	-76.5	0	0	0	113.8	K231 Y232 Y258	H210-K231 HydrophobicContact CB-CD 4.44Å; H210-K231 HydrophobicContact CB-CG 3.73Å; H210-K231 VanDerWaalsContact CG-CE 3.41Å; H210-Y232 CarbonylContact C-O 3.5Å; H210-Y232 WeakPolarHBondContact CA-O 3.28Å; H210-Y232 VanDerWaalsContact CB-O 3.26Å; H210-Y232 WeakPolarHBondContact CB-O 3.47Å; H210-Y258 AromaticContact CD2-CD2 3.93Å; H210-Y258 VanDerWaalsContact CE1-CB 3.43Å; H210-Y258 WeakPolarHBondContact CE1-CB 3.3Å; H210-Y258 AromaticContact CE1-CG 3.73Å; H210-Y258 PolarHBondContact N-O 3.32Å; H210-Y258 VanDerWaalsContact N-O 3.12Å; H210-Y258 AromaticContact NE2-CD1 3.98Å; H210-Y258 AromaticContact NE2-CD2 3.74Å; H210-Y258 AromaticContact NE2-CG 3.52Å; H210-Y258 WeakPolarHBondContact O-CB 3.42Å; H210-Y258 PolarHBondContact O-N 3.43Å
211	Y	64	Low	62	Low	0 Å²	0	66.1 Å²	66.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	153.3	167	-59.2	-63.2	0	0	0	112.9	W197 I200 L208 M230 K231 Y232 V234 G236 H237 L238 V255 K256 A257	W197-Y211 HydrophobicContact CE3-CD1 4.36Å; W197-Y211 AromaticContact CE3-CE1 3.68Å; W197-Y211 HydrophobicContact CE3-CE1 3.68Å; W197-Y211 AromaticContact CE3-CZ 3.81Å; W197-Y211 HydrophobicContact CH2-CE1 4.17Å; W197-Y211 HydrophobicContact CZ3-CD1 4.14Å; W197-Y211 AromaticContact CZ3-CE1 3.18Å; W197-Y211 HydrophobicContact CZ3-CE1 3.18Å; W197-Y211 AromaticContact CZ3-CZ 3.49Å; W197-Y211 VanDerWaalsContact CZ3-CZ 3.49Å; W197-Y211 VanDerWaalsContact CZ3-OH 3.25Å; W197-Y211 WeakPolarHBondContact CZ3-OH 3.42Å; I200-Y211 HydrophobicContact CD1-CE1 3.93Å; I200-Y211 WeakPolarHBondContact CD1-OH 3.47Å; L208-Y211 HydrophobicContact CD1-CD1 4.41Å; L208-Y211 HydrophobicContact CD1-CE1 3.73Å; L208-Y211 HydrophobicContact CD2-CE1 3.98Å; L208-Y211 HydrophobicContact CD2-CE2 3.64Å; L208-Y211 WeakPolarHBondContact CD2-OH 3.37Å; L208-Y211 HydrophobicContact CG-CE1 4.47Å; Y211-M230 VanDerWaalsContact O-O 3.07Å; Y211-K231 WeakPolarHBondContact O-CA 3.41Å; Y211-Y232 PolarHBondContact N-O 3.45Å; Y211-Y232 VanDerWaalsContact N-O 3.11Å; Y211-Y232 PolarHBondContact O-N 2.93Å; Y211-V234 HydrophobicContact CD2-CG2 4.34Å; Y211-V234 HydrophobicContact CE2-CB 4.3Å; Y211-V234 HydrophobicContact CE2-CG2 4.34Å; Y211-G236 PolarHBondContact OH-O 3.34Å; Y211-H237 PolarHBondContact OH-N 2.95Å; Y211-L238 HydrophobicContact CD2-CB 4.08Å; Y211-L238 HydrophobicContact CD2-CD1 4.43Å; Y211-L238 HydrophobicContact CE2-CB 4.27Å; Y211-L238 HydrophobicContact CG-CB 4.49Å; Y211-V255 HydrophobicContact CD1-CG2 4.26Å; Y211-K256 CarbonylContact C-O 3.39Å; Y211-K256 WeakPolarHBondContact CA-O 3.47Å; Y211-A257 HydrophobicContact CD1-CB 3.87Å; Y211-A257 HydrophobicContact CE1-CB 3.77Å
212	L	65.2	Low	60.8	Low	33 Å²	33	69.3 Å²	69.3	17%	0.173	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	100.3	167.7	-169.7	91.3	0	0	0	108.3	V214 V229 V255 K256 Y258 F267	L212-V214 HydrophobicContact CD2-CG2 4.25Å; L212-V214 HydrophobicContact CG-CG2 4.49Å; L212-V229 HydrophobicContact CD1-CG1 3.12Å; L212-V229 HydrophobicContact CG-CG1 3.9Å; L212-V255 CarbonylContact O-C 3.56Å; L212-V255 WeakPolarHBondContact O-CA 3.47Å; L212-K256 HydrophobicContact CB-CB 4.27Å; L212-K256 PolarHBondContact N-O 2.74Å; L212-K256 PolarHBondContact O-N 3.16Å; L212-Y258 HydrophobicContact CB-CD2 4.31Å; L212-Y258 HydrophobicContact CB-CE2 3.7Å; L212-Y258 HydrophobicContact CD2-CE2 4.32Å; L212-Y258 HydrophobicContact CG-CE2 4.44Å; L212-F267 HydrophobicContact CD2-CE1 4.13Å; L212-F267 HydrophobicContact CD2-CZ 3.93Å
213	L	67.5	Low	59.6	Low	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	127.4	171.5	177.5	66.3	0	0	0	109.4	L195 M230 L238 Y253	L195-L213 HydrophobicContact CD2-CD1 3.58Å; L195-L213 HydrophobicContact CD2-CD2 3.78Å; L195-L213 HydrophobicContact CD2-CG 4.29Å; L213-M230 HydrophobicContact CD2-SD 4.43Å; L213-M230 PolarHBondContact N-O 2.9Å; L213-L238 HydrophobicContact CD1-CD2 4.33Å; L213-Y253 HydrophobicContact CD1-CD1 4.32Å
214	V	67.1	Low	58.6	Low	7 Å²	7	68.7 Å²	68.7	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.8	175.5	176.6	0	0	0	0	109.1	L212 I216 I226 Y253 K254 F267	L212-V214 HydrophobicContact CD2-CG2 4.25Å; L212-V214 HydrophobicContact CG-CG2 4.49Å; V214-I216 HydrophobicContact CG1-CD1 4.31Å; V214-I216 HydrophobicContact CG1-CG1 4.02Å; V214-I226 HydrophobicContact CG1-CG2 4.34Å; V214-Y253 WeakPolarHBondContact O-CA 3.42Å; V214-K254 HydrophobicContact CB-CG 3.83Å; V214-K254 HydrophobicContact CG1-CG 4.32Å; V214-K254 PolarHBondContact N-O 2.92Å; V214-K254 PolarHBondContact O-N 2.86Å; V214-K254 VanDerWaalsContact O-N 3.11Å; V214-F267 HydrophobicContact CB-CE1 4.36Å; V214-F267 HydrophobicContact CG2-CE1 3.61Å; V214-F267 HydrophobicContact CG2-CZ 3.89Å
215	R	72.4	Confident	57.4	Low	7 Å²	7	72 Å²	72	3%	0.026	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.6	171.3	178.2	-179.4	64.9	176.8	-1	110	L227 S228 D244 Y251 Y253	R215-L227 PolarHBondContact O-N 2.93Å; R215-S228 PolarHBondContact NE-OG 2.83Å; R215-D244 IonicContact CZ-OD1 3.71Å; R215-D244 IonicContact CZ-OD2 3.4Å; R215-D244 PolarHBondContact NH1-O 2.83Å; R215-D244 IonicContact NH1-OD1 2.73Å; R215-D244 PolarHBondContact NH1-OD1 2.79Å; R215-D244 IonicContact NH1-OD2 3.06Å; R215-D244 PolarHBondContact NH1-OD2 3.29Å; R215-D244 IonicContact NH2-OD1 3.81Å; R215-D244 IonicContact NH2-OD2 2.78Å; R215-D244 PolarHBondContact NH2-OD2 3.34Å; R215-Y251 HydrophobicContact CG-CD1 3.93Å; R215-Y253 HydrophobicContact CB-CD1 4.01Å; R215-Y253 HydrophobicContact CB-CE1 3.73Å; R215-Y253 WeakPolarHBondContact CD-OH 3.43Å; R215-Y253 HydrophobicContact CG-CD1 4.17Å; R215-Y253 HydrophobicContact CG-CE1 3.52Å
216	I	70.7	Confident	56.3	Low	23 Å²	23	75.1 Å²	75.1	12%	0.118	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.4	176.4	-62.6	161.8	0	0	0	108.5	V214 V224 Y251 I252	V214-I216 HydrophobicContact CG1-CD1 4.31Å; V214-I216 HydrophobicContact CG1-CG1 4.02Å; I216-V224 HydrophobicContact CD1-CG1 4.22Å; I216-V224 HydrophobicContact CG1-CG1 4.03Å; I216-V224 HydrophobicContact CG2-CG1 3.82Å; I216-Y251 CarbonylContact O-C 3.15Å; I216-Y251 WeakPolarHBondContact O-CA 3.3Å; I216-I252 HydrophobicContact CB-CB 4.17Å; I216-I252 PolarHBondContact N-O 2.88Å; I216-I252 PolarHBondContact O-N 2.77Å
217	H	67.5	Low	55.4	Low	16 Å²	16	72.7 Å²	72.7	7%	0.074	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.5	172	-179.1	-104.8	0	0	0	110.1	R219 L227 Q249 Y251	H217-R219 VanDerWaalsContact CE1-CG 3.47Å; H217-R219 WeakPolarHBondContact CE1-CG 3.32Å; H217-R219 PolarHBondContact O-N 2.97Å; H217-L227 HydrophobicContact CB-CD1 3.48Å; H217-L227 VanDerWaalsContact CB-CD1 3.48Å; H217-L227 HydrophobicContact CB-CG 4.2Å; H217-Q249 WeakPolarHBondContact NE2-CB 3.28Å; H217-Q249 WeakPolarHBondContact NE2-CG 3.41Å; H217-Q249 PolarHBondContact NE2-OE1 2.84Å; H217-Y251 HydrophobicContact CB-CD1 4.23Å; H217-Y251 HydrophobicContact CB-CE1 4.03Å; H217-Y251 AromaticContact CD2-CE1 3.44Å; H217-Y251 VanDerWaalsContact CD2-CE1 3.44Å; H217-Y251 WeakPolarHBondContact CD2-CE1 3.44Å; H217-Y251 AromaticContact CD2-CE2 3.98Å; H217-Y251 AromaticContact CD2-CZ 3.41Å; H217-Y251 VanDerWaalsContact CD2-CZ 3.41Å
218	R	60.3	Low	54.3	Low	119 Å²	119	73.2 Å²	73.2	45%	0.449	36%	0.361	S	S	.	.			trans	-84.7	91.8	175.8	-96.4	-171.6	170.4	152.3	8.5	109.4	N250 I252 E272	R218-N250 HydrophobicContact CB-CB 4.36Å; R218-N250 PolarHBondContact N-O 2.86Å; R218-N250 VanDerWaalsContact N-O 3.13Å; R218-I252 HydrophobicContact CG-CD1 4.05Å; R218-E272 IonicContact CZ-OE1 3.4Å; R218-E272 IonicContact CZ-OE2 3.9Å; R218-E272 IonicContact NH1-OE1 2.98Å; R218-E272 PolarHBondContact NH1-OE1 2.77Å; R218-E272 IonicContact NH1-OE2 2.81Å; R218-E272 PolarHBondContact NH1-OE2 2.94Å; R218-E272 IonicContact NH2-OE1 3.21Å; R218-E272 PolarHBondContact NH2-OE1 2.99Å
219	R	53.8	Low	52.9	Low	185 Å²	185	76.7 Å²	76.7	70%	0.698	38%	0.382	S	S	*	.			trans	-81.8	146.5	152.7	-80.8	-176.3	176.6	176.8	0.3	109.3	H217 K221	H217-R219 VanDerWaalsContact CE1-CG 3.47Å; H217-R219 WeakPolarHBondContact CE1-CG 3.32Å; H217-R219 PolarHBondContact O-N 2.97Å; R219-K221 PolarHBondContact O-N 2.94Å
220	L	39.2	Very low	52.1	Low	178 Å²	178	77.2 Å²	77.2	93%	0.932	38%	0.381	S	S	*	.	S	Bend	trans	-48	100.6	175.8	-70.9	158	0	0	0	111.3
221	K	40.6	Very low	50.9	Low	200 Å²	200	82.6 Å²	82.6	87%	0.87	40%	0.404	S	S	*	.	S	Bend	trans	53.3	138.4	165.1	-65	-177.6	175.9	179.5	0	119	R219	R219-K221 PolarHBondContact O-N 2.94Å
222	P	37.5	Very low	50.1	Low	125 Å²	125	85.4 Å²	85.4	81%	0.812	42%	0.415	S	S	*	.	S	Bend	cis	-114	19	-28.1	39.9	-26.2	0	0	0	112.4	V224	P222-V224 PolarHBondContact O-N 3.12Å
223	K	34.4	Very low	49.1	Very low	176 Å²	176	93.9 Å²	93.9	77%	0.765	44%	0.444	S	S	*	.			trans	-88.5	105.9	-177.7	-72.4	-172.9	176.9	-176.9	0	111	I225	K223-I225 PolarHBondContact O-N 3.36Å
224	V	37.3	Very low	48.2	Very low	102 Å²	102	94.5 Å²	94.5	62%	0.618	45%	0.448	S	S	*	.			trans	-67.5	110.8	164.2	174	0	0	0	0	107.5	I216 P222	I216-V224 HydrophobicContact CD1-CG1 4.22Å; I216-V224 HydrophobicContact CG1-CG1 4.03Å; I216-V224 HydrophobicContact CG2-CG1 3.82Å; P222-V224 PolarHBondContact O-N 3.12Å
225	I	39.3	Very low	47.4	Very low	88 Å²	88	98.8 Å²	98.8	45%	0.451	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	111.9	170.8	-57.6	175.8	0	0	0	107	K223 L227	K223-I225 PolarHBondContact O-N 3.36Å; I225-L227 HydrophobicContact CG2-CD2 3.76Å; I225-L227 HydrophobicContact CG2-CG 4.25Å; I225-L227 PolarHBondContact O-N 2.9Å
226	I	42.1	Very low	46.4	Very low	103 Å²	103	98.5 Å²	98.5	53%	0.528	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	106.7	166.4	-61.7	173	0	0	0	105.9	V214 V229	V214-I226 HydrophobicContact CG1-CG2 4.34Å; I226-V229 HydrophobicContact CG2-CG2 3.83Å
227	L	44.2	Very low	45.6	Very low	72 Å²	72	99 Å²	99	38%	0.377	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-24.8	-173.4	-76.1	175.8	0	0	0	113	R215 H217 I225 Y251	R215-L227 PolarHBondContact O-N 2.93Å; H217-L227 HydrophobicContact CB-CD1 3.48Å; H217-L227 VanDerWaalsContact CB-CD1 3.48Å; H217-L227 HydrophobicContact CB-CG 4.2Å; I225-L227 HydrophobicContact CG2-CD2 3.76Å; I225-L227 HydrophobicContact CG2-CG 4.25Å; I225-L227 PolarHBondContact O-N 2.9Å; L227-Y251 HydrophobicContact CD1-CE1 3.89Å
228	S	41.6	Very low	45.2	Very low	23 Å²	23	98.3 Å²	98.3	16%	0.161	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	144.1	177.5	50.3	0	0	0	0	110.6	R215	R215-S228 PolarHBondContact NE-OG 2.83Å
229	V	38.7	Very low	45.2	Very low	85 Å²	85	95 Å²	95	52%	0.515	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	107.7	167	173.3	0	0	0	0	105.7	L212 I226	L212-V229 HydrophobicContact CD1-CG1 3.12Å; L212-V229 HydrophobicContact CG-CG1 3.9Å; I226-V229 HydrophobicContact CG2-CG2 3.83Å
230	M	46.8	Very low	45.4	Very low	51 Å²	51	87.5 Å²	87.5	25%	0.251	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.4	-176.9	-66	165.6	170.9	0	0	109.4	Y211 L213 Y232 N240 I242	Y211-M230 VanDerWaalsContact O-O 3.07Å; L213-M230 HydrophobicContact CD2-SD 4.43Å; L213-M230 PolarHBondContact N-O 2.9Å; M230-Y232 HydrophobicContact CB-CD2 4.13Å; M230-Y232 HydrophobicContact CB-CE2 3.31Å; M230-Y232 HydrophobicContact CG-CE2 4.34Å; M230-Y232 HydrophobicContact SD-CE2 4.28Å; M230-Y232 PolarHBondContact SD-OH 3.13Å; M230-N240 PolarHBondContact SD-ND2 2.95Å; M230-I242 HydrophobicContact CE-CD1 3.96Å; M230-I242 HydrophobicContact SD-CD1 4.03Å
231	K	38.4	Very low	46.1	Very low	141 Å²	141	81 Å²	81	61%	0.613	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	112.2	176.8	-176.6	173.2	-178.8	174.1	0	109.3	H210 Y211	H210-K231 HydrophobicContact CB-CD 4.44Å; H210-K231 HydrophobicContact CB-CG 3.73Å; H210-K231 VanDerWaalsContact CG-CE 3.41Å; Y211-K231 WeakPolarHBondContact O-CA 3.41Å
232	Y	48	Very low	47.1	Very low	59 Å²	59	71.6 Å²	71.6	23%	0.231	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.6	178.1	-65.2	-76.1	0	0	0	110.3	H210 Y211 M230 L238 N240	H210-Y232 CarbonylContact C-O 3.5Å; H210-Y232 WeakPolarHBondContact CA-O 3.28Å; H210-Y232 VanDerWaalsContact CB-O 3.26Å; H210-Y232 WeakPolarHBondContact CB-O 3.47Å; Y211-Y232 PolarHBondContact N-O 3.45Å; Y211-Y232 VanDerWaalsContact N-O 3.11Å; Y211-Y232 PolarHBondContact O-N 2.93Å; M230-Y232 HydrophobicContact CB-CD2 4.13Å; M230-Y232 HydrophobicContact CB-CE2 3.31Å; M230-Y232 HydrophobicContact CG-CE2 4.34Å; M230-Y232 HydrophobicContact SD-CE2 4.28Å; M230-Y232 PolarHBondContact SD-OH 3.13Å; Y232-L238 HydrophobicContact CD2-CD1 3.41Å; Y232-L238 VanDerWaalsContact CD2-CD1 3.41Å; Y232-L238 HydrophobicContact CE2-CD1 3.79Å; Y232-L238 HydrophobicContact CG-CD1 4.01Å; Y232-N240 PolarHBondContact OH-ND2 3.24Å; Y232-N240 PolarHBondContact OH-OD1 2.9Å
233	R	43.3	Very low	48.1	Very low	211 Å²	211	69.7 Å²	69.7	80%	0.796	35%	0.345	S	S	*	.			trans	-81.8	116.6	162.3	-84.9	-176.8	171.8	179.1	-2	106.8
234	V	49.1	Very low	49.5	Very low	14 Å²	14	64.8 Å²	64.8	9%	0.085	33%	0.327	C	S	.	.			trans	-146	149.9	-178.4	-161.7	0	0	0	0	111.1	H12 L208 Y211 G236 H237	H12-V234 WeakPolarHBondContact CE1-CG1 3.11Å; H12-V234 WeakPolarHBondContact NE2-CG1 2.88Å; L208-V234 VanDerWaalsContact CD2-O 3.31Å; L208-V234 WeakPolarHBondContact CD2-O 3.32Å; Y211-V234 HydrophobicContact CD2-CG2 4.34Å; Y211-V234 HydrophobicContact CE2-CB 4.3Å; Y211-V234 HydrophobicContact CE2-CG2 4.34Å; V234-G236 PolarHBondContact O-N 2.69Å; V234-H237 VanDerWaalsContact CB-O 3.27Å; V234-H237 WeakPolarHBondContact CB-O 3.27Å; V234-H237 WeakPolarHBondContact CG1-O 3.31Å; V234-H237 WeakPolarHBondContact CG2-O 3.36Å
235	D	51.3	Low	51.1	Low	96 Å²	96	60.7 Å²	60.7	51%	0.513	30%	0.301	S	S	.	.	S	Bend	trans	-65.4	41	170.3	-54.2	-21.3	0	0	0	113.2
236	G	49.9	Very low	52.7	Low	1 Å²	1	59.5 Å²	59.5	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	104	-2.3	172.5	0	0	0	0	0	117.7	Y211 V234	Y211-G236 PolarHBondContact OH-O 3.34Å; V234-G236 PolarHBondContact O-N 2.69Å
237	H	55.2	Low	54.3	Low	34 Å²	34	58.8 Å²	58.8	16%	0.157	30%	0.295	C	S	.	.			trans	-135	145.4	-173.3	-51.7	-68.5	0	0	0	114.2	F14 N198 Y211 V234	F14-H237 AromaticContact CD1-CD2 3.9Å; F14-H237 HydrophobicContact CE1-CB 3.92Å; F14-H237 AromaticContact CE1-CD2 3Å; F14-H237 WeakPolarHBondContact CE1-CD2 3.34Å; F14-H237 AromaticContact CE1-CG 3.54Å; F14-H237 AromaticContact CE1-NE2 3.72Å; F14-H237 HydrophobicContact CZ-CB 4.45Å; F14-H237 AromaticContact CZ-CD2 3.34Å; F14-H237 WeakPolarHBondContact CZ-CD2 3.24Å; N198-H237 PolarHBondContact ND2-CE1 3.1Å; N198-H237 PolarHBondContact ND2-ND1 2.79Å; N198-H237 PolarHBondContact OD1-CE1 3.04Å; N198-H237 PolarHBondContact OD1-ND1 2.99Å; Y211-H237 PolarHBondContact OH-N 2.95Å; V234-H237 VanDerWaalsContact CB-O 3.27Å; V234-H237 WeakPolarHBondContact CB-O 3.27Å; V234-H237 WeakPolarHBondContact CG1-O 3.31Å; V234-H237 WeakPolarHBondContact CG2-O 3.36Å
238	L	58.6	Low	55.8	Low	1 Å²	1	59.8 Å²	59.8	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	116.4	169.3	176.2	70.9	0	0	0	108.5	L182 S196 W197 Y211 L213 Y232 V255	L182-L238 HydrophobicContact CD1-CD2 4.44Å; S196-L238 CarbonylContact C-O 3.56Å; S196-L238 VanDerWaalsContact CA-O 3.26Å; S196-L238 WeakPolarHBondContact CA-O 3.36Å; W197-L238 HydrophobicContact CB-CB 4.07Å; W197-L238 HydrophobicContact CB-CD2 4.49Å; W197-L238 PolarHBondContact N-O 2.91Å; W197-L238 PolarHBondContact O-N 3.13Å; Y211-L238 HydrophobicContact CD2-CB 4.08Å; Y211-L238 HydrophobicContact CD2-CD1 4.43Å; Y211-L238 HydrophobicContact CE2-CB 4.27Å; Y211-L238 HydrophobicContact CG-CB 4.49Å; L213-L238 HydrophobicContact CD1-CD2 4.33Å; Y232-L238 HydrophobicContact CD2-CD1 3.41Å; Y232-L238 VanDerWaalsContact CD2-CD1 3.41Å; Y232-L238 HydrophobicContact CE2-CD1 3.79Å; Y232-L238 HydrophobicContact CG-CD1 4.01Å; L238-V255 HydrophobicContact CD2-CB 4.31Å; L238-V255 HydrophobicContact CD2-CG2 3.86Å
239	N	60.2	Low	57.6	Low	50 Å²	50	61.6 Å²	61.6	27%	0.267	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	120	168.4	-74.2	-31.1	0	0	0	107.6	L195 S196	L195-N239 WeakPolarHBondContact O-CA 2.91Å; S196-N239 WeakPolarHBondContact CB-OD1 3.46Å; S196-N239 PolarHBondContact OG-OD1 2.9Å
240	N	57.4	Low	59.7	Low	27 Å²	27	61.2 Å²	61.2	14%	0.144	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	147	-173.5	-166.4	18.3	0	0	0	112.2	L195 M230 Y232 I242	L195-N240 HydrophobicContact CB-CB 4.48Å; L195-N240 PolarHBondContact N-O 2.91Å; L195-N240 PolarHBondContact O-N 2.82Å; M230-N240 PolarHBondContact SD-ND2 2.95Å; Y232-N240 PolarHBondContact OH-ND2 3.24Å; Y232-N240 PolarHBondContact OH-OD1 2.9Å; N240-I242 WeakPolarHBondContact ND2-CD1 3.43Å
241	I	53.9	Low	61.3	Low	42 Å²	42	59.1 Å²	59.1	22%	0.215	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.1	177.9	-53.4	-171.3	0	0	0	108.3	N8 I192 L194 T243	N8-I241 WeakPolarHBondContact O-CD1 3.49Å; I192-I241 HydrophobicContact CG2-CG2 3.38Å; L194-I241 HydrophobicContact CD2-CB 4.35Å; L194-I241 HydrophobicContact CD2-CD1 3.95Å; L194-I241 HydrophobicContact CD2-CG1 3.7Å; L194-I241 HydrophobicContact CD2-CG2 4.1Å; I241-T243 HydrophobicContact CG2-CG2 3.84Å
242	I	62.5	Low	63.4	Low	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	111.6	177.9	-53.9	-63.9	0	0	0	107.8	I192 H193 L195 M230 N240 D244 I245 Y253	I192-I242 WeakPolarHBondContact CA-O 3.32Å; H193-I242 HydrophobicContact CB-CB 4.41Å; H193-I242 PolarHBondContact N-O 3.49Å; H193-I242 PolarHBondContact O-N 3.17Å; L195-I242 HydrophobicContact CD1-CB 4.34Å; L195-I242 HydrophobicContact CD1-CD1 4.37Å; L195-I242 HydrophobicContact CD1-CG1 3.36Å; M230-I242 HydrophobicContact CE-CD1 3.96Å; M230-I242 HydrophobicContact SD-CD1 4.03Å; N240-I242 WeakPolarHBondContact ND2-CD1 3.43Å; I242-D244 WeakPolarHBondContact CG2-OD1 3.44Å; I242-I245 HydrophobicContact CG2-CG2 3.67Å; I242-Y253 HydrophobicContact CG1-CE1 4.39Å
243	T	58.9	Low	65	Low	86 Å²	86	50.3 Å²	50.3	53%	0.528	26%	0.255	S	S	.	.			trans	-109.2	-11.3	-179.2	57.7	0	0	0	0	112.9	I192 I241 I245	I192-T243 HydrophobicContact CD1-CG2 4.29Å; I192-T243 HydrophobicContact CG1-CG2 4.11Å; I192-T243 HydrophobicContact CG2-CG2 4.17Å; I241-T243 HydrophobicContact CG2-CG2 3.84Å; T243-I245 PolarHBondContact O-N 2.82Å; T243-I245 VanDerWaalsContact O-N 3.16Å
244	D	62.6	Low	66.8	Low	73 Å²	73	43.1 Å²	43.1	39%	0.39	23%	0.23	S	C	.	.			trans	-88.1	50	177.5	68.9	-40.5	0	0	0	111.5	R215 I242 M304	R215-D244 IonicContact CZ-OD1 3.71Å; R215-D244 IonicContact CZ-OD2 3.4Å; R215-D244 PolarHBondContact NH1-O 2.83Å; R215-D244 IonicContact NH1-OD1 2.73Å; R215-D244 PolarHBondContact NH1-OD1 2.79Å; R215-D244 IonicContact NH1-OD2 3.06Å; R215-D244 PolarHBondContact NH1-OD2 3.29Å; R215-D244 IonicContact NH2-OD1 3.81Å; R215-D244 IonicContact NH2-OD2 2.78Å; R215-D244 PolarHBondContact NH2-OD2 3.34Å; I242-D244 WeakPolarHBondContact CG2-OD1 3.44Å; D244-M304 HydrophobicContact CB-CE 3.94Å
245	I	70.6	Confident	68	Low	15 Å²	15	42.4 Å²	42.4	8%	0.077	23%	0.225	C	C	.	.			trans	-116.4	149.5	177.5	55.8	178.1	0	0	0	111.5	S191 H193 I242 T243 Y251 T275	S191-I245 VanDerWaalsContact O-CD1 3.27Å; S191-I245 WeakPolarHBondContact O-CD1 3.38Å; S191-I245 WeakPolarHBondContact O-CG1 3.41Å; H193-I245 HydrophobicContact CB-CD1 4.16Å; H193-I245 WeakPolarHBondContact CD2-CD1 3.45Å; H193-I245 VanDerWaalsContact CG-CD1 3.43Å; H193-I245 WeakPolarHBondContact NE2-CD1 3.46Å; I242-I245 HydrophobicContact CG2-CG2 3.67Å; T243-I245 PolarHBondContact O-N 2.82Å; T243-I245 VanDerWaalsContact O-N 3.16Å; I245-Y251 WeakPolarHBondContact CA-OH 3.44Å; I245-Y251 HydrophobicContact CB-CD2 4.47Å; I245-Y251 HydrophobicContact CB-CE1 4.41Å; I245-Y251 HydrophobicContact CB-CE2 3.65Å; I245-Y251 HydrophobicContact CG2-CD1 4.3Å; I245-Y251 HydrophobicContact CG2-CD2 4.27Å; I245-Y251 HydrophobicContact CG2-CE1 3.78Å; I245-Y251 HydrophobicContact CG2-CE2 3.76Å; I245-Y251 VanDerWaalsContact CG2-CZ 3.49Å; I245-T275 HydrophobicContact CD1-CG2 3.58Å; I245-T275 HydrophobicContact CG1-CG2 3.96Å
246	S	73.2	Confident	69.3	Low	64 Å²	64	39.2 Å²	39.2	45%	0.448	21%	0.207	S	C	.	.			trans	-87.3	136.6	177.2	-62.9	0	0	0	0	110	Q249 Y251 T275	S246-Q249 VanDerWaalsContact CB-CG 3.48Å; S246-Q249 WeakPolarHBondContact O-CB 3.41Å; S246-Q249 PolarHBondContact O-N 2.87Å; S246-Y251 PolarHBondContact N-OH 3.02Å; S246-T275 VanDerWaalsContact O-CB 3.31Å; S246-T275 WeakPolarHBondContact O-CB 3.31Å; S246-T275 WeakPolarHBondContact O-CG2 3.38Å; S246-T275 PolarHBondContact O-OG1 3.11Å
247	E	75.9	Confident	70.5	Confident	87 Å²	87	39.2 Å²	39.2	41%	0.407	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	145.9	171.8	-72.9	176.4	-141.7	0	0	111.7	S191 Q249 A278	S191-E247 WeakPolarHBondContact OG-CG 3.38Å; E247-Q249 PolarHBondContact O-N 3.32Å; E247-Q249 VanDerWaalsContact O-N 3.11Å; E247-A278 HydrophobicContact CG-CB 4.38Å; E247-A278 VanDerWaalsContact OE1-CB 3.24Å; E247-A278 WeakPolarHBondContact OE1-CB 3.34Å; E247-A278 PolarHBondContact OE2-N 3.47Å
248	D	76.7	Confident	71.2	Confident	94 Å²	94	40.4 Å²	40.4	50%	0.503	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	29.4	176.7	-160.7	37.7	0	0	0	114.1	Q274 T275 M277	D248-Q274 PolarHBondContact O-NE2 2.97Å; D248-Q274 PolarHBondContact OD1-NE2 2.86Å; D248-T275 WeakPolarHBondContact CA-O 3.41Å; D248-T275 PolarHBondContact N-O 3.37Å; D248-M277 HydrophobicContact CB-CG 4.01Å
249	Q	79.1	Confident	71.8	Confident	60 Å²	60	40.7 Å²	40.7	28%	0.28	21%	0.211	S	C	.	.			trans	-111.3	146	175	-61.1	-53.7	-65.4	0	0	113.2	H217 S246 E247 Y251 Q274 T275	H217-Q249 WeakPolarHBondContact NE2-CB 3.28Å; H217-Q249 WeakPolarHBondContact NE2-CG 3.41Å; H217-Q249 PolarHBondContact NE2-OE1 2.84Å; S246-Q249 VanDerWaalsContact CB-CG 3.48Å; S246-Q249 WeakPolarHBondContact O-CB 3.41Å; S246-Q249 PolarHBondContact O-N 2.87Å; E247-Q249 PolarHBondContact O-N 3.32Å; E247-Q249 VanDerWaalsContact O-N 3.11Å; Q249-Y251 HydrophobicContact CB-CD2 4.34Å; Q249-Y251 HydrophobicContact CB-CE2 3.7Å; Q249-Y251 WeakPolarHBondContact O-CD2 3.44Å; Q249-Q274 PolarHBondContact O-OE1 2.94Å; Q249-T275 PolarHBondContact O-N 2.83Å; Q249-T275 PolarHBondContact O-OG1 3.44Å
250	N	82	Confident	72.1	Confident	78 Å²	78	45 Å²	45	42%	0.417	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	123.8	174.9	-79.5	-70.2	0	0	0	110.9	R218 Q274	R218-N250 HydrophobicContact CB-CB 4.36Å; R218-N250 PolarHBondContact N-O 2.86Å; R218-N250 VanDerWaalsContact N-O 3.13Å; N250-Q274 VanDerWaalsContact N-OE1 3.16Å; N250-Q274 PolarHBondContact ND2-OE1 2.99Å; N250-Q274 PolarHBondContact OD1-OE1 2.81Å
251	Y	81.2	Confident	72.5	Confident	6 Å²	6	48.5 Å²	48.5	2%	0.024	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148.2	174	-69	-93	0	0	0	110.9	H193 R215 I216 H217 L227 I245 S246 Q249 Y253 E272 I273 T275	H193-Y251 AromaticContact CE1-CD2 3.69Å; R215-Y251 HydrophobicContact CG-CD1 3.93Å; I216-Y251 CarbonylContact O-C 3.15Å; I216-Y251 WeakPolarHBondContact O-CA 3.3Å; H217-Y251 HydrophobicContact CB-CD1 4.23Å; H217-Y251 HydrophobicContact CB-CE1 4.03Å; H217-Y251 AromaticContact CD2-CE1 3.44Å; H217-Y251 VanDerWaalsContact CD2-CE1 3.44Å; H217-Y251 WeakPolarHBondContact CD2-CE1 3.44Å; H217-Y251 AromaticContact CD2-CE2 3.98Å; H217-Y251 AromaticContact CD2-CZ 3.41Å; H217-Y251 VanDerWaalsContact CD2-CZ 3.41Å; L227-Y251 HydrophobicContact CD1-CE1 3.89Å; I245-Y251 WeakPolarHBondContact CA-OH 3.44Å; I245-Y251 HydrophobicContact CB-CD2 4.47Å; I245-Y251 HydrophobicContact CB-CE1 4.41Å; I245-Y251 HydrophobicContact CB-CE2 3.65Å; I245-Y251 HydrophobicContact CG2-CD1 4.3Å; I245-Y251 HydrophobicContact CG2-CD2 4.27Å; I245-Y251 HydrophobicContact CG2-CE1 3.78Å; I245-Y251 HydrophobicContact CG2-CE2 3.76Å; I245-Y251 VanDerWaalsContact CG2-CZ 3.49Å; S246-Y251 PolarHBondContact N-OH 3.02Å; Q249-Y251 HydrophobicContact CB-CD2 4.34Å; Q249-Y251 HydrophobicContact CB-CE2 3.7Å; Q249-Y251 WeakPolarHBondContact O-CD2 3.44Å; Y251-Y253 HydrophobicContact CG-CE2 4.48Å; Y251-E272 WeakPolarHBondContact O-CA 3.35Å; Y251-I273 PolarHBondContact N-O 2.98Å; Y251-I273 PolarHBondContact O-N 3.21Å; Y251-T275 VanDerWaalsContact CD2-OG1 3.3Å; Y251-T275 WeakPolarHBondContact CD2-OG1 3.29Å; Y251-T275 VanDerWaalsContact CE2-OG1 3.25Å; Y251-T275 WeakPolarHBondContact CE2-OG1 3.33Å
252	I	82.7	Confident	73	Confident	16 Å²	16	51.8 Å²	51.8	8%	0.082	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.8	172	-51.8	-179.4	0	0	0	108.2	I216 R218 R270 V271 E272	I216-I252 HydrophobicContact CB-CB 4.17Å; I216-I252 PolarHBondContact N-O 2.88Å; I216-I252 PolarHBondContact O-N 2.77Å; R218-I252 HydrophobicContact CG-CD1 4.05Å; I252-R270 HydrophobicContact CG2-CB 3.78Å; I252-V271 WeakPolarHBondContact CA-O 3.12Å; I252-E272 HydrophobicContact CD1-CG 4.3Å; I252-E272 HydrophobicContact CG1-CG 4.02Å; I252-E272 HydrophobicContact CG2-CG 4.49Å
253	Y	81.3	Confident	73.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	143	176	-63.8	-84.3	0	0	0	110.9	V184 H193 L195 L213 V214 R215 I242 Y251 V271 I273	V184-Y253 HydrophobicContact CB-CD2 4.48Å; V184-Y253 HydrophobicContact CG1-CD2 3.91Å; V184-Y253 HydrophobicContact CG1-CE2 4.04Å; V184-Y253 HydrophobicContact CG2-CD2 4Å; V184-Y253 HydrophobicContact CG2-CG 4.16Å; H193-Y253 AromaticContact ND1-CE2 3.42Å; H193-Y253 WeakPolarHBondContact ND1-CE2 3.39Å; H193-Y253 AromaticContact ND1-CZ 3.63Å; H193-Y253 PolarHBondContact ND1-OH 3.2Å; H193-Y253 VanDerWaalsContact ND1-OH 3.12Å; L195-Y253 HydrophobicContact CD1-CE1 4.23Å; L195-Y253 HydrophobicContact CD2-CD1 3.46Å; L195-Y253 VanDerWaalsContact CD2-CD1 3.46Å; L195-Y253 HydrophobicContact CD2-CE1 3.94Å; L195-Y253 HydrophobicContact CD2-CG 3.77Å; L195-Y253 HydrophobicContact CG-CD1 4.47Å; L213-Y253 HydrophobicContact CD1-CD1 4.32Å; V214-Y253 WeakPolarHBondContact O-CA 3.42Å; R215-Y253 HydrophobicContact CB-CD1 4.01Å; R215-Y253 HydrophobicContact CB-CE1 3.73Å; R215-Y253 WeakPolarHBondContact CD-OH 3.43Å; R215-Y253 HydrophobicContact CG-CD1 4.17Å; R215-Y253 HydrophobicContact CG-CE1 3.52Å; I242-Y253 HydrophobicContact CG1-CE1 4.39Å; Y251-Y253 HydrophobicContact CG-CE2 4.48Å; Y253-V271 PolarHBondContact N-O 2.79Å; Y253-V271 PolarHBondContact O-N 3.02Å; Y253-I273 HydrophobicContact CD2-CG2 3.94Å; Y253-I273 HydrophobicContact CE2-CG2 3.67Å
254	K	80.2	Confident	73.8	Confident	59 Å²	59	54.8 Å²	54.8	26%	0.257	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	149	168.5	62.4	-178.2	-175.1	173.2	0	109.9	V214 F267 S268	V214-K254 HydrophobicContact CB-CG 3.83Å; V214-K254 HydrophobicContact CG1-CG 4.32Å; V214-K254 PolarHBondContact N-O 2.92Å; V214-K254 PolarHBondContact O-N 2.86Å; V214-K254 VanDerWaalsContact O-N 3.11Å; K254-F267 HydrophobicContact CB-CD1 4.12Å; K254-F267 HydrophobicContact CD-CB 4.14Å; K254-F267 HydrophobicContact CD-CD1 3.65Å; K254-F267 HydrophobicContact CD-CD2 4.37Å; K254-F267 HydrophobicContact CD-CE1 4.12Å; K254-F267 HydrophobicContact CD-CG 3.8Å; K254-F267 HydrophobicContact CG-CD1 3.63Å; K254-F267 HydrophobicContact CG-CE1 4.02Å; K254-F267 HydrophobicContact CG-CG 4.26Å; K254-S268 WeakPolarHBondContact CA-OG 3.31Å
255	V	75.5	Confident	74.4	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	152.2	-177.8	56.3	0	0	0	0	110.7	V179 L182 W197 Y211 L212 L238 F267 S268	V179-V255 HydrophobicContact CG1-CB 4.39Å; V179-V255 HydrophobicContact CG1-CG1 3.41Å; V179-V255 VanDerWaalsContact CG1-CG1 3.41Å; V179-V255 HydrophobicContact CG1-CG2 4.33Å; L182-V255 HydrophobicContact CB-CG1 4.08Å; L182-V255 HydrophobicContact CD1-CG1 4.05Å; L182-V255 HydrophobicContact CD2-CG1 4.15Å; L182-V255 HydrophobicContact CG-CG1 4.31Å; W197-V255 HydrophobicContact CG-CG1 4.48Å; Y211-V255 HydrophobicContact CD1-CG2 4.26Å; L212-V255 CarbonylContact O-C 3.56Å; L212-V255 WeakPolarHBondContact O-CA 3.47Å; L238-V255 HydrophobicContact CD2-CB 4.31Å; L238-V255 HydrophobicContact CD2-CG2 3.86Å; V255-F267 CarbonylContact O-C 3.54Å; V255-F267 WeakPolarHBondContact O-CA 3.17Å; V255-S268 PolarHBondContact N-OG 3.36Å; V255-S268 PolarHBondContact O-N 2.99Å
256	K	77.2	Confident	74.8	Confident	29 Å²	29	56.4 Å²	56.4	13%	0.126	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139.7	173.5	-174.6	-175.1	-168.4	-170.8	0	109.4	Y211 L212 Y258 T265 F267	Y211-K256 CarbonylContact C-O 3.39Å; Y211-K256 WeakPolarHBondContact CA-O 3.47Å; L212-K256 HydrophobicContact CB-CB 4.27Å; L212-K256 PolarHBondContact N-O 2.74Å; L212-K256 PolarHBondContact O-N 3.16Å; K256-Y258 HydrophobicContact CB-CE2 4.5Å; K256-Y258 HydrophobicContact CD-CE2 3.92Å; K256-Y258 HydrophobicContact CG-CE2 4.12Å; K256-T265 WeakPolarHBondContact CE-O 3.48Å; K256-T265 WeakPolarHBondContact CG-O 3.38Å; K256-F267 HydrophobicContact CB-CD1 3.77Å; K256-F267 HydrophobicContact CB-CE1 3.79Å; K256-F267 HydrophobicContact CB-CG 4.37Å; K256-F267 HydrophobicContact CB-CZ 4.42Å; K256-F267 HydrophobicContact CD-CE1 4.47Å; K256-F267 HydrophobicContact CD-CE2 4.38Å; K256-F267 HydrophobicContact CD-CZ 4.3Å
257	A	74.9	Confident	75	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	146.7	179.1	0	0	0	0	0	111.4	V179 L208 Y211 F259 K264 T265	V179-A257 HydrophobicContact CG2-CB 3.89Å; L208-A257 HydrophobicContact CD1-CB 4.1Å; Y211-A257 HydrophobicContact CD1-CB 3.87Å; Y211-A257 HydrophobicContact CE1-CB 3.77Å; A257-F259 HydrophobicContact CB-CE2 4.22Å; A257-K264 WeakPolarHBondContact O-CA 3.13Å; A257-T265 HydrophobicContact CB-CG2 3.94Å; A257-T265 PolarHBondContact N-OG1 2.94Å; A257-T265 PolarHBondContact O-N 3Å; A257-T265 VanDerWaalsContact O-N 3.14Å
258	Y	71.5	Confident	75.3	Confident	60 Å²	60	52.9 Å²	52.9	24%	0.235	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130	177	-72.2	-102.9	0	0	0	109.3	S209 H210 L212 K256 K264	S209-Y258 WeakPolarHBondContact CA-O 3.25Å; S209-Y258 VanDerWaalsContact CB-O 3.27Å; S209-Y258 WeakPolarHBondContact CB-O 3.44Å; S209-Y258 PolarHBondContact N-O 2.8Å; H210-Y258 AromaticContact CD2-CD2 3.93Å; H210-Y258 VanDerWaalsContact CE1-CB 3.43Å; H210-Y258 WeakPolarHBondContact CE1-CB 3.3Å; H210-Y258 AromaticContact CE1-CG 3.73Å; H210-Y258 PolarHBondContact N-O 3.32Å; H210-Y258 VanDerWaalsContact N-O 3.12Å; H210-Y258 AromaticContact NE2-CD1 3.98Å; H210-Y258 AromaticContact NE2-CD2 3.74Å; H210-Y258 AromaticContact NE2-CG 3.52Å; H210-Y258 WeakPolarHBondContact O-CB 3.42Å; H210-Y258 PolarHBondContact O-N 3.43Å; L212-Y258 HydrophobicContact CB-CD2 4.31Å; L212-Y258 HydrophobicContact CB-CE2 3.7Å; L212-Y258 HydrophobicContact CD2-CE2 4.32Å; L212-Y258 HydrophobicContact CG-CE2 4.44Å; K256-Y258 HydrophobicContact CB-CE2 4.5Å; K256-Y258 HydrophobicContact CD-CE2 3.92Å; K256-Y258 HydrophobicContact CG-CE2 4.12Å; Y258-K264 HydrophobicContact CD1-CB 4.11Å; Y258-K264 HydrophobicContact CE1-CB 4.11Å
259	F	71.3	Confident	75.6	Confident	7 Å²	7	55.4 Å²	55.4	3%	0.031	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	160.2	179.2	-62.4	-91.8	0	0	0	111.2	P171 I200 F204 C207 L208 A257 N261 S262 I263 T265	P171-F259 HydrophobicContact CG-CD1 4.08Å; P171-F259 HydrophobicContact CG-CE1 4.23Å; P171-F259 HydrophobicContact CG-CG 4.28Å; I200-F259 HydrophobicContact CD1-CE1 4.35Å; I200-F259 HydrophobicContact CD1-CZ 4.19Å; F204-F259 HydrophobicContact CB-CE1 3.99Å; C207-F259 HydrophobicContact CB-CD1 4.08Å; C207-F259 CarbonylContact O-C 3.56Å; C207-F259 VanDerWaalsContact O-CA 3.26Å; C207-F259 WeakPolarHBondContact O-CA 3.5Å; C207-F259 WeakPolarHBondContact O-CB 3.42Å; L208-F259 HydrophobicContact CB-CD1 4.45Å; L208-F259 HydrophobicContact CB-CE1 4.42Å; L208-F259 HydrophobicContact CD1-CE1 4.34Å; A257-F259 HydrophobicContact CB-CE2 4.22Å; F259-N261 PolarHBondContact O-N 3.38Å; F259-N261 VanDerWaalsContact O-N 3.15Å; F259-S262 PolarHBondContact O-N 2.78Å; F259-I263 HydrophobicContact CB-CB 4.27Å; F259-I263 HydrophobicContact CD2-CB 4.4Å; F259-I263 HydrophobicContact CD2-CG2 4.18Å; F259-I263 PolarHBondContact N-O 3.37Å; F259-T265 HydrophobicContact CE2-CG2 3.91Å
260	K	66.3	Low	75.9	Confident	141 Å²	141	60.7 Å²	60.7	61%	0.613	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-32	-177.4	-72.1	173.3	179.6	167.8	0	113.1	E206 C207 S262	E206-K260 VanDerWaalsContact O-CE 3.24Å; E206-K260 WeakPolarHBondContact O-CE 3.3Å; E206-K260 PolarHBondContact O-NZ 3.47Å; C207-K260 PolarHBondContact O-N 2.74Å; K260-S262 PolarHBondContact O-N 3.13Å
261	N	65.8	Low	76	Confident	99 Å²	99	58.6 Å²	58.6	53%	0.529	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	24.8	-178.4	-63.7	-2.4	0	0	0	114	F259 I263	F259-N261 PolarHBondContact O-N 3.38Å; F259-N261 VanDerWaalsContact O-N 3.15Å; N261-I263 HydrophobicContact CB-CD1 4.38Å; N261-I263 HydrophobicContact CB-CG1 4.47Å; N261-I263 PolarHBondContact O-N 2.68Å
262	S	63.1	Low	76.3	Confident	111 Å²	111	62.4 Å²	62.4	78%	0.776	30%	0.295	S	S	*	.	S	Bend	trans	63	5.9	-175.1	-54.3	0	0	0	0	115.8	F259 K260	F259-S262 PolarHBondContact O-N 2.78Å; K260-S262 PolarHBondContact O-N 3.13Å
263	I	65.9	Low	76.5	Confident	18 Å²	18	62.7 Å²	62.7	9%	0.092	30%	0.297	C	S	.	.			trans	-68.2	134.9	172.6	-62.8	170.2	0	0	0	108.8	P171 E173 F259 N261	P171-I263 WeakPolarHBondContact O-CD1 3.24Å; E173-I263 HydrophobicContact CG-CG1 4.23Å; F259-I263 HydrophobicContact CB-CB 4.27Å; F259-I263 HydrophobicContact CD2-CB 4.4Å; F259-I263 HydrophobicContact CD2-CG2 4.18Å; F259-I263 PolarHBondContact N-O 3.37Å; N261-I263 HydrophobicContact CB-CD1 4.38Å; N261-I263 HydrophobicContact CB-CG1 4.47Å; N261-I263 PolarHBondContact O-N 2.68Å
264	K	72.5	Confident	76.6	Confident	134 Å²	134	66 Å²	66	58%	0.583	31%	0.312	S	S	*	.	B	Isolated β-bridge	trans	-132.9	135.8	178.7	71.1	-162.2	178.2	-169.6	0	108.6	A257 Y258	A257-K264 WeakPolarHBondContact O-CA 3.13Å; Y258-K264 HydrophobicContact CD1-CB 4.11Å; Y258-K264 HydrophobicContact CE1-CB 4.11Å
265	T	75.9	Confident	76.6	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.031	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-74.2	171.8	175.7	64.7	0	0	0	0	110.6	F176 V179 K256 A257 F259	F176-T265 HydrophobicContact CB-CG2 4.28Å; V179-T265 HydrophobicContact CG2-CG2 3.62Å; V179-T265 WeakPolarHBondContact CG2-OG1 3.19Å; K256-T265 WeakPolarHBondContact CE-O 3.48Å; K256-T265 WeakPolarHBondContact CG-O 3.38Å; A257-T265 HydrophobicContact CB-CG2 3.94Å; A257-T265 PolarHBondContact N-OG1 2.94Å; A257-T265 PolarHBondContact O-N 3Å; A257-T265 VanDerWaalsContact O-N 3.14Å; F259-T265 HydrophobicContact CE2-CG2 3.91Å
266	Q	78.5	Confident	76.2	Confident	117 Å²	117	64.8 Å²	64.8	55%	0.547	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-69	168.6	156.8	-62	-173.3	21.5	0	0	110.5	I177	I177-Q266 VanDerWaalsContact O-CB 3.23Å; I177-Q266 WeakPolarHBondContact O-CB 3.38Å; I177-Q266 VanDerWaalsContact O-CG 3.27Å; I177-Q266 WeakPolarHBondContact O-CG 3.47Å; I177-Q266 PolarHBondContact O-N 3.43Å
267	F	77.7	Confident	75.8	Confident	67 Å²	67	69.5 Å²	69.5	29%	0.294	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-68.3	145.7	169.6	-83.2	-74.2	0	0	0	109.1	L212 V214 K254 V255 K256	L212-F267 HydrophobicContact CD2-CE1 4.13Å; L212-F267 HydrophobicContact CD2-CZ 3.93Å; V214-F267 HydrophobicContact CB-CE1 4.36Å; V214-F267 HydrophobicContact CG2-CE1 3.61Å; V214-F267 HydrophobicContact CG2-CZ 3.89Å; K254-F267 HydrophobicContact CB-CD1 4.12Å; K254-F267 HydrophobicContact CD-CB 4.14Å; K254-F267 HydrophobicContact CD-CD1 3.65Å; K254-F267 HydrophobicContact CD-CD2 4.37Å; K254-F267 HydrophobicContact CD-CE1 4.12Å; K254-F267 HydrophobicContact CD-CG 3.8Å; K254-F267 HydrophobicContact CG-CD1 3.63Å; K254-F267 HydrophobicContact CG-CE1 4.02Å; K254-F267 HydrophobicContact CG-CG 4.26Å; V255-F267 CarbonylContact O-C 3.54Å; V255-F267 WeakPolarHBondContact O-CA 3.17Å; K256-F267 HydrophobicContact CB-CD1 3.77Å; K256-F267 HydrophobicContact CB-CE1 3.79Å; K256-F267 HydrophobicContact CB-CG 4.37Å; K256-F267 HydrophobicContact CB-CZ 4.42Å; K256-F267 HydrophobicContact CD-CE1 4.47Å; K256-F267 HydrophobicContact CD-CE2 4.38Å; K256-F267 HydrophobicContact CD-CZ 4.3Å
268	S	81.3	Confident	74.9	Confident	9 Å²	9	71 Å²	71	6%	0.063	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-54.4	161.9	166.1	71.2	0	0	0	0	111.9	V179 K254 V255	V179-S268 VanDerWaalsContact O-CA 3.25Å; V179-S268 WeakPolarHBondContact O-CA 3.23Å; V179-S268 WeakPolarHBondContact O-CB 3.24Å; K254-S268 WeakPolarHBondContact CA-OG 3.31Å; V255-S268 PolarHBondContact N-OG 3.36Å; V255-S268 PolarHBondContact O-N 2.99Å
269	E	83	Confident	73.7	Confident	148 Å²	148	71.6 Å²	71.6	69%	0.692	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-46.1	145.9	156.9	-66	-166.4	154.1	0	0	111.4	E178	E178-E269 PolarHBondContact OE1-N 3.18Å
270	R	85.5	Confident	72.2	Confident	170 Å²	170	78.5 Å²	78.5	64%	0.642	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-75.9	130.6	178.4	63.3	-178.1	173.3	-170.3	-3.3	109.7	I252 E272	I252-R270 HydrophobicContact CG2-CB 3.78Å; R270-E272 IonicContact NE-OE1 3.89Å
271	V	85.1	Confident	70.7	Confident	34 Å²	34	78.4 Å²	78.4	21%	0.206	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	112.5	170.3	-174.6	0	0	0	0	108.1	L182 V184 I252 Y253	L182-V271 HydrophobicContact CB-CG2 4.12Å; L182-V271 HydrophobicContact CD2-CB 4.5Å; L182-V271 HydrophobicContact CD2-CG2 3.96Å; L182-V271 HydrophobicContact CG-CG2 4Å; L182-V271 WeakPolarHBondContact O-CG2 3.38Å; V184-V271 HydrophobicContact CB-CG1 3.79Å; V184-V271 HydrophobicContact CG2-CB 3.89Å; V184-V271 HydrophobicContact CG2-CG1 3.67Å; V184-V271 HydrophobicContact CG2-CG2 4.4Å; I252-V271 WeakPolarHBondContact CA-O 3.12Å; Y253-V271 PolarHBondContact N-O 2.79Å; Y253-V271 PolarHBondContact O-N 3.02Å
272	E	87.3	Confident	68.7	Low	87 Å²	87	81.2 Å²	81.2	41%	0.407	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.1	174	-52.1	-161	169.3	0	0	109.1	R218 Y251 I252 R270	R218-E272 IonicContact CZ-OE1 3.4Å; R218-E272 IonicContact CZ-OE2 3.9Å; R218-E272 IonicContact NH1-OE1 2.98Å; R218-E272 PolarHBondContact NH1-OE1 2.77Å; R218-E272 IonicContact NH1-OE2 2.81Å; R218-E272 PolarHBondContact NH1-OE2 2.94Å; R218-E272 IonicContact NH2-OE1 3.21Å; R218-E272 PolarHBondContact NH2-OE1 2.99Å; Y251-E272 WeakPolarHBondContact O-CA 3.35Å; I252-E272 HydrophobicContact CD1-CG 4.3Å; I252-E272 HydrophobicContact CG1-CG 4.02Å; I252-E272 HydrophobicContact CG2-CG 4.49Å; R270-E272 IonicContact NE-OE1 3.89Å
273	I	86.4	Confident	67	Low	22 Å²	22	81 Å²	81	11%	0.113	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	139.6	-179.7	-168.9	166.1	0	0	0	111.1	V184 A186 H193 Y251 Y253	V184-I273 HydrophobicContact CB-CD1 4.22Å; V184-I273 HydrophobicContact CG1-CB 4.46Å; V184-I273 HydrophobicContact CG1-CD1 3.75Å; V184-I273 HydrophobicContact CG1-CG2 3.9Å; A186-I273 HydrophobicContact CB-CD1 3.7Å; A186-I273 HydrophobicContact CB-CG1 4.17Å; H193-I273 VanDerWaalsContact CE1-CG2 3.44Å; H193-I273 WeakPolarHBondContact CE1-CG2 3.15Å; Y251-I273 PolarHBondContact N-O 2.98Å; Y251-I273 PolarHBondContact O-N 3.21Å; Y253-I273 HydrophobicContact CD2-CG2 3.94Å; Y253-I273 HydrophobicContact CE2-CG2 3.67Å
274	Q	84.2	Confident	65	Low	69 Å²	69	85.7 Å²	85.7	32%	0.322	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.6	173.8	-179.2	66.1	3.1	0	0	109.5	D248 Q249 N250 P276	D248-Q274 PolarHBondContact O-NE2 2.97Å; D248-Q274 PolarHBondContact OD1-NE2 2.86Å; Q249-Q274 PolarHBondContact O-OE1 2.94Å; N250-Q274 VanDerWaalsContact N-OE1 3.16Å; N250-Q274 PolarHBondContact ND2-OE1 2.99Å; N250-Q274 PolarHBondContact OD1-OE1 2.81Å; Q274-P276 WeakPolarHBondContact O-CD 3.09Å
275	T	79.4	Confident	62.7	Low	0 Å²	0	84.5 Å²	84.5	0%	0	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-74.7	122.4	172.5	-45.3	0	0	0	0	108.2	H193 I245 S246 D248 Q249 Y251	H193-T275 PolarHBondContact CE1-OG1 2.8Å; H193-T275 PolarHBondContact NE2-OG1 2.89Å; I245-T275 HydrophobicContact CD1-CG2 3.58Å; I245-T275 HydrophobicContact CG1-CG2 3.96Å; S246-T275 VanDerWaalsContact O-CB 3.31Å; S246-T275 WeakPolarHBondContact O-CB 3.31Å; S246-T275 WeakPolarHBondContact O-CG2 3.38Å; S246-T275 PolarHBondContact O-OG1 3.11Å; D248-T275 WeakPolarHBondContact CA-O 3.41Å; D248-T275 PolarHBondContact N-O 3.37Å; Q249-T275 PolarHBondContact O-N 2.83Å; Q249-T275 PolarHBondContact O-OG1 3.44Å; Y251-T275 VanDerWaalsContact CD2-OG1 3.3Å; Y251-T275 WeakPolarHBondContact CD2-OG1 3.29Å; Y251-T275 VanDerWaalsContact CE2-OG1 3.25Å; Y251-T275 WeakPolarHBondContact CE2-OG1 3.33Å
276	P	67.3	Low	60.4	Low	34 Å²	34	91.9 Å²	91.9	22%	0.221	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-63.3	154.6	174.7	26.8	-34.8	0	0	0	110.7	A186 A188 Q274	A186-P276 HydrophobicContact CB-CG 4.24Å; A188-P276 VanDerWaalsContact CA-CG 3.45Å; A188-P276 HydrophobicContact CB-CB 4.03Å; A188-P276 HydrophobicContact CB-CG 4.01Å; Q274-P276 WeakPolarHBondContact O-CD 3.09Å
277	M	68.6	Low	57.8	Low	127 Å²	127	92.7 Å²	92.7	63%	0.626	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-65.8	140.3	162.9	-68.3	-171.5	72.4	0	0	109.1	D248 V279	D248-M277 HydrophobicContact CB-CG 4.01Å; M277-V279 PolarHBondContact O-N 2.67Å
278	A	56.8	Low	55.4	Low	31 Å²	31	94.3 Å²	94.3	26%	0.256	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-64.5	120.9	179.5	0	0	0	0	0	109.5	A188 E247 N280	A188-A278 WeakPolarHBondContact O-CA 3.28Å; E247-A278 HydrophobicContact CG-CB 4.38Å; E247-A278 VanDerWaalsContact OE1-CB 3.24Å; E247-A278 WeakPolarHBondContact OE1-CB 3.34Å; E247-A278 PolarHBondContact OE2-N 3.47Å; A278-N280 PolarHBondContact O-N 2.94Å
279	V	46.5	Very low	52.8	Low	74 Å²	74	101.9 Å²	101.9	45%	0.448	56%	0.56	S	S	.	*			trans	-81.2	101.8	174.3	-174.8	0	0	0	0	107.2	A188 M277 H281	A188-V279 HydrophobicContact CB-CG2 4.28Å; A188-V279 PolarHBondContact O-N 2.73Å; M277-V279 PolarHBondContact O-N 2.67Å; V279-H281 VanDerWaalsContact C-N 3.27Å; V279-H281 PolarHBondContact O-N 3.09Å
280	N	39.1	Very low	50.2	Low	151 Å²	151	100.8 Å²	100.8	81%	0.807	56%	0.563	S	S	*	*			trans	-64.9	91.3	168.9	-93	-19.7	0	0	0	109.1	A278 N282	A278-N280 PolarHBondContact O-N 2.94Å; N280-N282 VanDerWaalsContact C-N 3.3Å; N280-N282 PolarHBondContact O-N 2.75Å
281	H	34	Very low	47.4	Very low	139 Å²	139	101.2 Å²	101.2	64%	0.644	57%	0.572	S	S	*	*			trans	-72.1	92.6	161.3	-74.6	-63.3	0	0	0	107.8	V279 C283	V279-H281 VanDerWaalsContact C-N 3.27Å; V279-H281 PolarHBondContact O-N 3.09Å; H281-C283 PolarHBondContact O-N 3.24Å
282	N	25.3	Very low	44.7	Very low	159 Å²	159	105.9 Å²	105.9	85%	0.85	60%	0.601	S	S	*	*			trans	-62.6	88.9	160.5	-98.2	-4.8	0	0	0	107.7	N280 S284	N280-N282 VanDerWaalsContact C-N 3.3Å; N280-N282 PolarHBondContact O-N 2.75Å; N282-S284 PolarHBondContact O-N 2.72Å
283	C	26.2	Very low	41.8	Very low	107 Å²	107	108.6 Å²	108.6	72%	0.723	62%	0.618	S	S	*	*			trans	-75.4	109.4	165.3	-116.4	0	0	0	0	107.4	H281 C285	H281-C283 PolarHBondContact O-N 3.24Å; C283-C285 PolarHBondContact O-N 2.81Å
284	S	23.7	Very low	39	Very low	116 Å²	116	117.3 Å²	117.3	81%	0.811	66%	0.655	S	S	*	*			trans	-68.8	73.8	167.8	40	0	0	0	0	110	N282 L286	N282-S284 PolarHBondContact O-N 2.72Å; S284-L286 PolarHBondContact O-N 2.85Å
285	C	25.9	Very low	36.3	Very low	108 Å²	108	120 Å²	120	73%	0.73	68%	0.677	S	S	*	*			trans	-71.1	97.9	165.5	-69.3	0	0	0	0	108.1	C283 T287	C283-C285 PolarHBondContact O-N 2.81Å; C285-T287 PolarHBondContact O-N 2.74Å; C285-T287 VanDerWaalsContact O-N 3.07Å
286	L	26.2	Very low	33.7	Very low	161 Å²	161	124.2 Å²	124.2	84%	0.843	72%	0.72	S	S	*	*			trans	-50.7	113.6	160	-85.1	153.7	0	0	0	107.7	S284 S288	S284-L286 PolarHBondContact O-N 2.85Å; L286-S288 PolarHBondContact O-N 3.25Å
287	T	25.3	Very low	31.6	Very low	134 Å²	134	127.5 Å²	127.5	82%	0.822	74%	0.735	S	S	*	*			trans	-53.8	101.4	169.7	46	0	0	0	0	108.7	C285	C285-T287 PolarHBondContact O-N 2.74Å; C285-T287 VanDerWaalsContact O-N 3.07Å
288	S	27.1	Very low	29.5	Very low	100 Å²	100	133 Å²	133	70%	0.699	75%	0.749	S	S	*	*			trans	-98.1	125.7	158.1	43.2	0	0	0	0	106.6	L286 V290	L286-S288 PolarHBondContact O-N 3.25Å; S288-V290 PolarHBondContact O-N 3.3Å
289	D	25.8	Very low	28	Very low	168 Å²	168	137.5 Å²	137.5	90%	0.898	77%	0.773	S	S	*	*			trans	-53.7	100.2	-175.1	-69	-54.6	0	0	0	111.9
290	V	28.9	Very low	27.1	Very low	125 Å²	125	139.1 Å²	139.1	76%	0.758	79%	0.785	S	S	*	*			trans	-95.9	105.1	163.8	-176.8	0	0	0	0	107.2	S288 T292	S288-V290 PolarHBondContact O-N 3.3Å; V290-T292 PolarHBondContact O-N 2.83Å
291	H	27	Very low	26.4	Very low	179 Å²	179	136.3 Å²	136.3	83%	0.829	78%	0.783	S	S	*	*			trans	-46	109.4	175.1	-102.7	-55.5	0	0	0	111.7	N293	H291-N293 VanDerWaalsContact C-N 3.27Å; H291-N293 PolarHBondContact O-N 3.01Å
292	T	27.7	Very low	26	Very low	133 Å²	133	137.8 Å²	137.8	82%	0.816	79%	0.794	S	S	*	*			trans	-74.1	75.7	172	39.5	0	0	0	0	110.4	V290	V290-T292 PolarHBondContact O-N 2.83Å
293	N	26.7	Very low	26	Very low	144 Å²	144	136.4 Å²	136.4	77%	0.77	79%	0.791	S	S	*	*			trans	-150.8	115.4	162	-94.8	-28.1	0	0	0	108.3	H291	H291-N293 VanDerWaalsContact C-N 3.27Å; H291-N293 PolarHBondContact O-N 3.01Å
294	K	28.5	Very low	26	Very low	204 Å²	204	138.1 Å²	138.1	89%	0.887	79%	0.791	S	S	*	*	S	Bend	trans	97.5	76.9	-176	-57.2	170.5	176.8	179.9	0	114.9
295	T	26.8	Very low	26.1	Very low	126 Å²	126	139.3 Å²	139.3	77%	0.773	79%	0.788	S	S	*	*			trans	162.7	90.2	132.2	39.7	0	0	0	0	109.2	I297	T295-I297 PolarHBondContact O-N 2.84Å
296	G	24	Very low	26.1	Very low	89 Å²	89	145.4 Å²	145.4	92%	0.918	80%	0.795	S	S	*	*			trans	-73.6	83.1	177.9	0	0	0	0	0	112.7
297	I	24.5	Very low	26	Very low	102 Å²	102	148.6 Å²	148.6	52%	0.523	80%	0.796	S	S	.	*			trans	-109.9	100.8	169	-53.7	-179.7	0	0	0	108.7	R103 T295	R103-I297 VanDerWaalsContact NH2-CG1 3.31Å; T295-I297 PolarHBondContact O-N 2.84Å
298	R	24.2	Very low	26.2	Very low	243 Å²	243	146.9 Å²	146.9	92%	0.917	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-82.2	118.7	159.6	-72.5	-177.4	177.4	-173.1	-0.7	107.6
299	V	25.2	Very low	26	Very low	126 Å²	126	151.6 Å²	151.6	76%	0.764	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-78.9	123.3	165.3	-175.9	0	0	0	0	107	A301	V299-A301 PolarHBondContact O-N 3.18Å
300	P	26.2	Very low	26.2	Very low	107 Å²	107	151.1 Å²	151.1	70%	0.695	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-66.1	130.5	179	-13.1	26.7	0	0	0	109.8	L302	P300-L302 PolarHBondContact O-N 3.19Å
301	A	24.9	Very low	26.3	Very low	93 Å²	93	153.5 Å²	153.5	77%	0.769	84%	0.835	S	S	*	*			trans	-57.9	110.9	159.5	0	0	0	0	0	107.5	V299 V303	V299-A301 PolarHBondContact O-N 3.18Å; A301-V303 PolarHBondContact O-N 3.02Å
302	L	26	Very low	26.3	Very low	170 Å²	170	152.2 Å²	152.2	89%	0.89	84%	0.835	S	S	*	*			trans	-66.3	101.3	170.5	-105.5	147.7	0	0	0	107.5	P300 M304	P300-L302 PolarHBondContact O-N 3.19Å; L302-M304 PolarHBondContact O-N 3.07Å; L302-M304 VanDerWaalsContact O-N 3.15Å
303	V	24.7	Very low	26.2	Very low	129 Å²	129	153.2 Å²	153.2	78%	0.782	84%	0.836	S	S	*	*			trans	-60.1	108.7	170.3	176.8	0	0	0	0	107.6	A301 D305	A301-V303 PolarHBondContact O-N 3.02Å; V303-D305 PolarHBondContact O-N 3.3Å
304	M	26.4	Very low	26.2	Very low	144 Å²	144	153.7 Å²	153.7	71%	0.709	84%	0.84	S	S	*	*			trans	-67.3	113.2	162.8	-80.3	-171.8	171	0	0	108.2	D244 L302 R306	D244-M304 HydrophobicContact CB-CE 3.94Å; L302-M304 PolarHBondContact O-N 3.07Å; L302-M304 VanDerWaalsContact O-N 3.15Å; M304-R306 PolarHBondContact O-N 3.24Å
305	D	25.9	Very low	26.1	Very low	140 Å²	140	150.8 Å²	150.8	75%	0.749	84%	0.837	S	S	*	*			trans	-65.3	102.1	173.2	-162.2	-10.2	0	0	0	109.6	V303 R307	V303-D305 PolarHBondContact O-N 3.3Å; D305-R307 VanDerWaalsContact C-N 3.33Å; D305-R307 PolarHBondContact O-N 2.92Å; D305-R307 VanDerWaalsContact O-N 3.09Å
306	R	25.9	Very low	26	Very low	237 Å²	237	152.3 Å²	152.3	89%	0.894	84%	0.841	S	S	*	*			trans	-74.2	82.5	169.3	-75.1	-176.8	178.5	-179	0.3	108.6	M304	M304-R306 PolarHBondContact O-N 3.24Å
307	R	25.3	Very low	26.2	Very low	228 Å²	228	156.5 Å²	156.5	86%	0.86	84%	0.836	S	S	*	*			trans	-162	86.5	165.6	-103.1	151.4	-161.6	-145.7	7.9	112.4	D305	D305-R307 VanDerWaalsContact C-N 3.33Å; D305-R307 PolarHBondContact O-N 2.92Å; D305-R307 VanDerWaalsContact O-N 3.09Å
308	A	28.2	Very low	26.3	Very low	97 Å²	97	160.4 Å²	160.4	80%	0.802	86%	0.858	S	S	*	*			trans	-148.4	63.2	148.3	0	0	0	0	0	108.5
309	Q	23.9	Very low	26.4	Very low	199 Å²	199	154.1 Å²	154.1	93%	0.93	85%	0.854	S	S	*	*			trans	-77.9	108.7	151.2	-81.5	-179.1	-17.9	0	0	106.1
310	I	30.6	Very low	26.6	Very low	158 Å²	158	156.4 Å²	156.4	81%	0.81	86%	0.861	S	S	*	*			trans	-129.9	109.4	160.4	-58.2	179.3	0	0	0	105.7
311	A	30.7	Very low	26.6	Very low	175 Å²	175	160.9 Å²	160.9	100%	1.446	88%	0.876	S	S	*	*			trans	42.8	0	164.3	0	0	0	0	0	119

Retrieved 311 of 311 residues in 533.5 ms (Link to these results)

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