A0A077ZBM3_TRITR Loading...

Zinc finger protein

AlphaFold DB , UniProt , Accession A0A077ZBM3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 352 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	32.5	Very low	39.6	Very low	214 Å²	214	108 Å²	108	100%	1.054	56%	0.56	S	S	*	*				0	89	0	-96.1	-154.6	-69.6	0	0	103.8	V3	M1-V3 PolarHBondContact O-N 3.22Å
2	D	40.4	Very low	41.1	Very low	68 Å²	68	99.6 Å²	99.6	36%	0.364	52%	0.519	S	S	.	.			trans	-86.4	104.1	-172.1	-54.2	-28.1	0	0	0	105.2	P4 Q64	D2-P4 WeakPolarHBondContact O-CD 3.4Å; D2-Q64 PolarHBondContact O-NE2 3.01Å
3	V	38.2	Very low	41.8	Very low	100 Å²	100	94.8 Å²	94.8	61%	0.606	50%	0.497	S	S	*	.			trans	-92.6	115.9	-175.4	-175.8	0	0	0	0	106.7	M1 L5	M1-V3 PolarHBondContact O-N 3.22Å; V3-L5 PolarHBondContact O-N 3.49Å
4	P	42.2	Very low	42.7	Very low	34 Å²	34	90.4 Å²	90.4	22%	0.221	47%	0.474	C	S	.	.			trans	-62.8	126.5	173.7	23.5	-30.2	0	0	0	109.2	D2 I15	D2-P4 WeakPolarHBondContact O-CD 3.4Å; P4-I15 HydrophobicContact CB-CG2 4.49Å
5	L	32.6	Very low	43.5	Very low	80 Å²	80	85.3 Å²	85.3	42%	0.419	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.5	172.7	-161.2	85.2	0	0	0	108.8	V3 L7 V16 M18	V3-L5 PolarHBondContact O-N 3.49Å; L5-L7 HydrophobicContact CD2-CD1 4.2Å; L5-L7 HydrophobicContact CD2-CD2 4.28Å; L5-L7 HydrophobicContact CD2-CG 4.14Å; L5-V16 PolarHBondContact N-O 3.25Å; L5-V16 PolarHBondContact O-N 3.1Å; L5-M18 HydrophobicContact CB-CE 3.9Å; L5-M18 HydrophobicContact CB-SD 4.3Å; L5-M18 HydrophobicContact CD2-CE 3.75Å; L5-M18 HydrophobicContact CG-CE 4.38Å
6	W	40.4	Very low	44	Very low	97 Å²	97	80.8 Å²	80.8	37%	0.367	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114.5	-179.5	-66.3	90.4	0	0	0	110.2	V13 I15 A68 T71	W6-V13 HydrophobicContact CE3-CG1 4.28Å; W6-V13 HydrophobicContact CZ3-CG1 4.17Å; W6-I15 HydrophobicContact CE3-CG1 4.35Å; W6-I15 HydrophobicContact CH2-CD1 4.35Å; W6-I15 HydrophobicContact CH2-CG1 4.01Å; W6-I15 HydrophobicContact CZ3-CD1 4.33Å; W6-I15 HydrophobicContact CZ3-CG1 3.7Å; W6-A68 HydrophobicContact CH2-CB 3.35Å; W6-A68 VanDerWaalsContact CH2-O 3.26Å; W6-A68 WeakPolarHBondContact CH2-O 3.42Å; W6-A68 VanDerWaalsContact CZ2-CA 3.46Å; W6-A68 HydrophobicContact CZ2-CB 3.61Å; W6-A68 HydrophobicContact CZ3-CB 4.48Å; W6-T71 HydrophobicContact CH2-CG2 4.31Å; W6-T71 HydrophobicContact CZ2-CG2 4.27Å
7	L	34.3	Very low	44.3	Very low	91 Å²	91	76.6 Å²	76.6	48%	0.476	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	112.4	173.2	-66.6	172.8	0	0	0	109.7	L5 N14	L5-L7 HydrophobicContact CD2-CD1 4.2Å; L5-L7 HydrophobicContact CD2-CD2 4.28Å; L5-L7 HydrophobicContact CD2-CG 4.14Å; L7-N14 PolarHBondContact N-O 3.25Å; L7-N14 PolarHBondContact O-N 3.24Å; L7-N14 VanDerWaalsContact O-N 3.09Å
8	L	31.9	Very low	44.3	Very low	166 Å²	166	74 Å²	74	87%	0.869	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.3	161.8	-90.2	134.3	0	0	0	108.6
9	C	45.7	Very low	44.6	Very low	44 Å²	44	72.3 Å²	72.3	30%	0.297	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	161.3	169.7	66.4	0	0	0	0	110.1	E11 G12 N14	C9-E11 PolarHBondContact O-N 2.91Å; C9-G12 PolarHBondContact N-O 2.78Å; C9-G12 PolarHBondContact O-N 3.41Å; C9-G12 VanDerWaalsContact O-N 3.14Å; C9-G12 PolarHBondContact SG-O 3.19Å; C9-N14 PolarHBondContact SG-ND2 2.81Å
10	D	41.3	Very low	44.6	Very low	166 Å²	166	74.2 Å²	74.2	89%	0.888	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-20.3	-178.2	-62.8	-25.7	0	0	0	112.7	N32	D10-N32 PolarHBondContact O-ND2 2.96Å
11	E	56.3	Low	44.7	Very low	128 Å²	128	76 Å²	76	60%	0.598	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-0.3	-177.5	-60.3	-172.2	169.9	0	0	114.3	C9 R31 N32	C9-E11 PolarHBondContact O-N 2.91Å; E11-R31 VanDerWaalsContact O-CA 3.32Å; E11-R31 WeakPolarHBondContact O-CA 3.17Å; E11-N32 PolarHBondContact O-N 3.13Å; E11-N32 VanDerWaalsContact O-N 3.12Å
12	G	58	Low	45.2	Very low	7 Å²	7	72 Å²	72	7%	0.072	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.2	-150.1	178.4	0	0	0	0	0	115	C9 I30	C9-G12 PolarHBondContact N-O 2.78Å; C9-G12 PolarHBondContact O-N 3.41Å; C9-G12 VanDerWaalsContact O-N 3.14Å; C9-G12 PolarHBondContact SG-O 3.19Å; G12-I30 CarbonylContact C-O 3.53Å; G12-I30 VanDerWaalsContact CA-O 3.23Å; G12-I30 WeakPolarHBondContact CA-O 3.38Å
13	V	49.4	Very low	45.3	Very low	38 Å²	38	73.2 Å²	73.2	23%	0.23	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.9	178.9	-177.4	0	0	0	0	109.6	W6 I15 Q29 I30	W6-V13 HydrophobicContact CE3-CG1 4.28Å; W6-V13 HydrophobicContact CZ3-CG1 4.17Å; V13-I15 HydrophobicContact CG1-CG1 4.38Å; V13-Q29 WeakPolarHBondContact O-CA 3.21Å; V13-I30 PolarHBondContact N-O 3.38Å; V13-I30 PolarHBondContact O-N 3.33Å
14	N	54.2	Low	45.7	Very low	33 Å²	33	71.3 Å²	71.3	18%	0.176	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.9	169.9	-72.1	-34.4	0	0	0	109.4	L7 C9 T27 V28 Q29	L7-N14 PolarHBondContact N-O 3.25Å; L7-N14 PolarHBondContact O-N 3.24Å; L7-N14 VanDerWaalsContact O-N 3.09Å; C9-N14 PolarHBondContact SG-ND2 2.81Å; N14-T27 HydrophobicContact CB-CG2 4.13Å; N14-V28 WeakPolarHBondContact CA-O 3.44Å; N14-Q29 WeakPolarHBondContact OD1-CA 3.3Å; N14-Q29 WeakPolarHBondContact OD1-CB 3.43Å; N14-Q29 WeakPolarHBondContact OD1-CG 3.44Å
15	I	54.6	Low	46.1	Very low	13 Å²	13	73.3 Å²	73.3	7%	0.067	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	105.8	169.3	-55.3	158.3	0	0	0	106.7	P4 W6 V13 T27 V28 I30 A68	P4-I15 HydrophobicContact CB-CG2 4.49Å; W6-I15 HydrophobicContact CE3-CG1 4.35Å; W6-I15 HydrophobicContact CH2-CD1 4.35Å; W6-I15 HydrophobicContact CH2-CG1 4.01Å; W6-I15 HydrophobicContact CZ3-CD1 4.33Å; W6-I15 HydrophobicContact CZ3-CG1 3.7Å; V13-I15 HydrophobicContact CG1-CG1 4.38Å; I15-T27 CarbonylContact O-C 3.3Å; I15-T27 WeakPolarHBondContact O-CA 3.43Å; I15-V28 HydrophobicContact CB-CB 4.17Å; I15-V28 HydrophobicContact CD1-CB 4.37Å; I15-V28 PolarHBondContact N-O 3.49Å; I15-V28 PolarHBondContact O-N 2.97Å; I15-I30 HydrophobicContact CD1-CD1 4.2Å; I15-A68 HydrophobicContact CD1-CB 3.86Å; I15-A68 HydrophobicContact CG1-CB 4.41Å; I15-A68 HydrophobicContact CG2-CB 4.19Å
16	V	51.6	Low	46.8	Very low	13 Å²	13	70.8 Å²	70.8	8%	0.079	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	109.3	177.6	-175.5	0	0	0	0	108.3	L5 M18 P24 M26 T27	L5-V16 PolarHBondContact N-O 3.25Å; L5-V16 PolarHBondContact O-N 3.1Å; V16-M18 HydrophobicContact CG1-CE 4.02Å; V16-M18 HydrophobicContact CG1-CG 4.1Å; V16-P24 HydrophobicContact CG1-CB 3.63Å; V16-M26 CarbonylContact C-O 3.57Å; V16-M26 WeakPolarHBondContact CA-O 3.23Å; V16-T27 HydrophobicContact CG2-CG2 4.15Å
17	G	49.8	Very low	47.6	Very low	11 Å²	11	67.7 Å²	67.7	11%	0.113	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	128.7	164.3	0	0	0	0	0	108.1	P24 I25 M26	G17-P24 CarbonylContact O-C 3.57Å; G17-P24 WeakPolarHBondContact O-CA 3.34Å; G17-I25 VanDerWaalsContact C-CG1 3.48Å; G17-I25 WeakPolarHBondContact O-CG1 3.45Å; G17-I25 PolarHBondContact O-N 3.12Å; G17-M26 PolarHBondContact N-O 3.42Å; G17-M26 PolarHBondContact O-N 3.27Å
18	M	44.5	Very low	48.7	Very low	29 Å²	29	64.5 Å²	64.5	14%	0.143	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144.6	176.5	-67.1	-163	171	0	0	110.3	L5 V16 L22 D23	L5-M18 HydrophobicContact CB-CE 3.9Å; L5-M18 HydrophobicContact CB-SD 4.3Å; L5-M18 HydrophobicContact CD2-CE 3.75Å; L5-M18 HydrophobicContact CG-CE 4.38Å; V16-M18 HydrophobicContact CG1-CE 4.02Å; V16-M18 HydrophobicContact CG1-CG 4.1Å; M18-L22 HydrophobicContact SD-CB 4.08Å; M18-L22 HydrophobicContact SD-CD2 4.08Å; M18-D23 CarbonylContact C-O 3.49Å; M18-D23 VanDerWaalsContact CA-O 3.28Å; M18-D23 WeakPolarHBondContact CA-O 3.32Å
19	D	49.1	Very low	50.1	Low	41 Å²	41	57.4 Å²	57.4	22%	0.219	32%	0.318	C	S	.	.			trans	-74.1	-178.5	169.4	82.4	-13.8	0	0	0	111.4	N21 L22 D23 I25	D19-N21 PolarHBondContact O-N 3.03Å; D19-N21 VanDerWaalsContact O-N 3.12Å; D19-N21 VanDerWaalsContact OD1-C 3.32Å; D19-N21 VanDerWaalsContact OD1-CA 3.24Å; D19-N21 WeakPolarHBondContact OD1-CA 3.28Å; D19-N21 WeakPolarHBondContact OD1-CB 3.24Å; D19-N21 PolarHBondContact OD1-N 3.1Å; D19-N21 PolarHBondContact OD2-ND2 3.08Å; D19-L22 PolarHBondContact O-N 3.26Å; D19-L22 PolarHBondContact OD1-N 3.32Å; D19-D23 PolarHBondContact N-O 3.43Å; D19-D23 WeakPolarHBondContact OD1-CB 3.37Å; D19-D23 PolarHBondContact OD1-N 2.82Å; D19-I25 HydrophobicContact CB-CG2 3.74Å
20	T	45.9	Very low	50.6	Low	110 Å²	110	57.4 Å²	57.4	68%	0.675	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.9	176.8	52.8	0	0	0	0	114.8
21	N	46.3	Very low	51.3	Low	114 Å²	114	54.2 Å²	54.2	61%	0.61	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	3.4	176.8	-56.3	-59.3	0	0	0	113.2	D19 D23	D19-N21 PolarHBondContact O-N 3.03Å; D19-N21 VanDerWaalsContact O-N 3.12Å; D19-N21 VanDerWaalsContact OD1-C 3.32Å; D19-N21 VanDerWaalsContact OD1-CA 3.24Å; D19-N21 WeakPolarHBondContact OD1-CA 3.28Å; D19-N21 WeakPolarHBondContact OD1-CB 3.24Å; D19-N21 PolarHBondContact OD1-N 3.1Å; D19-N21 PolarHBondContact OD2-ND2 3.08Å; N21-D23 VanDerWaalsContact C-N 3.25Å
22	L	41.6	Very low	50.9	Low	129 Å²	129	53.7 Å²	53.7	68%	0.675	29%	0.291	S	S	*	.	S	Bend	trans	67.9	20.8	-171.4	-55.4	166.3	0	0	0	113.9	M18 D19	M18-L22 HydrophobicContact SD-CB 4.08Å; M18-L22 HydrophobicContact SD-CD2 4.08Å; D19-L22 PolarHBondContact O-N 3.26Å; D19-L22 PolarHBondContact OD1-N 3.32Å
23	D	44	Very low	50.8	Low	94 Å²	94	58.8 Å²	58.8	50%	0.503	32%	0.317	S	S	.	.			trans	-82.1	131.1	171.4	-70	-42	0	0	0	109.2	M18 D19 N21 I25	M18-D23 CarbonylContact C-O 3.49Å; M18-D23 VanDerWaalsContact CA-O 3.28Å; M18-D23 WeakPolarHBondContact CA-O 3.32Å; D19-D23 PolarHBondContact N-O 3.43Å; D19-D23 WeakPolarHBondContact OD1-CB 3.37Å; D19-D23 PolarHBondContact OD1-N 2.82Å; N21-D23 VanDerWaalsContact C-N 3.25Å; D23-I25 PolarHBondContact O-N 3.44Å
24	P	46.4	Very low	50.5	Low	60 Å²	60	58.9 Å²	58.9	39%	0.39	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	128.7	176	25.5	-32.2	0	0	0	109	V16 G17 P41	V16-P24 HydrophobicContact CG1-CB 3.63Å; G17-P24 CarbonylContact O-C 3.57Å; G17-P24 WeakPolarHBondContact O-CA 3.34Å; P24-P41 WeakPolarHBondContact O-CG 3.27Å
25	I	49.7	Very low	50.2	Low	76 Å²	76	59.3 Å²	59.3	39%	0.39	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-25	175.7	50.3	166.7	0	0	0	112.3	G17 D19 D23 P41	G17-I25 VanDerWaalsContact C-CG1 3.48Å; G17-I25 WeakPolarHBondContact O-CG1 3.45Å; G17-I25 PolarHBondContact O-N 3.12Å; D19-I25 HydrophobicContact CB-CG2 3.74Å; D23-I25 PolarHBondContact O-N 3.44Å; I25-P41 VanDerWaalsContact O-CD 3.25Å; I25-P41 WeakPolarHBondContact O-CD 3.29Å
26	M	48.8	Very low	49.8	Very low	27 Å²	27	60.4 Å²	60.4	13%	0.133	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	149.7	172.3	69.1	165.1	-161	0	0	110.2	V16 G17 V28 F39 I60	V16-M26 CarbonylContact C-O 3.57Å; V16-M26 WeakPolarHBondContact CA-O 3.23Å; G17-M26 PolarHBondContact N-O 3.42Å; G17-M26 PolarHBondContact O-N 3.27Å; M26-V28 HydrophobicContact CE-CG2 3.98Å; M26-V28 HydrophobicContact SD-CG2 4.21Å; M26-F39 CarbonylContact C-O 3.58Å; M26-F39 WeakPolarHBondContact CA-O 3.2Å; M26-I60 HydrophobicContact CE-CD1 4.07Å; M26-I60 HydrophobicContact CE-CG1 4.36Å; M26-I60 HydrophobicContact CE-CG2 4.18Å; M26-I60 HydrophobicContact CG-CD1 4.38Å; M26-I60 HydrophobicContact SD-CD1 3.21Å; M26-I60 WeakPolarHBondContact SD-CD1 3.5Å; M26-I60 HydrophobicContact SD-CG1 3.93Å
27	T	56	Low	49.6	Very low	32 Å²	32	60.8 Å²	60.8	20%	0.196	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	112.9	168.3	-58.6	0	0	0	0	108.8	N14 I15 V16 V38 F39	N14-T27 HydrophobicContact CB-CG2 4.13Å; I15-T27 CarbonylContact O-C 3.3Å; I15-T27 WeakPolarHBondContact O-CA 3.43Å; V16-T27 HydrophobicContact CG2-CG2 4.15Å; T27-V38 CarbonylContact O-C 3.49Å; T27-V38 VanDerWaalsContact O-CA 3.26Å; T27-V38 WeakPolarHBondContact O-CA 3.26Å; T27-F39 HydrophobicContact CG2-CD2 4.47Å; T27-F39 PolarHBondContact N-O 2.93Å; T27-F39 PolarHBondContact O-N 3.04Å
28	V	57.1	Low	49.6	Very low	23 Å²	23	61.8 Å²	61.8	14%	0.139	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	104.7	168.3	-174.9	0	0	0	0	107.3	N14 I15 M26 I30 V36 A37 V38	N14-V28 WeakPolarHBondContact CA-O 3.44Å; I15-V28 HydrophobicContact CB-CB 4.17Å; I15-V28 HydrophobicContact CD1-CB 4.37Å; I15-V28 PolarHBondContact N-O 3.49Å; I15-V28 PolarHBondContact O-N 2.97Å; M26-V28 HydrophobicContact CE-CG2 3.98Å; M26-V28 HydrophobicContact SD-CG2 4.21Å; V28-I30 HydrophobicContact CG1-CG1 4.32Å; V28-V36 HydrophobicContact CG1-CG1 3.54Å; V28-A37 CarbonylContact C-O 3.57Å; V28-V38 HydrophobicContact CB-CG2 4.44Å; V28-V38 HydrophobicContact CG1-CG2 4.19Å; V28-V38 HydrophobicContact CG2-CG1 4.32Å; V28-V38 HydrophobicContact CG2-CG2 4.04Å
29	Q	60.8	Low	49.9	Very low	18 Å²	18	65 Å²	65	8%	0.084	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	114.4	171.4	-176.8	176.7	35.6	0	0	108.9	V13 N14 R31 V36 A37 F39	V13-Q29 WeakPolarHBondContact O-CA 3.21Å; N14-Q29 WeakPolarHBondContact OD1-CA 3.3Å; N14-Q29 WeakPolarHBondContact OD1-CB 3.43Å; N14-Q29 WeakPolarHBondContact OD1-CG 3.44Å; Q29-R31 HydrophobicContact CG-CG 3.84Å; Q29-V36 CarbonylContact O-C 3.54Å; Q29-V36 WeakPolarHBondContact O-CA 3.18Å; Q29-A37 HydrophobicContact CB-CB 4.4Å; Q29-A37 PolarHBondContact N-O 3.14Å; Q29-A37 PolarHBondContact O-N 3.04Å; Q29-F39 HydrophobicContact CB-CD2 4.4Å; Q29-F39 HydrophobicContact CB-CE2 3.82Å
30	I	56.4	Low	49.9	Very low	43 Å²	43	66.5 Å²	66.5	22%	0.221	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	107.3	167.8	-54.8	176.2	0	0	0	106.4	G12 V13 I15 V28 V36	G12-I30 CarbonylContact C-O 3.53Å; G12-I30 VanDerWaalsContact CA-O 3.23Å; G12-I30 WeakPolarHBondContact CA-O 3.38Å; V13-I30 PolarHBondContact N-O 3.38Å; V13-I30 PolarHBondContact O-N 3.33Å; I15-I30 HydrophobicContact CD1-CD1 4.2Å; V28-I30 HydrophobicContact CG1-CG1 4.32Å; I30-V36 HydrophobicContact CG1-CG1 4.49Å; I30-V36 HydrophobicContact CG1-CG2 4.29Å
31	R	56.3	Low	50	Low	99 Å²	99	64.4 Å²	64.4	37%	0.374	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	160.2	-178	-64.1	-171.4	-176	172.1	-3.7	111.8	E11 Q29 D33 A34 S35	E11-R31 VanDerWaalsContact O-CA 3.32Å; E11-R31 WeakPolarHBondContact O-CA 3.17Å; Q29-R31 HydrophobicContact CG-CG 3.84Å; R31-D33 WeakPolarHBondContact CB-OD1 3.25Å; R31-D33 PolarHBondContact O-N 3.45Å; R31-D33 VanDerWaalsContact O-N 3.12Å; R31-A34 WeakPolarHBondContact O-CA 3.37Å; R31-A34 PolarHBondContact O-N 3.03Å; R31-S35 WeakPolarHBondContact CD-OG 3.48Å; R31-S35 PolarHBondContact N-O 2.9Å
32	N	48.1	Very low	49.9	Very low	117 Å²	117	64.7 Å²	64.7	63%	0.626	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.3	177.2	-66.5	-20.6	0	0	0	114.1	D10 E11 A34	D10-N32 PolarHBondContact O-ND2 2.96Å; E11-N32 PolarHBondContact O-N 3.13Å; E11-N32 VanDerWaalsContact O-N 3.12Å; N32-A34 PolarHBondContact O-N 3.42Å
33	D	55.5	Low	49.7	Very low	115 Å²	115	63.9 Å²	63.9	62%	0.615	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	13	174	68.7	-6.4	0	0	0	113.4	R31 S35	R31-D33 WeakPolarHBondContact CB-OD1 3.25Å; R31-D33 PolarHBondContact O-N 3.45Å; R31-D33 VanDerWaalsContact O-N 3.12Å; D33-S35 PolarHBondContact O-N 2.84Å; D33-S35 VanDerWaalsContact OD1-CB 3.23Å; D33-S35 WeakPolarHBondContact OD1-CB 3.44Å; D33-S35 PolarHBondContact OD1-N 3.25Å; D33-S35 PolarHBondContact OD1-OG 3.25Å; D33-S35 PolarHBondContact OD2-OG 3.48Å
34	A	44.7	Very low	49.1	Very low	39 Å²	39	67.7 Å²	67.7	32%	0.322	39%	0.393	S	S	.	.	S	Bend	trans	62.7	11.3	-174.1	0	0	0	0	0	114.9	R31 N32	R31-A34 WeakPolarHBondContact O-CA 3.37Å; R31-A34 PolarHBondContact O-N 3.03Å; N32-A34 PolarHBondContact O-N 3.42Å
35	S	46.4	Very low	48.3	Very low	43 Å²	43	71.1 Å²	71.1	30%	0.301	42%	0.415	S	S	.	.			trans	-74.3	131.2	169.3	67.1	0	0	0	0	110.4	R31 D33	R31-S35 WeakPolarHBondContact CD-OG 3.48Å; R31-S35 PolarHBondContact N-O 2.9Å; D33-S35 PolarHBondContact O-N 2.84Å; D33-S35 VanDerWaalsContact OD1-CB 3.23Å; D33-S35 WeakPolarHBondContact OD1-CB 3.44Å; D33-S35 PolarHBondContact OD1-N 3.25Å; D33-S35 PolarHBondContact OD1-OG 3.25Å; D33-S35 PolarHBondContact OD2-OG 3.48Å
36	V	46	Very low	47.3	Very low	35 Å²	35	72.3 Å²	72.3	21%	0.212	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	117.8	173	-175.4	0	0	0	0	108	V28 Q29 I30 V38 A109	V28-V36 HydrophobicContact CG1-CG1 3.54Å; Q29-V36 CarbonylContact O-C 3.54Å; Q29-V36 WeakPolarHBondContact O-CA 3.18Å; I30-V36 HydrophobicContact CG1-CG1 4.49Å; I30-V36 HydrophobicContact CG1-CG2 4.29Å; V36-V38 HydrophobicContact CG1-CG2 4.45Å; V36-A109 WeakPolarHBondContact CG1-O 3.43Å
37	A	47.4	Very low	46.3	Very low	21 Å²	21	79.5 Å²	79.5	17%	0.174	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.6	173.8	0	0	0	0	0	108.9	V28 Q29 F39	V28-A37 CarbonylContact C-O 3.57Å; Q29-A37 HydrophobicContact CB-CB 4.4Å; Q29-A37 PolarHBondContact N-O 3.14Å; Q29-A37 PolarHBondContact O-N 3.04Å; A37-F39 HydrophobicContact CB-CD2 4.48Å; A37-F39 HydrophobicContact CB-CE2 3.63Å; A37-F39 HydrophobicContact CB-CZ 3.71Å
38	V	49.8	Very low	45.2	Very low	32 Å²	32	82.2 Å²	82.2	19%	0.194	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.8	176	-178.1	0	0	0	0	108	T27 V28 V36 F52 A109	T27-V38 CarbonylContact O-C 3.49Å; T27-V38 VanDerWaalsContact O-CA 3.26Å; T27-V38 WeakPolarHBondContact O-CA 3.26Å; V28-V38 HydrophobicContact CB-CG2 4.44Å; V28-V38 HydrophobicContact CG1-CG2 4.19Å; V28-V38 HydrophobicContact CG2-CG1 4.32Å; V28-V38 HydrophobicContact CG2-CG2 4.04Å; V36-V38 HydrophobicContact CG1-CG2 4.45Å; V38-F52 HydrophobicContact CB-CE1 3.97Å; V38-F52 HydrophobicContact CB-CE2 3.77Å; V38-F52 HydrophobicContact CB-CZ 3.3Å; V38-F52 HydrophobicContact CG1-CD1 4.34Å; V38-F52 HydrophobicContact CG1-CE1 3.51Å; V38-F52 HydrophobicContact CG1-CE2 4.05Å; V38-F52 HydrophobicContact CG1-CZ 3.41Å; V38-F52 VanDerWaalsContact CG1-CZ 3.41Å; V38-F52 HydrophobicContact CG2-CE2 3.81Å; V38-F52 HydrophobicContact CG2-CZ 3.91Å; V38-A109 HydrophobicContact CG2-CB 4.2Å
39	F	51.2	Low	44.3	Very low	98 Å²	98	92.8 Å²	92.8	43%	0.43	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.6	179.6	-55.7	-86.2	0	0	0	109.5	M26 T27 Q29 A37	M26-F39 CarbonylContact C-O 3.58Å; M26-F39 WeakPolarHBondContact CA-O 3.2Å; T27-F39 HydrophobicContact CG2-CD2 4.47Å; T27-F39 PolarHBondContact N-O 2.93Å; T27-F39 PolarHBondContact O-N 3.04Å; Q29-F39 HydrophobicContact CB-CD2 4.4Å; Q29-F39 HydrophobicContact CB-CE2 3.82Å; A37-F39 HydrophobicContact CB-CD2 4.48Å; A37-F39 HydrophobicContact CB-CE2 3.63Å; A37-F39 HydrophobicContact CB-CZ 3.71Å
40	A	50.1	Low	43.3	Very low	71 Å²	71	95.7 Å²	95.7	59%	0.587	55%	0.545	S	S	*	.			trans	-87.7	150.3	161.3	0	0	0	0	0	109.2	S42	A40-S42 PolarHBondContact O-N 2.76Å
41	P	47.2	Very low	42.7	Very low	67 Å²	67	97.2 Å²	97.2	44%	0.435	55%	0.554	S	S	.	*	S	Bend	trans	-69.8	121.4	174.3	-2.7	18.7	0	0	0	108.1	P24 I25	P24-P41 WeakPolarHBondContact O-CG 3.27Å; I25-P41 VanDerWaalsContact O-CD 3.25Å; I25-P41 WeakPolarHBondContact O-CD 3.29Å
42	S	43.8	Very low	42.2	Very low	120 Å²	120	95.6 Å²	95.6	84%	0.839	55%	0.549	S	S	*	.	S	Bend	trans	64.4	77.7	169.5	61.5	0	0	0	0	117.8	A40	A40-S42 PolarHBondContact O-N 2.76Å
43	S	37.3	Very low	42.4	Very low	111 Å²	111	93.4 Å²	93.4	78%	0.776	54%	0.538	S	S	*	.			trans	-167.4	139.4	131.7	52	0	0	0	0	109.5
44	E	32.1	Very low	42.2	Very low	175 Å²	175	89.1 Å²	89.1	82%	0.818	52%	0.515	S	S	*	.			trans	-40.2	149.4	-173.9	-62.6	177	153.4	0	0	115.4	S46	E44-S46 VanDerWaalsContact C-N 3.26Å; E44-S46 PolarHBondContact O-N 2.83Å
45	P	29.3	Very low	42.5	Very low	132 Å²	132	91.1 Å²	91.1	86%	0.857	52%	0.517	S	S	*	.			trans	-74.1	80.8	178.7	32.7	-32.7	0	0	0	109.7
46	S	29.5	Very low	42.6	Very low	100 Å²	100	91.7 Å²	91.7	70%	0.699	52%	0.522	S	S	*	.			trans	-75.7	124.8	166	51.6	0	0	0	0	109.5	E44 S48	E44-S46 VanDerWaalsContact C-N 3.26Å; E44-S46 PolarHBondContact O-N 2.83Å; S46-S48 PolarHBondContact O-N 2.95Å
47	I	27.7	Very low	42.3	Very low	179 Å²	179	99.8 Å²	99.8	92%	0.918	56%	0.557	S	S	*	*	S	Bend	trans	-63.8	87.5	-174.3	-59.8	161.9	0	0	0	110.2
48	S	33.6	Very low	42.1	Very low	89 Å²	89	105.8 Å²	105.8	62%	0.622	59%	0.586	S	S	*	*	S	Bend	trans	-162.1	117.3	159.3	58.1	0	0	0	0	107.1	S46 P50	S46-S48 PolarHBondContact O-N 2.95Å; S48-P50 WeakPolarHBondContact O-CD 3.46Å
49	R	38.1	Very low	41.9	Very low	244 Å²	244	106.1 Å²	106.1	92%	0.921	60%	0.596	S	S	*	*			trans	-54.6	108.5	-175.6	-66.9	176.2	179.2	-179.5	-1.6	109.5
50	P	38.1	Very low	41.6	Very low	79 Å²	79	103.4 Å²	103.4	51%	0.513	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-76.2	132.1	-171.6	28.6	-30.8	0	0	0	110.2	S48 F52	S48-P50 WeakPolarHBondContact O-CD 3.46Å; P50-F52 HydrophobicContact CG-CZ 4.3Å
51	L	43.9	Very low	41.4	Very low	76 Å²	76	107 Å²	107	40%	0.398	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.5	131.3	161.1	-73.7	172	0	0	0	107.7	K106 D113 V115	L51-K106 HydrophobicContact CB-CB 4.11Å; L51-K106 HydrophobicContact CB-CD 4.26Å; L51-K106 HydrophobicContact CD1-CB 4.4Å; L51-K106 HydrophobicContact CD1-CD 4.21Å; L51-D113 HydrophobicContact CD2-CB 4.21Å; L51-V115 HydrophobicContact CD1-CG2 4.36Å
52	F	46.1	Very low	41.5	Very low	64 Å²	64	105.3 Å²	105.3	28%	0.281	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.7	129	177.1	-62.7	-76.2	0	0	0	110.1	V38 P50 L54 K106 L107 A109	V38-F52 HydrophobicContact CB-CE1 3.97Å; V38-F52 HydrophobicContact CB-CE2 3.77Å; V38-F52 HydrophobicContact CB-CZ 3.3Å; V38-F52 HydrophobicContact CG1-CD1 4.34Å; V38-F52 HydrophobicContact CG1-CE1 3.51Å; V38-F52 HydrophobicContact CG1-CE2 4.05Å; V38-F52 HydrophobicContact CG1-CZ 3.41Å; V38-F52 VanDerWaalsContact CG1-CZ 3.41Å; V38-F52 HydrophobicContact CG2-CE2 3.81Å; V38-F52 HydrophobicContact CG2-CZ 3.91Å; P50-F52 HydrophobicContact CG-CZ 4.3Å; F52-L54 PolarHBondContact O-N 2.88Å; F52-K106 VanDerWaalsContact O-CA 3.25Å; F52-K106 WeakPolarHBondContact O-CA 3.44Å; F52-L107 PolarHBondContact N-O 3.43Å; F52-L107 PolarHBondContact O-N 2.93Å; F52-A109 HydrophobicContact CE2-CB 3.86Å
53	D	52.1	Low	41.8	Very low	72 Å²	72	104.9 Å²	104.9	39%	0.385	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.6	105.9	172.6	-172.1	-15.5	0	0	0	109.7	Q55 S56 H105	D53-Q55 VanDerWaalsContact C-N 3.32Å; D53-Q55 PolarHBondContact OD1-N 3.3Å; D53-S56 PolarHBondContact O-OG 2.78Å; D53-S56 PolarHBondContact OD1-N 3.43Å; D53-H105 IonicContact OD1-CE1 3.56Å; D53-H105 IonicContact OD1-ND1 3.98Å
54	L	52.5	Low	42.4	Very low	25 Å²	25	102 Å²	102	13%	0.131	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-9	-172.8	-63.8	156.9	0	0	0	112.6	F52 F62 V104 H105 L107	F52-L54 PolarHBondContact O-N 2.88Å; L54-F62 HydrophobicContact CB-CE2 4Å; L54-F62 HydrophobicContact CB-CZ 4.27Å; L54-F62 HydrophobicContact CD1-CE2 3.96Å; L54-F62 HydrophobicContact CD1-CZ 3.42Å; L54-F62 VanDerWaalsContact CD1-CZ 3.42Å; L54-F62 HydrophobicContact CD2-CE1 4.39Å; L54-F62 HydrophobicContact CD2-CE2 3.83Å; L54-F62 HydrophobicContact CD2-CZ 3.48Å; L54-F62 VanDerWaalsContact CD2-CZ 3.48Å; L54-F62 HydrophobicContact CG-CE2 4.11Å; L54-F62 HydrophobicContact CG-CZ 3.86Å; L54-V104 HydrophobicContact CD1-CB 4.36Å; L54-V104 HydrophobicContact CD1-CG1 3.54Å; L54-H105 PolarHBondContact N-O 2.93Å; L54-L107 HydrophobicContact CD1-CB 3.57Å; L54-L107 HydrophobicContact CD1-CD2 4.3Å
55	Q	50.9	Low	43.3	Very low	80 Å²	80	95.4 Å²	95.4	37%	0.374	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	7.2	178.2	-64.7	-173.6	-10.7	0	0	112.5	D53 E102	D53-Q55 VanDerWaalsContact C-N 3.32Å; D53-Q55 PolarHBondContact OD1-N 3.3Å; Q55-E102 PolarHBondContact NE2-O 3.41Å
56	S	48.4	Very low	44.2	Very low	56 Å²	56	92.9 Å²	92.9	39%	0.392	48%	0.482	S	S	.	.	S	Bend	trans	-68.1	154.4	173.2	65.9	0	0	0	0	111.5	D53 N58 G59	D53-S56 PolarHBondContact O-OG 2.78Å; D53-S56 PolarHBondContact OD1-N 3.43Å; S56-N58 PolarHBondContact O-N 2.92Å; S56-G59 PolarHBondContact O-N 2.84Å
57	E	40.3	Very low	45.3	Very low	205 Å²	205	91.7 Å²	91.7	96%	0.958	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-13.2	-174	-74.7	-177.1	157.4	0	0	114.8
58	N	42.7	Very low	46.3	Very low	146 Å²	146	83.2 Å²	83.2	78%	0.781	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	28.6	176.1	-64.4	-22.6	0	0	0	113	S56 I60	S56-N58 PolarHBondContact O-N 2.92Å; N58-I60 PolarHBondContact O-N 3.14Å
59	G	44.5	Very low	47.1	Very low	39 Å²	39	80.6 Å²	80.6	40%	0.402	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-54.4	124.4	-172.5	0	0	0	0	0	114.1	S56 E61	S56-G59 PolarHBondContact O-N 2.84Å; G59-E61 PolarHBondContact O-N 3.13Å
60	I	45.3	Very low	47.7	Very low	41 Å²	41	73.4 Å²	73.4	21%	0.21	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-64.2	125.7	171.2	-63.3	141	0	0	0	108.1	M26 N58 F62 I65	M26-I60 HydrophobicContact CE-CD1 4.07Å; M26-I60 HydrophobicContact CE-CG1 4.36Å; M26-I60 HydrophobicContact CE-CG2 4.18Å; M26-I60 HydrophobicContact CG-CD1 4.38Å; M26-I60 HydrophobicContact SD-CD1 3.21Å; M26-I60 WeakPolarHBondContact SD-CD1 3.5Å; M26-I60 HydrophobicContact SD-CG1 3.93Å; N58-I60 PolarHBondContact O-N 3.14Å; I60-F62 PolarHBondContact O-N 2.95Å; I60-I65 HydrophobicContact CG2-CD1 3.96Å; I60-I65 HydrophobicContact CG2-CG1 3.92Å
61	E	45.8	Very low	48.2	Very low	148 Å²	148	73.2 Å²	73.2	69%	0.692	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-68.4	116.7	174.5	-72	-154.9	169	0	0	109.7	G59 H63 Q64	G59-E61 PolarHBondContact O-N 3.13Å; E61-H63 PolarHBondContact O-N 3.17Å; E61-Q64 VanDerWaalsContact O-CB 3.22Å; E61-Q64 WeakPolarHBondContact O-CB 3.38Å; E61-Q64 WeakPolarHBondContact O-CG 3.05Å; E61-Q64 PolarHBondContact O-N 3.34Å
62	F	49.3	Very low	48	Very low	31 Å²	31	71.5 Å²	71.5	14%	0.136	37%	0.374	C	S	.	.	H	α-helix	trans	-54.8	-28.2	-171	-98.4	-74.4	0	0	0	116	L54 I60 Q64 I65 E66 W101	L54-F62 HydrophobicContact CB-CE2 4Å; L54-F62 HydrophobicContact CB-CZ 4.27Å; L54-F62 HydrophobicContact CD1-CE2 3.96Å; L54-F62 HydrophobicContact CD1-CZ 3.42Å; L54-F62 VanDerWaalsContact CD1-CZ 3.42Å; L54-F62 HydrophobicContact CD2-CE1 4.39Å; L54-F62 HydrophobicContact CD2-CE2 3.83Å; L54-F62 HydrophobicContact CD2-CZ 3.48Å; L54-F62 VanDerWaalsContact CD2-CZ 3.48Å; L54-F62 HydrophobicContact CG-CE2 4.11Å; L54-F62 HydrophobicContact CG-CZ 3.86Å; I60-F62 PolarHBondContact O-N 2.95Å; F62-Q64 PolarHBondContact O-N 3.36Å; F62-I65 HydrophobicContact CD1-CB 4.49Å; F62-I65 HydrophobicContact CD1-CD1 4Å; F62-I65 HydrophobicContact CE1-CD1 3.85Å; F62-I65 PolarHBondContact O-N 3.12Å; F62-E66 PolarHBondContact O-N 2.72Å; F62-W101 HydrophobicContact CB-CB 4.44Å; F62-W101 HydrophobicContact CB-CD2 4.24Å; F62-W101 HydrophobicContact CB-CG 4.14Å; F62-W101 AromaticContact CD1-CD2 3.52Å; F62-W101 HydrophobicContact CD1-CD2 3.52Å; F62-W101 AromaticContact CD1-CE2 3.86Å; F62-W101 AromaticContact CD1-CE3 3.29Å; F62-W101 HydrophobicContact CD1-CE3 3.29Å; F62-W101 HydrophobicContact CD1-CG 4.25Å; F62-W101 AromaticContact CD1-CH2 3.74Å; F62-W101 HydrophobicContact CD1-CH2 3.74Å; F62-W101 AromaticContact CD1-CZ2 3.97Å; F62-W101 HydrophobicContact CD1-CZ2 3.97Å; F62-W101 AromaticContact CD1-CZ3 3.43Å; F62-W101 HydrophobicContact CD1-CZ3 3.43Å; F62-W101 VanDerWaalsContact CD1-CZ3 3.43Å; F62-W101 HydrophobicContact CD2-CB 3.98Å; F62-W101 HydrophobicContact CD2-CD2 4.11Å; F62-W101 AromaticContact CD2-CE3 3.88Å; F62-W101 HydrophobicContact CD2-CE3 3.88Å; F62-W101 HydrophobicContact CD2-CG 4.21Å; F62-W101 AromaticContact CE1-CD2 3.84Å; F62-W101 HydrophobicContact CE1-CD2 3.84Å; F62-W101 AromaticContact CE1-CE3 3.08Å; F62-W101 HydrophobicContact CE1-CE3 3.08Å; F62-W101 AromaticContact CE1-CH2 3.52Å; F62-W101 HydrophobicContact CE1-CH2 3.52Å; F62-W101 HydrophobicContact CE1-CZ2 4.22Å; F62-W101 AromaticContact CE1-CZ3 2.91Å; F62-W101 HydrophobicContact CE1-CZ3 2.91Å; F62-W101 HydrophobicContact CE2-CB 4.47Å; F62-W101 HydrophobicContact CE2-CD2 4.33Å; F62-W101 AromaticContact CE2-CE3 3.64Å; F62-W101 HydrophobicContact CE2-CE3 3.64Å; F62-W101 HydrophobicContact CE2-CZ3 4.25Å; F62-W101 HydrophobicContact CG-CB 4.16Å; F62-W101 AromaticContact CG-CD2 3.67Å; F62-W101 HydrophobicContact CG-CD2 3.67Å; F62-W101 AromaticContact CG-CE3 3.69Å; F62-W101 HydrophobicContact CG-CE3 3.69Å; F62-W101 AromaticContact CG-CG 3.92Å; F62-W101 HydrophobicContact CG-CG 3.92Å; F62-W101 HydrophobicContact CG-CZ3 4.29Å; F62-W101 HydrophobicContact CZ-CD2 4.19Å; F62-W101 AromaticContact CZ-CE3 3.23Å; F62-W101 HydrophobicContact CZ-CE3 3.23Å; F62-W101 HydrophobicContact CZ-CH2 4.37Å; F62-W101 AromaticContact CZ-CZ3 3.36Å; F62-W101 HydrophobicContact CZ-CZ3 3.36Å
63	H	50.1	Low	47.8	Very low	111 Å²	111	71.4 Å²	71.4	51%	0.514	38%	0.375	S	S	.	.	H	α-helix	trans	-59.8	-27.8	175.7	-162.9	47.8	0	0	0	111.5	E61 E66 D67	E61-H63 PolarHBondContact O-N 3.17Å; H63-E66 IonicContact CE1-OE2 2.86Å; H63-E66 IonicContact ND1-OE2 2.81Å; H63-E66 PolarHBondContact ND1-OE2 3.25Å; H63-D67 IonicContact CE1-OD1 3.82Å; H63-D67 IonicContact NE2-OD1 3.83Å; H63-D67 IonicContact NE2-OD2 3.25Å; H63-D67 VanDerWaalsContact O-CB 3.22Å; H63-D67 WeakPolarHBondContact O-CB 3.4Å; H63-D67 PolarHBondContact O-N 3.46Å
64	Q	49.4	Very low	47.4	Very low	51 Å²	51	71.4 Å²	71.4	24%	0.238	39%	0.385	C	S	.	.	H	α-helix	trans	-69.2	-35	173.8	-60.2	173.9	-32.2	0	0	112.5	D2 E61 F62 A68	D2-Q64 PolarHBondContact O-NE2 3.01Å; E61-Q64 VanDerWaalsContact O-CB 3.22Å; E61-Q64 WeakPolarHBondContact O-CB 3.38Å; E61-Q64 WeakPolarHBondContact O-CG 3.05Å; E61-Q64 PolarHBondContact O-N 3.34Å; F62-Q64 PolarHBondContact O-N 3.36Å; Q64-A68 WeakPolarHBondContact O-CB 3.22Å; Q64-A68 PolarHBondContact O-N 3.03Å
65	I	50.8	Low	46.9	Very low	36 Å²	36	73.1 Å²	73.1	19%	0.185	41%	0.41	C	S	.	.	H	α-helix	trans	-73.8	-43	176.6	-59.6	175.7	0	0	0	109.6	I60 F62 A68 M69	I60-I65 HydrophobicContact CG2-CD1 3.96Å; I60-I65 HydrophobicContact CG2-CG1 3.92Å; F62-I65 HydrophobicContact CD1-CB 4.49Å; F62-I65 HydrophobicContact CD1-CD1 4Å; F62-I65 HydrophobicContact CE1-CD1 3.85Å; F62-I65 PolarHBondContact O-N 3.12Å; I65-A68 PolarHBondContact O-N 3.1Å; I65-M69 HydrophobicContact CG2-SD 4.47Å; I65-M69 WeakPolarHBondContact O-CG 3.46Å; I65-M69 PolarHBondContact O-N 3.21Å
66	E	49.5	Very low	46.3	Very low	79 Å²	79	79.4 Å²	79.4	37%	0.369	43%	0.43	S	S	.	.	H	α-helix	trans	-61.3	-54.8	175.9	-177.1	-177.6	-154.9	0	0	111.6	F62 H63 A68 M69 L70	F62-E66 PolarHBondContact O-N 2.72Å; H63-E66 IonicContact CE1-OE2 2.86Å; H63-E66 IonicContact ND1-OE2 2.81Å; H63-E66 PolarHBondContact ND1-OE2 3.25Å; E66-A68 PolarHBondContact O-N 3.21Å; E66-M69 PolarHBondContact O-N 2.63Å; E66-M69 VanDerWaalsContact O-N 3.15Å; E66-L70 HydrophobicContact CG-CD1 3.98Å; E66-L70 HydrophobicContact CG-CG 4.49Å; E66-L70 WeakPolarHBondContact O-CB 3.34Å; E66-L70 WeakPolarHBondContact O-CG 3.44Å; E66-L70 PolarHBondContact O-N 3.35Å
67	D	52.6	Low	46.1	Very low	74 Å²	74	81.1 Å²	81.1	40%	0.396	44%	0.442	S	S	.	.	H	α-helix	trans	-57.3	-36.1	175.8	-89.8	-3.4	0	0	0	110.9	H63 L70 T71	H63-D67 IonicContact CE1-OD1 3.82Å; H63-D67 IonicContact NE2-OD1 3.83Å; H63-D67 IonicContact NE2-OD2 3.25Å; H63-D67 VanDerWaalsContact O-CB 3.22Å; H63-D67 WeakPolarHBondContact O-CB 3.4Å; H63-D67 PolarHBondContact O-N 3.46Å; D67-L70 PolarHBondContact O-N 3.44Å; D67-T71 VanDerWaalsContact O-CB 3.25Å; D67-T71 WeakPolarHBondContact O-CB 3.2Å; D67-T71 PolarHBondContact O-N 2.84Å; D67-T71 PolarHBondContact O-OG1 3.08Å
68	A	49.1	Very low	46.1	Very low	2 Å²	2	79.2 Å²	79.2	2%	0.017	43%	0.432	C	S	.	.	H	α-helix	trans	-67	-46	179.2	0	0	0	0	0	112.5	W6 I15 Q64 I65 E66 T71 C72	W6-A68 HydrophobicContact CH2-CB 3.35Å; W6-A68 VanDerWaalsContact CH2-O 3.26Å; W6-A68 WeakPolarHBondContact CH2-O 3.42Å; W6-A68 VanDerWaalsContact CZ2-CA 3.46Å; W6-A68 HydrophobicContact CZ2-CB 3.61Å; W6-A68 HydrophobicContact CZ3-CB 4.48Å; I15-A68 HydrophobicContact CD1-CB 3.86Å; I15-A68 HydrophobicContact CG1-CB 4.41Å; I15-A68 HydrophobicContact CG2-CB 4.19Å; Q64-A68 WeakPolarHBondContact O-CB 3.22Å; Q64-A68 PolarHBondContact O-N 3.03Å; I65-A68 PolarHBondContact O-N 3.1Å; E66-A68 PolarHBondContact O-N 3.21Å; A68-T71 PolarHBondContact O-N 2.89Å; A68-C72 PolarHBondContact O-N 3.35Å; A68-C72 PolarHBondContact O-SG 2.63Å
69	M	48.8	Very low	46.4	Very low	34 Å²	34	77.1 Å²	77.1	17%	0.167	42%	0.421	C	S	.	.	H	α-helix	trans	-63.8	-46.9	175.3	-70.7	-170.7	146.8	0	0	110.7	I65 E66 T71 C72 L73 L93 L111	I65-M69 HydrophobicContact CG2-SD 4.47Å; I65-M69 WeakPolarHBondContact O-CG 3.46Å; I65-M69 PolarHBondContact O-N 3.21Å; E66-M69 PolarHBondContact O-N 2.63Å; E66-M69 VanDerWaalsContact O-N 3.15Å; M69-T71 VanDerWaalsContact C-N 3.28Å; M69-T71 PolarHBondContact O-N 2.79Å; M69-C72 WeakPolarHBondContact O-CB 3.17Å; M69-C72 PolarHBondContact O-N 2.81Å; M69-C72 VanDerWaalsContact O-N 3.16Å; M69-L73 WeakPolarHBondContact O-CG 3.4Å; M69-L73 PolarHBondContact O-N 2.94Å; M69-L93 HydrophobicContact SD-CD1 3.5Å; M69-L93 WeakPolarHBondContact SD-CD1 3.37Å; M69-L93 HydrophobicContact SD-CD2 4.32Å; M69-L93 HydrophobicContact SD-CG 4.47Å; M69-L111 HydrophobicContact CE-CD1 3.46Å; M69-L111 VanDerWaalsContact CE-CD1 3.46Å; M69-L111 HydrophobicContact SD-CD1 4.09Å
70	L	52.2	Low	46.9	Very low	93 Å²	93	81.4 Å²	81.4	49%	0.487	44%	0.435	S	S	.	.	H	α-helix	trans	-59	-35.9	176.6	-68.9	174.3	0	0	0	113.1	E66 D67 L73 A74	E66-L70 HydrophobicContact CG-CD1 3.98Å; E66-L70 HydrophobicContact CG-CG 4.49Å; E66-L70 WeakPolarHBondContact O-CB 3.34Å; E66-L70 WeakPolarHBondContact O-CG 3.44Å; E66-L70 PolarHBondContact O-N 3.35Å; D67-L70 PolarHBondContact O-N 3.44Å; L70-L73 HydrophobicContact CD2-CD1 4.4Å; L70-L73 WeakPolarHBondContact O-CB 3.46Å; L70-L73 PolarHBondContact O-N 2.68Å; L70-A74 PolarHBondContact O-N 3.33Å; L70-A74 VanDerWaalsContact O-N 3.09Å
71	T	46.7	Very low	47.2	Very low	75 Å²	75	86.2 Å²	86.2	46%	0.46	46%	0.46	S	S	.	.	H	α-helix	trans	-69.8	-42.6	176.5	-59.8	0	0	0	0	111.7	W6 D67 A68 M69 L73 A74 G75	W6-T71 HydrophobicContact CH2-CG2 4.31Å; W6-T71 HydrophobicContact CZ2-CG2 4.27Å; D67-T71 VanDerWaalsContact O-CB 3.25Å; D67-T71 WeakPolarHBondContact O-CB 3.2Å; D67-T71 PolarHBondContact O-N 2.84Å; D67-T71 PolarHBondContact O-OG1 3.08Å; A68-T71 PolarHBondContact O-N 2.89Å; M69-T71 VanDerWaalsContact C-N 3.28Å; M69-T71 PolarHBondContact O-N 2.79Å; T71-L73 PolarHBondContact O-N 2.97Å; T71-A74 PolarHBondContact O-N 2.97Å; T71-A74 VanDerWaalsContact O-N 3.12Å; T71-G75 PolarHBondContact O-N 2.83Å
72	C	40.2	Very low	47.3	Very low	40 Å²	40	82.9 Å²	82.9	27%	0.27	45%	0.446	S	S	.	.	H	α-helix	trans	-57.5	-36.2	171.1	-74.2	0	0	0	0	111.7	A68 M69 G75	A68-C72 PolarHBondContact O-N 3.35Å; A68-C72 PolarHBondContact O-SG 2.63Å; M69-C72 WeakPolarHBondContact O-CB 3.17Å; M69-C72 PolarHBondContact O-N 2.81Å; M69-C72 VanDerWaalsContact O-N 3.16Å; C72-G75 PolarHBondContact O-N 3.03Å
73	L	42	Very low	47.4	Very low	61 Å²	61	85.6 Å²	85.6	32%	0.319	46%	0.46	S	S	.	.	H	α-helix	trans	-71.9	-26.5	177.8	-63.5	175.5	0	0	0	113.9	M69 L70 T71 V86	M69-L73 WeakPolarHBondContact O-CG 3.4Å; M69-L73 PolarHBondContact O-N 2.94Å; L70-L73 HydrophobicContact CD2-CD1 4.4Å; L70-L73 WeakPolarHBondContact O-CB 3.46Å; L70-L73 PolarHBondContact O-N 2.68Å; T71-L73 PolarHBondContact O-N 2.97Å; L73-V86 HydrophobicContact CD1-CG1 4.29Å; L73-V86 HydrophobicContact CD2-CB 3.83Å; L73-V86 HydrophobicContact CD2-CG1 3.07Å; L73-V86 HydrophobicContact CD2-CG2 3.45Å; L73-V86 VanDerWaalsContact CD2-CG2 3.45Å; L73-V86 HydrophobicContact CG-CG1 4.28Å
74	A	44.2	Very low	47.9	Very low	72 Å²	72	84.8 Å²	84.8	60%	0.595	46%	0.456	S	S	*	.	H	α-helix	trans	-76.9	-23.7	175.9	0	0	0	0	0	113	L70 T71 R76	L70-A74 PolarHBondContact O-N 3.33Å; L70-A74 VanDerWaalsContact O-N 3.09Å; T71-A74 PolarHBondContact O-N 2.97Å; T71-A74 VanDerWaalsContact O-N 3.12Å; A74-R76 PolarHBondContact O-N 3.1Å; A74-R76 VanDerWaalsContact O-N 3.12Å
75	G	41.6	Very low	48.3	Very low	62 Å²	62	84.7 Å²	84.7	64%	0.639	46%	0.456	S	S	*	.	S	Bend	trans	-82.6	70.8	179.2	0	0	0	0	0	113.6	T71 C72 S77	T71-G75 PolarHBondContact O-N 2.83Å; C72-G75 PolarHBondContact O-N 3.03Å; G75-S77 PolarHBondContact O-N 3.29Å
76	R	38.8	Very low	48.6	Very low	212 Å²	212	84.5 Å²	84.5	80%	0.8	46%	0.456	S	S	*	.			trans	-70.9	119.4	-168.4	-55.6	178.6	-169	-136.2	-1.1	114.3	A74	A74-R76 PolarHBondContact O-N 3.1Å; A74-R76 VanDerWaalsContact O-N 3.12Å
77	S	43.1	Very low	49.3	Very low	92 Å²	92	85.3 Å²	85.3	64%	0.643	46%	0.46	S	S	*	.			trans	-122.7	127.6	145.3	58.3	0	0	0	0	108.9	G75 D79	G75-S77 PolarHBondContact O-N 3.29Å; S77-D79 PolarHBondContact O-N 2.91Å
78	H	42.1	Very low	50.4	Low	164 Å²	164	84.2 Å²	84.2	76%	0.759	45%	0.45	S	S	*	.			trans	-74.6	88	-172	-75.5	50.5	0	0	0	112.1
79	D	48.3	Very low	51.4	Low	103 Å²	103	85 Å²	85	55%	0.551	45%	0.454	S	S	*	.			trans	-118.6	117.8	158.6	-87.8	-31.9	0	0	0	109.4	S77 I81 I82 M83	S77-D79 PolarHBondContact O-N 2.91Å; D79-I81 PolarHBondContact O-N 2.97Å; D79-I81 VanDerWaalsContact O-N 3.15Å; D79-I82 HydrophobicContact CB-CD1 4.3Å; D79-I82 HydrophobicContact CB-CG1 4.46Å; D79-I82 PolarHBondContact O-N 3.16Å; D79-I82 VanDerWaalsContact O-N 3.15Å; D79-M83 PolarHBondContact O-N 3.48Å
80	D	54.3	Low	52.4	Low	129 Å²	129	89.1 Å²	89.1	69%	0.69	47%	0.473	S	S	*	.	H	α-helix	trans	-56.2	-33.8	-171.5	-70.9	-30.4	0	0	0	112.9	M83 E84	D80-M83 PolarHBondContact O-N 3.16Å; D80-E84 WeakPolarHBondContact O-CG 3.34Å; D80-E84 PolarHBondContact O-N 3.22Å
81	I	52	Low	53.9	Low	141 Å²	141	86.6 Å²	86.6	72%	0.723	46%	0.462	S	S	*	.	H	α-helix	trans	-67.5	-41.2	-178.3	-62.6	170.5	0	0	0	111.8	D79 M83 E84 H85	D79-I81 PolarHBondContact O-N 2.97Å; D79-I81 VanDerWaalsContact O-N 3.15Å; I81-M83 VanDerWaalsContact C-N 3.35Å; I81-E84 PolarHBondContact O-N 3.49Å; I81-H85 PolarHBondContact O-N 2.92Å; I81-H85 VanDerWaalsContact O-N 3.1Å
82	I	48.2	Very low	55.7	Low	78 Å²	78	83 Å²	83	40%	0.4	44%	0.44	S	S	.	.	H	α-helix	trans	-68.1	-42.2	179.8	-61.8	176.5	0	0	0	109	D79 E84 H85 V86	D79-I82 HydrophobicContact CB-CD1 4.3Å; D79-I82 HydrophobicContact CB-CG1 4.46Å; D79-I82 PolarHBondContact O-N 3.16Å; D79-I82 VanDerWaalsContact O-N 3.15Å; I82-E84 PolarHBondContact O-N 3.25Å; I82-H85 PolarHBondContact O-N 3.1Å; I82-V86 HydrophobicContact CG2-CG2 4.37Å; I82-V86 VanDerWaalsContact O-CB 3.28Å; I82-V86 WeakPolarHBondContact O-CB 3Å; I82-V86 VanDerWaalsContact O-CG2 3.3Å; I82-V86 WeakPolarHBondContact O-CG2 3.46Å; I82-V86 PolarHBondContact O-N 3.46Å
83	M	50.7	Low	57.6	Low	88 Å²	88	82.6 Å²	82.6	43%	0.433	43%	0.434	S	S	.	.	H	α-helix	trans	-62.8	-40.6	177.4	-71.4	-56.8	-52.7	0	0	112.5	D79 D80 I81 V86 Q87	D79-M83 PolarHBondContact O-N 3.48Å; D80-M83 PolarHBondContact O-N 3.16Å; I81-M83 VanDerWaalsContact C-N 3.35Å; M83-V86 HydrophobicContact CE-CG1 4.47Å; M83-V86 WeakPolarHBondContact O-CB 3.2Å; M83-Q87 WeakPolarHBondContact O-CB 3.48Å; M83-Q87 VanDerWaalsContact O-CG 3.26Å; M83-Q87 WeakPolarHBondContact O-CG 3.35Å; M83-Q87 PolarHBondContact O-N 3.47Å
84	E	60.7	Low	59.7	Low	94 Å²	94	83 Å²	83	44%	0.439	44%	0.442	S	S	.	.	H	α-helix	trans	-63.2	-42.8	174.2	-76.9	-174	-168.3	0	0	112.2	D80 I81 I82 Q87 R88	D80-E84 WeakPolarHBondContact O-CG 3.34Å; D80-E84 PolarHBondContact O-N 3.22Å; I81-E84 PolarHBondContact O-N 3.49Å; I82-E84 PolarHBondContact O-N 3.25Å; E84-Q87 PolarHBondContact O-N 3.22Å; E84-R88 WeakPolarHBondContact O-CD 3.28Å; E84-R88 WeakPolarHBondContact O-CG 3.12Å; E84-R88 PolarHBondContact O-N 2.95Å; E84-R88 IonicContact OE2-CZ 3.39Å; E84-R88 IonicContact OE2-NH2 3.16Å; E84-R88 PolarHBondContact OE2-NH2 3.06Å
85	H	59.1	Low	61.9	Low	50 Å²	50	79.9 Å²	79.9	23%	0.231	42%	0.415	C	S	.	.	H	α-helix	trans	-64.6	-44.6	178.7	-169.8	88.4	0	0	0	111.6	I81 I82 Q87 R88 L89 L134	I81-H85 PolarHBondContact O-N 2.92Å; I81-H85 VanDerWaalsContact O-N 3.1Å; I82-H85 PolarHBondContact O-N 3.1Å; H85-Q87 PolarHBondContact O-N 2.92Å; H85-R88 WeakPolarHBondContact O-CB 3.39Å; H85-R88 PolarHBondContact O-N 3.36Å; H85-R88 VanDerWaalsContact O-N 3.15Å; H85-L89 PolarHBondContact O-N 3.3Å; H85-L134 VanDerWaalsContact CE1-CD1 3.49Å; H85-L134 WeakPolarHBondContact CE1-CD1 3.34Å
86	V	57.5	Low	64	Low	31 Å²	31	76.9 Å²	76.9	19%	0.188	39%	0.385	C	S	.	.	H	α-helix	trans	-54.2	-48.3	173.2	145.6	0	0	0	0	112.3	L73 I82 M83 R88 L89 E90	L73-V86 HydrophobicContact CD1-CG1 4.29Å; L73-V86 HydrophobicContact CD2-CB 3.83Å; L73-V86 HydrophobicContact CD2-CG1 3.07Å; L73-V86 HydrophobicContact CD2-CG2 3.45Å; L73-V86 VanDerWaalsContact CD2-CG2 3.45Å; L73-V86 HydrophobicContact CG-CG1 4.28Å; I82-V86 HydrophobicContact CG2-CG2 4.37Å; I82-V86 VanDerWaalsContact O-CB 3.28Å; I82-V86 WeakPolarHBondContact O-CB 3Å; I82-V86 VanDerWaalsContact O-CG2 3.3Å; I82-V86 WeakPolarHBondContact O-CG2 3.46Å; I82-V86 PolarHBondContact O-N 3.46Å; M83-V86 HydrophobicContact CE-CG1 4.47Å; M83-V86 WeakPolarHBondContact O-CB 3.2Å; V86-R88 PolarHBondContact O-N 3.05Å; V86-L89 PolarHBondContact O-N 3.05Å; V86-E90 PolarHBondContact O-N 3.02Å
87	Q	64.1	Low	66.2	Low	97 Å²	97	70.2 Å²	70.2	45%	0.453	37%	0.368	S	S	.	.	H	α-helix	trans	-63	-33.3	-179.6	-76.8	171.7	-4.8	0	0	111.3	M83 E84 H85 V91	M83-Q87 WeakPolarHBondContact O-CB 3.48Å; M83-Q87 VanDerWaalsContact O-CG 3.26Å; M83-Q87 WeakPolarHBondContact O-CG 3.35Å; M83-Q87 PolarHBondContact O-N 3.47Å; E84-Q87 PolarHBondContact O-N 3.22Å; H85-Q87 PolarHBondContact O-N 2.92Å; Q87-V91 PolarHBondContact O-N 3.03Å
88	R	74.6	Confident	68.5	Low	50 Å²	50	69.1 Å²	69.1	19%	0.189	36%	0.364	C	S	.	.	H	α-helix	trans	-71.1	-40.1	176.6	-64.2	165.8	-164	-180	11	111.6	E84 H85 V86 V91 I92 L134 W136 V138	E84-R88 WeakPolarHBondContact O-CD 3.28Å; E84-R88 WeakPolarHBondContact O-CG 3.12Å; E84-R88 PolarHBondContact O-N 2.95Å; E84-R88 IonicContact OE2-CZ 3.39Å; E84-R88 IonicContact OE2-NH2 3.16Å; E84-R88 PolarHBondContact OE2-NH2 3.06Å; H85-R88 WeakPolarHBondContact O-CB 3.39Å; H85-R88 PolarHBondContact O-N 3.36Å; H85-R88 VanDerWaalsContact O-N 3.15Å; V86-R88 PolarHBondContact O-N 3.05Å; R88-V91 WeakPolarHBondContact O-CB 3.47Å; R88-V91 PolarHBondContact O-N 2.76Å; R88-I92 PolarHBondContact O-N 3.05Å; R88-L134 HydrophobicContact CB-CD2 4.05Å; R88-L134 VanDerWaalsContact CD-O 3.22Å; R88-L134 WeakPolarHBondContact CD-O 3.44Å; R88-L134 PolarHBondContact NH1-O 2.94Å; R88-W136 HydrophobicContact CG-CE3 4.25Å; R88-V138 HydrophobicContact CB-CG2 3.63Å; R88-V138 HydrophobicContact CG-CG2 3.74Å
89	L	70	Confident	70.8	Confident	19 Å²	19	61.7 Å²	61.7	10%	0.099	33%	0.33	C	S	.	.	H	α-helix	trans	-66.1	-37	174.1	-65.9	-179.4	0	0	0	112	H85 V86 V91 I92 L93 L111 L134	H85-L89 PolarHBondContact O-N 3.3Å; V86-L89 PolarHBondContact O-N 3.05Å; L89-V91 VanDerWaalsContact C-N 3.25Å; L89-V91 PolarHBondContact O-N 2.88Å; L89-I92 HydrophobicContact CD2-CD1 4.34Å; L89-I92 WeakPolarHBondContact O-CB 3.49Å; L89-I92 PolarHBondContact O-N 2.95Å; L89-L93 WeakPolarHBondContact O-CG 3.27Å; L89-L93 PolarHBondContact O-N 2.89Å; L89-L111 HydrophobicContact CD1-CD1 4.49Å; L89-L111 HydrophobicContact CD2-CB 4.13Å; L89-L111 HydrophobicContact CD2-CD1 4.11Å; L89-L134 HydrophobicContact CD2-CD1 4.45Å; L89-L134 HydrophobicContact CD2-CD2 4.1Å
90	E	70.7	Confident	72.6	Confident	121 Å²	121	57.3 Å²	57.3	57%	0.565	31%	0.309	S	S	*	.	H	α-helix	trans	-58	-37.5	175.1	-171.9	-177.8	-179.9	0	0	111.9	V86 L93 S94	V86-E90 PolarHBondContact O-N 3.02Å; E90-L93 PolarHBondContact O-N 2.82Å; E90-S94 VanDerWaalsContact O-CB 3.24Å; E90-S94 WeakPolarHBondContact O-CB 3.2Å; E90-S94 PolarHBondContact O-N 3.21Å
91	V	83.8	Confident	73.8	Confident	40 Å²	40	53.4 Å²	53.4	24%	0.242	29%	0.285	C	S	.	.	H	α-helix	trans	-61.1	-45	173.8	175.5	0	0	0	0	111.3	Q87 R88 L89 S94 D95 W136 V138	Q87-V91 PolarHBondContact O-N 3.03Å; R88-V91 WeakPolarHBondContact O-CB 3.47Å; R88-V91 PolarHBondContact O-N 2.76Å; L89-V91 VanDerWaalsContact C-N 3.25Å; L89-V91 PolarHBondContact O-N 2.88Å; V91-S94 PolarHBondContact O-N 3.37Å; V91-D95 PolarHBondContact O-N 3.12Å; V91-W136 HydrophobicContact CG2-CZ3 4.44Å; V91-V138 HydrophobicContact CB-CB 4.49Å; V91-V138 HydrophobicContact CB-CG2 4.38Å; V91-V138 HydrophobicContact CG1-CB 4.19Å; V91-V138 HydrophobicContact CG1-CG1 4.37Å
92	I	83.5	Confident	75.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-49.4	179.3	-59.1	177.9	0	0	0	110.1	R88 L89 S94 D95 L96 Y132 L134 V138	R88-I92 PolarHBondContact O-N 3.05Å; L89-I92 HydrophobicContact CD2-CD1 4.34Å; L89-I92 WeakPolarHBondContact O-CB 3.49Å; L89-I92 PolarHBondContact O-N 2.95Å; I92-S94 VanDerWaalsContact C-N 3.3Å; I92-S94 PolarHBondContact O-N 3.3Å; I92-D95 WeakPolarHBondContact O-CB 3.48Å; I92-D95 PolarHBondContact O-N 3.48Å; I92-D95 VanDerWaalsContact O-N 3.11Å; I92-L96 HydrophobicContact CG2-CD1 4.22Å; I92-L96 HydrophobicContact CG2-CG 4.39Å; I92-L96 WeakPolarHBondContact O-CG 3.44Å; I92-L96 PolarHBondContact O-N 2.89Å; I92-Y132 HydrophobicContact CD1-CD1 4.16Å; I92-Y132 HydrophobicContact CD1-CD2 4.27Å; I92-Y132 HydrophobicContact CD1-CG 3.78Å; I92-Y132 HydrophobicContact CG1-CD1 3.71Å; I92-Y132 HydrophobicContact CG1-CD2 4.31Å; I92-Y132 HydrophobicContact CG1-CE1 4.09Å; I92-Y132 HydrophobicContact CG1-CG 3.82Å; I92-Y132 HydrophobicContact CG2-CD2 4.01Å; I92-Y132 HydrophobicContact CG2-CE2 3.89Å; I92-Y132 HydrophobicContact CG2-CG 4.39Å; I92-L134 HydrophobicContact CD1-CD2 3.67Å; I92-V138 HydrophobicContact CG1-CG1 4.34Å
93	L	79.4	Confident	77.1	Confident	31 Å²	31	52.6 Å²	52.6	16%	0.162	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-39.5	179.4	-64	170.7	0	0	0	111.7	M69 L89 E90 D95 L96 T97 W101 L111	M69-L93 HydrophobicContact SD-CD1 3.5Å; M69-L93 WeakPolarHBondContact SD-CD1 3.37Å; M69-L93 HydrophobicContact SD-CD2 4.32Å; M69-L93 HydrophobicContact SD-CG 4.47Å; L89-L93 WeakPolarHBondContact O-CG 3.27Å; L89-L93 PolarHBondContact O-N 2.89Å; E90-L93 PolarHBondContact O-N 2.82Å; L93-D95 VanDerWaalsContact C-N 3.33Å; L93-D95 PolarHBondContact O-N 3.42Å; L93-L96 PolarHBondContact O-N 3.2Å; L93-T97 WeakPolarHBondContact O-CB 3.45Å; L93-T97 PolarHBondContact O-N 3.11Å; L93-T97 PolarHBondContact O-OG1 2.83Å; L93-T97 VanDerWaalsContact O-OG1 3.13Å; L93-W101 HydrophobicContact CD2-CH2 3.91Å; L93-W101 HydrophobicContact CD2-CZ2 4.11Å; L93-L111 HydrophobicContact CD2-CD1 4.22Å
94	S	86.1	Confident	78.9	Confident	68 Å²	68	48.5 Å²	48.5	48%	0.476	25%	0.253	S	S	.	.	H	α-helix	trans	-62.7	-39.4	174.3	179.5	0	0	0	0	112.2	E90 V91 I92 A98	E90-S94 VanDerWaalsContact O-CB 3.24Å; E90-S94 WeakPolarHBondContact O-CB 3.2Å; E90-S94 PolarHBondContact O-N 3.21Å; V91-S94 PolarHBondContact O-N 3.37Å; I92-S94 VanDerWaalsContact C-N 3.3Å; I92-S94 PolarHBondContact O-N 3.3Å; S94-A98 WeakPolarHBondContact O-CB 3.06Å; S94-A98 PolarHBondContact O-N 2.99Å; S94-A98 VanDerWaalsContact O-N 3.08Å
95	D	90.5	Very high	80.1	Confident	7 Å²	7	45.3 Å²	45.3	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-44.7	175.2	-82.5	-4	0	0	0	110.7	V91 I92 L93 A98 I99 Y132 A158 P159	V91-D95 PolarHBondContact O-N 3.12Å; I92-D95 WeakPolarHBondContact O-CB 3.48Å; I92-D95 PolarHBondContact O-N 3.48Å; I92-D95 VanDerWaalsContact O-N 3.11Å; L93-D95 VanDerWaalsContact C-N 3.33Å; L93-D95 PolarHBondContact O-N 3.42Å; D95-A98 PolarHBondContact O-N 2.9Å; D95-I99 WeakPolarHBondContact O-CG1 3.28Å; D95-I99 PolarHBondContact O-N 3.4Å; D95-Y132 PolarHBondContact OD2-OH 2.99Å; D95-A158 HydrophobicContact CB-CB 4.23Å; D95-A158 WeakPolarHBondContact OD2-CB 3.19Å; D95-P159 HydrophobicContact CB-CG 4.15Å; D95-P159 WeakPolarHBondContact OD1-CD 3.49Å
96	L	87.1	Confident	81.2	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-42.4	179	-62.9	-176.6	0	0	0	112.8	I92 L93 A98 I99 G100 W101 V104 L107 V114 L116	I92-L96 HydrophobicContact CG2-CD1 4.22Å; I92-L96 HydrophobicContact CG2-CG 4.39Å; I92-L96 WeakPolarHBondContact O-CG 3.44Å; I92-L96 PolarHBondContact O-N 2.89Å; L93-L96 PolarHBondContact O-N 3.2Å; L96-A98 VanDerWaalsContact C-N 3.29Å; L96-A98 PolarHBondContact O-N 2.87Å; L96-I99 PolarHBondContact O-N 3.1Å; L96-G100 PolarHBondContact O-N 3.06Å; L96-W101 HydrophobicContact CB-CE3 4.37Å; L96-W101 HydrophobicContact CB-CH2 3.8Å; L96-W101 HydrophobicContact CB-CZ2 3.9Å; L96-W101 HydrophobicContact CB-CZ3 4Å; L96-W101 HydrophobicContact CD1-CH2 3.58Å; L96-W101 HydrophobicContact CD1-CZ2 4.47Å; L96-W101 HydrophobicContact CD1-CZ3 3.64Å; L96-W101 HydrophobicContact CG-CH2 4.34Å; L96-W101 HydrophobicContact CG-CZ3 4.45Å; L96-V104 HydrophobicContact CD2-CG2 4.26Å; L96-L107 HydrophobicContact CD1-CD1 4.29Å; L96-V114 HydrophobicContact CD1-CG1 4.47Å; L96-V114 HydrophobicContact CD1-CG2 4.3Å; L96-V114 HydrophobicContact CD2-CB 4.42Å; L96-V114 HydrophobicContact CD2-CG1 3.76Å; L96-V114 HydrophobicContact CD2-CG2 4.17Å; L96-L116 HydrophobicContact CD2-CD2 4.41Å
97	T	83.8	Confident	82.2	Confident	71 Å²	71	45.6 Å²	45.6	44%	0.436	24%	0.237	S	C	.	.	H	α-helix	trans	-61.5	-38.5	173.5	-66	0	0	0	0	111.5	L93 G100 W101	L93-T97 WeakPolarHBondContact O-CB 3.45Å; L93-T97 PolarHBondContact O-N 3.11Å; L93-T97 PolarHBondContact O-OG1 2.83Å; L93-T97 VanDerWaalsContact O-OG1 3.13Å; T97-G100 PolarHBondContact O-N 3.4Å; T97-W101 PolarHBondContact OG1-NE1 2.93Å
98	A	91.2	Very high	82.7	Confident	70 Å²	70	41.5 Å²	41.5	58%	0.579	22%	0.219	S	C	*	.	H	α-helix	trans	-70.1	-30.3	176.5	0	0	0	0	0	113.3	S94 D95 L96 P159	S94-A98 WeakPolarHBondContact O-CB 3.06Å; S94-A98 PolarHBondContact O-N 2.99Å; S94-A98 VanDerWaalsContact O-N 3.08Å; D95-A98 PolarHBondContact O-N 2.9Å; L96-A98 VanDerWaalsContact C-N 3.29Å; L96-A98 PolarHBondContact O-N 2.87Å; A98-P159 HydrophobicContact CB-CB 4.12Å; A98-P159 HydrophobicContact CB-CG 3.72Å
99	I	92.4	Very high	81.9	Confident	8 Å²	8	40.4 Å²	40.4	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-74.4	-33.7	174.6	-74.5	164.8	0	0	0	111.9	D95 L96 R103 L116 L130 A158 P159 F162	D95-I99 WeakPolarHBondContact O-CG1 3.28Å; D95-I99 PolarHBondContact O-N 3.4Å; L96-I99 PolarHBondContact O-N 3.1Å; I99-R103 HydrophobicContact CG2-CB 4.24Å; I99-L116 HydrophobicContact CD1-CD1 3.9Å; I99-L116 HydrophobicContact CG2-CD1 4.16Å; I99-L116 HydrophobicContact CG2-CD2 4.08Å; I99-L130 HydrophobicContact CD1-CD1 4.48Å; I99-A158 HydrophobicContact CD1-CB 4.39Å; I99-P159 HydrophobicContact CD1-CG 4.41Å; I99-P159 HydrophobicContact CG1-CB 3.97Å; I99-P159 HydrophobicContact CG1-CG 4.07Å; I99-F162 HydrophobicContact CB-CD1 4.39Å; I99-F162 HydrophobicContact CD1-CB 4.17Å; I99-F162 HydrophobicContact CD1-CG 4.44Å; I99-F162 HydrophobicContact CG1-CB 4.11Å; I99-F162 HydrophobicContact CG1-CD1 4.14Å; I99-F162 HydrophobicContact CG1-CG 4.2Å; I99-F162 HydrophobicContact CG2-CD1 3.73Å; I99-F162 HydrophobicContact CG2-CD2 4.45Å; I99-F162 HydrophobicContact CG2-CE1 3.71Å; I99-F162 HydrophobicContact CG2-CE2 4.45Å; I99-F162 HydrophobicContact CG2-CG 4.08Å; I99-F162 HydrophobicContact CG2-CZ 4.07Å
100	G	85.7	Confident	81.6	Confident	11 Å²	11	43 Å²	43	11%	0.113	24%	0.235	C	C	.	.			trans	100.7	119.2	-173	0	0	0	0	0	111.4	L96 T97 E102 R103	L96-G100 PolarHBondContact O-N 3.06Å; T97-G100 PolarHBondContact O-N 3.4Å; G100-E102 VanDerWaalsContact CA-OE2 3.23Å; G100-E102 WeakPolarHBondContact CA-OE2 3.24Å; G100-E102 PolarHBondContact O-N 3.3Å; G100-R103 WeakPolarHBondContact O-CB 3.11Å; G100-R103 PolarHBondContact O-N 2.9Å
101	W	79.6	Confident	81.6	Confident	47 Å²	47	38 Å²	38	18%	0.178	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-62.7	-26.8	-178.1	-74.1	104.4	0	0	0	113.4	F62 L93 L96 T97 R103 V104 L107	F62-W101 HydrophobicContact CB-CB 4.44Å; F62-W101 HydrophobicContact CB-CD2 4.24Å; F62-W101 HydrophobicContact CB-CG 4.14Å; F62-W101 AromaticContact CD1-CD2 3.52Å; F62-W101 HydrophobicContact CD1-CD2 3.52Å; F62-W101 AromaticContact CD1-CE2 3.86Å; F62-W101 AromaticContact CD1-CE3 3.29Å; F62-W101 HydrophobicContact CD1-CE3 3.29Å; F62-W101 HydrophobicContact CD1-CG 4.25Å; F62-W101 AromaticContact CD1-CH2 3.74Å; F62-W101 HydrophobicContact CD1-CH2 3.74Å; F62-W101 AromaticContact CD1-CZ2 3.97Å; F62-W101 HydrophobicContact CD1-CZ2 3.97Å; F62-W101 AromaticContact CD1-CZ3 3.43Å; F62-W101 HydrophobicContact CD1-CZ3 3.43Å; F62-W101 VanDerWaalsContact CD1-CZ3 3.43Å; F62-W101 HydrophobicContact CD2-CB 3.98Å; F62-W101 HydrophobicContact CD2-CD2 4.11Å; F62-W101 AromaticContact CD2-CE3 3.88Å; F62-W101 HydrophobicContact CD2-CE3 3.88Å; F62-W101 HydrophobicContact CD2-CG 4.21Å; F62-W101 AromaticContact CE1-CD2 3.84Å; F62-W101 HydrophobicContact CE1-CD2 3.84Å; F62-W101 AromaticContact CE1-CE3 3.08Å; F62-W101 HydrophobicContact CE1-CE3 3.08Å; F62-W101 AromaticContact CE1-CH2 3.52Å; F62-W101 HydrophobicContact CE1-CH2 3.52Å; F62-W101 HydrophobicContact CE1-CZ2 4.22Å; F62-W101 AromaticContact CE1-CZ3 2.91Å; F62-W101 HydrophobicContact CE1-CZ3 2.91Å; F62-W101 HydrophobicContact CE2-CB 4.47Å; F62-W101 HydrophobicContact CE2-CD2 4.33Å; F62-W101 AromaticContact CE2-CE3 3.64Å; F62-W101 HydrophobicContact CE2-CE3 3.64Å; F62-W101 HydrophobicContact CE2-CZ3 4.25Å; F62-W101 HydrophobicContact CG-CB 4.16Å; F62-W101 AromaticContact CG-CD2 3.67Å; F62-W101 HydrophobicContact CG-CD2 3.67Å; F62-W101 AromaticContact CG-CE3 3.69Å; F62-W101 HydrophobicContact CG-CE3 3.69Å; F62-W101 AromaticContact CG-CG 3.92Å; F62-W101 HydrophobicContact CG-CG 3.92Å; F62-W101 HydrophobicContact CG-CZ3 4.29Å; F62-W101 HydrophobicContact CZ-CD2 4.19Å; F62-W101 AromaticContact CZ-CE3 3.23Å; F62-W101 HydrophobicContact CZ-CE3 3.23Å; F62-W101 HydrophobicContact CZ-CH2 4.37Å; F62-W101 AromaticContact CZ-CZ3 3.36Å; F62-W101 HydrophobicContact CZ-CZ3 3.36Å; L93-W101 HydrophobicContact CD2-CH2 3.91Å; L93-W101 HydrophobicContact CD2-CZ2 4.11Å; L96-W101 HydrophobicContact CB-CE3 4.37Å; L96-W101 HydrophobicContact CB-CH2 3.8Å; L96-W101 HydrophobicContact CB-CZ2 3.9Å; L96-W101 HydrophobicContact CB-CZ3 4Å; L96-W101 HydrophobicContact CD1-CH2 3.58Å; L96-W101 HydrophobicContact CD1-CZ2 4.47Å; L96-W101 HydrophobicContact CD1-CZ3 3.64Å; L96-W101 HydrophobicContact CG-CH2 4.34Å; L96-W101 HydrophobicContact CG-CZ3 4.45Å; T97-W101 PolarHBondContact OG1-NE1 2.93Å; W101-R103 PolarHBondContact O-N 3.04Å; W101-R103 VanDerWaalsContact O-N 3.1Å; W101-V104 HydrophobicContact CE3-CB 4.18Å; W101-V104 HydrophobicContact CE3-CG2 3.74Å; W101-V104 HydrophobicContact CZ3-CG2 4.22Å; W101-V104 PolarHBondContact O-N 2.99Å; W101-L107 HydrophobicContact CZ3-CD2 4.31Å
102	E	80.6	Confident	81.4	Confident	130 Å²	130	36.6 Å²	36.6	61%	0.607	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-60.2	-20.3	173.1	74.3	-73	175.1	0	0	112.9	Q55 G100	Q55-E102 PolarHBondContact NE2-O 3.41Å; G100-E102 VanDerWaalsContact CA-OE2 3.23Å; G100-E102 WeakPolarHBondContact CA-OE2 3.24Å; G100-E102 PolarHBondContact O-N 3.3Å
103	R	88.8	Confident	81.4	Confident	72 Å²	72	39.2 Å²	39.2	27%	0.272	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-93.6	-7.9	177.9	-48.7	-164	-176.8	-155.7	5.2	112.9	I99 G100 W101 H105 L116 K117 F162	I99-R103 HydrophobicContact CG2-CB 4.24Å; G100-R103 WeakPolarHBondContact O-CB 3.11Å; G100-R103 PolarHBondContact O-N 2.9Å; W101-R103 PolarHBondContact O-N 3.04Å; W101-R103 VanDerWaalsContact O-N 3.1Å; R103-H105 PolarHBondContact O-N 2.89Å; R103-L116 CarbonylContact O-C 3.53Å; R103-L116 VanDerWaalsContact O-CA 3.24Å; R103-L116 WeakPolarHBondContact O-CA 3.44Å; R103-K117 PolarHBondContact O-N 2.87Å; R103-F162 HydrophobicContact CB-CZ 4.15Å; R103-F162 HydrophobicContact CG-CZ 4.4Å
104	V	87.2	Confident	81.8	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	108.9	176.9	-174.1	0	0	0	0	108.8	L54 L96 W101 V114 L116	L54-V104 HydrophobicContact CD1-CB 4.36Å; L54-V104 HydrophobicContact CD1-CG1 3.54Å; L96-V104 HydrophobicContact CD2-CG2 4.26Å; W101-V104 HydrophobicContact CE3-CB 4.18Å; W101-V104 HydrophobicContact CE3-CG2 3.74Å; W101-V104 HydrophobicContact CZ3-CG2 4.22Å; W101-V104 PolarHBondContact O-N 2.99Å; V104-V114 HydrophobicContact CG1-CG1 3.8Å; V104-L116 HydrophobicContact CB-CD2 4.42Å; V104-L116 HydrophobicContact CG2-CD2 3.82Å
105	H	87.1	Confident	82.1	Confident	28 Å²	28	35.4 Å²	35.4	13%	0.13	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-44.6	179.9	178.4	47.9	0	0	0	111.9	D53 L54 R103 V115 K117 F127	D53-H105 IonicContact OD1-CE1 3.56Å; D53-H105 IonicContact OD1-ND1 3.98Å; L54-H105 PolarHBondContact N-O 2.93Å; R103-H105 PolarHBondContact O-N 2.89Å; H105-V115 WeakPolarHBondContact CA-O 3.38Å; H105-V115 WeakPolarHBondContact CB-O 3.37Å; H105-V115 PolarHBondContact N-O 2.73Å; H105-K117 HydrophobicContact CB-CB 3.72Å; H105-K117 HydrophobicContact CB-CD 4.42Å; H105-F127 AromaticContact CD2-CE1 3.56Å
106	K	81.2	Confident	82.3	Confident	74 Å²	74	35.1 Å²	35.1	32%	0.322	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	151	177.4	-59.9	178.5	178.8	175.2	0	112.2	L51 F52 V114 V115	L51-K106 HydrophobicContact CB-CB 4.11Å; L51-K106 HydrophobicContact CB-CD 4.26Å; L51-K106 HydrophobicContact CD1-CB 4.4Å; L51-K106 HydrophobicContact CD1-CD 4.21Å; F52-K106 VanDerWaalsContact O-CA 3.25Å; F52-K106 WeakPolarHBondContact O-CA 3.44Å; K106-V114 WeakPolarHBondContact O-CA 3.33Å; K106-V115 HydrophobicContact CB-CB 3.88Å; K106-V115 HydrophobicContact CB-CG2 3.93Å; K106-V115 HydrophobicContact CD-CG2 4.46Å; K106-V115 HydrophobicContact CG-CB 4.47Å; K106-V115 PolarHBondContact N-O 3.37Å; K106-V115 VanDerWaalsContact N-O 3.09Å; K106-V115 PolarHBondContact O-N 3.12Å
107	L	78.5	Confident	82.6	Confident	12 Å²	12	37.6 Å²	37.6	6%	0.063	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	135.4	179.1	-176	59.7	0	0	0	110.5	F52 L54 L96 W101 L111 D113 V114	F52-L107 PolarHBondContact N-O 3.43Å; F52-L107 PolarHBondContact O-N 2.93Å; L54-L107 HydrophobicContact CD1-CB 3.57Å; L54-L107 HydrophobicContact CD1-CD2 4.3Å; L96-L107 HydrophobicContact CD1-CD1 4.29Å; W101-L107 HydrophobicContact CZ3-CD2 4.31Å; L107-L111 HydrophobicContact CD1-CD2 3.98Å; L107-L111 HydrophobicContact CD2-CD2 3.53Å; L107-L111 HydrophobicContact CG-CD2 3.76Å; L107-D113 CarbonylContact C-O 3.5Å; L107-D113 WeakPolarHBondContact CA-O 3.28Å; L107-V114 HydrophobicContact CD1-CB 4.38Å; L107-V114 HydrophobicContact CD1-CG1 4.35Å; L107-V114 HydrophobicContact CD1-CG2 3.65Å
108	S	74.2	Confident	83.2	Confident	11 Å²	11	35 Å²	35	8%	0.077	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	155.3	175.9	62.3	0	0	0	0	112.5	N110 L111 T112 D113	S108-N110 VanDerWaalsContact CB-OD1 3.24Å; S108-N110 WeakPolarHBondContact CB-OD1 3.35Å; S108-N110 PolarHBondContact O-N 3.33Å; S108-N110 VanDerWaalsContact O-N 3.11Å; S108-N110 PolarHBondContact OG-OD1 3.25Å; S108-L111 PolarHBondContact O-N 3.31Å; S108-L111 PolarHBondContact OG-N 3.41Å; S108-T112 PolarHBondContact OG-N 2.93Å; S108-D113 PolarHBondContact N-O 3.03Å; S108-D113 PolarHBondContact OG-N 2.74Å; S108-D113 PolarHBondContact OG-O 3.35Å
109	A	58.8	Low	83.4	Confident	28 Å²	28	35.7 Å²	35.7	23%	0.231	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.2	178.1	0	0	0	0	0	114	V36 V38 F52	V36-A109 WeakPolarHBondContact CG1-O 3.43Å; V38-A109 HydrophobicContact CG2-CB 4.2Å; F52-A109 HydrophobicContact CE2-CB 3.86Å
110	N	63	Low	83.4	Confident	73 Å²	73	36.2 Å²	36.2	39%	0.39	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	8	179.8	66.7	-21.4	0	0	0	113.4	S108 T112	S108-N110 VanDerWaalsContact CB-OD1 3.24Å; S108-N110 WeakPolarHBondContact CB-OD1 3.35Å; S108-N110 PolarHBondContact O-N 3.33Å; S108-N110 VanDerWaalsContact O-N 3.11Å; S108-N110 PolarHBondContact OG-OD1 3.25Å; N110-T112 PolarHBondContact ND2-OG1 3.1Å; N110-T112 PolarHBondContact O-N 2.89Å; N110-T112 PolarHBondContact OD1-OG1 2.03Å
111	L	71.5	Confident	83.7	Confident	15 Å²	15	39.3 Å²	39.3	8%	0.079	21%	0.205	C	C	.	.	S	Bend	trans	61	8.9	179.6	-52.8	-179.7	0	0	0	116.1	M69 L89 L93 L107 S108	M69-L111 HydrophobicContact CE-CD1 3.46Å; M69-L111 VanDerWaalsContact CE-CD1 3.46Å; M69-L111 HydrophobicContact SD-CD1 4.09Å; L89-L111 HydrophobicContact CD1-CD1 4.49Å; L89-L111 HydrophobicContact CD2-CB 4.13Å; L89-L111 HydrophobicContact CD2-CD1 4.11Å; L93-L111 HydrophobicContact CD2-CD1 4.22Å; L107-L111 HydrophobicContact CD1-CD2 3.98Å; L107-L111 HydrophobicContact CD2-CD2 3.53Å; L107-L111 HydrophobicContact CG-CD2 3.76Å; S108-L111 PolarHBondContact O-N 3.31Å; S108-L111 PolarHBondContact OG-N 3.41Å
112	T	78.5	Confident	84.3	Confident	11 Å²	11	40.3 Å²	40.3	7%	0.067	21%	0.214	C	C	.	.			trans	-83.4	-27.5	-179	56.3	0	0	0	0	113.4	S108 N110 H131 Y132 L134	S108-T112 PolarHBondContact OG-N 2.93Å; N110-T112 PolarHBondContact ND2-OG1 3.1Å; N110-T112 PolarHBondContact O-N 2.89Å; N110-T112 PolarHBondContact OD1-OG1 2.03Å; T112-H131 CarbonylContact O-C 3.04Å; T112-H131 WeakPolarHBondContact O-CA 3.4Å; T112-Y132 WeakPolarHBondContact CB-O 3.32Å; T112-Y132 PolarHBondContact O-N 3.24Å; T112-L134 HydrophobicContact CG2-CD1 3.94Å; T112-L134 HydrophobicContact CG2-CG 3.99Å
113	D	84.1	Confident	84.9	Confident	56 Å²	56	44.6 Å²	44.6	30%	0.299	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.8	-175.5	-57.1	-92.1	0	0	0	109.3	L51 L107 S108 L130 H131	L51-D113 HydrophobicContact CD2-CB 4.21Å; L107-D113 CarbonylContact C-O 3.5Å; L107-D113 WeakPolarHBondContact CA-O 3.28Å; S108-D113 PolarHBondContact N-O 3.03Å; S108-D113 PolarHBondContact OG-N 2.74Å; S108-D113 PolarHBondContact OG-O 3.35Å; D113-L130 WeakPolarHBondContact CA-O 3.38Å; D113-H131 IonicContact OD1-CE1 2.68Å; D113-H131 IonicContact OD1-CG 2.85Å; D113-H131 IonicContact OD1-ND1 3.69Å; D113-H131 PolarHBondContact OD1-ND1 3.2Å; D113-H131 IonicContact OD2-ND1 3.86Å
114	V	87.8	Confident	85.2	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131	-177	-165.6	0	0	0	0	109	L96 V104 K106 L107 L116 N129 L130 Y132	L96-V114 HydrophobicContact CD1-CG1 4.47Å; L96-V114 HydrophobicContact CD1-CG2 4.3Å; L96-V114 HydrophobicContact CD2-CB 4.42Å; L96-V114 HydrophobicContact CD2-CG1 3.76Å; L96-V114 HydrophobicContact CD2-CG2 4.17Å; V104-V114 HydrophobicContact CG1-CG1 3.8Å; K106-V114 WeakPolarHBondContact O-CA 3.33Å; L107-V114 HydrophobicContact CD1-CB 4.38Å; L107-V114 HydrophobicContact CD1-CG1 4.35Å; L107-V114 HydrophobicContact CD1-CG2 3.65Å; V114-L116 HydrophobicContact CG1-CD2 3.87Å; V114-L116 HydrophobicContact CG1-CG 4.36Å; V114-N129 CarbonylContact O-C 3.47Å; V114-L130 HydrophobicContact CB-CB 4.2Å; V114-L130 PolarHBondContact N-O 2.85Å; V114-L130 PolarHBondContact O-N 3.4Å; V114-Y132 HydrophobicContact CG2-CD2 4.18Å; V114-Y132 HydrophobicContact CG2-CE2 3.88Å
115	V	92.7	Very high	85.6	Confident	17 Å²	17	44.9 Å²	44.9	10%	0.103	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114.1	169.5	-174.4	0	0	0	0	107.8	L51 H105 K106 F127	L51-V115 HydrophobicContact CD1-CG2 4.36Å; H105-V115 WeakPolarHBondContact CA-O 3.38Å; H105-V115 WeakPolarHBondContact CB-O 3.37Å; H105-V115 PolarHBondContact N-O 2.73Å; K106-V115 HydrophobicContact CB-CB 3.88Å; K106-V115 HydrophobicContact CB-CG2 3.93Å; K106-V115 HydrophobicContact CD-CG2 4.46Å; K106-V115 HydrophobicContact CG-CB 4.47Å; K106-V115 PolarHBondContact N-O 3.37Å; K106-V115 VanDerWaalsContact N-O 3.09Å; K106-V115 PolarHBondContact O-N 3.12Å; V115-F127 HydrophobicContact CG1-CB 4.34Å; V115-F127 HydrophobicContact CG1-CD1 3.95Å
116	L	93.9	Very high	86	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	147.9	173.6	-56.2	174.7	0	0	0	109.7	L96 I99 R103 V104 V114 F127 M128 L130 F162	L96-L116 HydrophobicContact CD2-CD2 4.41Å; I99-L116 HydrophobicContact CD1-CD1 3.9Å; I99-L116 HydrophobicContact CG2-CD1 4.16Å; I99-L116 HydrophobicContact CG2-CD2 4.08Å; R103-L116 CarbonylContact O-C 3.53Å; R103-L116 VanDerWaalsContact O-CA 3.24Å; R103-L116 WeakPolarHBondContact O-CA 3.44Å; V104-L116 HydrophobicContact CB-CD2 4.42Å; V104-L116 HydrophobicContact CG2-CD2 3.82Å; V114-L116 HydrophobicContact CG1-CD2 3.87Å; V114-L116 HydrophobicContact CG1-CG 4.36Å; L116-F127 CarbonylContact O-C 3.56Å; L116-F127 VanDerWaalsContact O-CA 3.25Å; L116-F127 WeakPolarHBondContact O-CA 3.24Å; L116-M128 HydrophobicContact CB-CB 4.32Å; L116-M128 HydrophobicContact CD1-SD 4.44Å; L116-M128 PolarHBondContact N-O 2.83Å; L116-M128 PolarHBondContact O-N 3.48Å; L116-L130 HydrophobicContact CD1-CD1 3.63Å; L116-L130 HydrophobicContact CD1-CG 4.16Å; L116-L130 HydrophobicContact CG-CD1 4.31Å; L116-F162 HydrophobicContact CB-CD2 4.25Å; L116-F162 HydrophobicContact CB-CE2 3.81Å; L116-F162 HydrophobicContact CD1-CD2 3.4Å; L116-F162 HydrophobicContact CD1-CE2 3.78Å; L116-F162 HydrophobicContact CD1-CG 4.1Å; L116-F162 HydrophobicContact CG-CD2 4.45Å; L116-F162 HydrophobicContact CG-CE2 4.4Å
117	K	95	Very high	86.7	Confident	52 Å²	52	44.3 Å²	44.3	23%	0.226	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.9	179.6	177.9	-173.5	174.5	-172.8	0	110.4	R103 H105 C125 H126 F127	R103-K117 PolarHBondContact O-N 2.87Å; H105-K117 HydrophobicContact CB-CB 3.72Å; H105-K117 HydrophobicContact CB-CD 4.42Å; K117-C125 VanDerWaalsContact CE-SG 3.51Å; K117-H126 WeakPolarHBondContact CA-O 3.22Å; K117-F127 HydrophobicContact CB-CD1 3.97Å; K117-F127 HydrophobicContact CB-CE1 3.93Å; K117-F127 HydrophobicContact CD-CE1 3.86Å; K117-F127 HydrophobicContact CD-CZ 4.35Å; K117-F127 HydrophobicContact CG-CD1 4.17Å; K117-F127 HydrophobicContact CG-CE1 3.76Å; K117-F127 HydrophobicContact CG-CZ 4.35Å
118	I	95.3	Very high	87.5	Confident	18 Å²	18	43.8 Å²	43.8	9%	0.092	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	156.8	166.5	66.7	176.9	0	0	0	109.9	C125 H126 F162 F165 V166 V169	I118-C125 WeakPolarHBondContact O-CA 3.24Å; I118-H126 HydrophobicContact CG1-CB 3.85Å; I118-H126 PolarHBondContact N-O 3.15Å; I118-H126 PolarHBondContact O-N 2.69Å; I118-F162 HydrophobicContact CG2-CE1 4.44Å; I118-F162 HydrophobicContact CG2-CE2 3.9Å; I118-F162 HydrophobicContact CG2-CZ 3.42Å; I118-F162 VanDerWaalsContact CG2-CZ 3.42Å; I118-F165 HydrophobicContact CD1-CD1 3.98Å; I118-F165 HydrophobicContact CD1-CE1 3.57Å; I118-F165 HydrophobicContact CD1-CZ 4.23Å; I118-F165 HydrophobicContact CG1-CE1 3.8Å; I118-F165 HydrophobicContact CG1-CZ 4.36Å; I118-V166 HydrophobicContact CD1-CB 4.36Å; I118-V166 HydrophobicContact CD1-CG2 3.91Å; I118-V166 HydrophobicContact CG2-CG2 4.19Å; I118-V169 HydrophobicContact CD1-CB 4.06Å; I118-V169 HydrophobicContact CD1-CG1 4.06Å; I118-V169 HydrophobicContact CD1-CG2 4.01Å
119	T	95.1	Very high	88.5	Confident	83 Å²	83	46.4 Å²	46.4	51%	0.509	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.4	173.4	-57.2	0	0	0	0	108.3	R124	T119-R124 VanDerWaalsContact CA-O 3.29Å; T119-R124 WeakPolarHBondContact CA-O 3.42Å
120	D	93.8	Very high	90.2	Very high	19 Å²	19	45.2 Å²	45.2	10%	0.102	23%	0.23	C	C	.	.			trans	-78.6	177.1	177.9	73.9	14.5	0	0	0	112.4	D122 R123 R124 H126 V169	D120-D122 PolarHBondContact O-N 3.31Å; D120-D122 VanDerWaalsContact OD1-C 3.3Å; D120-D122 WeakPolarHBondContact OD1-CA 3.47Å; D120-D122 PolarHBondContact OD1-N 3.46Å; D120-R123 PolarHBondContact O-N 3.01Å; D120-R123 PolarHBondContact OD1-N 3.12Å; D120-R124 PolarHBondContact N-O 2.94Å; D120-R124 PolarHBondContact OD1-N 3.42Å; D120-R124 IonicContact OD1-NE 3.85Å; D120-R124 IonicContact OD1-NH2 3.75Å; D120-R124 IonicContact OD2-CZ 2.65Å; D120-R124 IonicContact OD2-NE 3.72Å; D120-R124 PolarHBondContact OD2-NE 3.08Å; D120-R124 IonicContact OD2-NH2 2.72Å; D120-R124 PolarHBondContact OD2-NH2 2.89Å; D120-H126 IonicContact OD2-CE1 3.67Å; D120-H126 IonicContact OD2-NE2 3.38Å; D120-H126 PolarHBondContact OD2-NE2 3.24Å; D120-V169 HydrophobicContact CB-CG1 4.18Å
121	S	91.5	Very high	91.7	Very high	77 Å²	77	45.4 Å²	45.4	54%	0.538	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-18	-179.7	42	0	0	0	0	114.4	R123 R173	S121-R123 VanDerWaalsContact C-N 3.28Å; S121-R173 WeakPolarHBondContact OG-CD 3.39Å; S121-R173 PolarHBondContact OG-NH1 2.89Å
122	D	92.5	Very high	92.5	Very high	67 Å²	67	44.8 Å²	44.8	36%	0.358	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	10	173	-68	-55.9	0	0	0	112	D120 R124 R173 N177	D120-D122 PolarHBondContact O-N 3.31Å; D120-D122 VanDerWaalsContact OD1-C 3.3Å; D120-D122 WeakPolarHBondContact OD1-CA 3.47Å; D120-D122 PolarHBondContact OD1-N 3.46Å; D122-R124 VanDerWaalsContact C-N 3.34Å; D122-R124 PolarHBondContact O-N 2.74Å; D122-R124 IonicContact OD2-CZ 3.64Å; D122-R124 IonicContact OD2-NH1 2.72Å; D122-R124 IonicContact OD2-NH2 2.77Å; D122-R124 PolarHBondContact OD2-NH2 3.2Å; D122-R173 VanDerWaalsContact OD2-CD 3.24Å; D122-R173 WeakPolarHBondContact OD2-CD 3.21Å; D122-R173 WeakPolarHBondContact OD2-CG 3.43Å; D122-R173 IonicContact OD2-NE 3.91Å; D122-N177 PolarHBondContact OD2-ND2 2.65Å; D122-N177 PolarHBondContact OD2-OD1 3.12Å
123	R	93.6	Very high	93	Very high	221 Å²	221	46.3 Å²	46.3	83%	0.834	23%	0.234	S	C	*	.			trans	65.7	27.7	179.9	-56	-176.3	-73.6	-178.1	-4.1	114.3	D120 S121	D120-R123 PolarHBondContact O-N 3.01Å; D120-R123 PolarHBondContact OD1-N 3.12Å; S121-R123 VanDerWaalsContact C-N 3.28Å
124	R	94.8	Very high	92.7	Very high	31 Å²	31	45.3 Å²	45.3	12%	0.117	23%	0.228	C	C	.	.			trans	-88.5	136.1	171.7	-61.2	174.3	-69.1	-129.6	-14	110.1	T119 D120 D122 H126 W176 N177 F196	T119-R124 VanDerWaalsContact CA-O 3.29Å; T119-R124 WeakPolarHBondContact CA-O 3.42Å; D120-R124 PolarHBondContact N-O 2.94Å; D120-R124 PolarHBondContact OD1-N 3.42Å; D120-R124 IonicContact OD1-NE 3.85Å; D120-R124 IonicContact OD1-NH2 3.75Å; D120-R124 IonicContact OD2-CZ 2.65Å; D120-R124 IonicContact OD2-NE 3.72Å; D120-R124 PolarHBondContact OD2-NE 3.08Å; D120-R124 IonicContact OD2-NH2 2.72Å; D120-R124 PolarHBondContact OD2-NH2 2.89Å; D122-R124 VanDerWaalsContact C-N 3.34Å; D122-R124 PolarHBondContact O-N 2.74Å; D122-R124 IonicContact OD2-CZ 3.64Å; D122-R124 IonicContact OD2-NH1 2.72Å; D122-R124 IonicContact OD2-NH2 2.77Å; D122-R124 PolarHBondContact OD2-NH2 3.2Å; R124-H126 PolarHBondContact O-CD2 2.88Å; R124-W176 VanDerWaalsContact NH1-CB 3.28Å; R124-N177 PolarHBondContact NH1-OD1 2.91Å; R124-F196 HydrophobicContact CB-CZ 4.25Å
125	C	95.3	Very high	92.5	Very high	48 Å²	48	50.5 Å²	50.5	32%	0.324	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130.3	175.3	-67.1	0	0	0	0	110	K117 I118 F127	K117-C125 VanDerWaalsContact CE-SG 3.51Å; I118-C125 WeakPolarHBondContact O-CA 3.24Å; C125-F127 HydrophobicContact CB-CE2 4.07Å; C125-F127 HydrophobicContact CB-CZ 4.15Å
126	H	96	Very high	91.8	Very high	3 Å²	3	58.4 Å²	58.4	1%	0.014	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140.8	177.1	-57	-85.2	0	0	0	109.1	K117 I118 D120 R124 F165 V169 W176 F196	K117-H126 WeakPolarHBondContact CA-O 3.22Å; I118-H126 HydrophobicContact CG1-CB 3.85Å; I118-H126 PolarHBondContact N-O 3.15Å; I118-H126 PolarHBondContact O-N 2.69Å; D120-H126 IonicContact OD2-CE1 3.67Å; D120-H126 IonicContact OD2-NE2 3.38Å; D120-H126 PolarHBondContact OD2-NE2 3.24Å; R124-H126 PolarHBondContact O-CD2 2.88Å; H126-F165 HydrophobicContact CB-CZ 3.81Å; H126-V169 HydrophobicContact CB-CG2 4.19Å; H126-V169 WeakPolarHBondContact CD2-CG1 3.48Å; H126-W176 AromaticContact CE1-CE3 3.78Å; H126-W176 AromaticContact CE1-CH2 3.33Å; H126-W176 WeakPolarHBondContact CE1-CH2 3.43Å; H126-W176 AromaticContact CE1-CZ3 3.22Å; H126-W176 WeakPolarHBondContact CE1-CZ3 3.4Å; H126-W176 AromaticContact ND1-CH2 3.74Å; H126-W176 AromaticContact NE2-CZ3 3.66Å; H126-F196 AromaticContact CE1-CE1 3.88Å; H126-F196 AromaticContact CE1-CZ 3.83Å; H126-F196 AromaticContact ND1-CD2 3.88Å; H126-F196 AromaticContact ND1-CE2 3.78Å
127	F	95.5	Very high	91.3	Very high	87 Å²	87	62.2 Å²	62.2	38%	0.382	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.5	-175.3	-59.5	-85.5	0	0	0	111.2	H105 V115 L116 K117 C125	H105-F127 AromaticContact CD2-CE1 3.56Å; V115-F127 HydrophobicContact CG1-CB 4.34Å; V115-F127 HydrophobicContact CG1-CD1 3.95Å; L116-F127 CarbonylContact O-C 3.56Å; L116-F127 VanDerWaalsContact O-CA 3.25Å; L116-F127 WeakPolarHBondContact O-CA 3.24Å; K117-F127 HydrophobicContact CB-CD1 3.97Å; K117-F127 HydrophobicContact CB-CE1 3.93Å; K117-F127 HydrophobicContact CD-CE1 3.86Å; K117-F127 HydrophobicContact CD-CZ 4.35Å; K117-F127 HydrophobicContact CG-CD1 4.17Å; K117-F127 HydrophobicContact CG-CE1 3.76Å; K117-F127 HydrophobicContact CG-CZ 4.35Å; C125-F127 HydrophobicContact CB-CE2 4.07Å; C125-F127 HydrophobicContact CB-CZ 4.15Å
128	M	95.3	Very high	90.8	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	119.2	172	176	179.2	-167.6	0	0	108.7	L116 L130 C142 V144 V161 F162 F165	L116-M128 HydrophobicContact CB-CB 4.32Å; L116-M128 HydrophobicContact CD1-SD 4.44Å; L116-M128 PolarHBondContact N-O 2.83Å; L116-M128 PolarHBondContact O-N 3.48Å; M128-L130 HydrophobicContact CE-CD2 3.6Å; M128-L130 HydrophobicContact CG-CD2 4.3Å; M128-L130 HydrophobicContact SD-CD2 4.31Å; M128-C142 HydrophobicContact CE-CB 3.57Å; M128-V144 HydrophobicContact CB-CG1 3.79Å; M128-V144 HydrophobicContact CG-CG1 3.58Å; M128-V144 HydrophobicContact SD-CG1 4.41Å; M128-V161 HydrophobicContact CE-CB 4.32Å; M128-V161 HydrophobicContact CE-CG1 3.59Å; M128-F162 HydrophobicContact SD-CB 4.38Å; M128-F162 HydrophobicContact SD-CD2 3.86Å; M128-F165 HydrophobicContact CB-CD1 4.06Å; M128-F165 HydrophobicContact CB-CE1 3.9Å; M128-F165 HydrophobicContact CB-CE2 4.5Å; M128-F165 HydrophobicContact CB-CG 4.4Å; M128-F165 HydrophobicContact CB-CZ 4.13Å; M128-F165 HydrophobicContact SD-CB 4.01Å; M128-F165 HydrophobicContact SD-CD1 4.16Å; M128-F165 HydrophobicContact SD-CG 4.1Å
129	N	95.1	Very high	90.6	Very high	66 Å²	66	65.7 Å²	65.7	35%	0.353	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.6	176.3	-55.6	-59.2	0	0	0	108.4	V114 C142 D143	V114-N129 CarbonylContact O-C 3.47Å; N129-C142 CarbonylContact O-C 3.5Å; N129-C142 WeakPolarHBondContact O-CA 3.49Å; N129-C142 WeakPolarHBondContact O-CB 3.4Å; N129-D143 HydrophobicContact CB-CB 4.33Å; N129-D143 PolarHBondContact N-O 3.04Å; N129-D143 PolarHBondContact O-N 2.87Å
130	L	94.2	Very high	90.4	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.8	171.7	-62.2	179.8	0	0	0	109.3	I99 D113 V114 L116 M128 Y132 F140 T141 C142 A158	I99-L130 HydrophobicContact CD1-CD1 4.48Å; D113-L130 WeakPolarHBondContact CA-O 3.38Å; V114-L130 HydrophobicContact CB-CB 4.2Å; V114-L130 PolarHBondContact N-O 2.85Å; V114-L130 PolarHBondContact O-N 3.4Å; L116-L130 HydrophobicContact CD1-CD1 3.63Å; L116-L130 HydrophobicContact CD1-CG 4.16Å; L116-L130 HydrophobicContact CG-CD1 4.31Å; M128-L130 HydrophobicContact CE-CD2 3.6Å; M128-L130 HydrophobicContact CG-CD2 4.3Å; M128-L130 HydrophobicContact SD-CD2 4.31Å; L130-Y132 HydrophobicContact CB-CE2 4.04Å; L130-Y132 HydrophobicContact CD1-CE2 4.13Å; L130-F140 HydrophobicContact CD2-CD2 4.04Å; L130-F140 HydrophobicContact CD2-CE2 4.43Å; L130-T141 WeakPolarHBondContact CA-O 3.42Å; L130-C142 HydrophobicContact CD2-CB 3.58Å; L130-A158 HydrophobicContact CD1-CB 4.11Å
131	H	93.6	Very high	90.3	Very high	76 Å²	76	65.4 Å²	65.4	35%	0.352	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	111.3	171	178.5	81	0	0	0	109.9	T112 D113 F140 T141	T112-H131 CarbonylContact O-C 3.04Å; T112-H131 WeakPolarHBondContact O-CA 3.4Å; D113-H131 IonicContact OD1-CE1 2.68Å; D113-H131 IonicContact OD1-CG 2.85Å; D113-H131 IonicContact OD1-ND1 3.69Å; D113-H131 PolarHBondContact OD1-ND1 3.2Å; D113-H131 IonicContact OD2-ND1 3.86Å; H131-F140 CarbonylContact O-C 3.59Å; H131-F140 VanDerWaalsContact O-CA 3.22Å; H131-F140 WeakPolarHBondContact O-CA 3.17Å; H131-T141 PolarHBondContact N-O 2.87Å; H131-T141 PolarHBondContact O-N 3.42Å; H131-T141 PolarHBondContact O-OG1 3.02Å
132	Y	89.7	Confident	90.4	Very high	3 Å²	3	63 Å²	63	1%	0.012	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	137.1	178	-68.7	-91.3	0	0	0	111.4	I92 D95 T112 V114 L130 V138 E139 F140 A158	I92-Y132 HydrophobicContact CD1-CD1 4.16Å; I92-Y132 HydrophobicContact CD1-CD2 4.27Å; I92-Y132 HydrophobicContact CD1-CG 3.78Å; I92-Y132 HydrophobicContact CG1-CD1 3.71Å; I92-Y132 HydrophobicContact CG1-CD2 4.31Å; I92-Y132 HydrophobicContact CG1-CE1 4.09Å; I92-Y132 HydrophobicContact CG1-CG 3.82Å; I92-Y132 HydrophobicContact CG2-CD2 4.01Å; I92-Y132 HydrophobicContact CG2-CE2 3.89Å; I92-Y132 HydrophobicContact CG2-CG 4.39Å; D95-Y132 PolarHBondContact OD2-OH 2.99Å; T112-Y132 WeakPolarHBondContact CB-O 3.32Å; T112-Y132 PolarHBondContact O-N 3.24Å; V114-Y132 HydrophobicContact CG2-CD2 4.18Å; V114-Y132 HydrophobicContact CG2-CE2 3.88Å; L130-Y132 HydrophobicContact CB-CE2 4.04Å; L130-Y132 HydrophobicContact CD1-CE2 4.13Å; Y132-V138 HydrophobicContact CD1-CG1 4.02Å; Y132-E139 CarbonylContact C-O 3.54Å; Y132-E139 WeakPolarHBondContact CA-O 3.06Å; Y132-F140 HydrophobicContact CD1-CB 3.73Å; Y132-F140 HydrophobicContact CE1-CB 3.93Å; Y132-F140 HydrophobicContact CE1-CD1 4.48Å; Y132-F140 HydrophobicContact CE1-CG 4.41Å; Y132-F140 HydrophobicContact CG-CB 4.17Å; Y132-A158 HydrophobicContact CE1-CB 4.48Å; Y132-A158 WeakPolarHBondContact OH-CB 3.35Å
133	T	88.7	Confident	90.3	Very high	43 Å²	43	64.9 Å²	64.9	26%	0.264	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124	169.4	63.3	0	0	0	0	109.3	N135 E139	T133-N135 PolarHBondContact O-N 3.2Å; T133-E139 PolarHBondContact N-O 2.99Å; T133-E139 PolarHBondContact O-N 3.48Å; T133-E139 PolarHBondContact OG1-O 3.17Å
134	L	78.4	Confident	90.3	Very high	34 Å²	34	55.7 Å²	55.7	18%	0.178	29%	0.286	C	S	.	.			trans	-80.3	33.9	-178.4	-59.9	175.5	0	0	0	112.3	H85 R88 L89 I92 T112	H85-L134 VanDerWaalsContact CE1-CD1 3.49Å; H85-L134 WeakPolarHBondContact CE1-CD1 3.34Å; R88-L134 HydrophobicContact CB-CD2 4.05Å; R88-L134 VanDerWaalsContact CD-O 3.22Å; R88-L134 WeakPolarHBondContact CD-O 3.44Å; R88-L134 PolarHBondContact NH1-O 2.94Å; L89-L134 HydrophobicContact CD2-CD1 4.45Å; L89-L134 HydrophobicContact CD2-CD2 4.1Å; I92-L134 HydrophobicContact CD1-CD2 3.67Å; T112-L134 HydrophobicContact CG2-CD1 3.94Å; T112-L134 HydrophobicContact CG2-CG 3.99Å
135	N	81.9	Confident	90.2	Very high	111 Å²	111	57 Å²	57	59%	0.594	30%	0.295	S	S	*	.	S	Bend	trans	-81.7	169.3	166.2	-69.2	-27.2	0	0	0	109.3	T133 P137 V138	T133-N135 PolarHBondContact O-N 3.2Å; N135-P137 CarbonylContact C-O 3.57Å; N135-P137 VanDerWaalsContact C-O 3.3Å; N135-P137 CarbonylContact O-C 3.54Å; N135-V138 VanDerWaalsContact O-CA 3.28Å; N135-V138 WeakPolarHBondContact O-CA 3.5Å; N135-V138 PolarHBondContact O-N 3.41Å; N135-V138 VanDerWaalsContact O-N 3.12Å
136	W	78.1	Confident	90.1	Very high	183 Å²	183	55.2 Å²	55.2	69%	0.693	28%	0.282	S	S	*	.	S	Bend	trans	-109.5	124.3	171	-169.9	-102.8	0	0	0	110.3	R88 V91 V138	R88-W136 HydrophobicContact CG-CE3 4.25Å; V91-W136 HydrophobicContact CG2-CZ3 4.44Å; W136-V138 HydrophobicContact CE3-CG2 4.29Å; W136-V138 HydrophobicContact CZ3-CG2 4.38Å
137	P	85.3	Confident	89.7	Confident	80 Å²	80	56.2 Å²	56.2	52%	0.519	29%	0.289	S	S	.	.	S	Bend	cis	-65.4	155	-3.2	31	-36	0	0	0	112.4	N135 E139	N135-P137 CarbonylContact C-O 3.57Å; N135-P137 VanDerWaalsContact C-O 3.3Å; N135-P137 CarbonylContact O-C 3.54Å; P137-E139 PolarHBondContact O-N 3.27Å
138	V	83.8	Confident	88.9	Confident	24 Å²	24	54 Å²	54	15%	0.145	29%	0.287	C	S	.	.			trans	-66.9	119.6	173.2	177.5	0	0	0	0	108	R88 V91 I92 Y132 N135 W136	R88-V138 HydrophobicContact CB-CG2 3.63Å; R88-V138 HydrophobicContact CG-CG2 3.74Å; V91-V138 HydrophobicContact CB-CB 4.49Å; V91-V138 HydrophobicContact CB-CG2 4.38Å; V91-V138 HydrophobicContact CG1-CB 4.19Å; V91-V138 HydrophobicContact CG1-CG1 4.37Å; I92-V138 HydrophobicContact CG1-CG1 4.34Å; Y132-V138 HydrophobicContact CD1-CG1 4.02Å; N135-V138 VanDerWaalsContact O-CA 3.28Å; N135-V138 WeakPolarHBondContact O-CA 3.5Å; N135-V138 PolarHBondContact O-N 3.41Å; N135-V138 VanDerWaalsContact O-N 3.12Å; W136-V138 HydrophobicContact CE3-CG2 4.29Å; W136-V138 HydrophobicContact CZ3-CG2 4.38Å
139	E	89.8	Confident	87.8	Confident	119 Å²	119	59.6 Å²	59.6	56%	0.556	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	157.8	179	-66.9	178.2	170.5	0	0	109.7	Y132 T133 P137	Y132-E139 CarbonylContact C-O 3.54Å; Y132-E139 WeakPolarHBondContact CA-O 3.06Å; T133-E139 PolarHBondContact N-O 2.99Å; T133-E139 PolarHBondContact O-N 3.48Å; T133-E139 PolarHBondContact OG1-O 3.17Å; P137-E139 PolarHBondContact O-N 3.27Å
140	F	91.9	Very high	86.5	Confident	21 Å²	21	57.5 Å²	57.5	9%	0.092	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	154.7	174.5	67.9	-82.8	0	0	0	110.8	L130 H131 Y132 W154 Q156 A158 V161	L130-F140 HydrophobicContact CD2-CD2 4.04Å; L130-F140 HydrophobicContact CD2-CE2 4.43Å; H131-F140 CarbonylContact O-C 3.59Å; H131-F140 VanDerWaalsContact O-CA 3.22Å; H131-F140 WeakPolarHBondContact O-CA 3.17Å; Y132-F140 HydrophobicContact CD1-CB 3.73Å; Y132-F140 HydrophobicContact CE1-CB 3.93Å; Y132-F140 HydrophobicContact CE1-CD1 4.48Å; Y132-F140 HydrophobicContact CE1-CG 4.41Å; Y132-F140 HydrophobicContact CG-CB 4.17Å; F140-W154 HydrophobicContact CD2-CZ3 4.42Å; F140-W154 HydrophobicContact CE2-CZ3 4.23Å; F140-W154 VanDerWaalsContact O-CZ3 3.26Å; F140-W154 WeakPolarHBondContact O-CZ3 3.13Å; F140-Q156 WeakPolarHBondContact CE1-O 3.46Å; F140-A158 HydrophobicContact CD1-CB 4.29Å; F140-A158 HydrophobicContact CD2-CB 4.46Å; F140-A158 HydrophobicContact CE1-CB 4.14Å; F140-A158 HydrophobicContact CE2-CB 4.29Å; F140-A158 HydrophobicContact CG-CB 4.47Å; F140-A158 HydrophobicContact CZ-CB 4.14Å; F140-V161 HydrophobicContact CE2-CB 4.36Å; F140-V161 HydrophobicContact CE2-CG2 4.07Å; F140-V161 HydrophobicContact CZ-CB 4.37Å; F140-V161 HydrophobicContact CZ-CG2 3.71Å
141	T	92.4	Very high	85.5	Confident	76 Å²	76	66.6 Å²	66.6	47%	0.466	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	156.5	165.7	57.4	0	0	0	0	108.5	L130 H131	L130-T141 WeakPolarHBondContact CA-O 3.42Å; H131-T141 PolarHBondContact N-O 2.87Å; H131-T141 PolarHBondContact O-N 3.42Å; H131-T141 PolarHBondContact O-OG1 3.02Å
142	C	92.2	Very high	84.4	Confident	26 Å²	26	64.5 Å²	64.5	18%	0.176	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	151.3	175.5	74.4	0	0	0	0	112.7	M128 N129 L130 I152	M128-C142 HydrophobicContact CE-CB 3.57Å; N129-C142 CarbonylContact O-C 3.5Å; N129-C142 WeakPolarHBondContact O-CA 3.49Å; N129-C142 WeakPolarHBondContact O-CB 3.4Å; L130-C142 HydrophobicContact CD2-CB 3.58Å; C142-I152 WeakPolarHBondContact SG-CD1 3.4Å
143	D	91.9	Very high	83.9	Confident	106 Å²	106	68.5 Å²	68.5	57%	0.567	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.8	178.2	178.8	59.7	0	0	0	109.5	N129	N129-D143 HydrophobicContact CB-CB 4.33Å; N129-D143 PolarHBondContact N-O 3.04Å; N129-D143 PolarHBondContact O-N 2.87Å
144	V	93.2	Very high	83.3	Confident	29 Å²	29	73.4 Å²	73.4	18%	0.176	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	142	-174.4	-66.5	0	0	0	0	110.2	M128 L146 F165	M128-V144 HydrophobicContact CB-CG1 3.79Å; M128-V144 HydrophobicContact CG-CG1 3.58Å; M128-V144 HydrophobicContact SD-CG1 4.41Å; V144-L146 HydrophobicContact CB-CD1 4.16Å; V144-L146 HydrophobicContact CB-CG 4.14Å; V144-L146 HydrophobicContact CG2-CB 4.45Å; V144-L146 HydrophobicContact CG2-CD1 3.64Å; V144-L146 HydrophobicContact CG2-CG 3.92Å; V144-L146 PolarHBondContact O-N 2.81Å; V144-F165 HydrophobicContact CB-CD2 4.23Å; V144-F165 HydrophobicContact CB-CE2 4.11Å; V144-F165 HydrophobicContact CG1-CD2 3.73Å; V144-F165 HydrophobicContact CG1-CE2 3.84Å; V144-F165 HydrophobicContact CG1-CG 4.47Å
145	D	93.1	Very high	83.3	Confident	57 Å²	57	81 Å²	81	31%	0.305	42%	0.415	S	S	.	.			trans	-88.4	83.4	176.2	-176.3	20.8	0	0	0	110	F196 C197	D145-F196 HydrophobicContact CB-CB 4.42Å; D145-F196 WeakPolarHBondContact O-CB 3.44Å; D145-F196 PolarHBondContact OD1-N 3.31Å; D145-F196 WeakPolarHBondContact OD2-CB 3.25Å; D145-F196 PolarHBondContact OD2-N 3.09Å; D145-C197 VanDerWaalsContact OD1-CB 3.27Å; D145-C197 WeakPolarHBondContact OD1-CB 3.11Å; D145-C197 PolarHBondContact OD1-N 3.4Å; D145-C197 PolarHBondContact OD1-SG 2.84Å
146	L	92.2	Very high	83.4	Confident	12 Å²	12	79.4 Å²	79.4	6%	0.063	40%	0.404	C	S	.	.			trans	-129	148.2	-177.6	-63.9	175.3	0	0	0	112.9	V144 A148 L150 F165 H168 V169 W176 C197	V144-L146 HydrophobicContact CB-CD1 4.16Å; V144-L146 HydrophobicContact CB-CG 4.14Å; V144-L146 HydrophobicContact CG2-CB 4.45Å; V144-L146 HydrophobicContact CG2-CD1 3.64Å; V144-L146 HydrophobicContact CG2-CG 3.92Å; V144-L146 PolarHBondContact O-N 2.81Å; L146-A148 PolarHBondContact O-N 2.92Å; L146-A148 VanDerWaalsContact O-N 3.17Å; L146-L150 HydrophobicContact CD1-CD1 4.35Å; L146-F165 HydrophobicContact CD1-CD2 3.97Å; L146-F165 HydrophobicContact CD1-CE2 4.32Å; L146-F165 HydrophobicContact CD2-CE2 4.21Å; L146-F165 HydrophobicContact CG-CE2 4.42Å; L146-H168 HydrophobicContact CD1-CB 4.34Å; L146-V169 HydrophobicContact CD2-CG2 3.97Å; L146-W176 HydrophobicContact CD2-CH2 4.23Å; L146-W176 HydrophobicContact CD2-CZ2 4.13Å; L146-C197 WeakPolarHBondContact O-CB 3.12Å
147	P	88.4	Confident	84	Confident	23 Å²	23	77.1 Å²	77.1	15%	0.149	40%	0.399	C	S	.	.	S	Bend	trans	-55.6	-29.4	179.1	-28.8	34.6	0	0	0	115.9	C172 L175 F196 V199 P217	P147-C172 HydrophobicContact CG-CB 4.5Å; P147-L175 HydrophobicContact CB-CD2 3.82Å; P147-L175 HydrophobicContact CG-CD2 3.34Å; P147-F196 WeakPolarHBondContact CD-O 3.38Å; P147-F196 WeakPolarHBondContact CG-O 3.26Å; P147-V199 HydrophobicContact CB-CG1 3.58Å; P147-V199 HydrophobicContact CG-CG1 4.29Å; P147-P217 HydrophobicContact CB-CB 3.9Å; P147-P217 HydrophobicContact CB-CG 3.6Å
148	A	77.3	Confident	84.3	Confident	42 Å²	42	73.3 Å²	73.3	35%	0.347	37%	0.374	S	S	.	.	S	Bend	trans	-131	149.9	177.3	0	0	0	0	0	108.5	L146 L150	L146-A148 PolarHBondContact O-N 2.92Å; L146-A148 VanDerWaalsContact O-N 3.17Å; A148-L150 PolarHBondContact O-N 3.2Å
149	S	71.8	Confident	84.8	Confident	117 Å²	117	73.4 Å²	73.4	82%	0.818	38%	0.375	S	S	*	.			trans	-60	130.2	172.7	-56.2	0	0	0	0	109.5	E151	S149-E151 PolarHBondContact O-N 3.29Å
150	L	69.5	Low	85	Confident	22 Å²	22	69.8 Å²	69.8	12%	0.115	37%	0.366	C	S	.	.			trans	-61.5	121.2	170.5	-163.9	72.9	0	0	0	107.5	L146 A148 I152 V161 A164 F165 H168	L146-L150 HydrophobicContact CD1-CD1 4.35Å; A148-L150 PolarHBondContact O-N 3.2Å; L150-I152 HydrophobicContact CB-CD1 4.11Å; L150-I152 HydrophobicContact CB-CG1 3.9Å; L150-I152 HydrophobicContact CD2-CD1 4.13Å; L150-I152 HydrophobicContact CD2-CG1 3.72Å; L150-I152 HydrophobicContact CG-CD1 4.48Å; L150-I152 HydrophobicContact CG-CG1 3.88Å; L150-I152 WeakPolarHBondContact O-CG1 3.21Å; L150-I152 PolarHBondContact O-N 3.26Å; L150-V161 HydrophobicContact CD2-CG1 3.92Å; L150-A164 HydrophobicContact CD1-CB 4.4Å; L150-A164 HydrophobicContact CD2-CB 4.44Å; L150-F165 HydrophobicContact CD2-CB 4.32Å; L150-H168 HydrophobicContact CD1-CB 3.88Å
151	E	71.7	Confident	85	Confident	194 Å²	194	68.9 Å²	68.9	91%	0.907	36%	0.362	S	S	*	.			trans	-70.9	84.6	173.9	-70.6	-168.4	169.8	0	0	109.1	S149	S149-E151 PolarHBondContact O-N 3.29Å
152	I	72	Confident	85.1	Confident	33 Å²	33	65.3 Å²	65.3	17%	0.169	34%	0.34	C	S	.	.			trans	-86.7	119.3	-176.4	-61.1	156.8	0	0	0	109	C142 L150 W154 V161	C142-I152 WeakPolarHBondContact SG-CD1 3.4Å; L150-I152 HydrophobicContact CB-CD1 4.11Å; L150-I152 HydrophobicContact CB-CG1 3.9Å; L150-I152 HydrophobicContact CD2-CD1 4.13Å; L150-I152 HydrophobicContact CD2-CG1 3.72Å; L150-I152 HydrophobicContact CG-CD1 4.48Å; L150-I152 HydrophobicContact CG-CG1 3.88Å; L150-I152 WeakPolarHBondContact O-CG1 3.21Å; L150-I152 PolarHBondContact O-N 3.26Å; I152-W154 HydrophobicContact CB-CZ2 4.3Å; I152-W154 HydrophobicContact CD1-CH2 4.11Å; I152-W154 HydrophobicContact CD1-CZ2 4.11Å; I152-W154 HydrophobicContact CG2-CD2 3.86Å; I152-W154 HydrophobicContact CG2-CE3 3.93Å; I152-W154 HydrophobicContact CG2-CG 4.4Å; I152-W154 HydrophobicContact CG2-CH2 4.25Å; I152-W154 HydrophobicContact CG2-CZ2 4.18Å; I152-W154 HydrophobicContact CG2-CZ3 4.12Å; I152-W154 PolarHBondContact O-N 3.47Å; I152-V161 HydrophobicContact CD1-CG1 4.3Å; I152-V161 HydrophobicContact CG1-CG1 3.94Å; I152-V161 HydrophobicContact CG2-CG1 4.09Å; I152-V161 HydrophobicContact CG2-CG2 3.89Å
153	N	78.1	Confident	85.2	Confident	86 Å²	86	68.3 Å²	68.3	46%	0.46	35%	0.351	S	S	.	.			trans	-83.1	101.3	164.5	-179.6	-2.1	0	0	0	108.8	K155 Q156	N153-K155 PolarHBondContact O-N 3.47Å; N153-K155 WeakPolarHBondContact OD1-CB 3.43Å; N153-K155 WeakPolarHBondContact OD1-CG 3.5Å; N153-K155 PolarHBondContact OD1-N 2.85Å; N153-K155 VanDerWaalsContact OD1-N 3.16Å; N153-Q156 HydrophobicContact CB-CG 4.11Å; N153-Q156 VanDerWaalsContact O-CB 3.24Å; N153-Q156 WeakPolarHBondContact O-CB 3.45Å; N153-Q156 WeakPolarHBondContact O-CG 3.2Å; N153-Q156 PolarHBondContact O-N 2.93Å
154	W	76.7	Confident	85.2	Confident	147 Å²	147	65 Å²	65	56%	0.557	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-1	-179.4	-60.9	105.2	0	0	0	115.5	F140 I152 Q156	F140-W154 HydrophobicContact CD2-CZ3 4.42Å; F140-W154 HydrophobicContact CE2-CZ3 4.23Å; F140-W154 VanDerWaalsContact O-CZ3 3.26Å; F140-W154 WeakPolarHBondContact O-CZ3 3.13Å; I152-W154 HydrophobicContact CB-CZ2 4.3Å; I152-W154 HydrophobicContact CD1-CH2 4.11Å; I152-W154 HydrophobicContact CD1-CZ2 4.11Å; I152-W154 HydrophobicContact CG2-CD2 3.86Å; I152-W154 HydrophobicContact CG2-CE3 3.93Å; I152-W154 HydrophobicContact CG2-CG 4.4Å; I152-W154 HydrophobicContact CG2-CH2 4.25Å; I152-W154 HydrophobicContact CG2-CZ2 4.18Å; I152-W154 HydrophobicContact CG2-CZ3 4.12Å; I152-W154 PolarHBondContact O-N 3.47Å; W154-Q156 VanDerWaalsContact C-N 3.28Å
155	K	78.1	Confident	85.3	Confident	192 Å²	192	63.7 Å²	63.7	84%	0.835	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-10.6	166.7	-60.2	-178.6	178.2	179.5	0	113	N153	N153-K155 PolarHBondContact O-N 3.47Å; N153-K155 WeakPolarHBondContact OD1-CB 3.43Å; N153-K155 WeakPolarHBondContact OD1-CG 3.5Å; N153-K155 PolarHBondContact OD1-N 2.85Å; N153-K155 VanDerWaalsContact OD1-N 3.16Å
156	Q	83.9	Confident	85.3	Confident	79 Å²	79	62.7 Å²	62.7	37%	0.369	33%	0.326	S	S	.	.	S	Bend	trans	-86.5	150.8	179.6	-64.9	177.9	-46.1	0	0	110.9	F140 N153 W154 A160 V161	F140-Q156 WeakPolarHBondContact CE1-O 3.46Å; N153-Q156 HydrophobicContact CB-CG 4.11Å; N153-Q156 VanDerWaalsContact O-CB 3.24Å; N153-Q156 WeakPolarHBondContact O-CB 3.45Å; N153-Q156 WeakPolarHBondContact O-CG 3.2Å; N153-Q156 PolarHBondContact O-N 2.93Å; W154-Q156 VanDerWaalsContact C-N 3.28Å; Q156-A160 HydrophobicContact CB-CB 4.14Å; Q156-V161 HydrophobicContact CB-CG2 4.23Å
157	K	90.1	Very high	85.3	Confident	135 Å²	135	67.2 Å²	67.2	59%	0.587	35%	0.35	S	S	*	.			trans	-78.3	161.2	172.1	-64.2	-169.3	172	-165.8	0	111.2	P159 A160 V161	K157-P159 VanDerWaalsContact C-N 3.32Å; K157-A160 PolarHBondContact O-N 3.41Å; K157-A160 VanDerWaalsContact O-N 3.07Å; K157-V161 PolarHBondContact O-N 3.24Å
158	A	92.3	Very high	85.5	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-52.5	-39	-177.7	0	0	0	0	0	114.4	D95 I99 L130 Y132 F140 A160 V161 F162	D95-A158 HydrophobicContact CB-CB 4.23Å; D95-A158 WeakPolarHBondContact OD2-CB 3.19Å; I99-A158 HydrophobicContact CD1-CB 4.39Å; L130-A158 HydrophobicContact CD1-CB 4.11Å; Y132-A158 HydrophobicContact CE1-CB 4.48Å; Y132-A158 WeakPolarHBondContact OH-CB 3.35Å; F140-A158 HydrophobicContact CD1-CB 4.29Å; F140-A158 HydrophobicContact CD2-CB 4.46Å; F140-A158 HydrophobicContact CE1-CB 4.14Å; F140-A158 HydrophobicContact CE2-CB 4.29Å; F140-A158 HydrophobicContact CG-CB 4.47Å; F140-A158 HydrophobicContact CZ-CB 4.14Å; A158-A160 VanDerWaalsContact C-N 3.33Å; A158-A160 PolarHBondContact O-N 3.31Å; A158-V161 PolarHBondContact O-N 2.9Å; A158-F162 WeakPolarHBondContact O-CB 3.3Å; A158-F162 PolarHBondContact O-N 2.96Å
159	P	94.1	Very high	86.3	Confident	26 Å²	26	66.5 Å²	66.5	17%	0.169	34%	0.338	C	S	.	.	H	α-helix	trans	-61	-38	178.1	-24.3	34.1	0	0	0	113.9	D95 A98 I99 K157 F162 E163	D95-P159 HydrophobicContact CB-CG 4.15Å; D95-P159 WeakPolarHBondContact OD1-CD 3.49Å; A98-P159 HydrophobicContact CB-CB 4.12Å; A98-P159 HydrophobicContact CB-CG 3.72Å; I99-P159 HydrophobicContact CD1-CG 4.41Å; I99-P159 HydrophobicContact CG1-CB 3.97Å; I99-P159 HydrophobicContact CG1-CG 4.07Å; K157-P159 VanDerWaalsContact C-N 3.32Å; P159-F162 PolarHBondContact O-N 3.39Å; P159-E163 WeakPolarHBondContact O-CG 3.3Å; P159-E163 PolarHBondContact O-N 3.4Å
160	A	93.2	Very high	87.3	Confident	43 Å²	43	65.6 Å²	65.6	36%	0.355	32%	0.324	S	S	.	.	H	α-helix	trans	-71	-36	178.5	0	0	0	0	0	111.9	Q156 K157 A158 F162 E163 A164	Q156-A160 HydrophobicContact CB-CB 4.14Å; K157-A160 PolarHBondContact O-N 3.41Å; K157-A160 VanDerWaalsContact O-N 3.07Å; A158-A160 VanDerWaalsContact C-N 3.33Å; A158-A160 PolarHBondContact O-N 3.31Å; A160-F162 VanDerWaalsContact C-N 3.35Å; A160-E163 PolarHBondContact O-N 2.85Å; A160-A164 PolarHBondContact O-N 3.39Å; A160-A164 VanDerWaalsContact O-N 3.08Å
161	V	93.2	Very high	88.3	Confident	1 Å²	1	68 Å²	68	1%	0.006	35%	0.348	C	S	.	.	H	α-helix	trans	-68.5	-38.5	174.3	-175.7	0	0	0	0	110.7	M128 F140 L150 I152 Q156 K157 A158 A164 F165	M128-V161 HydrophobicContact CE-CB 4.32Å; M128-V161 HydrophobicContact CE-CG1 3.59Å; F140-V161 HydrophobicContact CE2-CB 4.36Å; F140-V161 HydrophobicContact CE2-CG2 4.07Å; F140-V161 HydrophobicContact CZ-CB 4.37Å; F140-V161 HydrophobicContact CZ-CG2 3.71Å; L150-V161 HydrophobicContact CD2-CG1 3.92Å; I152-V161 HydrophobicContact CD1-CG1 4.3Å; I152-V161 HydrophobicContact CG1-CG1 3.94Å; I152-V161 HydrophobicContact CG2-CG1 4.09Å; I152-V161 HydrophobicContact CG2-CG2 3.89Å; Q156-V161 HydrophobicContact CB-CG2 4.23Å; K157-V161 PolarHBondContact O-N 3.24Å; A158-V161 PolarHBondContact O-N 2.9Å; V161-A164 WeakPolarHBondContact O-CB 3.27Å; V161-A164 PolarHBondContact O-N 3.2Å; V161-F165 PolarHBondContact O-N 3.43Å
162	F	94.5	Very high	89.4	Confident	1 Å²	1	59 Å²	59	0%	0.004	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-41.8	174.8	-179.2	-103.5	0	0	0	112.5	I99 R103 L116 I118 M128 A158 P159 A160 A164 F165 V166	I99-F162 HydrophobicContact CB-CD1 4.39Å; I99-F162 HydrophobicContact CD1-CB 4.17Å; I99-F162 HydrophobicContact CD1-CG 4.44Å; I99-F162 HydrophobicContact CG1-CB 4.11Å; I99-F162 HydrophobicContact CG1-CD1 4.14Å; I99-F162 HydrophobicContact CG1-CG 4.2Å; I99-F162 HydrophobicContact CG2-CD1 3.73Å; I99-F162 HydrophobicContact CG2-CD2 4.45Å; I99-F162 HydrophobicContact CG2-CE1 3.71Å; I99-F162 HydrophobicContact CG2-CE2 4.45Å; I99-F162 HydrophobicContact CG2-CG 4.08Å; I99-F162 HydrophobicContact CG2-CZ 4.07Å; R103-F162 HydrophobicContact CB-CZ 4.15Å; R103-F162 HydrophobicContact CG-CZ 4.4Å; L116-F162 HydrophobicContact CB-CD2 4.25Å; L116-F162 HydrophobicContact CB-CE2 3.81Å; L116-F162 HydrophobicContact CD1-CD2 3.4Å; L116-F162 HydrophobicContact CD1-CE2 3.78Å; L116-F162 HydrophobicContact CD1-CG 4.1Å; L116-F162 HydrophobicContact CG-CD2 4.45Å; L116-F162 HydrophobicContact CG-CE2 4.4Å; I118-F162 HydrophobicContact CG2-CE1 4.44Å; I118-F162 HydrophobicContact CG2-CE2 3.9Å; I118-F162 HydrophobicContact CG2-CZ 3.42Å; I118-F162 VanDerWaalsContact CG2-CZ 3.42Å; M128-F162 HydrophobicContact SD-CB 4.38Å; M128-F162 HydrophobicContact SD-CD2 3.86Å; A158-F162 WeakPolarHBondContact O-CB 3.3Å; A158-F162 PolarHBondContact O-N 2.96Å; P159-F162 PolarHBondContact O-N 3.39Å; A160-F162 VanDerWaalsContact C-N 3.35Å; F162-A164 VanDerWaalsContact C-N 3.32Å; F162-A164 PolarHBondContact O-N 2.68Å; F162-F165 HydrophobicContact CD2-CD1 4.1Å; F162-F165 HydrophobicContact CE2-CD1 4.05Å; F162-F165 HydrophobicContact CE2-CE1 4.43Å; F162-F165 VanDerWaalsContact O-CB 3.32Å; F162-F165 WeakPolarHBondContact O-CB 3.43Å; F162-F165 PolarHBondContact O-N 3.39Å; F162-V166 HydrophobicContact CD1-CG2 4.28Å; F162-V166 HydrophobicContact CE1-CG2 3.9Å; F162-V166 HydrophobicContact CZ-CG2 4.06Å; F162-V166 WeakPolarHBondContact O-CG2 3.41Å; F162-V166 PolarHBondContact O-N 3.39Å
163	E	93.4	Very high	90.5	Very high	90 Å²	90	62.1 Å²	62.1	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-62.8	-38.1	172.2	-74.1	-59.8	129	0	0	112.1	P159 A160 F165 V166 N167	P159-E163 WeakPolarHBondContact O-CG 3.3Å; P159-E163 PolarHBondContact O-N 3.4Å; A160-E163 PolarHBondContact O-N 2.85Å; E163-F165 VanDerWaalsContact C-N 3.33Å; E163-F165 PolarHBondContact O-N 3.2Å; E163-V166 PolarHBondContact O-N 2.79Å; E163-N167 PolarHBondContact O-N 3.08Å; E163-N167 PolarHBondContact O-ND2 2.87Å
164	A	92.7	Very high	91.3	Very high	36 Å²	36	60.5 Å²	60.5	30%	0.298	31%	0.306	S	S	.	.	H	α-helix	trans	-62.8	-40.6	172.8	0	0	0	0	0	111.9	L150 A160 V161 F162 N167 H168	L150-A164 HydrophobicContact CD1-CB 4.4Å; L150-A164 HydrophobicContact CD2-CB 4.44Å; A160-A164 PolarHBondContact O-N 3.39Å; A160-A164 VanDerWaalsContact O-N 3.08Å; V161-A164 WeakPolarHBondContact O-CB 3.27Å; V161-A164 PolarHBondContact O-N 3.2Å; F162-A164 VanDerWaalsContact C-N 3.32Å; F162-A164 PolarHBondContact O-N 2.68Å; A164-N167 PolarHBondContact O-N 2.89Å; A164-H168 WeakPolarHBondContact O-CB 3.35Å; A164-H168 PolarHBondContact O-N 2.8Å
165	F	94.2	Very high	92.3	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.009	28%	0.28	C	S	.	.	H	α-helix	trans	-59.3	-48.7	173.5	167.4	-111.3	0	0	0	111.9	I118 H126 M128 V144 L146 L150 V161 F162 E163 N167 H168 V169	I118-F165 HydrophobicContact CD1-CD1 3.98Å; I118-F165 HydrophobicContact CD1-CE1 3.57Å; I118-F165 HydrophobicContact CD1-CZ 4.23Å; I118-F165 HydrophobicContact CG1-CE1 3.8Å; I118-F165 HydrophobicContact CG1-CZ 4.36Å; H126-F165 HydrophobicContact CB-CZ 3.81Å; M128-F165 HydrophobicContact CB-CD1 4.06Å; M128-F165 HydrophobicContact CB-CE1 3.9Å; M128-F165 HydrophobicContact CB-CE2 4.5Å; M128-F165 HydrophobicContact CB-CG 4.4Å; M128-F165 HydrophobicContact CB-CZ 4.13Å; M128-F165 HydrophobicContact SD-CB 4.01Å; M128-F165 HydrophobicContact SD-CD1 4.16Å; M128-F165 HydrophobicContact SD-CG 4.1Å; V144-F165 HydrophobicContact CB-CD2 4.23Å; V144-F165 HydrophobicContact CB-CE2 4.11Å; V144-F165 HydrophobicContact CG1-CD2 3.73Å; V144-F165 HydrophobicContact CG1-CE2 3.84Å; V144-F165 HydrophobicContact CG1-CG 4.47Å; L146-F165 HydrophobicContact CD1-CD2 3.97Å; L146-F165 HydrophobicContact CD1-CE2 4.32Å; L146-F165 HydrophobicContact CD2-CE2 4.21Å; L146-F165 HydrophobicContact CG-CE2 4.42Å; L150-F165 HydrophobicContact CD2-CB 4.32Å; V161-F165 PolarHBondContact O-N 3.43Å; F162-F165 HydrophobicContact CD2-CD1 4.1Å; F162-F165 HydrophobicContact CE2-CD1 4.05Å; F162-F165 HydrophobicContact CE2-CE1 4.43Å; F162-F165 VanDerWaalsContact O-CB 3.32Å; F162-F165 WeakPolarHBondContact O-CB 3.43Å; F162-F165 PolarHBondContact O-N 3.39Å; E163-F165 VanDerWaalsContact C-N 3.33Å; E163-F165 PolarHBondContact O-N 3.2Å; F165-N167 VanDerWaalsContact C-N 3.34Å; F165-N167 PolarHBondContact O-N 3.12Å; F165-H168 PolarHBondContact O-N 2.81Å; F165-V169 HydrophobicContact CD2-CG2 4.09Å; F165-V169 HydrophobicContact CE1-CG2 4.45Å; F165-V169 HydrophobicContact CE2-CG2 3.69Å; F165-V169 HydrophobicContact CZ-CG2 3.9Å; F165-V169 WeakPolarHBondContact O-CG2 3.47Å; F165-V169 PolarHBondContact O-N 2.99Å
166	V	94.1	Very high	93.2	Very high	36 Å²	36	44.9 Å²	44.9	22%	0.218	24%	0.242	C	C	.	.	H	α-helix	trans	-56.9	-47.1	177	173.8	0	0	0	0	111.3	I118 F162 E163 H168 V169 D170	I118-V166 HydrophobicContact CD1-CB 4.36Å; I118-V166 HydrophobicContact CD1-CG2 3.91Å; I118-V166 HydrophobicContact CG2-CG2 4.19Å; F162-V166 HydrophobicContact CD1-CG2 4.28Å; F162-V166 HydrophobicContact CE1-CG2 3.9Å; F162-V166 HydrophobicContact CZ-CG2 4.06Å; F162-V166 WeakPolarHBondContact O-CG2 3.41Å; F162-V166 PolarHBondContact O-N 3.39Å; E163-V166 PolarHBondContact O-N 2.79Å; V166-H168 VanDerWaalsContact C-N 3.33Å; V166-H168 PolarHBondContact O-N 2.85Å; V166-V169 PolarHBondContact O-N 2.77Å; V166-D170 PolarHBondContact O-N 2.87Å; V166-D170 VanDerWaalsContact O-N 3.12Å
167	N	92.3	Very high	93.8	Very high	106 Å²	106	43.3 Å²	43.3	57%	0.567	24%	0.237	S	C	*	.	H	α-helix	trans	-63.8	-38.3	178.6	-71.8	-50.6	0	0	0	112.4	E163 A164 F165 D170 A171	E163-N167 PolarHBondContact O-N 3.08Å; E163-N167 PolarHBondContact O-ND2 2.87Å; A164-N167 PolarHBondContact O-N 2.89Å; F165-N167 VanDerWaalsContact C-N 3.34Å; F165-N167 PolarHBondContact O-N 3.12Å; N167-D170 PolarHBondContact O-N 3.12Å; N167-A171 PolarHBondContact O-N 3.45Å
168	H	92.6	Very high	94.1	Very high	46 Å²	46	37.4 Å²	37.4	21%	0.213	21%	0.211	C	C	.	.	H	α-helix	trans	-69.1	-38	178.5	-161.1	91.7	0	0	0	112.2	L146 L150 A164 F165 V166 D170 A171 C172	L146-H168 HydrophobicContact CD1-CB 4.34Å; L150-H168 HydrophobicContact CD1-CB 3.88Å; A164-H168 WeakPolarHBondContact O-CB 3.35Å; A164-H168 PolarHBondContact O-N 2.8Å; F165-H168 PolarHBondContact O-N 2.81Å; V166-H168 VanDerWaalsContact C-N 3.33Å; V166-H168 PolarHBondContact O-N 2.85Å; H168-D170 VanDerWaalsContact C-N 3.34Å; H168-A171 PolarHBondContact O-N 3.38Å; H168-C172 VanDerWaalsContact CD2-SG 3.53Å; H168-C172 PolarHBondContact O-N 3.21Å; H168-C172 PolarHBondContact O-SG 2.99Å
169	V	94.1	Very high	94.4	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.024	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-43.8	173.7	166.9	0	0	0	0	110.8	I118 D120 H126 L146 F165 V166 A171 C172 R173 W176	I118-V169 HydrophobicContact CD1-CB 4.06Å; I118-V169 HydrophobicContact CD1-CG1 4.06Å; I118-V169 HydrophobicContact CD1-CG2 4.01Å; D120-V169 HydrophobicContact CB-CG1 4.18Å; H126-V169 HydrophobicContact CB-CG2 4.19Å; H126-V169 WeakPolarHBondContact CD2-CG1 3.48Å; L146-V169 HydrophobicContact CD2-CG2 3.97Å; F165-V169 HydrophobicContact CD2-CG2 4.09Å; F165-V169 HydrophobicContact CE1-CG2 4.45Å; F165-V169 HydrophobicContact CE2-CG2 3.69Å; F165-V169 HydrophobicContact CZ-CG2 3.9Å; F165-V169 WeakPolarHBondContact O-CG2 3.47Å; F165-V169 PolarHBondContact O-N 2.99Å; V166-V169 PolarHBondContact O-N 2.77Å; V169-A171 VanDerWaalsContact C-N 3.35Å; V169-A171 PolarHBondContact O-N 2.88Å; V169-C172 PolarHBondContact O-N 2.97Å; V169-R173 PolarHBondContact O-N 3.16Å; V169-W176 HydrophobicContact CB-CH2 4.22Å; V169-W176 HydrophobicContact CB-CZ3 4.42Å; V169-W176 HydrophobicContact CG1-CH2 4.06Å; V169-W176 HydrophobicContact CG1-CZ3 3.88Å; V169-W176 HydrophobicContact CG2-CH2 4.14Å; V169-W176 WeakPolarHBondContact O-CZ3 3.36Å
170	D	92.2	Very high	94.5	Very high	99 Å²	99	42.5 Å²	42.5	53%	0.529	23%	0.231	S	C	.	.	H	α-helix	trans	-64.7	-38.6	176.2	-166	57.6	0	0	0	112.3	V166 N167 H168 C172 R173	V166-D170 PolarHBondContact O-N 2.87Å; V166-D170 VanDerWaalsContact O-N 3.12Å; N167-D170 PolarHBondContact O-N 3.12Å; H168-D170 VanDerWaalsContact C-N 3.34Å; D170-C172 VanDerWaalsContact C-N 3.34Å; D170-C172 PolarHBondContact O-N 3.45Å; D170-R173 VanDerWaalsContact O-CB 3.24Å; D170-R173 WeakPolarHBondContact O-CB 3.45Å; D170-R173 PolarHBondContact O-N 3.12Å
171	A	91.9	Very high	94.7	Very high	73 Å²	73	41.9 Å²	41.9	60%	0.603	23%	0.225	S	C	*	.	H	α-helix	trans	-65	-33.8	176.2	0	0	0	0	0	113.4	N167 H168 V169 R173	N167-A171 PolarHBondContact O-N 3.45Å; H168-A171 PolarHBondContact O-N 3.38Å; V169-A171 VanDerWaalsContact C-N 3.35Å; V169-A171 PolarHBondContact O-N 2.88Å; A171-R173 VanDerWaalsContact C-N 3.28Å; A171-R173 PolarHBondContact O-N 3.15Å
172	C	94.3	Very high	94.9	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.02	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-2.1	-179.6	-67.6	0	0	0	0	114	P147 H168 V169 D170 D174 L175 W176	P147-C172 HydrophobicContact CG-CB 4.5Å; H168-C172 VanDerWaalsContact CD2-SG 3.53Å; H168-C172 PolarHBondContact O-N 3.21Å; H168-C172 PolarHBondContact O-SG 2.99Å; V169-C172 PolarHBondContact O-N 2.97Å; D170-C172 VanDerWaalsContact C-N 3.34Å; D170-C172 PolarHBondContact O-N 3.45Å; C172-D174 PolarHBondContact O-N 3.31Å; C172-L175 WeakPolarHBondContact O-CB 3.27Å; C172-L175 PolarHBondContact O-N 3.3Å; C172-L175 VanDerWaalsContact O-N 3.14Å; C172-W176 HydrophobicContact CB-CD2 4Å; C172-W176 HydrophobicContact CB-CE3 3.96Å; C172-W176 HydrophobicContact CB-CH2 3.53Å; C172-W176 HydrophobicContact CB-CZ2 3.55Å; C172-W176 HydrophobicContact CB-CZ3 3.72Å; C172-W176 PolarHBondContact O-N 3.04Å; C172-W176 VanDerWaalsContact O-N 3.09Å
173	R	94.9	Very high	94.9	Very high	100 Å²	100	44.1 Å²	44.1	38%	0.377	24%	0.237	S	C	.	.	H	α-helix	trans	-57.1	-45.2	-172.5	-160.3	-173.3	65.3	-179.4	-7.4	113.4	S121 D122 V169 D170 A171 W176 N177	S121-R173 WeakPolarHBondContact OG-CD 3.39Å; S121-R173 PolarHBondContact OG-NH1 2.89Å; D122-R173 VanDerWaalsContact OD2-CD 3.24Å; D122-R173 WeakPolarHBondContact OD2-CD 3.21Å; D122-R173 WeakPolarHBondContact OD2-CG 3.43Å; D122-R173 IonicContact OD2-NE 3.91Å; V169-R173 PolarHBondContact O-N 3.16Å; D170-R173 VanDerWaalsContact O-CB 3.24Å; D170-R173 WeakPolarHBondContact O-CB 3.45Å; D170-R173 PolarHBondContact O-N 3.12Å; A171-R173 VanDerWaalsContact C-N 3.28Å; A171-R173 PolarHBondContact O-N 3.15Å; R173-W176 PolarHBondContact O-N 3.21Å; R173-N177 VanDerWaalsContact O-CG 3.23Å; R173-N177 PolarHBondContact O-N 3.4Å; R173-N177 VanDerWaalsContact O-N 3.09Å; R173-N177 PolarHBondContact O-ND2 2.67Å
174	D	95.3	Very high	95	Very high	51 Å²	51	43 Å²	43	27%	0.273	24%	0.237	S	C	.	.	H	α-helix	trans	-67.5	-39	179.4	-169.2	39.3	0	0	0	111.7	C172 W176 N177 Q178 P220 R221	C172-D174 PolarHBondContact O-N 3.31Å; D174-W176 PolarHBondContact O-N 3.32Å; D174-N177 PolarHBondContact O-N 3.46Å; D174-Q178 WeakPolarHBondContact O-CG 3.46Å; D174-Q178 PolarHBondContact O-N 2.92Å; D174-Q178 PolarHBondContact OD1-NE2 2.96Å; D174-P220 HydrophobicContact CB-CG 4Å; D174-R221 IonicContact OD1-CZ 3.98Å; D174-R221 IonicContact OD1-NE 2.83Å; D174-R221 PolarHBondContact OD1-NE 3.16Å; D174-R221 VanDerWaalsContact OD1-NE 3.16Å; D174-R221 IonicContact OD1-NH2 3.03Å; D174-R221 PolarHBondContact OD1-NH2 2.98Å; D174-R221 WeakPolarHBondContact OD2-CD 3.29Å; D174-R221 IonicContact OD2-CZ 3.59Å; D174-R221 IonicContact OD2-NE 3.89Å; D174-R221 PolarHBondContact OD2-NE 2.62Å; D174-R221 IonicContact OD2-NH2 3.21Å
175	L	96.5	Very high	95.1	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-55.3	-53.6	174.5	169.4	73.3	0	0	0	111	P147 C172 N177 Q178 L179 V199 L215 P217 P220	P147-L175 HydrophobicContact CB-CD2 3.82Å; P147-L175 HydrophobicContact CG-CD2 3.34Å; C172-L175 WeakPolarHBondContact O-CB 3.27Å; C172-L175 PolarHBondContact O-N 3.3Å; C172-L175 VanDerWaalsContact O-N 3.14Å; L175-N177 PolarHBondContact O-N 2.89Å; L175-Q178 PolarHBondContact O-N 3.09Å; L175-Q178 VanDerWaalsContact O-N 3.09Å; L175-L179 HydrophobicContact CD1-CD1 3.98Å; L175-L179 HydrophobicContact CD1-CG 4.23Å; L175-L179 HydrophobicContact CD2-CD1 4.45Å; L175-L179 HydrophobicContact CG-CD1 3.92Å; L175-L179 HydrophobicContact CG-CG 4.48Å; L175-L179 WeakPolarHBondContact O-CG 3.37Å; L175-L179 PolarHBondContact O-N 3.32Å; L175-V199 HydrophobicContact CD2-CG1 4.06Å; L175-L215 HydrophobicContact CD1-CB 3.61Å; L175-L215 HydrophobicContact CD1-CD1 3.97Å; L175-L215 HydrophobicContact CD1-CG 4.38Å; L175-P217 HydrophobicContact CD2-CB 4.09Å; L175-P217 HydrophobicContact CD2-CG 4.37Å; L175-P220 HydrophobicContact CB-CB 3.86Å; L175-P220 HydrophobicContact CB-CG 4.27Å; L175-P220 HydrophobicContact CD1-CB 4.01Å
176	W	97.1	Very high	95.1	Very high	10 Å²	10	47.1 Å²	47.1	4%	0.038	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-28.3	-179	-62.8	-42.9	0	0	0	112.7	R124 H126 L146 V169 C172 R173 D174 K180 F196	R124-W176 VanDerWaalsContact NH1-CB 3.28Å; H126-W176 AromaticContact CE1-CE3 3.78Å; H126-W176 AromaticContact CE1-CH2 3.33Å; H126-W176 WeakPolarHBondContact CE1-CH2 3.43Å; H126-W176 AromaticContact CE1-CZ3 3.22Å; H126-W176 WeakPolarHBondContact CE1-CZ3 3.4Å; H126-W176 AromaticContact ND1-CH2 3.74Å; H126-W176 AromaticContact NE2-CZ3 3.66Å; L146-W176 HydrophobicContact CD2-CH2 4.23Å; L146-W176 HydrophobicContact CD2-CZ2 4.13Å; V169-W176 HydrophobicContact CB-CH2 4.22Å; V169-W176 HydrophobicContact CB-CZ3 4.42Å; V169-W176 HydrophobicContact CG1-CH2 4.06Å; V169-W176 HydrophobicContact CG1-CZ3 3.88Å; V169-W176 HydrophobicContact CG2-CH2 4.14Å; V169-W176 WeakPolarHBondContact O-CZ3 3.36Å; C172-W176 HydrophobicContact CB-CD2 4Å; C172-W176 HydrophobicContact CB-CE3 3.96Å; C172-W176 HydrophobicContact CB-CH2 3.53Å; C172-W176 HydrophobicContact CB-CZ2 3.55Å; C172-W176 HydrophobicContact CB-CZ3 3.72Å; C172-W176 PolarHBondContact O-N 3.04Å; C172-W176 VanDerWaalsContact O-N 3.09Å; R173-W176 PolarHBondContact O-N 3.21Å; D174-W176 PolarHBondContact O-N 3.32Å; W176-K180 WeakPolarHBondContact O-CB 3.33Å; W176-K180 PolarHBondContact O-N 3.44Å; W176-F196 AromaticContact CD1-CD1 3.86Å; W176-F196 AromaticContact CD2-CD1 3.99Å; W176-F196 HydrophobicContact CD2-CD1 3.99Å; W176-F196 AromaticContact CE2-CD1 3.7Å; W176-F196 HydrophobicContact CG-CD1 4.08Å; W176-F196 HydrophobicContact CZ2-CB 3.98Å; W176-F196 HydrophobicContact CZ2-CD1 4.19Å; W176-F196 HydrophobicContact CZ2-CG 4.27Å; W176-F196 AromaticContact NE1-CD1 3.63Å; W176-F196 PolarHBondContact NE1-O 3.19Å
177	N	96.6	Very high	95.1	Very high	47 Å²	47	45.4 Å²	45.4	25%	0.251	24%	0.239	S	C	.	.	H	α-helix	trans	-67.7	-39.5	171.9	-71.5	-18.2	0	0	0	111.8	D122 R124 R173 D174 L175 A181	D122-N177 PolarHBondContact OD2-ND2 2.65Å; D122-N177 PolarHBondContact OD2-OD1 3.12Å; R124-N177 PolarHBondContact NH1-OD1 2.91Å; R173-N177 VanDerWaalsContact O-CG 3.23Å; R173-N177 PolarHBondContact O-N 3.4Å; R173-N177 VanDerWaalsContact O-N 3.09Å; R173-N177 PolarHBondContact O-ND2 2.67Å; D174-N177 PolarHBondContact O-N 3.46Å; L175-N177 PolarHBondContact O-N 2.89Å; N177-A181 PolarHBondContact O-N 3.42Å; N177-A181 VanDerWaalsContact O-N 3.16Å
178	Q	97.7	Very high	95.2	Very high	11 Å²	11	41.2 Å²	41.2	5%	0.051	22%	0.216	C	C	.	.	H	α-helix	trans	-66.8	-45.7	174.5	-60.7	-41.1	-62.6	0	0	112	D174 L175 A181 I182 L215 P220 R221 V255	D174-Q178 WeakPolarHBondContact O-CG 3.46Å; D174-Q178 PolarHBondContact O-N 2.92Å; D174-Q178 PolarHBondContact OD1-NE2 2.96Å; L175-Q178 PolarHBondContact O-N 3.09Å; L175-Q178 VanDerWaalsContact O-N 3.09Å; Q178-A181 PolarHBondContact O-N 2.8Å; Q178-I182 PolarHBondContact O-N 3.12Å; Q178-L215 HydrophobicContact CB-CD1 3.95Å; Q178-P220 HydrophobicContact CG-CB 4.32Å; Q178-R221 HydrophobicContact CG-CG 4.22Å; Q178-R221 VanDerWaalsContact NE2-CZ 3.26Å; Q178-V255 HydrophobicContact CB-CB 4.22Å; Q178-V255 HydrophobicContact CB-CG2 3.86Å; Q178-V255 HydrophobicContact CG-CB 4.44Å; Q178-V255 HydrophobicContact CG-CG2 3.71Å
179	L	97.5	Very high	95.2	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-44.7	177.8	-69.2	172.2	0	0	0	111.5	L175 A181 I182 D183 D198 R201 L215	L175-L179 HydrophobicContact CD1-CD1 3.98Å; L175-L179 HydrophobicContact CD1-CG 4.23Å; L175-L179 HydrophobicContact CD2-CD1 4.45Å; L175-L179 HydrophobicContact CG-CD1 3.92Å; L175-L179 HydrophobicContact CG-CG 4.48Å; L175-L179 WeakPolarHBondContact O-CG 3.37Å; L175-L179 PolarHBondContact O-N 3.32Å; L179-A181 VanDerWaalsContact C-N 3.28Å; L179-A181 PolarHBondContact O-N 3.25Å; L179-I182 WeakPolarHBondContact O-CB 3.36Å; L179-I182 PolarHBondContact O-N 2.92Å; L179-I182 VanDerWaalsContact O-N 3.08Å; L179-D183 VanDerWaalsContact O-CG 3.25Å; L179-D183 PolarHBondContact O-N 3.4Å; L179-D198 WeakPolarHBondContact CD1-O 3.47Å; L179-R201 HydrophobicContact CD2-CG 4.14Å; L179-L215 HydrophobicContact CD2-CD1 3.66Å; L179-L215 HydrophobicContact CD2-CG 4.03Å; L179-L215 HydrophobicContact CG-CD1 3.98Å
180	K	96.2	Very high	95	Very high	128 Å²	128	43.1 Å²	43.1	56%	0.557	23%	0.228	S	C	*	.	H	α-helix	trans	-59	-38.9	176.6	-178.2	175.3	-179.2	179.9	0	112.3	W176 D183 T184	W176-K180 WeakPolarHBondContact O-CB 3.33Å; W176-K180 PolarHBondContact O-N 3.44Å; K180-D183 PolarHBondContact O-N 3.03Å; K180-T184 WeakPolarHBondContact O-CB 3.38Å; K180-T184 PolarHBondContact O-N 3.01Å; K180-T184 PolarHBondContact O-OG1 3.17Å
181	A	96.9	Very high	95	Very high	30 Å²	30	39.4 Å²	39.4	25%	0.248	21%	0.209	C	C	.	.	H	α-helix	trans	-62.6	-43.6	175.8	0	0	0	0	0	111.3	N177 Q178 L179 T184 F185	N177-A181 PolarHBondContact O-N 3.42Å; N177-A181 VanDerWaalsContact O-N 3.16Å; Q178-A181 PolarHBondContact O-N 2.8Å; L179-A181 VanDerWaalsContact C-N 3.28Å; L179-A181 PolarHBondContact O-N 3.25Å; A181-T184 PolarHBondContact O-N 3.03Å; A181-F185 VanDerWaalsContact O-CD2 3.26Å; A181-F185 WeakPolarHBondContact O-CD2 3.46Å; A181-F185 PolarHBondContact O-N 2.98Å
182	I	97.5	Very high	94.8	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-50.3	174.1	-64.6	169.3	0	0	0	110.4	Q178 L179 T184 F185 A186 V188 R201 L203 V255 L256 L259	Q178-I182 PolarHBondContact O-N 3.12Å; L179-I182 WeakPolarHBondContact O-CB 3.36Å; L179-I182 PolarHBondContact O-N 2.92Å; L179-I182 VanDerWaalsContact O-N 3.08Å; I182-T184 PolarHBondContact O-N 3.28Å; I182-F185 PolarHBondContact O-N 3.15Å; I182-A186 HydrophobicContact CG2-CB 4.18Å; I182-A186 WeakPolarHBondContact O-CB 3.35Å; I182-A186 PolarHBondContact O-N 3.21Å; I182-V188 HydrophobicContact CG2-CG2 4.05Å; I182-R201 HydrophobicContact CG2-CB 4.33Å; I182-R201 HydrophobicContact CG2-CG 4.16Å; I182-L203 HydrophobicContact CG2-CD1 4.39Å; I182-L203 HydrophobicContact CG2-CD2 3.62Å; I182-V255 HydrophobicContact CD1-CG1 4Å; I182-L256 HydrophobicContact CG1-CB 4.16Å; I182-L259 HydrophobicContact CD1-CD1 4.31Å
183	D	95.5	Very high	94.6	Very high	48 Å²	48	49.8 Å²	49.8	26%	0.257	24%	0.243	S	C	.	.	H	α-helix	trans	-61.5	-27.6	-178.5	-66.5	-28.4	0	0	0	113.2	L179 K180 R201	L179-D183 VanDerWaalsContact O-CG 3.25Å; L179-D183 PolarHBondContact O-N 3.4Å; K180-D183 PolarHBondContact O-N 3.03Å; D183-R201 WeakPolarHBondContact OD1-CD 3.42Å; D183-R201 IonicContact OD1-CZ 2.83Å; D183-R201 IonicContact OD1-NE 3.96Å; D183-R201 PolarHBondContact OD1-NE 2.84Å; D183-R201 IonicContact OD1-NH2 2.76Å; D183-R201 IonicContact OD2-CZ 3.97Å; D183-R201 IonicContact OD2-NE 3.93Å; D183-R201 PolarHBondContact OD2-NE 3.01Å; D183-R201 IonicContact OD2-NH2 2.99Å; D183-R201 PolarHBondContact OD2-NH2 3.16Å
184	T	94.8	Very high	94.5	Very high	67 Å²	67	47.7 Å²	47.7	41%	0.411	24%	0.243	S	C	.	.	H	α-helix	trans	-83.2	-35.7	-178.3	-56.3	0	0	0	0	112.6	K180 A181 I182	K180-T184 WeakPolarHBondContact O-CB 3.38Å; K180-T184 PolarHBondContact O-N 3.01Å; K180-T184 PolarHBondContact O-OG1 3.17Å; A181-T184 PolarHBondContact O-N 3.03Å; I182-T184 PolarHBondContact O-N 3.28Å
185	F	95	Very high	94.5	Very high	122 Å²	122	51.5 Å²	51.5	54%	0.535	26%	0.257	S	S	.	.	H	α-helix	trans	-121	-16.3	-165.2	-62	-64.4	0	0	0	114.5	A181 I182 L256 E269 L270	A181-F185 VanDerWaalsContact O-CD2 3.26Å; A181-F185 WeakPolarHBondContact O-CD2 3.46Å; A181-F185 PolarHBondContact O-N 2.98Å; I182-F185 PolarHBondContact O-N 3.15Å; F185-L256 HydrophobicContact CB-CD2 3.55Å; F185-L256 HydrophobicContact CD2-CD2 4.01Å; F185-L256 HydrophobicContact CG-CD2 4.22Å; F185-E269 WeakPolarHBondContact O-CA 3.18Å; F185-L270 PolarHBondContact O-N 3.39Å
186	A	94.9	Very high	94.4	Very high	2 Å²	2	54.1 Å²	54.1	2%	0.017	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-104.9	156.4	178	0	0	0	0	0	111.4	I182 V188 L203 L256	I182-A186 HydrophobicContact CG2-CB 4.18Å; I182-A186 WeakPolarHBondContact O-CB 3.35Å; I182-A186 PolarHBondContact O-N 3.21Å; A186-V188 PolarHBondContact O-N 2.72Å; A186-L203 HydrophobicContact CB-CD2 4.26Å; A186-L256 HydrophobicContact CB-CD1 4.06Å
187	C	94	Very high	94.3	Very high	1 Å²	1	56 Å²	56	1%	0.007	28%	0.282	C	S	.	.			trans	-79.4	86.3	176.6	-51.1	0	0	0	0	110.6	F204 E269 L270 C273 L278	C187-F204 HydrophobicContact CB-CB 3.92Å; C187-F204 PolarHBondContact O-N 3.29Å; C187-E269 VanDerWaalsContact SG-C 3.6Å; C187-E269 PolarHBondContact SG-O 2.86Å; C187-L270 VanDerWaalsContact SG-CA 3.53Å; C187-C273 HydrophobicContact CB-CB 4.25Å; C187-C273 WeakPolarHBondContact CB-SG 3.32Å; C187-C273 WeakPolarHBondContact SG-CB 3.44Å; C187-C273 CovalentContact SG-SG 2.03Å; C187-C273 PolarHBondContact SG-SG 3.12Å; C187-L278 HydrophobicContact CB-CD1 3.86Å; C187-L278 HydrophobicContact CB-CD2 4.42Å
188	V	94.9	Very high	94.3	Very high	17 Å²	17	56 Å²	56	10%	0.103	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121.9	-179.5	-179.7	0	0	0	0	111.1	I182 A186 L203 W282	I182-V188 HydrophobicContact CG2-CG2 4.05Å; A186-V188 PolarHBondContact O-N 2.72Å; V188-L203 HydrophobicContact CG2-CD2 3.78Å; V188-W282 PolarHBondContact O-NE1 2.92Å
189	I	92.6	Very high	94.2	Very high	17 Å²	17	56.8 Å²	56.8	9%	0.087	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-48.3	175.6	-58	169.9	0	0	0	110.9	Q202 F204 A281 W282	I189-Q202 HydrophobicContact CB-CB 4.36Å; I189-Q202 HydrophobicContact CB-CG 4.26Å; I189-Q202 HydrophobicContact CD1-CG 4.3Å; I189-Q202 PolarHBondContact N-O 3.46Å; I189-F204 HydrophobicContact CD1-CB 3.79Å; I189-F204 HydrophobicContact CD1-CD2 4.19Å; I189-F204 HydrophobicContact CG1-CB 3.9Å; I189-A281 HydrophobicContact CD1-CB 3.96Å; I189-A281 HydrophobicContact CG1-CB 4.08Å; I189-W282 PolarHBondContact O-NE1 2.79Å
190	D	89.8	Confident	94.1	Very high	74 Å²	74	60.3 Å²	60.3	40%	0.396	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	135.8	-173.7	-175.6	64.6	0	0	0	110.9	R201 Q202	D190-R201 CarbonylContact O-C 3.52Å; D190-R201 WeakPolarHBondContact O-CA 3.26Å; D190-Q202 HydrophobicContact CB-CB 3.94Å; D190-Q202 PolarHBondContact O-N 3.23Å
191	P	92.1	Very high	94.1	Very high	21 Å²	21	54.5 Å²	54.5	14%	0.136	28%	0.277	C	S	.	.			cis	-72.3	146.7	-6.7	31.5	-35	0	0	0	112.6	Q193 P194 D198 K200	P191-Q193 VanDerWaalsContact C-N 3.26Å; P191-Q193 PolarHBondContact O-N 2.87Å; P191-P194 HydrophobicContact CG-CB 3.89Å; P191-P194 HydrophobicContact CG-CG 4.06Å; P191-D198 HydrophobicContact CG-CB 4.04Å; P191-K200 WeakPolarHBondContact CD-O 3.49Å
192	K	87	Confident	94	Very high	124 Å²	124	54.4 Å²	54.4	54%	0.539	27%	0.272	S	S	.	.	S	Bend	trans	-64.3	-31	174.1	-65.8	-174.8	-178.2	-176	0	112.9	W282	K192-W282 VanDerWaalsContact CE-O 3.24Å; K192-W282 WeakPolarHBondContact CE-O 3.45Å; K192-W282 PolarHBondContact NZ-O 3.27Å
193	Q	89.7	Confident	94	Very high	169 Å²	169	54.3 Å²	54.3	79%	0.79	27%	0.271	S	S	*	.	S	Bend	trans	-131.2	88.7	177.2	-68.7	-177.1	4	0	0	108.2	P191 K195	P191-Q193 VanDerWaalsContact C-N 3.26Å; P191-Q193 PolarHBondContact O-N 2.87Å; Q193-K195 PolarHBondContact O-N 3.03Å
194	P	94.1	Very high	93.9	Very high	57 Å²	57	52.5 Å²	52.5	37%	0.37	26%	0.261	S	S	.	.			trans	-64.9	133.1	-176	-16.8	27.4	0	0	0	112.8	P191	P191-P194 HydrophobicContact CG-CB 3.89Å; P191-P194 HydrophobicContact CG-CG 4.06Å
195	K	94.5	Very high	93.8	Very high	131 Å²	131	49.7 Å²	49.7	57%	0.57	24%	0.244	S	C	*	.			trans	-96.5	170.3	169.8	-63.9	-175.8	-178.8	178.9	0	111.3	Q193 C197 D198	Q193-K195 PolarHBondContact O-N 3.03Å; K195-C197 VanDerWaalsContact C-N 3.29Å; K195-C197 PolarHBondContact O-N 2.72Å; K195-D198 WeakPolarHBondContact CB-OD2 3.36Å; K195-D198 PolarHBondContact N-OD2 2.76Å; K195-D198 PolarHBondContact O-N 3.49Å
196	F	95	Very high	93.6	Very high	56 Å²	56	44.9 Å²	44.9	25%	0.246	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-26.6	178.5	-69.7	-59	0	0	0	113.1	R124 H126 D145 P147 W176 D198	R124-F196 HydrophobicContact CB-CZ 4.25Å; H126-F196 AromaticContact CE1-CE1 3.88Å; H126-F196 AromaticContact CE1-CZ 3.83Å; H126-F196 AromaticContact ND1-CD2 3.88Å; H126-F196 AromaticContact ND1-CE2 3.78Å; D145-F196 HydrophobicContact CB-CB 4.42Å; D145-F196 WeakPolarHBondContact O-CB 3.44Å; D145-F196 PolarHBondContact OD1-N 3.31Å; D145-F196 WeakPolarHBondContact OD2-CB 3.25Å; D145-F196 PolarHBondContact OD2-N 3.09Å; P147-F196 WeakPolarHBondContact CD-O 3.38Å; P147-F196 WeakPolarHBondContact CG-O 3.26Å; W176-F196 AromaticContact CD1-CD1 3.86Å; W176-F196 AromaticContact CD2-CD1 3.99Å; W176-F196 HydrophobicContact CD2-CD1 3.99Å; W176-F196 AromaticContact CE2-CD1 3.7Å; W176-F196 HydrophobicContact CG-CD1 4.08Å; W176-F196 HydrophobicContact CZ2-CB 3.98Å; W176-F196 HydrophobicContact CZ2-CD1 4.19Å; W176-F196 HydrophobicContact CZ2-CG 4.27Å; W176-F196 AromaticContact NE1-CD1 3.63Å; W176-F196 PolarHBondContact NE1-O 3.19Å; F196-D198 VanDerWaalsContact C-N 3.32Å
197	C	94.7	Very high	93.2	Very high	48 Å²	48	52 Å²	52	32%	0.324	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.6	172.2	63.7	0	0	0	0	114.4	D145 L146 K195 V199	D145-C197 VanDerWaalsContact OD1-CB 3.27Å; D145-C197 WeakPolarHBondContact OD1-CB 3.11Å; D145-C197 PolarHBondContact OD1-N 3.4Å; D145-C197 PolarHBondContact OD1-SG 2.84Å; L146-C197 WeakPolarHBondContact O-CB 3.12Å; K195-C197 VanDerWaalsContact C-N 3.29Å; K195-C197 PolarHBondContact O-N 2.72Å; C197-V199 PolarHBondContact O-N 3.09Å; C197-V199 VanDerWaalsContact O-N 3.12Å
198	D	95.3	Very high	92.8	Very high	49 Å²	49	54.2 Å²	54.2	26%	0.262	27%	0.271	S	S	.	.			trans	-78.6	100.3	-176.8	-64.9	-37.4	0	0	0	111.2	L179 P191 K195 F196 R201	L179-D198 WeakPolarHBondContact CD1-O 3.47Å; P191-D198 HydrophobicContact CG-CB 4.04Å; K195-D198 WeakPolarHBondContact CB-OD2 3.36Å; K195-D198 PolarHBondContact N-OD2 2.76Å; K195-D198 PolarHBondContact O-N 3.49Å; F196-D198 VanDerWaalsContact C-N 3.32Å; D198-R201 PolarHBondContact O-NH1 3.19Å
199	V	95.9	Very high	92.6	Very high	27 Å²	27	53.6 Å²	53.6	16%	0.164	27%	0.268	C	S	.	.			trans	-91.9	-6	178.5	-60.4	0	0	0	0	114.4	P147 L175 C197 T214 L215 P217	P147-V199 HydrophobicContact CB-CG1 3.58Å; P147-V199 HydrophobicContact CG-CG1 4.29Å; L175-V199 HydrophobicContact CD2-CG1 4.06Å; C197-V199 PolarHBondContact O-N 3.09Å; C197-V199 VanDerWaalsContact O-N 3.12Å; V199-T214 HydrophobicContact CG2-CG2 3.98Å; V199-L215 PolarHBondContact O-N 3.48Å; V199-P217 HydrophobicContact CG1-CG 3.97Å
200	K	96.1	Very high	92.7	Very high	78 Å²	78	53.2 Å²	53.2	34%	0.339	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	142.7	-177.8	178.5	177.1	154.7	-178.7	0	110.2	P191 I212 V213 T214	P191-K200 WeakPolarHBondContact CD-O 3.49Å; K200-I212 HydrophobicContact CD-CG2 3.73Å; K200-I212 HydrophobicContact CG-CG2 3.74Å; K200-V213 CarbonylContact C-O 3.56Å; K200-V213 WeakPolarHBondContact CA-O 3.34Å; K200-T214 HydrophobicContact CB-CG2 4.45Å
201	R	96.6	Very high	92.9	Very high	6 Å²	6	49.7 Å²	49.7	2%	0.023	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.2	169.1	-64.9	-62	-177.9	-82.6	-5.2	110.1	L179 I182 D183 D190 D198 L203 I212 V213	L179-R201 HydrophobicContact CD2-CG 4.14Å; I182-R201 HydrophobicContact CG2-CB 4.33Å; I182-R201 HydrophobicContact CG2-CG 4.16Å; D183-R201 WeakPolarHBondContact OD1-CD 3.42Å; D183-R201 IonicContact OD1-CZ 2.83Å; D183-R201 IonicContact OD1-NE 3.96Å; D183-R201 PolarHBondContact OD1-NE 2.84Å; D183-R201 IonicContact OD1-NH2 2.76Å; D183-R201 IonicContact OD2-CZ 3.97Å; D183-R201 IonicContact OD2-NE 3.93Å; D183-R201 PolarHBondContact OD2-NE 3.01Å; D183-R201 IonicContact OD2-NH2 2.99Å; D183-R201 PolarHBondContact OD2-NH2 3.16Å; D190-R201 CarbonylContact O-C 3.52Å; D190-R201 WeakPolarHBondContact O-CA 3.26Å; D198-R201 PolarHBondContact O-NH1 3.19Å; R201-L203 HydrophobicContact CB-CD2 3.93Å; R201-I212 CarbonylContact O-C 3.58Å; R201-I212 WeakPolarHBondContact O-CA 3.15Å; R201-V213 PolarHBondContact N-O 3.31Å; R201-V213 PolarHBondContact O-N 2.77Å
202	Q	95.2	Very high	93.1	Very high	27 Å²	27	48.9 Å²	48.9	13%	0.126	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.4	166.6	-173.1	174.2	-5.1	0	0	108.4	I189 D190 S210 M211 I212	I189-Q202 HydrophobicContact CB-CB 4.36Å; I189-Q202 HydrophobicContact CB-CG 4.26Å; I189-Q202 HydrophobicContact CD1-CG 4.3Å; I189-Q202 PolarHBondContact N-O 3.46Å; D190-Q202 HydrophobicContact CB-CB 3.94Å; D190-Q202 PolarHBondContact O-N 3.23Å; Q202-S210 PolarHBondContact NE2-OG 2.86Å; Q202-M211 CarbonylContact C-O 3.6Å; Q202-M211 WeakPolarHBondContact CA-O 3.41Å; Q202-I212 HydrophobicContact CB-CG1 4.12Å; Q202-I212 HydrophobicContact CG-CG1 4.01Å
203	L	95.4	Very high	93.6	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	133.4	-177.7	-51	-175.4	0	0	0	109.7	I182 A186 V188 R201 S210 M211 V213 L259 L267	I182-L203 HydrophobicContact CG2-CD1 4.39Å; I182-L203 HydrophobicContact CG2-CD2 3.62Å; A186-L203 HydrophobicContact CB-CD2 4.26Å; V188-L203 HydrophobicContact CG2-CD2 3.78Å; R201-L203 HydrophobicContact CB-CD2 3.93Å; L203-S210 CarbonylContact O-C 3.54Å; L203-S210 WeakPolarHBondContact O-CA 3.49Å; L203-S210 WeakPolarHBondContact O-CB 3.21Å; L203-M211 HydrophobicContact CD1-CE 3.8Å; L203-M211 PolarHBondContact N-O 2.89Å; L203-M211 PolarHBondContact O-N 2.79Å; L203-V213 HydrophobicContact CD1-CG2 4.07Å; L203-L259 HydrophobicContact CD1-CD1 4.25Å; L203-L267 HydrophobicContact CB-CD1 4.24Å; L203-L267 HydrophobicContact CD1-CD1 4.11Å; L203-L267 HydrophobicContact CD1-CD2 4.48Å
204	F	93.9	Very high	94	Very high	9 Å²	9	37 Å²	37	4%	0.039	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	137	171.1	179.8	-98.8	0	0	0	110.2	C187 I189 A206 P268 E277 L278 A281	C187-F204 HydrophobicContact CB-CB 3.92Å; C187-F204 PolarHBondContact O-N 3.29Å; I189-F204 HydrophobicContact CD1-CB 3.79Å; I189-F204 HydrophobicContact CD1-CD2 4.19Å; I189-F204 HydrophobicContact CG1-CB 3.9Å; F204-A206 WeakPolarHBondContact CE2-O 3.46Å; F204-P268 HydrophobicContact CD1-CG 4.16Å; F204-P268 WeakPolarHBondContact O-CD 3.19Å; F204-E277 HydrophobicContact CZ-CB 4.03Å; F204-L278 HydrophobicContact CB-CD1 4.17Å; F204-A281 HydrophobicContact CD2-CB 3.68Å; F204-A281 HydrophobicContact CE2-CB 4.05Å
205	L	93.8	Very high	94.1	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.042	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	-39.4	173	-59.5	178.4	0	0	0	112.3	A209 M211 F228 Y238 L263 L267	L205-A209 HydrophobicContact CB-CB 4.33Å; L205-A209 WeakPolarHBondContact CB-O 3.17Å; L205-A209 PolarHBondContact N-O 2.94Å; L205-M211 HydrophobicContact CD1-CB 3.86Å; L205-M211 HydrophobicContact CD2-CB 4.2Å; L205-M211 HydrophobicContact CG-CB 4.08Å; L205-F228 HydrophobicContact CD1-CD1 3.76Å; L205-F228 HydrophobicContact CD1-CE1 3.8Å; L205-Y238 HydrophobicContact CB-CE1 4.2Å; L205-Y238 HydrophobicContact CB-CE2 4.25Å; L205-Y238 WeakPolarHBondContact CB-OH 3.23Å; L205-Y238 HydrophobicContact CD1-CD1 4.05Å; L205-Y238 HydrophobicContact CD1-CD2 3.98Å; L205-Y238 HydrophobicContact CD1-CE1 3.9Å; L205-Y238 HydrophobicContact CD1-CE2 3.86Å; L205-Y238 HydrophobicContact CD1-CG 4.06Å; L205-Y238 HydrophobicContact CD2-CE1 4.45Å; L205-Y238 HydrophobicContact CG-CE1 4.45Å; L205-Y238 PolarHBondContact O-OH 3.04Å; L205-L263 HydrophobicContact CD2-CD1 3.77Å; L205-L267 HydrophobicContact CD2-CD1 3.75Å
206	A	90.5	Very high	94.1	Very high	21 Å²	21	32 Å²	32	17%	0.174	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	172.2	176.2	0	0	0	0	0	109.7	F204 N208 A209	F204-A206 WeakPolarHBondContact CE2-O 3.46Å; A206-N208 PolarHBondContact O-N 3.06Å; A206-A209 HydrophobicContact CB-CB 4.22Å; A206-A209 PolarHBondContact N-O 2.86Å; A206-A209 PolarHBondContact O-N 2.75Å
207	E	85.7	Confident	94	Very high	151 Å²	151	31 Å²	31	71%	0.706	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-41.3	-41.6	-177.5	-170.8	-172.8	-179.2	0	0	115
208	N	86.3	Confident	93.8	Very high	49 Å²	49	33.9 Å²	33.9	26%	0.262	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	19	-178.8	-63.5	-81.8	0	0	0	112.9	A206 G230 P231 H310	A206-N208 PolarHBondContact O-N 3.06Å; N208-G230 WeakPolarHBondContact O-CA 3.22Å; N208-P231 HydrophobicContact CB-CG 4.25Å; N208-P231 WeakPolarHBondContact O-CD 3.36Å; N208-H310 HydrophobicContact CB-CB 4.33Å; N208-H310 WeakPolarHBondContact OD1-CB 3.13Å
209	A	91	Very high	93.8	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.033	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	131.4	-176.7	0	0	0	0	0	111.6	L205 A206 I229 L235 Y238	L205-A209 HydrophobicContact CB-CB 4.33Å; L205-A209 WeakPolarHBondContact CB-O 3.17Å; L205-A209 PolarHBondContact N-O 2.94Å; A206-A209 HydrophobicContact CB-CB 4.22Å; A206-A209 PolarHBondContact N-O 2.86Å; A206-A209 PolarHBondContact O-N 2.75Å; A209-I229 CarbonylContact C-O 3.58Å; A209-I229 WeakPolarHBondContact CA-O 3.25Å; A209-L235 HydrophobicContact CB-CD2 4.11Å; A209-Y238 HydrophobicContact CB-CE2 4.08Å
210	S	93.6	Very high	93.7	Very high	9 Å²	9	35.5 Å²	35.5	6%	0.063	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	162.1	174	58.1	0	0	0	0	111.4	Q202 L203 F228 I229	Q202-S210 PolarHBondContact NE2-OG 2.86Å; L203-S210 CarbonylContact O-C 3.54Å; L203-S210 WeakPolarHBondContact O-CA 3.49Å; L203-S210 WeakPolarHBondContact O-CB 3.21Å; S210-F228 WeakPolarHBondContact O-CA 3.27Å; S210-I229 PolarHBondContact N-O 2.96Å; S210-I229 PolarHBondContact O-N 3.09Å
211	M	95.4	Very high	93.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.1	177.6	179.4	172.9	67.1	0	0	109.8	Q202 L203 L205 V213 I226 Q227 F228 L259 L263 L267	Q202-M211 CarbonylContact C-O 3.6Å; Q202-M211 WeakPolarHBondContact CA-O 3.41Å; L203-M211 HydrophobicContact CD1-CE 3.8Å; L203-M211 PolarHBondContact N-O 2.89Å; L203-M211 PolarHBondContact O-N 2.79Å; L205-M211 HydrophobicContact CD1-CB 3.86Å; L205-M211 HydrophobicContact CD2-CB 4.2Å; L205-M211 HydrophobicContact CG-CB 4.08Å; M211-V213 HydrophobicContact CE-CG2 3.79Å; M211-V213 HydrophobicContact CG-CG2 3.98Å; M211-V213 HydrophobicContact SD-CG2 4.24Å; M211-I226 HydrophobicContact CG-CG2 3.76Å; M211-I226 HydrophobicContact SD-CG2 3.69Å; M211-Q227 CarbonylContact C-O 3.55Å; M211-Q227 WeakPolarHBondContact CA-O 3.38Å; M211-F228 HydrophobicContact CB-CD1 3.96Å; M211-F228 HydrophobicContact CB-CE1 3.89Å; M211-F228 HydrophobicContact CG-CD1 4.14Å; M211-F228 HydrophobicContact CG-CE1 3.8Å; M211-F228 HydrophobicContact CG-CZ 4.39Å; M211-F228 HydrophobicContact SD-CE1 3.68Å; M211-F228 HydrophobicContact SD-CZ 3.95Å; M211-L259 HydrophobicContact CE-CD2 4.08Å; M211-L263 HydrophobicContact CE-CD1 3.56Å; M211-L263 HydrophobicContact SD-CD1 3.89Å; M211-L263 HydrophobicContact SD-CD2 4.5Å; M211-L267 HydrophobicContact CE-CD1 4.29Å
212	I	96.1	Very high	93.8	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.015	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	128.5	167.5	-69.8	169.2	0	0	0	108.7	K200 R201 Q202 I226 Q227 I229	K200-I212 HydrophobicContact CD-CG2 3.73Å; K200-I212 HydrophobicContact CG-CG2 3.74Å; R201-I212 CarbonylContact O-C 3.58Å; R201-I212 WeakPolarHBondContact O-CA 3.15Å; Q202-I212 HydrophobicContact CB-CG1 4.12Å; Q202-I212 HydrophobicContact CG-CG1 4.01Å; I212-I226 WeakPolarHBondContact O-CA 3.36Å; I212-Q227 HydrophobicContact CB-CB 4.24Å; I212-Q227 PolarHBondContact N-O 2.88Å; I212-Q227 PolarHBondContact O-N 2.88Å; I212-I229 HydrophobicContact CD1-CD1 3.3Å; I212-I229 HydrophobicContact CD1-CG1 4.07Å; I212-I229 HydrophobicContact CG1-CD1 4.08Å
213	V	97.3	Very high	93.8	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123	172.4	-177.6	0	0	0	0	108.2	K200 R201 L203 M211 L215 P224 D225 L259	K200-V213 CarbonylContact C-O 3.56Å; K200-V213 WeakPolarHBondContact CA-O 3.34Å; R201-V213 PolarHBondContact N-O 3.31Å; R201-V213 PolarHBondContact O-N 2.77Å; L203-V213 HydrophobicContact CD1-CG2 4.07Å; M211-V213 HydrophobicContact CE-CG2 3.79Å; M211-V213 HydrophobicContact CG-CG2 3.98Å; M211-V213 HydrophobicContact SD-CG2 4.24Å; V213-L215 HydrophobicContact CG1-CD2 3.73Å; V213-P224 HydrophobicContact CG1-CB 3.69Å; V213-P224 HydrophobicContact CG1-CG 3.61Å; V213-D225 WeakPolarHBondContact CA-O 3.26Å; V213-L259 HydrophobicContact CG1-CD1 4.26Å; V213-L259 HydrophobicContact CG1-CD2 4.5Å; V213-L259 HydrophobicContact CG2-CD1 4.04Å; V213-L259 HydrophobicContact CG2-CD2 4.06Å
214	T	97.3	Very high	93.9	Very high	41 Å²	41	39 Å²	39	25%	0.252	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.4	175.8	-50.4	0	0	0	0	109.8	V199 K200 P224 D225	V199-T214 HydrophobicContact CG2-CG2 3.98Å; K200-T214 HydrophobicContact CB-CG2 4.45Å; T214-P224 VanDerWaalsContact O-CB 3.25Å; T214-P224 WeakPolarHBondContact O-CB 3.25Å; T214-D225 PolarHBondContact N-O 3.2Å; T214-D225 PolarHBondContact O-N 2.96Å; T214-D225 VanDerWaalsContact O-N 3.15Å
215	L	97.2	Very high	94	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.026	23%	0.234	C	C	.	.			trans	-86.6	143.9	-179.4	-54	-165.2	0	0	0	111	L175 Q178 L179 V199 V213 P217 P224 V255	L175-L215 HydrophobicContact CD1-CB 3.61Å; L175-L215 HydrophobicContact CD1-CD1 3.97Å; L175-L215 HydrophobicContact CD1-CG 4.38Å; Q178-L215 HydrophobicContact CB-CD1 3.95Å; L179-L215 HydrophobicContact CD2-CD1 3.66Å; L179-L215 HydrophobicContact CD2-CG 4.03Å; L179-L215 HydrophobicContact CG-CD1 3.98Å; V199-L215 PolarHBondContact O-N 3.48Å; V213-L215 HydrophobicContact CG1-CD2 3.73Å; L215-P217 WeakPolarHBondContact O-CD 3.35Å; L215-P224 HydrophobicContact CD2-CB 3.63Å; L215-P224 HydrophobicContact CD2-CG 4.22Å; L215-V255 HydrophobicContact CD1-CG2 4.43Å; L215-V255 HydrophobicContact CD2-CG1 3.89Å
216	N	93.8	Very high	94.1	Very high	79 Å²	79	44 Å²	44	42%	0.422	24%	0.241	S	C	.	.			trans	-82.1	120.7	170.1	-178.4	-17.3	0	0	0	109.2	S218 E219 P220	N216-S218 PolarHBondContact O-N 3.14Å; N216-S218 PolarHBondContact OD1-N 3.06Å; N216-E219 CarbonylContact O-C 3.6Å; N216-E219 PolarHBondContact O-N 3.31Å; N216-E219 VanDerWaalsContact O-N 3.15Å; N216-P220 VanDerWaalsContact O-CA 3.25Å; N216-P220 WeakPolarHBondContact O-CA 3.42Å; N216-P220 VanDerWaalsContact O-N 3.08Å
217	P	92.8	Very high	94.3	Very high	34 Å²	34	47.5 Å²	47.5	22%	0.221	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-34.9	178.9	-26.5	35	0	0	0	114.8	P147 L175 V199 L215	P147-P217 HydrophobicContact CB-CB 3.9Å; P147-P217 HydrophobicContact CB-CG 3.6Å; L175-P217 HydrophobicContact CD2-CB 4.09Å; L175-P217 HydrophobicContact CD2-CG 4.37Å; V199-P217 HydrophobicContact CG1-CG 3.97Å; L215-P217 WeakPolarHBondContact O-CD 3.35Å
218	S	91.3	Very high	94.7	Very high	109 Å²	109	41.6 Å²	41.6	76%	0.762	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-22.8	-177.8	-54.9	0	0	0	0	113.2	N216	N216-S218 PolarHBondContact O-N 3.14Å; N216-S218 PolarHBondContact OD1-N 3.06Å
219	E	94.1	Very high	94.9	Very high	98 Å²	98	40 Å²	40	46%	0.458	22%	0.217	S	C	.	.	S	Bend	trans	-139.5	66.4	179.3	-70.9	-170.3	-117	0	0	110.6	N216 R221 A222 K251	N216-E219 CarbonylContact O-C 3.6Å; N216-E219 PolarHBondContact O-N 3.31Å; N216-E219 VanDerWaalsContact O-N 3.15Å; E219-R221 PolarHBondContact O-N 3.11Å; E219-A222 HydrophobicContact CB-CB 3.87Å; E219-A222 WeakPolarHBondContact O-CB 3.49Å; E219-A222 PolarHBondContact O-N 3.47Å; E219-K251 IonicContact OE2-NZ 3.95Å; E219-K251 PolarHBondContact OE2-NZ 2.82Å
220	P	95.4	Very high	94.9	Very high	13 Å²	13	40.1 Å²	40.1	8%	0.084	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.3	-168.4	23.4	-34.5	0	0	0	114.5	D174 L175 Q178 N216 V255	D174-P220 HydrophobicContact CB-CG 4Å; L175-P220 HydrophobicContact CB-CB 3.86Å; L175-P220 HydrophobicContact CB-CG 4.27Å; L175-P220 HydrophobicContact CD1-CB 4.01Å; Q178-P220 HydrophobicContact CG-CB 4.32Å; N216-P220 VanDerWaalsContact O-CA 3.25Å; N216-P220 WeakPolarHBondContact O-CA 3.42Å; N216-P220 VanDerWaalsContact O-N 3.08Å; P220-V255 WeakPolarHBondContact O-CG2 3.22Å
221	R	97.2	Very high	94.7	Very high	74 Å²	74	39.7 Å²	39.7	28%	0.279	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-3.1	178.5	-59.9	179.4	-176.1	-114.4	3.2	114.1	D174 Q178 E219 W249 K251 N253	D174-R221 IonicContact OD1-CZ 3.98Å; D174-R221 IonicContact OD1-NE 2.83Å; D174-R221 PolarHBondContact OD1-NE 3.16Å; D174-R221 VanDerWaalsContact OD1-NE 3.16Å; D174-R221 IonicContact OD1-NH2 3.03Å; D174-R221 PolarHBondContact OD1-NH2 2.98Å; D174-R221 WeakPolarHBondContact OD2-CD 3.29Å; D174-R221 IonicContact OD2-CZ 3.59Å; D174-R221 IonicContact OD2-NE 3.89Å; D174-R221 PolarHBondContact OD2-NE 2.62Å; D174-R221 IonicContact OD2-NH2 3.21Å; Q178-R221 HydrophobicContact CG-CG 4.22Å; Q178-R221 VanDerWaalsContact NE2-CZ 3.26Å; E219-R221 PolarHBondContact O-N 3.11Å; R221-W249 PolarHBondContact O-NE1 2.94Å; R221-K251 HydrophobicContact CB-CB 4.47Å; R221-K251 VanDerWaalsContact CD-O 3.29Å; R221-K251 WeakPolarHBondContact CD-O 3.26Å; R221-N253 PolarHBondContact NH1-O 2.83Å
222	A	96.5	Very high	94.4	Very high	18 Å²	18	45.1 Å²	45.1	15%	0.149	24%	0.241	C	C	.	.	S	Bend	trans	-64.8	165.2	170	0	0	0	0	0	110.4	E219 P224	E219-A222 HydrophobicContact CB-CB 3.87Å; E219-A222 WeakPolarHBondContact O-CB 3.49Å; E219-A222 PolarHBondContact O-N 3.47Å; A222-P224 VanDerWaalsContact O-CD 3.26Å; A222-P224 WeakPolarHBondContact O-CD 3.31Å; A222-P224 VanDerWaalsContact O-N 3.13Å
223	L	96.6	Very high	94.1	Very high	81 Å²	81	48.5 Å²	48.5	42%	0.424	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-57.6	118.3	173.6	178.2	72.5	0	0	0	108.7	I226 L246 W249	L223-I226 HydrophobicContact CD1-CD1 4.49Å; L223-L246 HydrophobicContact CD1-CD1 3.44Å; L223-L246 VanDerWaalsContact CD1-CD1 3.44Å; L223-L246 HydrophobicContact CD2-CD1 3.66Å; L223-L246 HydrophobicContact CD2-CD2 4.3Å; L223-L246 HydrophobicContact CD2-CG 4.22Å; L223-L246 HydrophobicContact CG-CD1 4.2Å; L223-W249 HydrophobicContact CB-CD2 4.44Å; L223-W249 HydrophobicContact CB-CG 4.44Å; L223-W249 HydrophobicContact CD1-CD2 3.8Å; L223-W249 HydrophobicContact CD1-CE3 3.66Å; L223-W249 HydrophobicContact CD1-CG 4.22Å; L223-W249 HydrophobicContact CD1-CZ3 4.16Å
224	P	96.6	Very high	93.7	Very high	12 Å²	12	50.9 Å²	50.9	8%	0.078	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-74.9	167.4	-178.4	30.8	-35.5	0	0	0	111.7	V213 T214 L215 A222 I226 W249	V213-P224 HydrophobicContact CG1-CB 3.69Å; V213-P224 HydrophobicContact CG1-CG 3.61Å; T214-P224 VanDerWaalsContact O-CB 3.25Å; T214-P224 WeakPolarHBondContact O-CB 3.25Å; L215-P224 HydrophobicContact CD2-CB 3.63Å; L215-P224 HydrophobicContact CD2-CG 4.22Å; A222-P224 VanDerWaalsContact O-CD 3.26Å; A222-P224 WeakPolarHBondContact O-CD 3.31Å; A222-P224 VanDerWaalsContact O-N 3.13Å; P224-I226 HydrophobicContact CG-CD1 4.21Å; P224-I226 HydrophobicContact CG-CG1 3.99Å; P224-I226 PolarHBondContact O-N 3.45Å; P224-W249 VanDerWaalsContact CD-CZ2 3.44Å; P224-W249 HydrophobicContact CG-CH2 3.99Å; P224-W249 HydrophobicContact CG-CZ2 4.42Å
225	D	96	Very high	93.5	Very high	86 Å²	86	49.2 Å²	49.2	46%	0.46	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	123.8	164.2	-175.6	40.1	0	0	0	108.7	V213 T214 Q227	V213-D225 WeakPolarHBondContact CA-O 3.26Å; T214-D225 PolarHBondContact N-O 3.2Å; T214-D225 PolarHBondContact O-N 2.96Å; T214-D225 VanDerWaalsContact O-N 3.15Å; D225-Q227 PolarHBondContact OD2-NE2 2.77Å
226	I	96.1	Very high	93.3	Very high	34 Å²	34	55.1 Å²	55.1	17%	0.174	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.5	-176.3	-60.7	175.7	0	0	0	108.5	M211 I212 L223 P224 F228 L259 L262	M211-I226 HydrophobicContact CG-CG2 3.76Å; M211-I226 HydrophobicContact SD-CG2 3.69Å; I212-I226 WeakPolarHBondContact O-CA 3.36Å; L223-I226 HydrophobicContact CD1-CD1 4.49Å; P224-I226 HydrophobicContact CG-CD1 4.21Å; P224-I226 HydrophobicContact CG-CG1 3.99Å; P224-I226 PolarHBondContact O-N 3.45Å; I226-F228 HydrophobicContact CG2-CE2 4.02Å; I226-F228 HydrophobicContact CG2-CZ 4.03Å; I226-L259 HydrophobicContact CD1-CD2 4.11Å; I226-L262 HydrophobicContact CD1-CD2 3.46Å; I226-L262 VanDerWaalsContact CD1-CD2 3.46Å
227	Q	94	Very high	93.4	Very high	96 Å²	96	57.5 Å²	57.5	45%	0.449	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	135.5	177.1	-57.4	177	0.7	0	0	109.3	M211 I212 D225	M211-Q227 CarbonylContact C-O 3.55Å; M211-Q227 WeakPolarHBondContact CA-O 3.38Å; I212-Q227 HydrophobicContact CB-CB 4.24Å; I212-Q227 PolarHBondContact N-O 2.88Å; I212-Q227 PolarHBondContact O-N 2.88Å; D225-Q227 PolarHBondContact OD2-NE2 2.77Å
228	F	94.1	Very high	93.5	Very high	27 Å²	27	56 Å²	56	12%	0.118	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	138.3	175.5	-66.9	-76.1	0	0	0	110.1	L205 S210 M211 I226 L235 Y238 H239 V242 L263	L205-F228 HydrophobicContact CD1-CD1 3.76Å; L205-F228 HydrophobicContact CD1-CE1 3.8Å; S210-F228 WeakPolarHBondContact O-CA 3.27Å; M211-F228 HydrophobicContact CB-CD1 3.96Å; M211-F228 HydrophobicContact CB-CE1 3.89Å; M211-F228 HydrophobicContact CG-CD1 4.14Å; M211-F228 HydrophobicContact CG-CE1 3.8Å; M211-F228 HydrophobicContact CG-CZ 4.39Å; M211-F228 HydrophobicContact SD-CE1 3.68Å; M211-F228 HydrophobicContact SD-CZ 3.95Å; I226-F228 HydrophobicContact CG2-CE2 4.02Å; I226-F228 HydrophobicContact CG2-CZ 4.03Å; F228-L235 HydrophobicContact CB-CD1 3.79Å; F228-L235 HydrophobicContact CB-CD2 3.89Å; F228-L235 HydrophobicContact CB-CG 4.27Å; F228-Y238 HydrophobicContact CD1-CG 4.47Å; F228-Y238 HydrophobicContact CE1-CG 4.15Å; F228-H239 AromaticContact CD2-CE1 3.54Å; F228-H239 AromaticContact CD2-ND1 3.8Å; F228-H239 AromaticContact CD2-NE2 3.99Å; F228-V242 HydrophobicContact CE2-CG2 3.82Å; F228-V242 HydrophobicContact CZ-CG2 3.58Å; F228-L263 HydrophobicContact CE1-CD2 4.34Å; F228-L263 HydrophobicContact CZ-CD2 4.18Å
229	I	91	Very high	93.7	Very high	14 Å²	14	54 Å²	54	7%	0.072	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.9	176.7	-65	-176	0	0	0	108.1	A209 S210 I212 L286 I301 F305	A209-I229 CarbonylContact C-O 3.58Å; A209-I229 WeakPolarHBondContact CA-O 3.25Å; S210-I229 PolarHBondContact N-O 2.96Å; S210-I229 PolarHBondContact O-N 3.09Å; I212-I229 HydrophobicContact CD1-CD1 3.3Å; I212-I229 HydrophobicContact CD1-CG1 4.07Å; I212-I229 HydrophobicContact CG1-CD1 4.08Å; I229-L286 HydrophobicContact CG2-CD1 4.09Å; I229-I301 HydrophobicContact CD1-CD1 4.46Å; I229-F305 HydrophobicContact CG2-CE2 3.6Å; I229-F305 HydrophobicContact CG2-CZ 3.61Å
230	G	90.4	Very high	93.8	Very high	7 Å²	7	53.4 Å²	53.4	7%	0.072	26%	0.263	C	S	.	.	S	Bend	trans	149.4	-175.4	177.7	0	0	0	0	0	113.3	N208 E232 L235 F305	N208-G230 WeakPolarHBondContact O-CA 3.22Å; G230-E232 PolarHBondContact O-N 3.45Å; G230-L235 WeakPolarHBondContact O-CD1 3.33Å; G230-F305 VanDerWaalsContact C-CD2 3.49Å; G230-F305 WeakPolarHBondContact O-CD2 3.44Å
231	P	89.4	Confident	93.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.266	C	S	.	.			trans	-65.1	129.7	175.3	-13.3	25.4	0	0	0	111.8	N208 S233 Q234 L235 F305 H310	N208-P231 HydrophobicContact CB-CG 4.25Å; N208-P231 WeakPolarHBondContact O-CD 3.36Å; P231-S233 PolarHBondContact O-N 2.94Å; P231-S233 VanDerWaalsContact O-N 3.1Å; P231-Q234 HydrophobicContact CB-CG 4.45Å; P231-Q234 HydrophobicContact CG-CG 4.47Å; P231-Q234 WeakPolarHBondContact O-CA 3.21Å; P231-Q234 WeakPolarHBondContact O-CB 3.24Å; P231-Q234 PolarHBondContact O-N 3.28Å; P231-L235 WeakPolarHBondContact O-CG 3.35Å; P231-L235 PolarHBondContact O-N 2.81Å; P231-F305 HydrophobicContact CB-CB 4.35Å; P231-F305 HydrophobicContact CG-CB 4.25Å; P231-H310 HydrophobicContact CG-CB 4.17Å; P231-H310 WeakPolarHBondContact CG-ND1 3.49Å
232	E	88.6	Confident	93.8	Very high	115 Å²	115	51.4 Å²	51.4	54%	0.537	26%	0.257	S	S	.	.	H	α-helix	trans	-51.3	-39.5	-177.5	-175.2	63	-154.7	0	0	112.9	G230 Q234 L235 K236 D307	G230-E232 PolarHBondContact O-N 3.45Å; E232-Q234 VanDerWaalsContact C-N 3.25Å; E232-Q234 PolarHBondContact O-N 3.05Å; E232-L235 PolarHBondContact O-N 2.57Å; E232-L235 VanDerWaalsContact O-N 3.16Å; E232-K236 PolarHBondContact O-N 2.97Å; E232-D307 PolarHBondContact N-OD1 3.2Å
233	S	89.7	Confident	93.7	Very high	74 Å²	74	56.1 Å²	56.1	52%	0.517	28%	0.28	S	S	.	.	H	α-helix	trans	-56.7	-34.8	175.2	49.8	0	0	0	0	114	P231 D307	P231-S233 PolarHBondContact O-N 2.94Å; P231-S233 VanDerWaalsContact O-N 3.1Å; S233-D307 WeakPolarHBondContact CB-OD1 3.36Å; S233-D307 PolarHBondContact N-OD1 3.21Å; S233-D307 PolarHBondContact OG-OD1 2.82Å
234	Q	89.8	Confident	93.7	Very high	51 Å²	51	58.7 Å²	58.7	24%	0.238	28%	0.284	C	S	.	.	H	α-helix	trans	-85.1	-35.9	174.2	-61.2	-172.1	17.3	0	0	111.7	P231 E232 K236 R237	P231-Q234 HydrophobicContact CB-CG 4.45Å; P231-Q234 HydrophobicContact CG-CG 4.47Å; P231-Q234 WeakPolarHBondContact O-CA 3.21Å; P231-Q234 WeakPolarHBondContact O-CB 3.24Å; P231-Q234 PolarHBondContact O-N 3.28Å; E232-Q234 VanDerWaalsContact C-N 3.25Å; E232-Q234 PolarHBondContact O-N 3.05Å; Q234-K236 VanDerWaalsContact C-N 3.32Å; Q234-K236 PolarHBondContact O-N 3.2Å; Q234-R237 WeakPolarHBondContact O-CG 3.11Å
235	L	93.4	Very high	93.7	Very high	7 Å²	7	59.1 Å²	59.1	4%	0.037	29%	0.285	C	S	.	.	H	α-helix	trans	-69.1	-28.9	-177	-62.2	-169.6	0	0	0	113.6	A209 F228 G230 P231 E232 R237 Y238 H239	A209-L235 HydrophobicContact CB-CD2 4.11Å; F228-L235 HydrophobicContact CB-CD1 3.79Å; F228-L235 HydrophobicContact CB-CD2 3.89Å; F228-L235 HydrophobicContact CB-CG 4.27Å; G230-L235 WeakPolarHBondContact O-CD1 3.33Å; P231-L235 WeakPolarHBondContact O-CG 3.35Å; P231-L235 PolarHBondContact O-N 2.81Å; E232-L235 PolarHBondContact O-N 2.57Å; E232-L235 VanDerWaalsContact O-N 3.16Å; L235-R237 PolarHBondContact O-N 2.77Å; L235-R237 VanDerWaalsContact O-N 3.12Å; L235-Y238 HydrophobicContact CD2-CD2 4.45Å; L235-Y238 PolarHBondContact O-N 3.28Å; L235-H239 PolarHBondContact O-CD2 2.9Å; L235-H239 PolarHBondContact O-N 2.76Å
236	K	93.6	Very high	93.7	Very high	128 Å²	128	58 Å²	58	56%	0.557	28%	0.279	S	S	*	.	H	α-helix	trans	-48.9	-43.6	-178.9	-175.4	-179.9	177.3	-173.8	0	113.3	E232 Q234 Y238 H239 D240	E232-K236 PolarHBondContact O-N 2.97Å; Q234-K236 VanDerWaalsContact C-N 3.32Å; Q234-K236 PolarHBondContact O-N 3.2Å; K236-Y238 VanDerWaalsContact C-N 3.29Å; K236-Y238 PolarHBondContact O-N 2.82Å; K236-H239 PolarHBondContact O-N 2.96Å; K236-D240 WeakPolarHBondContact O-CB 3.42Å; K236-D240 VanDerWaalsContact O-CG 3.27Å; K236-D240 PolarHBondContact O-N 3.48Å
237	R	94.7	Very high	93.7	Very high	129 Å²	129	62.8 Å²	62.8	49%	0.487	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-40.9	179.8	76.2	-173.6	173.8	172.7	-7.6	111.8	Q234 L235 D240 L241	Q234-R237 WeakPolarHBondContact O-CG 3.11Å; L235-R237 PolarHBondContact O-N 2.77Å; L235-R237 VanDerWaalsContact O-N 3.12Å; R237-D240 PolarHBondContact O-N 2.87Å; R237-L241 WeakPolarHBondContact O-CG 3.35Å; R237-L241 PolarHBondContact O-N 3.05Å
238	Y	96.4	Very high	93.7	Very high	2 Å²	2	65.8 Å²	65.8	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-73.4	-39.5	-178.4	-58.7	-68.3	0	0	0	111.2	L205 A209 F228 L235 K236 D240 L241 V242 L263 A266	L205-Y238 HydrophobicContact CB-CE1 4.2Å; L205-Y238 HydrophobicContact CB-CE2 4.25Å; L205-Y238 WeakPolarHBondContact CB-OH 3.23Å; L205-Y238 HydrophobicContact CD1-CD1 4.05Å; L205-Y238 HydrophobicContact CD1-CD2 3.98Å; L205-Y238 HydrophobicContact CD1-CE1 3.9Å; L205-Y238 HydrophobicContact CD1-CE2 3.86Å; L205-Y238 HydrophobicContact CD1-CG 4.06Å; L205-Y238 HydrophobicContact CD2-CE1 4.45Å; L205-Y238 HydrophobicContact CG-CE1 4.45Å; L205-Y238 PolarHBondContact O-OH 3.04Å; A209-Y238 HydrophobicContact CB-CE2 4.08Å; F228-Y238 HydrophobicContact CD1-CG 4.47Å; F228-Y238 HydrophobicContact CE1-CG 4.15Å; L235-Y238 HydrophobicContact CD2-CD2 4.45Å; L235-Y238 PolarHBondContact O-N 3.28Å; K236-Y238 VanDerWaalsContact C-N 3.29Å; K236-Y238 PolarHBondContact O-N 2.82Å; Y238-D240 VanDerWaalsContact C-N 3.33Å; Y238-D240 PolarHBondContact O-N 2.82Å; Y238-L241 HydrophobicContact CD1-CD1 4.43Å; Y238-L241 PolarHBondContact O-N 2.73Å; Y238-V242 WeakPolarHBondContact O-CB 3.4Å; Y238-V242 VanDerWaalsContact O-CG2 3.3Å; Y238-V242 WeakPolarHBondContact O-CG2 3.18Å; Y238-V242 PolarHBondContact O-N 3.33Å; Y238-L263 HydrophobicContact CD1-CD2 4.09Å; Y238-A266 HydrophobicContact CE1-CB 3.99Å
239	H	95.4	Very high	93.9	Very high	67 Å²	67	66.4 Å²	66.4	31%	0.31	31%	0.313	S	S	.	.	H	α-helix	trans	-58.3	-45	170.7	-74.9	-62	0	0	0	112.2	F228 L235 K236 V242 N243	F228-H239 AromaticContact CD2-CE1 3.54Å; F228-H239 AromaticContact CD2-ND1 3.8Å; F228-H239 AromaticContact CD2-NE2 3.99Å; L235-H239 PolarHBondContact O-CD2 2.9Å; L235-H239 PolarHBondContact O-N 2.76Å; K236-H239 PolarHBondContact O-N 2.96Å; H239-V242 PolarHBondContact O-N 2.92Å; H239-N243 VanDerWaalsContact O-CB 3.27Å; H239-N243 WeakPolarHBondContact O-CB 3.31Å; H239-N243 PolarHBondContact O-N 3.37Å; H239-N243 PolarHBondContact O-ND2 3.29Å; H239-N243 VanDerWaalsContact O-ND2 3.08Å
240	D	95.8	Very high	94.1	Very high	87 Å²	87	69 Å²	69	47%	0.465	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-42.1	178.2	-70.2	-21	0	0	0	111.5	K236 R237 Y238 R244	K236-D240 WeakPolarHBondContact O-CB 3.42Å; K236-D240 VanDerWaalsContact O-CG 3.27Å; K236-D240 PolarHBondContact O-N 3.48Å; R237-D240 PolarHBondContact O-N 2.87Å; Y238-D240 VanDerWaalsContact C-N 3.33Å; Y238-D240 PolarHBondContact O-N 2.82Å; D240-R244 VanDerWaalsContact O-CB 3.3Å; D240-R244 WeakPolarHBondContact O-CB 3.46Å; D240-R244 PolarHBondContact O-N 3.5Å; D240-R244 VanDerWaalsContact O-N 3.12Å
241	L	96.8	Very high	94.4	Very high	28 Å²	28	73.9 Å²	73.9	15%	0.147	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-52.6	175.2	-71	171	0	0	0	111.8	R237 Y238 N243 R244 N245 L262 D264 A266	R237-L241 WeakPolarHBondContact O-CG 3.35Å; R237-L241 PolarHBondContact O-N 3.05Å; Y238-L241 HydrophobicContact CD1-CD1 4.43Å; Y238-L241 PolarHBondContact O-N 2.73Å; L241-N243 PolarHBondContact O-N 3.03Å; L241-R244 PolarHBondContact O-N 2.81Å; L241-N245 VanDerWaalsContact O-CB 3.27Å; L241-N245 WeakPolarHBondContact O-CB 3.49Å; L241-N245 PolarHBondContact O-N 3.19Å; L241-L262 CarbonylContact C-O 3.56Å; L241-D264 HydrophobicContact CD2-CB 3.8Å; L241-A266 HydrophobicContact CD1-CB 4.14Å
242	V	95.8	Very high	94.7	Very high	16 Å²	16	78 Å²	78	10%	0.097	38%	0.375	C	S	.	.	H	α-helix	trans	-57.6	-51.3	178.6	170.1	0	0	0	0	110.6	F228 Y238 H239 R244 N245 L246 L262 L263	F228-V242 HydrophobicContact CE2-CG2 3.82Å; F228-V242 HydrophobicContact CZ-CG2 3.58Å; Y238-V242 WeakPolarHBondContact O-CB 3.4Å; Y238-V242 VanDerWaalsContact O-CG2 3.3Å; Y238-V242 WeakPolarHBondContact O-CG2 3.18Å; Y238-V242 PolarHBondContact O-N 3.33Å; H239-V242 PolarHBondContact O-N 2.92Å; V242-R244 VanDerWaalsContact C-N 3.26Å; V242-R244 PolarHBondContact O-N 3.46Å; V242-N245 PolarHBondContact O-N 3.02Å; V242-L246 HydrophobicContact CG1-CD1 4.3Å; V242-L246 WeakPolarHBondContact O-CB 3.45Å; V242-L246 PolarHBondContact O-N 2.83Å; V242-L262 HydrophobicContact CB-CD1 4.39Å; V242-L262 HydrophobicContact CB-CD2 4.45Å; V242-L262 HydrophobicContact CB-CG 4.28Å; V242-L262 HydrophobicContact CG1-CD1 4.21Å; V242-L262 HydrophobicContact CG1-CD2 4.17Å; V242-L262 HydrophobicContact CG1-CG 4.35Å; V242-L262 HydrophobicContact CG2-CD2 3.85Å; V242-L262 HydrophobicContact CG2-CG 3.87Å; V242-L263 HydrophobicContact CG2-CD2 4.11Å
243	N	94.8	Very high	95.1	Very high	117 Å²	117	74.2 Å²	74.2	63%	0.626	36%	0.359	S	S	*	.	H	α-helix	trans	-60.1	-36.4	-177.5	-74.7	-29.6	0	0	0	112.7	H239 L241	H239-N243 VanDerWaalsContact O-CB 3.27Å; H239-N243 WeakPolarHBondContact O-CB 3.31Å; H239-N243 PolarHBondContact O-N 3.37Å; H239-N243 PolarHBondContact O-ND2 3.29Å; H239-N243 VanDerWaalsContact O-ND2 3.08Å; L241-N243 PolarHBondContact O-N 3.03Å
244	R	96.2	Very high	95.4	Very high	136 Å²	136	71.7 Å²	71.7	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-74.3	-40.4	178	-177.5	-179.2	65.1	-174.3	6.2	112.2	D240 L241 V242 D264	D240-R244 VanDerWaalsContact O-CB 3.3Å; D240-R244 WeakPolarHBondContact O-CB 3.46Å; D240-R244 PolarHBondContact O-N 3.5Å; D240-R244 VanDerWaalsContact O-N 3.12Å; L241-R244 PolarHBondContact O-N 2.81Å; V242-R244 VanDerWaalsContact C-N 3.26Å; V242-R244 PolarHBondContact O-N 3.46Å; R244-D264 IonicContact NH2-OD2 3.9Å; R244-D264 PolarHBondContact NH2-OD2 2.96Å
245	N	96.9	Very high	95.8	Very high	20 Å²	20	69.2 Å²	69.2	11%	0.107	33%	0.333	C	S	.	.	H	α-helix	trans	-96.1	-9.5	-168.1	-64.8	-11.4	0	0	0	113.4	L241 V242 I247 Y248 K261 L262	L241-N245 VanDerWaalsContact O-CB 3.27Å; L241-N245 WeakPolarHBondContact O-CB 3.49Å; L241-N245 PolarHBondContact O-N 3.19Å; V242-N245 PolarHBondContact O-N 3.02Å; N245-I247 PolarHBondContact O-N 3.46Å; N245-I247 VanDerWaalsContact O-N 3.12Å; N245-Y248 WeakPolarHBondContact O-CB 3.22Å; N245-Y248 PolarHBondContact O-N 2.76Å; N245-K261 PolarHBondContact ND2-O 3.36Å; N245-L262 HydrophobicContact CB-CD1 4.09Å; N245-L262 PolarHBondContact ND2-O 2.96Å
246	L	94.7	Very high	96	Very high	64 Å²	64	69.6 Å²	69.6	34%	0.335	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-53.4	-36.4	-176.9	-160.8	68.4	0	0	0	113.7	L223 V242 Y248 W249 L262	L223-L246 HydrophobicContact CD1-CD1 3.44Å; L223-L246 VanDerWaalsContact CD1-CD1 3.44Å; L223-L246 HydrophobicContact CD2-CD1 3.66Å; L223-L246 HydrophobicContact CD2-CD2 4.3Å; L223-L246 HydrophobicContact CD2-CG 4.22Å; L223-L246 HydrophobicContact CG-CD1 4.2Å; V242-L246 HydrophobicContact CG1-CD1 4.3Å; V242-L246 WeakPolarHBondContact O-CB 3.45Å; V242-L246 PolarHBondContact O-N 2.83Å; L246-Y248 PolarHBondContact O-N 3.03Å; L246-Y248 VanDerWaalsContact O-N 3.16Å; L246-W249 WeakPolarHBondContact O-CB 3.41Å; L246-W249 PolarHBondContact O-N 3.49Å; L246-W249 VanDerWaalsContact O-N 3.12Å; L246-L262 HydrophobicContact CD1-CD1 4.13Å
247	I	95.4	Very high	96.1	Very high	133 Å²	133	67.2 Å²	67.2	68%	0.682	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-64	-17.3	-179.3	60.8	171.5	0	0	0	113.5	N245	N245-I247 PolarHBondContact O-N 3.46Å; N245-I247 VanDerWaalsContact O-N 3.12Å
248	Y	95.6	Very high	96.3	Very high	159 Å²	159	61.2 Å²	61.2	62%	0.624	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-95.9	5.5	179.4	-55.5	-64	0	0	0	112.9	N245 L246 D250	N245-Y248 WeakPolarHBondContact O-CB 3.22Å; N245-Y248 PolarHBondContact O-N 2.76Å; L246-Y248 PolarHBondContact O-N 3.03Å; L246-Y248 VanDerWaalsContact O-N 3.16Å; Y248-D250 PolarHBondContact O-N 2.72Å
249	W	97.3	Very high	96.3	Very high	40 Å²	40	61.1 Å²	61.1	15%	0.152	30%	0.303	C	S	.	.			trans	-63.2	121.4	175	-170.9	-80.9	0	0	0	110.6	R221 L223 P224 L246 V255 N258 L259 L262	R221-W249 PolarHBondContact O-NE1 2.94Å; L223-W249 HydrophobicContact CB-CD2 4.44Å; L223-W249 HydrophobicContact CB-CG 4.44Å; L223-W249 HydrophobicContact CD1-CD2 3.8Å; L223-W249 HydrophobicContact CD1-CE3 3.66Å; L223-W249 HydrophobicContact CD1-CG 4.22Å; L223-W249 HydrophobicContact CD1-CZ3 4.16Å; P224-W249 VanDerWaalsContact CD-CZ2 3.44Å; P224-W249 HydrophobicContact CG-CH2 3.99Å; P224-W249 HydrophobicContact CG-CZ2 4.42Å; L246-W249 WeakPolarHBondContact O-CB 3.41Å; L246-W249 PolarHBondContact O-N 3.49Å; L246-W249 VanDerWaalsContact O-N 3.12Å; W249-V255 HydrophobicContact CH2-CG1 4.29Å; W249-N258 HydrophobicContact CD2-CB 3.88Å; W249-N258 HydrophobicContact CE3-CB 3.6Å; W249-N258 HydrophobicContact CH2-CB 3.52Å; W249-N258 HydrophobicContact CZ2-CB 3.81Å; W249-N258 HydrophobicContact CZ3-CB 3.42Å; W249-N258 VanDerWaalsContact CZ3-CB 3.42Å; W249-L259 HydrophobicContact CH2-CD2 4.25Å; W249-L259 HydrophobicContact CH2-CG 4.34Å; W249-L259 HydrophobicContact CZ3-CD2 4.15Å; W249-L259 HydrophobicContact CZ3-CG 4.47Å; W249-L262 HydrophobicContact CZ3-CD2 4.41Å
250	D	96.7	Very high	96.3	Very high	68 Å²	68	60.6 Å²	60.6	36%	0.364	30%	0.301	S	S	.	.			trans	-123.3	114.9	-176	-177.8	-7.3	0	0	0	110.4	Y248 S252 N253 N258	Y248-D250 PolarHBondContact O-N 2.72Å; D250-S252 PolarHBondContact O-N 2.84Å; D250-S252 VanDerWaalsContact O-N 3.09Å; D250-S252 VanDerWaalsContact OD1-CB 3.31Å; D250-S252 WeakPolarHBondContact OD1-CB 3.45Å; D250-S252 PolarHBondContact OD1-N 3.23Å; D250-S252 PolarHBondContact OD1-OG 2.82Å; D250-S252 PolarHBondContact OD2-OG 3.09Å; D250-N253 PolarHBondContact O-N 2.78Å; D250-N258 PolarHBondContact N-OD1 3.32Å; D250-N258 PolarHBondContact O-ND2 3.42Å
251	K	96.3	Very high	96.3	Very high	111 Å²	111	61 Å²	61	48%	0.483	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.8	-179.8	-61.2	-166.8	179.4	-170.7	0	113.2	E219 R221	E219-K251 IonicContact OE2-NZ 3.95Å; E219-K251 PolarHBondContact OE2-NZ 2.82Å; R221-K251 HydrophobicContact CB-CB 4.47Å; R221-K251 VanDerWaalsContact CD-O 3.29Å; R221-K251 WeakPolarHBondContact CD-O 3.26Å
252	S	96.1	Very high	96.3	Very high	85 Å²	85	59.9 Å²	59.9	59%	0.594	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-23.9	175.2	73.2	0	0	0	0	113.1	D250	D250-S252 PolarHBondContact O-N 2.84Å; D250-S252 VanDerWaalsContact O-N 3.09Å; D250-S252 VanDerWaalsContact OD1-CB 3.31Å; D250-S252 WeakPolarHBondContact OD1-CB 3.45Å; D250-S252 PolarHBondContact OD1-N 3.23Å; D250-S252 PolarHBondContact OD1-OG 2.82Å; D250-S252 PolarHBondContact OD2-OG 3.09Å
253	N	96.2	Very high	96.3	Very high	36 Å²	36	59.1 Å²	59.1	19%	0.193	29%	0.288	C	S	.	.	S	Bend	trans	-82.8	168.6	176.5	-63.7	-32	0	0	0	111.5	R221 D250 K261	R221-N253 PolarHBondContact NH1-O 2.83Å; D250-N253 PolarHBondContact O-N 2.78Å; N253-K261 PolarHBondContact ND2-NZ 3.37Å; N253-K261 VanDerWaalsContact ND2-NZ 3.12Å
254	G	96.5	Very high	96.3	Very high	21 Å²	21	58.7 Å²	58.7	22%	0.216	29%	0.286	C	S	.	.			trans	-71.1	152.5	169.8	0	0	0	0	0	111.7	L256 E257 N258	G254-L256 PolarHBondContact O-N 3.37Å; G254-E257 PolarHBondContact O-N 3.12Å; G254-N258 PolarHBondContact O-N 3.46Å; G254-N258 PolarHBondContact O-ND2 2.78Å
255	V	97.7	Very high	95.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.2	-46.6	179	173.6	0	0	0	0	111.2	Q178 I182 L215 P220 W249 E257 N258 L259	Q178-V255 HydrophobicContact CB-CB 4.22Å; Q178-V255 HydrophobicContact CB-CG2 3.86Å; Q178-V255 HydrophobicContact CG-CB 4.44Å; Q178-V255 HydrophobicContact CG-CG2 3.71Å; I182-V255 HydrophobicContact CD1-CG1 4Å; L215-V255 HydrophobicContact CD1-CG2 4.43Å; L215-V255 HydrophobicContact CD2-CG1 3.89Å; P220-V255 WeakPolarHBondContact O-CG2 3.22Å; W249-V255 HydrophobicContact CH2-CG1 4.29Å; V255-E257 VanDerWaalsContact C-N 3.33Å; V255-E257 PolarHBondContact O-N 3.48Å; V255-N258 PolarHBondContact O-N 3.32Å; V255-L259 HydrophobicContact CG1-CD1 3.96Å; V255-L259 HydrophobicContact CG1-CG 4.26Å; V255-L259 VanDerWaalsContact O-CG 3.32Å; V255-L259 WeakPolarHBondContact O-CG 3.37Å; V255-L259 PolarHBondContact O-N 3.43Å
256	L	97.2	Very high	95.7	Very high	15 Å²	15	56.1 Å²	56.1	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-58.4	-45	178.7	177.7	64.1	0	0	0	112	I182 F185 A186 G254 N258 L259 Q260 L267	I182-L256 HydrophobicContact CG1-CB 4.16Å; F185-L256 HydrophobicContact CB-CD2 3.55Å; F185-L256 HydrophobicContact CD2-CD2 4.01Å; F185-L256 HydrophobicContact CG-CD2 4.22Å; A186-L256 HydrophobicContact CB-CD1 4.06Å; G254-L256 PolarHBondContact O-N 3.37Å; L256-N258 VanDerWaalsContact C-N 3.32Å; L256-N258 PolarHBondContact O-N 2.96Å; L256-L259 WeakPolarHBondContact O-CB 2.84Å; L256-L259 PolarHBondContact O-N 3.41Å; L256-L259 VanDerWaalsContact O-N 3.12Å; L256-Q260 HydrophobicContact CD1-CG 4.41Å; L256-Q260 WeakPolarHBondContact O-CG 3.36Å; L256-Q260 PolarHBondContact O-N 3.05Å; L256-L267 HydrophobicContact CD1-CD2 3.97Å
257	E	96.5	Very high	95.6	Very high	78 Å²	78	53.5 Å²	53.5	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-61.5	-42.8	178.5	-172.4	-168.6	161.2	0	0	111.2	G254 V255 Q260 K261	G254-E257 PolarHBondContact O-N 3.12Å; V255-E257 VanDerWaalsContact C-N 3.33Å; V255-E257 PolarHBondContact O-N 3.48Å; E257-Q260 PolarHBondContact O-N 3.27Å; E257-K261 HydrophobicContact CG-CD 4.42Å; E257-K261 WeakPolarHBondContact O-CG 3.41Å; E257-K261 PolarHBondContact O-N 2.83Å; E257-K261 WeakPolarHBondContact OE1-CE 3.37Å; E257-K261 IonicContact OE1-NZ 3.62Å; E257-K261 PolarHBondContact OE1-NZ 2.93Å
258	N	97.5	Very high	95.4	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.011	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-39.3	174.2	-77.3	-37.3	0	0	0	111.9	W249 D250 G254 V255 L256 K261 L262	W249-N258 HydrophobicContact CD2-CB 3.88Å; W249-N258 HydrophobicContact CE3-CB 3.6Å; W249-N258 HydrophobicContact CH2-CB 3.52Å; W249-N258 HydrophobicContact CZ2-CB 3.81Å; W249-N258 HydrophobicContact CZ3-CB 3.42Å; W249-N258 VanDerWaalsContact CZ3-CB 3.42Å; D250-N258 PolarHBondContact N-OD1 3.32Å; D250-N258 PolarHBondContact O-ND2 3.42Å; G254-N258 PolarHBondContact O-N 3.46Å; G254-N258 PolarHBondContact O-ND2 2.78Å; V255-N258 PolarHBondContact O-N 3.32Å; L256-N258 VanDerWaalsContact C-N 3.32Å; L256-N258 PolarHBondContact O-N 2.96Å; N258-K261 PolarHBondContact O-N 2.94Å; N258-L262 WeakPolarHBondContact O-CB 3.29Å; N258-L262 PolarHBondContact O-N 3.4Å
259	L	97.4	Very high	95.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-41.5	175.6	-68.6	170.8	0	0	0	111.9	I182 L203 M211 V213 I226 W249 V255 L256 L262 L263 L267	I182-L259 HydrophobicContact CD1-CD1 4.31Å; L203-L259 HydrophobicContact CD1-CD1 4.25Å; M211-L259 HydrophobicContact CE-CD2 4.08Å; V213-L259 HydrophobicContact CG1-CD1 4.26Å; V213-L259 HydrophobicContact CG1-CD2 4.5Å; V213-L259 HydrophobicContact CG2-CD1 4.04Å; V213-L259 HydrophobicContact CG2-CD2 4.06Å; I226-L259 HydrophobicContact CD1-CD2 4.11Å; W249-L259 HydrophobicContact CH2-CD2 4.25Å; W249-L259 HydrophobicContact CH2-CG 4.34Å; W249-L259 HydrophobicContact CZ3-CD2 4.15Å; W249-L259 HydrophobicContact CZ3-CG 4.47Å; V255-L259 HydrophobicContact CG1-CD1 3.96Å; V255-L259 HydrophobicContact CG1-CG 4.26Å; V255-L259 VanDerWaalsContact O-CG 3.32Å; V255-L259 WeakPolarHBondContact O-CG 3.37Å; V255-L259 PolarHBondContact O-N 3.43Å; L256-L259 WeakPolarHBondContact O-CB 2.84Å; L256-L259 PolarHBondContact O-N 3.41Å; L256-L259 VanDerWaalsContact O-N 3.12Å; L259-L262 WeakPolarHBondContact O-CB 3.25Å; L259-L262 PolarHBondContact O-N 3.01Å; L259-L263 PolarHBondContact O-N 2.94Å; L259-L267 HydrophobicContact CB-CD2 4.14Å
260	Q	96.1	Very high	94.8	Very high	57 Å²	57	47 Å²	47	27%	0.266	27%	0.267	S	S	.	.	H	α-helix	trans	-62	-43.5	175.2	-72.2	173.6	-41.2	0	0	111.6	L256 E257 L263 D264 G265 L267 E269	L256-Q260 HydrophobicContact CD1-CG 4.41Å; L256-Q260 WeakPolarHBondContact O-CG 3.36Å; L256-Q260 PolarHBondContact O-N 3.05Å; E257-Q260 PolarHBondContact O-N 3.27Å; Q260-L263 CarbonylContact O-C 3.59Å; Q260-L263 PolarHBondContact O-N 3.17Å; Q260-D264 PolarHBondContact O-N 3.27Å; Q260-G265 PolarHBondContact O-N 3.05Å; Q260-L267 HydrophobicContact CG-CD2 4.1Å; Q260-E269 PolarHBondContact NE2-OE1 3.47Å
261	K	95.7	Very high	94.3	Very high	96 Å²	96	51.4 Å²	51.4	42%	0.417	29%	0.291	S	S	.	.	H	α-helix	trans	-63.2	-43.1	173.1	-73.9	167.1	172.3	167	0	111.7	N245 N253 E257 N258 L263 D264	N245-K261 PolarHBondContact ND2-O 3.36Å; N253-K261 PolarHBondContact ND2-NZ 3.37Å; N253-K261 VanDerWaalsContact ND2-NZ 3.12Å; E257-K261 HydrophobicContact CG-CD 4.42Å; E257-K261 WeakPolarHBondContact O-CG 3.41Å; E257-K261 PolarHBondContact O-N 2.83Å; E257-K261 WeakPolarHBondContact OE1-CE 3.37Å; E257-K261 IonicContact OE1-NZ 3.62Å; E257-K261 PolarHBondContact OE1-NZ 2.93Å; N258-K261 PolarHBondContact O-N 2.94Å; K261-L263 VanDerWaalsContact C-N 3.3Å; K261-L263 PolarHBondContact O-N 3.36Å; K261-D264 PolarHBondContact O-N 3.45Å
262	L	96.3	Very high	93.7	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-41.8	-179.9	-169.5	69.6	0	0	0	111.1	I226 L241 V242 N245 L246 W249 N258 L259	I226-L262 HydrophobicContact CD1-CD2 3.46Å; I226-L262 VanDerWaalsContact CD1-CD2 3.46Å; L241-L262 CarbonylContact C-O 3.56Å; V242-L262 HydrophobicContact CB-CD1 4.39Å; V242-L262 HydrophobicContact CB-CD2 4.45Å; V242-L262 HydrophobicContact CB-CG 4.28Å; V242-L262 HydrophobicContact CG1-CD1 4.21Å; V242-L262 HydrophobicContact CG1-CD2 4.17Å; V242-L262 HydrophobicContact CG1-CG 4.35Å; V242-L262 HydrophobicContact CG2-CD2 3.85Å; V242-L262 HydrophobicContact CG2-CG 3.87Å; N245-L262 HydrophobicContact CB-CD1 4.09Å; N245-L262 PolarHBondContact ND2-O 2.96Å; L246-L262 HydrophobicContact CD1-CD1 4.13Å; W249-L262 HydrophobicContact CZ3-CD2 4.41Å; N258-L262 WeakPolarHBondContact O-CB 3.29Å; N258-L262 PolarHBondContact O-N 3.4Å; L259-L262 WeakPolarHBondContact O-CB 3.25Å; L259-L262 PolarHBondContact O-N 3.01Å
263	L	96.2	Very high	93	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	4.6	178.7	-63.6	-178.5	0	0	0	114.3	L205 M211 F228 Y238 V242 L259 Q260 K261 G265 A266 L267	L205-L263 HydrophobicContact CD2-CD1 3.77Å; M211-L263 HydrophobicContact CE-CD1 3.56Å; M211-L263 HydrophobicContact SD-CD1 3.89Å; M211-L263 HydrophobicContact SD-CD2 4.5Å; F228-L263 HydrophobicContact CE1-CD2 4.34Å; F228-L263 HydrophobicContact CZ-CD2 4.18Å; Y238-L263 HydrophobicContact CD1-CD2 4.09Å; V242-L263 HydrophobicContact CG2-CD2 4.11Å; L259-L263 PolarHBondContact O-N 2.94Å; Q260-L263 CarbonylContact O-C 3.59Å; Q260-L263 PolarHBondContact O-N 3.17Å; K261-L263 VanDerWaalsContact C-N 3.3Å; K261-L263 PolarHBondContact O-N 3.36Å; L263-G265 VanDerWaalsContact C-N 3.26Å; L263-G265 PolarHBondContact O-N 3.27Å; L263-A266 HydrophobicContact CB-CB 4.38Å; L263-A266 WeakPolarHBondContact O-CB 3.24Å; L263-A266 PolarHBondContact O-N 2.94Å; L263-L267 HydrophobicContact CB-CB 4.34Å; L263-L267 HydrophobicContact CD1-CB 3.83Å; L263-L267 HydrophobicContact CD1-CD1 4.09Å; L263-L267 HydrophobicContact CD1-CG 4.41Å
264	D	93.8	Very high	92.4	Very high	108 Å²	108	49.5 Å²	49.5	58%	0.578	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	43.8	174	-157.9	18.7	0	0	0	113	L241 R244 Q260 K261 A266	L241-D264 HydrophobicContact CD2-CB 3.8Å; R244-D264 IonicContact NH2-OD2 3.9Å; R244-D264 PolarHBondContact NH2-OD2 2.96Å; Q260-D264 PolarHBondContact O-N 3.27Å; K261-D264 PolarHBondContact O-N 3.45Å; D264-A266 VanDerWaalsContact C-N 3.3Å; D264-A266 PolarHBondContact O-N 3.12Å
265	G	88.5	Confident	91.7	Very high	66 Å²	66	56.6 Å²	56.6	68%	0.68	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	2.9	-177.5	0	0	0	0	0	115.6	Q260 L263 L267	Q260-G265 PolarHBondContact O-N 3.05Å; L263-G265 VanDerWaalsContact C-N 3.26Å; L263-G265 PolarHBondContact O-N 3.27Å; G265-L267 PolarHBondContact O-N 3.12Å
266	A	91.5	Very high	91	Very high	35 Å²	35	60.8 Å²	60.8	29%	0.289	34%	0.34	S	S	.	.			trans	-82.3	3.8	176.5	0	0	0	0	0	114.1	Y238 L241 L263 D264 P268	Y238-A266 HydrophobicContact CE1-CB 3.99Å; L241-A266 HydrophobicContact CD1-CB 4.14Å; L263-A266 HydrophobicContact CB-CB 4.38Å; L263-A266 WeakPolarHBondContact O-CB 3.24Å; L263-A266 PolarHBondContact O-N 2.94Å; D264-A266 VanDerWaalsContact C-N 3.3Å; D264-A266 PolarHBondContact O-N 3.12Å; A266-P268 WeakPolarHBondContact O-CD 3.04Å
267	L	93.1	Very high	90.3	Very high	10 Å²	10	64.2 Å²	64.2	5%	0.052	36%	0.355	C	S	.	.	S	Bend	trans	-90.2	113.2	170.7	-176.1	60.6	0	0	0	108.7	L203 L205 M211 L256 L259 Q260 L263 G265	L203-L267 HydrophobicContact CB-CD1 4.24Å; L203-L267 HydrophobicContact CD1-CD1 4.11Å; L203-L267 HydrophobicContact CD1-CD2 4.48Å; L205-L267 HydrophobicContact CD2-CD1 3.75Å; M211-L267 HydrophobicContact CE-CD1 4.29Å; L256-L267 HydrophobicContact CD1-CD2 3.97Å; L259-L267 HydrophobicContact CB-CD2 4.14Å; Q260-L267 HydrophobicContact CG-CD2 4.1Å; L263-L267 HydrophobicContact CB-CB 4.34Å; L263-L267 HydrophobicContact CD1-CB 3.83Å; L263-L267 HydrophobicContact CD1-CD1 4.09Å; L263-L267 HydrophobicContact CD1-CG 4.41Å; G265-L267 PolarHBondContact O-N 3.12Å
268	P	90.4	Very high	89.6	Confident	28 Å²	28	60.9 Å²	60.9	18%	0.182	34%	0.34	C	S	.	.			trans	-61.1	137.8	176.8	-23.7	35.7	0	0	0	112.2	F204 A266 C273	F204-P268 HydrophobicContact CD1-CG 4.16Å; F204-P268 WeakPolarHBondContact O-CD 3.19Å; A266-P268 WeakPolarHBondContact O-CD 3.04Å; P268-C273 WeakPolarHBondContact CB-SG 3.33Å
269	E	91.1	Very high	88.9	Confident	104 Å²	104	66 Å²	66	49%	0.486	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-86.9	146.5	170.3	-63.9	-175.8	171.9	0	0	109.5	F185 C187 Q260 D271 S272 C273	F185-E269 WeakPolarHBondContact O-CA 3.18Å; C187-E269 VanDerWaalsContact SG-C 3.6Å; C187-E269 PolarHBondContact SG-O 2.86Å; Q260-E269 PolarHBondContact NE2-OE1 3.47Å; E269-D271 VanDerWaalsContact C-N 3.28Å; E269-D271 PolarHBondContact O-N 2.9Å; E269-S272 PolarHBondContact N-OG 3.46Å; E269-S272 VanDerWaalsContact N-OG 3.15Å; E269-S272 CarbonylContact O-C 3.59Å; E269-S272 WeakPolarHBondContact O-CA 3.2Å; E269-S272 PolarHBondContact O-N 3.22Å; E269-S272 PolarHBondContact O-OG 3.46Å; E269-C273 PolarHBondContact O-N 3.1Å; E269-C273 VanDerWaalsContact O-N 3.1Å
270	L	89.2	Confident	88.2	Confident	63 Å²	63	70.4 Å²	70.4	33%	0.33	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-54.1	-44.2	-175.5	-173.8	63.1	0	0	0	112.4	F185 C187 S272 C273 L278	F185-L270 PolarHBondContact O-N 3.39Å; C187-L270 VanDerWaalsContact SG-CA 3.53Å; L270-S272 PolarHBondContact O-N 2.86Å; L270-C273 PolarHBondContact O-N 2.83Å; L270-L278 HydrophobicContact CD1-CD2 3.97Å
271	D	86.4	Confident	87.5	Confident	161 Å²	161	68.4 Å²	68.4	86%	0.861	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-66.6	-17.1	178.5	-67.3	-14.9	0	0	0	113.8	E269	E269-D271 VanDerWaalsContact C-N 3.28Å; E269-D271 PolarHBondContact O-N 2.9Å
272	S	84.2	Confident	86.7	Confident	84 Å²	84	68.5 Å²	68.5	59%	0.587	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-101.6	-11.3	-180	71.7	0	0	0	0	113.7	E269 L270	E269-S272 PolarHBondContact N-OG 3.46Å; E269-S272 VanDerWaalsContact N-OG 3.15Å; E269-S272 CarbonylContact O-C 3.59Å; E269-S272 WeakPolarHBondContact O-CA 3.2Å; E269-S272 PolarHBondContact O-N 3.22Å; E269-S272 PolarHBondContact O-OG 3.46Å; L270-S272 PolarHBondContact O-N 2.86Å
273	C	81.5	Confident	85.7	Confident	21 Å²	21	73.2 Å²	73.2	14%	0.142	40%	0.404	C	S	.	.	S	Bend	trans	-73.6	134.5	179.7	-87.6	0	0	0	0	110.8	C187 P268 E269 L270 E275	C187-C273 HydrophobicContact CB-CB 4.25Å; C187-C273 WeakPolarHBondContact CB-SG 3.32Å; C187-C273 WeakPolarHBondContact SG-CB 3.44Å; C187-C273 CovalentContact SG-SG 2.03Å; C187-C273 PolarHBondContact SG-SG 3.12Å; P268-C273 WeakPolarHBondContact CB-SG 3.33Å; E269-C273 PolarHBondContact O-N 3.1Å; E269-C273 VanDerWaalsContact O-N 3.1Å; L270-C273 PolarHBondContact O-N 2.83Å; C273-E275 PolarHBondContact O-N 3.16Å
274	D	82.6	Confident	84.6	Confident	87 Å²	87	77.1 Å²	77.1	47%	0.465	43%	0.428	S	S	.	.			trans	-66.7	122.8	169.4	-172.7	-57.3	0	0	0	108.9	V276 E277 L278	D274-V276 PolarHBondContact O-N 2.76Å; D274-V276 WeakPolarHBondContact OD1-CA 3.25Å; D274-V276 WeakPolarHBondContact OD1-CB 3.48Å; D274-V276 PolarHBondContact OD1-N 3.06Å; D274-E277 HydrophobicContact CB-CB 4.08Å; D274-E277 HydrophobicContact CB-CG 3.92Å; D274-E277 PolarHBondContact O-N 3.27Å; D274-E277 VanDerWaalsContact O-N 3.12Å; D274-E277 PolarHBondContact OD1-N 2.87Å; D274-L278 PolarHBondContact O-N 2.84Å
275	E	82.5	Confident	83.3	Confident	170 Å²	170	75.7 Å²	75.7	79%	0.794	43%	0.426	S	S	*	.	H	α-helix	trans	-55.9	-35.6	-178.6	-67.8	-177.4	172.7	0	0	111.9	C273 E279	C273-E275 PolarHBondContact O-N 3.16Å; E275-E279 VanDerWaalsContact O-CB 3.24Å; E275-E279 WeakPolarHBondContact O-CB 3.44Å; E275-E279 PolarHBondContact O-N 2.81Å
276	V	83.7	Confident	82.6	Confident	87 Å²	87	75.1 Å²	75.1	53%	0.527	41%	0.407	S	S	.	.	H	α-helix	trans	-71.7	-41.5	179.6	-176.9	0	0	0	0	110.5	D274 L278 N280	D274-V276 PolarHBondContact O-N 2.76Å; D274-V276 WeakPolarHBondContact OD1-CA 3.25Å; D274-V276 WeakPolarHBondContact OD1-CB 3.48Å; D274-V276 PolarHBondContact OD1-N 3.06Å; V276-L278 VanDerWaalsContact C-N 3.35Å; V276-N280 VanDerWaalsContact O-CB 3.28Å; V276-N280 WeakPolarHBondContact O-CB 3.37Å; V276-N280 PolarHBondContact O-N 3.42Å; V276-N280 PolarHBondContact O-ND2 2.88Å; V276-N280 VanDerWaalsContact O-ND2 3.08Å
277	E	82.4	Confident	82.4	Confident	87 Å²	87	76.2 Å²	76.2	41%	0.407	41%	0.408	S	S	.	.	H	α-helix	trans	-64.2	-41.6	176.1	-69.1	-170.9	173.5	0	0	111.5	F204 D274 N280 A281	F204-E277 HydrophobicContact CZ-CB 4.03Å; D274-E277 HydrophobicContact CB-CB 4.08Å; D274-E277 HydrophobicContact CB-CG 3.92Å; D274-E277 PolarHBondContact O-N 3.27Å; D274-E277 VanDerWaalsContact O-N 3.12Å; D274-E277 PolarHBondContact OD1-N 2.87Å; E277-N280 PolarHBondContact O-N 2.95Å; E277-A281 WeakPolarHBondContact O-CB 3.44Å; E277-A281 PolarHBondContact O-N 2.85Å
278	L	80.6	Confident	82.3	Confident	9 Å²	9	75.7 Å²	75.7	5%	0.047	41%	0.406	C	S	.	.	H	α-helix	trans	-69.6	-41.5	178.8	-169.3	60.6	0	0	0	111.9	C187 F204 L270 D274 V276 N280 A281 W282	C187-L278 HydrophobicContact CB-CD1 3.86Å; C187-L278 HydrophobicContact CB-CD2 4.42Å; F204-L278 HydrophobicContact CB-CD1 4.17Å; L270-L278 HydrophobicContact CD1-CD2 3.97Å; D274-L278 PolarHBondContact O-N 2.84Å; V276-L278 VanDerWaalsContact C-N 3.35Å; L278-N280 VanDerWaalsContact C-N 3.32Å; L278-N280 PolarHBondContact O-N 3.34Å; L278-A281 WeakPolarHBondContact O-CB 3.24Å; L278-A281 PolarHBondContact O-N 3.29Å; L278-W282 HydrophobicContact CD2-CH2 3.86Å; L278-W282 HydrophobicContact CD2-CZ2 3.86Å; L278-W282 HydrophobicContact CD2-CZ3 4.48Å; L278-W282 HydrophobicContact CG-CD2 4.36Å; L278-W282 HydrophobicContact CG-CH2 4.12Å; L278-W282 HydrophobicContact CG-CZ2 3.97Å; L278-W282 HydrophobicContact CG-CZ3 4.39Å; L278-W282 PolarHBondContact O-N 2.81Å
279	E	83.9	Confident	82.4	Confident	110 Å²	110	78.4 Å²	78.4	51%	0.514	42%	0.418	S	S	.	.	H	α-helix	trans	-62.4	-40.9	173.8	-175.2	175.7	-164.9	0	0	111.4	E275 W282 N283	E275-E279 VanDerWaalsContact O-CB 3.24Å; E275-E279 WeakPolarHBondContact O-CB 3.44Å; E275-E279 PolarHBondContact O-N 2.81Å; E279-W282 WeakPolarHBondContact O-CB 3.24Å; E279-W282 PolarHBondContact O-N 2.88Å; E279-N283 WeakPolarHBondContact O-CB 3.4Å; E279-N283 VanDerWaalsContact O-CG 3.3Å; E279-N283 PolarHBondContact O-N 2.82Å; E279-N283 PolarHBondContact O-ND2 3.1Å; E279-N283 VanDerWaalsContact O-ND2 3.11Å
280	N	83	Confident	82.5	Confident	91 Å²	91	76.6 Å²	76.6	49%	0.487	41%	0.411	S	S	.	.	H	α-helix	trans	-62.4	-43.9	172.8	-73.8	-28.5	0	0	0	111.2	V276 E277 L278 W282 N283 T284	V276-N280 VanDerWaalsContact O-CB 3.28Å; V276-N280 WeakPolarHBondContact O-CB 3.37Å; V276-N280 PolarHBondContact O-N 3.42Å; V276-N280 PolarHBondContact O-ND2 2.88Å; V276-N280 VanDerWaalsContact O-ND2 3.08Å; E277-N280 PolarHBondContact O-N 2.95Å; L278-N280 VanDerWaalsContact C-N 3.32Å; L278-N280 PolarHBondContact O-N 3.34Å; N280-W282 VanDerWaalsContact C-N 3.3Å; N280-W282 PolarHBondContact O-N 3.18Å; N280-N283 CarbonylContact O-C 3.17Å; N280-N283 PolarHBondContact O-N 3.21Å; N280-N283 VanDerWaalsContact O-N 3.1Å; N280-T284 WeakPolarHBondContact O-CB 3.39Å; N280-T284 PolarHBondContact O-N 2.98Å; N280-T284 PolarHBondContact O-OG1 3.05Å
281	A	80.7	Confident	82.7	Confident	16 Å²	16	76 Å²	76	13%	0.132	41%	0.412	C	S	.	.	H	α-helix	trans	-61.3	-39.1	176.6	0	0	0	0	0	111.7	I189 F204 E277 L278 N283	I189-A281 HydrophobicContact CD1-CB 3.96Å; I189-A281 HydrophobicContact CG1-CB 4.08Å; F204-A281 HydrophobicContact CD2-CB 3.68Å; F204-A281 HydrophobicContact CE2-CB 4.05Å; E277-A281 WeakPolarHBondContact O-CB 3.44Å; E277-A281 PolarHBondContact O-N 2.85Å; L278-A281 WeakPolarHBondContact O-CB 3.24Å; L278-A281 PolarHBondContact O-N 3.29Å; A281-N283 VanDerWaalsContact C-N 3.28Å; A281-N283 PolarHBondContact O-N 3.28Å
282	W	78.4	Confident	82.9	Confident	98 Å²	98	75.9 Å²	75.9	37%	0.371	41%	0.406	S	S	.	.	H	α-helix	trans	-66.4	-25.4	174.3	-80.8	-26.1	0	0	0	114.6	V188 I189 K192 L278 E279 N280	V188-W282 PolarHBondContact O-NE1 2.92Å; I189-W282 PolarHBondContact O-NE1 2.79Å; K192-W282 VanDerWaalsContact CE-O 3.24Å; K192-W282 WeakPolarHBondContact CE-O 3.45Å; K192-W282 PolarHBondContact NZ-O 3.27Å; L278-W282 HydrophobicContact CD2-CH2 3.86Å; L278-W282 HydrophobicContact CD2-CZ2 3.86Å; L278-W282 HydrophobicContact CD2-CZ3 4.48Å; L278-W282 HydrophobicContact CG-CD2 4.36Å; L278-W282 HydrophobicContact CG-CH2 4.12Å; L278-W282 HydrophobicContact CG-CZ2 3.97Å; L278-W282 HydrophobicContact CG-CZ3 4.39Å; L278-W282 PolarHBondContact O-N 2.81Å; E279-W282 WeakPolarHBondContact O-CB 3.24Å; E279-W282 PolarHBondContact O-N 2.88Å; N280-W282 VanDerWaalsContact C-N 3.3Å; N280-W282 PolarHBondContact O-N 3.18Å
283	N	76.9	Confident	83.2	Confident	102 Å²	102	74.5 Å²	74.5	55%	0.545	40%	0.395	S	S	.	.	H	α-helix	trans	-107.4	-4.6	-175.9	-66.6	-30.7	0	0	0	112.9	E279 N280 A281 S285	E279-N283 WeakPolarHBondContact O-CB 3.4Å; E279-N283 VanDerWaalsContact O-CG 3.3Å; E279-N283 PolarHBondContact O-N 2.82Å; E279-N283 PolarHBondContact O-ND2 3.1Å; E279-N283 VanDerWaalsContact O-ND2 3.11Å; N280-N283 CarbonylContact O-C 3.17Å; N280-N283 PolarHBondContact O-N 3.21Å; N280-N283 VanDerWaalsContact O-N 3.1Å; A281-N283 VanDerWaalsContact C-N 3.28Å; A281-N283 PolarHBondContact O-N 3.28Å; N283-S285 PolarHBondContact O-N 2.99Å
284	T	71.9	Confident	83.3	Confident	83 Å²	83	78.2 Å²	78.2	51%	0.509	41%	0.414	S	S	.	.			trans	-71.9	100.8	177.5	-64.6	0	0	0	0	108.8	N280 L286	N280-T284 WeakPolarHBondContact O-CB 3.39Å; N280-T284 PolarHBondContact O-N 2.98Å; N280-T284 PolarHBondContact O-OG1 3.05Å; T284-L286 HydrophobicContact CG2-CD2 4.45Å; T284-L286 PolarHBondContact O-N 3.25Å
285	S	66.4	Low	83.5	Confident	77 Å²	77	76.8 Å²	76.8	54%	0.538	41%	0.408	S	S	.	.			trans	-70.6	120.9	167	71.1	0	0	0	0	108.7	N283 D287	N283-S285 PolarHBondContact O-N 2.99Å; S285-D287 VanDerWaalsContact CB-OD2 3.27Å; S285-D287 WeakPolarHBondContact CB-OD2 3.35Å; S285-D287 PolarHBondContact O-N 3.14Å; S285-D287 PolarHBondContact OG-OD2 3.09Å
286	L	74.7	Confident	83.7	Confident	55 Å²	55	69.7 Å²	69.7	29%	0.288	38%	0.376	S	S	.	.			trans	-80.5	54.5	171.9	-70.6	172.9	0	0	0	109.4	I229 T284 A302 F305 A312	I229-L286 HydrophobicContact CG2-CD1 4.09Å; T284-L286 HydrophobicContact CG2-CD2 4.45Å; T284-L286 PolarHBondContact O-N 3.25Å; L286-A302 VanDerWaalsContact O-CB 3.28Å; L286-A302 WeakPolarHBondContact O-CB 3.32Å; L286-F305 HydrophobicContact CD1-CZ 4.43Å; L286-F305 HydrophobicContact CD2-CE1 3.5Å; L286-F305 HydrophobicContact CD2-CZ 3.44Å; L286-F305 VanDerWaalsContact CD2-CZ 3.44Å; L286-A312 HydrophobicContact CD2-CB 4.27Å
287	D	85.7	Confident	84	Confident	57 Å²	57	71.3 Å²	71.3	31%	0.305	39%	0.391	S	S	.	.			trans	-78.2	133	-179.9	-63	-31	0	0	0	109.4	S285 L289 D294	S285-D287 VanDerWaalsContact CB-OD2 3.27Å; S285-D287 WeakPolarHBondContact CB-OD2 3.35Å; S285-D287 PolarHBondContact O-N 3.14Å; S285-D287 PolarHBondContact OG-OD2 3.09Å; D287-L289 PolarHBondContact O-N 2.89Å; D287-L289 VanDerWaalsContact O-N 3.14Å; D287-D294 PolarHBondContact OD1-N 3.49Å
288	C	92.2	Very high	84.2	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	40%	0.399	C	S	.	.			trans	-62.9	120.5	172.9	172.8	0	0	0	0	109.5	I290 C291 Q292 C293 A302 A312 Y313 H314	C288-I290 PolarHBondContact O-N 3.04Å; C288-I290 PolarHBondContact SG-N 3.45Å; C288-C291 VanDerWaalsContact CB-SG 3.56Å; C288-C291 PolarHBondContact O-N 3.17Å; C288-Q292 WeakPolarHBondContact O-CA 3.23Å; C288-Q292 PolarHBondContact O-N 3.32Å; C288-C293 PolarHBondContact N-O 2.84Å; C288-A302 HydrophobicContact CB-CB 3.74Å; C288-A312 WeakPolarHBondContact CA-O 3.24Å; C288-Y313 VanDerWaalsContact SG-CA 3.6Å; C288-H314 VanDerWaalsContact CB-CE1 3.46Å; C288-H314 WeakPolarHBondContact CB-CE1 3.44Å; C288-H314 WeakPolarHBondContact CB-ND1 3.21Å; C288-H314 PolarHBondContact SG-N 2.91Å; C288-H314 VanDerWaalsContact SG-N 3.36Å
289	L	91.7	Very high	84.5	Confident	85 Å²	85	74.6 Å²	74.6	45%	0.445	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-7.8	-179.3	-67.4	-168.2	0	0	0	115.1	D287 S311 A312 Y313 H341	D287-L289 PolarHBondContact O-N 2.89Å; D287-L289 VanDerWaalsContact O-N 3.14Å; L289-S311 WeakPolarHBondContact CD1-OG 3.35Å; L289-A312 PolarHBondContact N-O 2.91Å; L289-A312 VanDerWaalsContact N-O 3.13Å; L289-Y313 HydrophobicContact CB-CD1 4.31Å; L289-Y313 HydrophobicContact CB-CE1 3.73Å; L289-H341 HydrophobicContact CD1-CB 3.99Å
290	I	93.3	Very high	84.6	Confident	66 Å²	66	74.8 Å²	74.8	34%	0.338	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-48.8	178.2	-67.2	166.2	0	0	0	111.4	C288 Y313 C317 I318 W321 P340	C288-I290 PolarHBondContact O-N 3.04Å; C288-I290 PolarHBondContact SG-N 3.45Å; I290-Y313 HydrophobicContact CD1-CD1 3.69Å; I290-Y313 HydrophobicContact CD1-CE1 4.18Å; I290-Y313 HydrophobicContact CG1-CD1 3.78Å; I290-Y313 HydrophobicContact CG1-CE1 4.01Å; I290-C317 HydrophobicContact CB-CB 4.01Å; I290-C317 HydrophobicContact CD1-CB 3.93Å; I290-C317 HydrophobicContact CG2-CB 4.06Å; I290-I318 HydrophobicContact CD1-CB 4.32Å; I290-I318 HydrophobicContact CD1-CD1 4.09Å; I290-W321 HydrophobicContact CD1-CB 4.02Å; I290-P340 HydrophobicContact CD1-CG 4.11Å; I290-P340 HydrophobicContact CG1-CG 4.21Å
291	C	93	Very high	84.8	Confident	51 Å²	51	74.4 Å²	74.4	35%	0.345	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-11.3	-178.7	60.5	0	0	0	0	113.7	C288 C293 H314	C288-C291 VanDerWaalsContact CB-SG 3.56Å; C288-C291 PolarHBondContact O-N 3.17Å; C291-C293 PolarHBondContact O-N 3.41Å; C291-H314 PolarHBondContact SG-CE1 3.48Å; C291-H314 PolarHBondContact SG-ND1 2.92Å
292	Q	91.3	Very high	85.2	Confident	158 Å²	158	73.7 Å²	73.7	74%	0.738	41%	0.412	S	S	*	.			trans	58.3	30.7	-176.6	-55.6	173.5	13.3	0	0	112.9	C288	C288-Q292 WeakPolarHBondContact O-CA 3.23Å; C288-Q292 PolarHBondContact O-N 3.32Å
293	C	90.4	Very high	85.6	Confident	54 Å²	54	73 Å²	73	37%	0.365	42%	0.416	S	S	.	.			trans	-114.8	148.5	172.6	-53.8	0	0	0	0	109.6	C288 C291 V295 H314	C288-C293 PolarHBondContact N-O 2.84Å; C291-C293 PolarHBondContact O-N 3.41Å; C293-V295 WeakPolarHBondContact CB-O 3.32Å; C293-H314 PolarHBondContact O-CE1 3.37Å
294	D	83.5	Confident	86.2	Confident	99 Å²	99	69.5 Å²	69.5	53%	0.529	40%	0.397	S	S	.	.	S	Bend	trans	-68.2	-45.2	167.2	57.7	-17.2	0	0	0	110.8	D287 I301 A302 H314	D287-D294 PolarHBondContact OD1-N 3.49Å; D294-I301 WeakPolarHBondContact O-CA 3.47Å; D294-A302 PolarHBondContact O-N 3.06Å; D294-H314 PolarHBondContact O-NE2 3.48Å
295	V	87.4	Confident	87.2	Confident	57 Å²	57	66.6 Å²	66.6	35%	0.345	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-118.3	133.1	-177.4	-172.3	0	0	0	0	110.3	C293 G299 R300 I301	C293-V295 WeakPolarHBondContact CB-O 3.32Å; V295-G299 VanDerWaalsContact CG1-CA 3.41Å; V295-R300 CarbonylContact C-O 3.5Å; V295-R300 VanDerWaalsContact CA-O 3.28Å; V295-R300 WeakPolarHBondContact CA-O 3.21Å; V295-I301 HydrophobicContact CG2-CG2 4.31Å
296	D	87.5	Confident	88.4	Confident	22 Å²	22	63 Å²	63	12%	0.118	35%	0.352	C	S	.	.			trans	-80.3	177.4	175.1	73.3	12.5	0	0	0	112.7	D298 G299 R300 H314	D296-D298 PolarHBondContact O-N 3.31Å; D296-D298 WeakPolarHBondContact OD1-CA 3.42Å; D296-D298 WeakPolarHBondContact OD1-CB 3.42Å; D296-D298 PolarHBondContact OD1-N 3.48Å; D296-G299 PolarHBondContact O-N 3.11Å; D296-G299 PolarHBondContact OD1-N 3Å; D296-R300 PolarHBondContact N-O 2.93Å; D296-R300 WeakPolarHBondContact OD1-CB 3.43Å; D296-R300 PolarHBondContact OD1-N 3.38Å; D296-H314 HydrophobicContact CB-CB 4.49Å; D296-H314 PolarHBondContact N-NE2 3.2Å
297	S	88.9	Confident	89.2	Confident	120 Å²	120	63.7 Å²	63.7	84%	0.839	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-17.4	179.3	58.6	0	0	0	0	114.4
298	D	87.4	Confident	89.4	Confident	109 Å²	109	63.4 Å²	63.4	58%	0.583	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	8.1	-179.2	-58.9	-27.4	0	0	0	111.7	D296 R300	D296-D298 PolarHBondContact O-N 3.31Å; D296-D298 WeakPolarHBondContact OD1-CA 3.42Å; D296-D298 WeakPolarHBondContact OD1-CB 3.42Å; D296-D298 PolarHBondContact OD1-N 3.48Å; D298-R300 HydrophobicContact CB-CG 4.35Å
299	G	85.3	Confident	89.4	Confident	57 Å²	57	65.1 Å²	65.1	59%	0.588	37%	0.37	S	S	*	.	S	Bend	trans	80.1	15.2	179.1	0	0	0	0	0	114.5	V295 D296	V295-G299 VanDerWaalsContact CG1-CA 3.41Å; D296-G299 PolarHBondContact O-N 3.11Å; D296-G299 PolarHBondContact OD1-N 3Å
300	R	86.4	Confident	89.2	Confident	113 Å²	113	63.7 Å²	63.7	43%	0.426	36%	0.361	S	S	.	.			trans	-96.2	142.7	-176.9	-54	175	-177.7	-168.1	-1.1	111.1	V295 D296 D298 H314 A352	V295-R300 CarbonylContact C-O 3.5Å; V295-R300 VanDerWaalsContact CA-O 3.28Å; V295-R300 WeakPolarHBondContact CA-O 3.21Å; D296-R300 PolarHBondContact N-O 2.93Å; D296-R300 WeakPolarHBondContact OD1-CB 3.43Å; D296-R300 PolarHBondContact OD1-N 3.38Å; D298-R300 HydrophobicContact CB-CG 4.35Å; R300-H314 PolarHBondContact O-CD2 3.02Å; R300-H314 PolarHBondContact O-NE2 3.34Å; R300-H314 VanDerWaalsContact O-NE2 3.1Å; R300-A352 PolarHBondContact NH1-OXT 3.09Å
301	I	86.8	Confident	89.1	Confident	83 Å²	83	61.2 Å²	61.2	43%	0.426	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-84.2	160.1	177.3	59.6	167.5	0	0	0	112.6	I229 D294 V295 D303 H314	I229-I301 HydrophobicContact CD1-CD1 4.46Å; D294-I301 WeakPolarHBondContact O-CA 3.47Å; V295-I301 HydrophobicContact CG2-CG2 4.31Å; I301-D303 VanDerWaalsContact C-N 3.35Å; I301-D303 HydrophobicContact CD1-CB 4.3Å; I301-D303 HydrophobicContact CG1-CB 4.17Å; I301-D303 PolarHBondContact O-N 3.25Å; I301-H314 PolarHBondContact O-CD2 3.15Å; I301-H314 VanDerWaalsContact O-CD2 3.3Å
302	A	89.5	Confident	89	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.008	34%	0.336	C	S	.	.			trans	-80.7	80	175.7	0	0	0	0	0	111.4	L286 C288 D294 A312 H314	L286-A302 VanDerWaalsContact O-CB 3.28Å; L286-A302 WeakPolarHBondContact O-CB 3.32Å; C288-A302 HydrophobicContact CB-CB 3.74Å; D294-A302 PolarHBondContact O-N 3.06Å; A302-A312 HydrophobicContact CB-CB 4.25Å; A302-H314 PolarHBondContact N-CD2 3.35Å; A302-H314 PolarHBondContact N-NE2 3.15Å
303	D	86.9	Confident	89.1	Confident	84 Å²	84	51.6 Å²	51.6	45%	0.449	30%	0.301	S	S	.	.			trans	-100.6	-2.9	-174.5	62.5	-7.5	0	0	0	114.5	I301 F305	I301-D303 VanDerWaalsContact C-N 3.35Å; I301-D303 HydrophobicContact CD1-CB 4.3Å; I301-D303 HydrophobicContact CG1-CB 4.17Å; I301-D303 PolarHBondContact O-N 3.25Å; D303-F305 WeakPolarHBondContact O-CD2 3.46Å; D303-F305 VanDerWaalsContact O-CE2 3.24Å; D303-F305 WeakPolarHBondContact O-CE2 3.28Å
304	L	90.7	Very high	89.3	Confident	29 Å²	29	49 Å²	49	15%	0.152	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	110.8	179.7	-164	158.2	0	0	0	110.6	A312 Y313 A315 I318 I346 V348	L304-A312 CarbonylContact O-C 3.55Å; L304-Y313 WeakPolarHBondContact CB-O 3.42Å; L304-Y313 PolarHBondContact N-O 3.4Å; L304-Y313 WeakPolarHBondContact O-CD2 3.28Å; L304-Y313 PolarHBondContact O-N 3.45Å; L304-A315 HydrophobicContact CD1-CB 4.47Å; L304-I318 HydrophobicContact CD1-CG2 3.81Å; L304-I318 HydrophobicContact CD2-CG2 4.1Å; L304-I318 HydrophobicContact CG-CG2 4.38Å; L304-I346 HydrophobicContact CD2-CD1 3.53Å; L304-I346 HydrophobicContact CD2-CG1 3.81Å; L304-V348 HydrophobicContact CD1-CB 3.75Å; L304-V348 HydrophobicContact CD1-CG2 3.54Å
305	F	92.2	Very high	89.7	Confident	22 Å²	22	45.5 Å²	45.5	10%	0.096	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	146.5	-176.9	-63.7	-98	0	0	0	112.7	I229 G230 P231 L286 D303 H310 S311 A312	I229-F305 HydrophobicContact CG2-CE2 3.6Å; I229-F305 HydrophobicContact CG2-CZ 3.61Å; G230-F305 VanDerWaalsContact C-CD2 3.49Å; G230-F305 WeakPolarHBondContact O-CD2 3.44Å; P231-F305 HydrophobicContact CB-CB 4.35Å; P231-F305 HydrophobicContact CG-CB 4.25Å; L286-F305 HydrophobicContact CD1-CZ 4.43Å; L286-F305 HydrophobicContact CD2-CE1 3.5Å; L286-F305 HydrophobicContact CD2-CZ 3.44Å; L286-F305 VanDerWaalsContact CD2-CZ 3.44Å; D303-F305 WeakPolarHBondContact O-CD2 3.46Å; D303-F305 VanDerWaalsContact O-CE2 3.24Å; D303-F305 WeakPolarHBondContact O-CE2 3.28Å; F305-H310 WeakPolarHBondContact CD1-O 3.34Å; F305-S311 CarbonylContact C-O 3.59Å; F305-S311 WeakPolarHBondContact CA-O 3.46Å; F305-A312 HydrophobicContact CD1-CB 4.11Å; F305-A312 HydrophobicContact CE1-CB 3.78Å; F305-A312 HydrophobicContact CZ-CB 4.21Å
306	C	92.3	Very high	90.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.256	C	S	.	.			trans	-74	125.1	163.6	-177.6	0	0	0	0	110.2	S308 C309 H310 S311 Y313 C339 C342 I346	C306-S308 PolarHBondContact O-N 3.35Å; C306-S308 PolarHBondContact SG-N 3.34Å; C306-C309 VanDerWaalsContact CB-SG 3.52Å; C306-H310 WeakPolarHBondContact O-CA 3.22Å; C306-H310 PolarHBondContact O-N 3.07Å; C306-H310 PolarHBondContact O-ND1 2.97Å; C306-S311 PolarHBondContact N-O 3.49Å; C306-Y313 HydrophobicContact CB-CE2 4.45Å; C306-C339 HydrophobicContact CB-CB 4.49Å; C306-C339 VanDerWaalsContact SG-SG 3.68Å; C306-C342 VanDerWaalsContact SG-SG 3.65Å; C306-I346 HydrophobicContact CB-CD1 3.99Å
307	D	91	Very high	90.4	Very high	70 Å²	70	43.3 Å²	43.3	37%	0.374	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-18.3	176.2	-82.8	-42.2	0	0	0	114.8	E232 S233 H310	E232-D307 PolarHBondContact N-OD1 3.2Å; S233-D307 WeakPolarHBondContact CB-OD1 3.36Å; S233-D307 PolarHBondContact N-OD1 3.21Å; S233-D307 PolarHBondContact OG-OD1 2.82Å; D307-H310 PolarHBondContact O-CE1 3.08Å; D307-H310 VanDerWaalsContact O-CE1 3.3Å
308	S	90.6	Very high	90.7	Very high	52 Å²	52	37.6 Å²	37.6	36%	0.364	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-29.6	-172.2	-61.1	0	0	0	0	116.4	C306 K344	C306-S308 PolarHBondContact O-N 3.35Å; C306-S308 PolarHBondContact SG-N 3.34Å; S308-K344 VanDerWaalsContact OG-CD 3.23Å; S308-K344 WeakPolarHBondContact OG-CD 3.41Å
309	C	90.7	Very high	91.1	Very high	35 Å²	35	33.1 Å²	33.1	24%	0.236	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	0.8	177.5	64.4	0	0	0	0	112.8	C306 S311 C339 C342	C306-C309 VanDerWaalsContact CB-SG 3.52Å; C309-S311 PolarHBondContact O-N 3.49Å; C309-S311 PolarHBondContact SG-OG 3.25Å; C309-C339 VanDerWaalsContact SG-SG 3.66Å; C309-C342 HydrophobicContact CB-CB 3.71Å; C309-C342 PolarHBondContact SG-SG 2.86Å
310	H	88.2	Confident	91.5	Very high	55 Å²	55	36.7 Å²	36.7	26%	0.255	19%	0.192	S	C	.	.			trans	58.5	15	174.5	-45.5	-46	0	0	0	114.7	N208 P231 F305 C306 D307	N208-H310 HydrophobicContact CB-CB 4.33Å; N208-H310 WeakPolarHBondContact OD1-CB 3.13Å; P231-H310 HydrophobicContact CG-CB 4.17Å; P231-H310 WeakPolarHBondContact CG-ND1 3.49Å; F305-H310 WeakPolarHBondContact CD1-O 3.34Å; C306-H310 WeakPolarHBondContact O-CA 3.22Å; C306-H310 PolarHBondContact O-N 3.07Å; C306-H310 PolarHBondContact O-ND1 2.97Å; D307-H310 PolarHBondContact O-CE1 3.08Å; D307-H310 VanDerWaalsContact O-CE1 3.3Å
311	S	90.1	Very high	91.9	Very high	15 Å²	15	36.9 Å²	36.9	11%	0.105	19%	0.192	C	C	.	.			trans	-67.2	134.7	171.8	-55.4	0	0	0	0	111.3	L289 F305 C306 C309 Y313 H341	L289-S311 WeakPolarHBondContact CD1-OG 3.35Å; F305-S311 CarbonylContact C-O 3.59Å; F305-S311 WeakPolarHBondContact CA-O 3.46Å; C306-S311 PolarHBondContact N-O 3.49Å; C309-S311 PolarHBondContact O-N 3.49Å; C309-S311 PolarHBondContact SG-OG 3.25Å; S311-Y313 WeakPolarHBondContact O-CD2 3.19Å; S311-Y313 VanDerWaalsContact O-CE2 3.25Å; S311-Y313 WeakPolarHBondContact O-CE2 3.36Å; S311-H341 PolarHBondContact OG-ND1 3.08Å; S311-H341 VanDerWaalsContact OG-ND1 3.12Å
312	A	92.4	Very high	92.3	Very high	7 Å²	7	32.9 Å²	32.9	6%	0.058	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	148.4	-180	0	0	0	0	0	112.7	L286 C288 L289 A302 L304 F305	L286-A312 HydrophobicContact CD2-CB 4.27Å; C288-A312 WeakPolarHBondContact CA-O 3.24Å; L289-A312 PolarHBondContact N-O 2.91Å; L289-A312 VanDerWaalsContact N-O 3.13Å; A302-A312 HydrophobicContact CB-CB 4.25Å; L304-A312 CarbonylContact O-C 3.55Å; F305-A312 HydrophobicContact CD1-CB 4.11Å; F305-A312 HydrophobicContact CE1-CB 3.78Å; F305-A312 HydrophobicContact CZ-CB 4.21Å
313	Y	93.9	Very high	92.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	146.7	177	-53.4	-87.2	0	0	0	111.6	C288 L289 I290 L304 C306 S311 A315 I318 C339 P340 H341 I346	C288-Y313 VanDerWaalsContact SG-CA 3.6Å; L289-Y313 HydrophobicContact CB-CD1 4.31Å; L289-Y313 HydrophobicContact CB-CE1 3.73Å; I290-Y313 HydrophobicContact CD1-CD1 3.69Å; I290-Y313 HydrophobicContact CD1-CE1 4.18Å; I290-Y313 HydrophobicContact CG1-CD1 3.78Å; I290-Y313 HydrophobicContact CG1-CE1 4.01Å; L304-Y313 WeakPolarHBondContact CB-O 3.42Å; L304-Y313 PolarHBondContact N-O 3.4Å; L304-Y313 WeakPolarHBondContact O-CD2 3.28Å; L304-Y313 PolarHBondContact O-N 3.45Å; C306-Y313 HydrophobicContact CB-CE2 4.45Å; S311-Y313 WeakPolarHBondContact O-CD2 3.19Å; S311-Y313 VanDerWaalsContact O-CE2 3.25Å; S311-Y313 WeakPolarHBondContact O-CE2 3.36Å; Y313-A315 PolarHBondContact O-N 2.98Å; Y313-I318 HydrophobicContact CD1-CD1 4.14Å; Y313-I318 HydrophobicContact CD2-CD1 4.29Å; Y313-I318 HydrophobicContact CD2-CG1 4.47Å; Y313-I318 HydrophobicContact CE1-CD1 4.34Å; Y313-I318 HydrophobicContact CG-CB 4.12Å; Y313-I318 HydrophobicContact CG-CD1 4.11Å; Y313-I318 HydrophobicContact CG-CG1 4.31Å; Y313-C339 PolarHBondContact OH-SG 3.16Å; Y313-P340 HydrophobicContact CE1-CB 4.24Å; Y313-P340 HydrophobicContact CE1-CG 3.7Å; Y313-H341 WeakPolarHBondContact OH-CB 3.42Å; Y313-I346 HydrophobicContact CD2-CD1 3.99Å; Y313-I346 HydrophobicContact CE2-CD1 4.02Å
314	H	93.6	Very high	92.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.208	C	C	.	.			trans	-64.2	136.7	161	-58.4	109.7	0	0	0	109.6	C288 C291 C293 D294 D296 R300 I301 A302 A316 C317 I318	C288-H314 VanDerWaalsContact CB-CE1 3.46Å; C288-H314 WeakPolarHBondContact CB-CE1 3.44Å; C288-H314 WeakPolarHBondContact CB-ND1 3.21Å; C288-H314 PolarHBondContact SG-N 2.91Å; C288-H314 VanDerWaalsContact SG-N 3.36Å; C291-H314 PolarHBondContact SG-CE1 3.48Å; C291-H314 PolarHBondContact SG-ND1 2.92Å; C293-H314 PolarHBondContact O-CE1 3.37Å; D294-H314 PolarHBondContact O-NE2 3.48Å; D296-H314 HydrophobicContact CB-CB 4.49Å; D296-H314 PolarHBondContact N-NE2 3.2Å; R300-H314 PolarHBondContact O-CD2 3.02Å; R300-H314 PolarHBondContact O-NE2 3.34Å; R300-H314 VanDerWaalsContact O-NE2 3.1Å; I301-H314 PolarHBondContact O-CD2 3.15Å; I301-H314 VanDerWaalsContact O-CD2 3.3Å; A302-H314 PolarHBondContact N-CD2 3.35Å; A302-H314 PolarHBondContact N-NE2 3.15Å; H314-A316 PolarHBondContact O-N 3.17Å; H314-A316 VanDerWaalsContact O-N 3.12Å; H314-C317 HydrophobicContact CB-CB 4.02Å; H314-C317 PolarHBondContact O-N 3.15Å; H314-I318 WeakPolarHBondContact O-CG2 3.37Å; H314-I318 PolarHBondContact O-N 3.3Å
315	A	92.8	Very high	93	Very high	25 Å²	25	45 Å²	45	21%	0.207	21%	0.211	C	C	.	.	H	α-helix	trans	-51.3	-38.6	174.4	0	0	0	0	0	111.8	L304 Y313 R319	L304-A315 HydrophobicContact CD1-CB 4.47Å; Y313-A315 PolarHBondContact O-N 2.98Å; A315-R319 WeakPolarHBondContact O-CB 3.37Å; A315-R319 PolarHBondContact O-N 3.05Å
316	A	93.8	Very high	93	Very high	12 Å²	12	49.3 Å²	49.3	10%	0.099	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-46.1	176.7	0	0	0	0	0	113.4	H314 K320	H314-A316 PolarHBondContact O-N 3.17Å; H314-A316 VanDerWaalsContact O-N 3.12Å; A316-K320 WeakPolarHBondContact O-CG 3.46Å; A316-K320 PolarHBondContact O-N 3.27Å
317	C	95.1	Very high	92.9	Very high	21 Å²	21	56 Å²	56	14%	0.142	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-53.3	-179.6	-70.2	0	0	0	0	111.1	I290 H314 R319 K320 W321	I290-C317 HydrophobicContact CB-CB 4.01Å; I290-C317 HydrophobicContact CD1-CB 3.93Å; I290-C317 HydrophobicContact CG2-CB 4.06Å; H314-C317 HydrophobicContact CB-CB 4.02Å; H314-C317 PolarHBondContact O-N 3.15Å; C317-R319 VanDerWaalsContact C-N 3.34Å; C317-R319 PolarHBondContact O-N 3.06Å; C317-K320 PolarHBondContact O-N 2.97Å; C317-W321 PolarHBondContact O-N 3.42Å
318	I	95.2	Very high	93	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68	-34.8	-178.5	-167	62.1	0	0	0	112.1	I290 L304 Y313 H314 K320 W321 V322 P340 I346 V348	I290-I318 HydrophobicContact CD1-CB 4.32Å; I290-I318 HydrophobicContact CD1-CD1 4.09Å; L304-I318 HydrophobicContact CD1-CG2 3.81Å; L304-I318 HydrophobicContact CD2-CG2 4.1Å; L304-I318 HydrophobicContact CG-CG2 4.38Å; Y313-I318 HydrophobicContact CD1-CD1 4.14Å; Y313-I318 HydrophobicContact CD2-CD1 4.29Å; Y313-I318 HydrophobicContact CD2-CG1 4.47Å; Y313-I318 HydrophobicContact CE1-CD1 4.34Å; Y313-I318 HydrophobicContact CG-CB 4.12Å; Y313-I318 HydrophobicContact CG-CD1 4.11Å; Y313-I318 HydrophobicContact CG-CG1 4.31Å; H314-I318 WeakPolarHBondContact O-CG2 3.37Å; H314-I318 PolarHBondContact O-N 3.3Å; I318-K320 PolarHBondContact O-N 2.82Å; I318-W321 HydrophobicContact CD1-CB 4.44Å; I318-W321 WeakPolarHBondContact O-CB 3.39Å; I318-W321 PolarHBondContact O-N 3.04Å; I318-V322 HydrophobicContact CD1-CG2 4.2Å; I318-V322 HydrophobicContact CG1-CG2 4.1Å; I318-V322 WeakPolarHBondContact O-CB 3.36Å; I318-V322 VanDerWaalsContact O-CG2 3.29Å; I318-V322 WeakPolarHBondContact O-CG2 3.5Å; I318-V322 PolarHBondContact O-N 2.96Å; I318-P340 VanDerWaalsContact CD1-CD 3.45Å; I318-P340 HydrophobicContact CD1-CG 3.76Å; I318-I346 HydrophobicContact CD1-CD1 4.37Å; I318-I346 HydrophobicContact CD1-CG2 4.19Å; I318-I346 HydrophobicContact CG1-CD1 4.11Å; I318-I346 HydrophobicContact CG1-CG2 4.22Å; I318-V348 HydrophobicContact CG2-CB 4.15Å; I318-V348 HydrophobicContact CG2-CG1 4.5Å; I318-V348 HydrophobicContact CG2-CG2 3.93Å
319	R	94.8	Very high	93.1	Very high	15 Å²	15	59.2 Å²	59.2	6%	0.057	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-42.7	174.2	-170.4	-168.8	-55.7	126.6	-15.2	112	A315 C317 W321 R323 V348 S349 R351 A352	A315-R319 WeakPolarHBondContact O-CB 3.37Å; A315-R319 PolarHBondContact O-N 3.05Å; C317-R319 VanDerWaalsContact C-N 3.34Å; C317-R319 PolarHBondContact O-N 3.06Å; R319-W321 VanDerWaalsContact C-N 3.34Å; R319-R323 VanDerWaalsContact O-CB 3.26Å; R319-R323 WeakPolarHBondContact O-CB 3.33Å; R319-R323 WeakPolarHBondContact O-CG 3.4Å; R319-R323 PolarHBondContact O-N 3.18Å; R319-V348 HydrophobicContact CB-CG1 4.13Å; R319-V348 HydrophobicContact CB-CG2 3.91Å; R319-V348 HydrophobicContact CG-CG1 4.38Å; R319-V348 HydrophobicContact CG-CG2 4.41Å; R319-S349 WeakPolarHBondContact CD-O 3.36Å; R319-S349 PolarHBondContact NE-O 3.05Å; R319-R351 PolarHBondContact NE-O 3.12Å; R319-R351 PolarHBondContact NH2-O 3.06Å; R319-A352 PolarHBondContact NH2-OXT 3.12Å
320	K	94.4	Very high	93.1	Very high	132 Å²	132	63 Å²	63	57%	0.574	30%	0.296	S	S	*	.	H	α-helix	trans	-62.3	-42.9	174.8	-75.3	172	-177.1	170.8	0	111	A316 C317 I318 R324	A316-K320 WeakPolarHBondContact O-CG 3.46Å; A316-K320 PolarHBondContact O-N 3.27Å; C317-K320 PolarHBondContact O-N 2.97Å; I318-K320 PolarHBondContact O-N 2.82Å; K320-R324 WeakPolarHBondContact O-CG 3.48Å; K320-R324 PolarHBondContact O-N 3.45Å
321	W	94.9	Very high	93.2	Very high	116 Å²	116	62.5 Å²	62.5	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-59.6	-59	175.9	176.1	-99.5	0	0	0	112	I290 C317 I318 R319 R323 R324 H325 P338 P340	I290-W321 HydrophobicContact CD1-CB 4.02Å; C317-W321 PolarHBondContact O-N 3.42Å; I318-W321 HydrophobicContact CD1-CB 4.44Å; I318-W321 WeakPolarHBondContact O-CB 3.39Å; I318-W321 PolarHBondContact O-N 3.04Å; R319-W321 VanDerWaalsContact C-N 3.34Å; W321-R323 VanDerWaalsContact C-N 3.33Å; W321-R323 PolarHBondContact O-N 2.98Å; W321-R324 PolarHBondContact O-N 2.88Å; W321-R324 VanDerWaalsContact O-N 3.08Å; W321-H325 PolarHBondContact O-N 3.35Å; W321-P338 PolarHBondContact NE1-O 3.41Å; W321-P340 HydrophobicContact CD2-CG 4.07Å; W321-P340 HydrophobicContact CG-CG 3.91Å; W321-P340 HydrophobicContact CZ2-CB 4.33Å
322	V	95.4	Very high	93.2	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.5	-40	-175.4	176.2	0	0	0	0	111.4	I318 R324 H325 R328 V335 M336 I346 V348	I318-V322 HydrophobicContact CD1-CG2 4.2Å; I318-V322 HydrophobicContact CG1-CG2 4.1Å; I318-V322 WeakPolarHBondContact O-CB 3.36Å; I318-V322 VanDerWaalsContact O-CG2 3.29Å; I318-V322 WeakPolarHBondContact O-CG2 3.5Å; I318-V322 PolarHBondContact O-N 2.96Å; V322-R324 PolarHBondContact O-N 3.04Å; V322-H325 WeakPolarHBondContact O-CB 3.45Å; V322-H325 PolarHBondContact O-N 3.02Å; V322-H325 VanDerWaalsContact O-N 3.1Å; V322-R328 WeakPolarHBondContact O-CB 3.24Å; V322-V335 HydrophobicContact CB-CG1 4.48Å; V322-V335 HydrophobicContact CG1-CB 4.18Å; V322-V335 HydrophobicContact CG1-CG1 3.54Å; V322-M336 WeakPolarHBondContact CG1-O 3.26Å; V322-I346 HydrophobicContact CG2-CG2 3.92Å; V322-V348 HydrophobicContact CB-CG1 4.49Å
323	R	93.8	Very high	93.1	Very high	111 Å²	111	72.7 Å²	72.7	42%	0.419	35%	0.352	S	S	.	.	H	α-helix	trans	-62.7	-28	178	-78.5	175.5	176.9	165.3	-6	113.8	R319 W321 R328 V335 A350	R319-R323 VanDerWaalsContact O-CB 3.26Å; R319-R323 WeakPolarHBondContact O-CB 3.33Å; R319-R323 WeakPolarHBondContact O-CG 3.4Å; R319-R323 PolarHBondContact O-N 3.18Å; W321-R323 VanDerWaalsContact C-N 3.33Å; W321-R323 PolarHBondContact O-N 2.98Å; R323-R328 WeakPolarHBondContact O-CD 3.44Å; R323-R328 PolarHBondContact O-NE 3.02Å; R323-V335 HydrophobicContact CG-CG1 4.32Å; R323-V335 HydrophobicContact CG-CG2 4.19Å; R323-A350 PolarHBondContact NH2-O 2.84Å
324	R	93.2	Very high	93	Very high	211 Å²	211	76.1 Å²	76.1	80%	0.796	37%	0.367	S	S	*	.	H	α-helix	trans	-88.2	-11.7	177.6	-69.3	178.4	177.5	177.3	-0.4	112.6	K320 W321 V322	K320-R324 WeakPolarHBondContact O-CG 3.48Å; K320-R324 PolarHBondContact O-N 3.45Å; W321-R324 PolarHBondContact O-N 2.88Å; W321-R324 VanDerWaalsContact O-N 3.08Å; V322-R324 PolarHBondContact O-N 3.04Å
325	H	93.9	Very high	93	Very high	46 Å²	46	76.2 Å²	76.2	21%	0.213	37%	0.367	C	S	.	.			trans	-73	138.7	-177.3	-156.4	-88.4	0	0	0	111.7	W321 V322 Q327 R328 P338	W321-H325 PolarHBondContact O-N 3.35Å; V322-H325 WeakPolarHBondContact O-CB 3.45Å; V322-H325 PolarHBondContact O-N 3.02Å; V322-H325 VanDerWaalsContact O-N 3.1Å; H325-Q327 PolarHBondContact ND1-N 3.22Å; H325-Q327 PolarHBondContact O-N 2.85Å; H325-R328 WeakPolarHBondContact O-CB 3.45Å; H325-R328 WeakPolarHBondContact O-CG 3.45Å; H325-R328 PolarHBondContact O-N 3.15Å; H325-R328 PolarHBondContact O-NH1 2.91Å; H325-P338 WeakPolarHBondContact CE1-CG 3.47Å; H325-P338 WeakPolarHBondContact ND1-CD 3.28Å; H325-P338 VanDerWaalsContact ND1-CG 3.3Å; H325-P338 WeakPolarHBondContact ND1-CG 3.3Å; H325-P338 WeakPolarHBondContact NE2-CG 3.48Å
326	P	92.8	Very high	93.1	Very high	113 Å²	113	77.1 Å²	77.1	73%	0.734	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-39	177.7	-25.4	34.4	0	0	0	113.6	R328	P326-R328 PolarHBondContact O-N 3.3Å
327	Q	90.2	Very high	93.1	Very high	140 Å²	140	76.6 Å²	76.6	65%	0.654	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	21.3	-179.1	-62	176.9	-21.7	0	0	113.8	H325	H325-Q327 PolarHBondContact ND1-N 3.22Å; H325-Q327 PolarHBondContact O-N 2.85Å
328	R	92.9	Very high	93.2	Very high	119 Å²	119	76 Å²	76	45%	0.449	36%	0.359	S	S	.	.			trans	-69.3	145.6	-179.3	74.4	-177	178.5	-82.8	-1.1	111.3	V322 R323 H325 P326 V335 M336	V322-R328 WeakPolarHBondContact O-CB 3.24Å; R323-R328 WeakPolarHBondContact O-CD 3.44Å; R323-R328 PolarHBondContact O-NE 3.02Å; H325-R328 WeakPolarHBondContact O-CB 3.45Å; H325-R328 WeakPolarHBondContact O-CG 3.45Å; H325-R328 PolarHBondContact O-N 3.15Å; H325-R328 PolarHBondContact O-NH1 2.91Å; P326-R328 PolarHBondContact O-N 3.3Å; R328-V335 HydrophobicContact CB-CG1 4.35Å; R328-M336 CarbonylContact C-O 3.52Å; R328-M336 VanDerWaalsContact CA-O 3.27Å; R328-M336 WeakPolarHBondContact CA-O 3.38Å
329	V	93.4	Very high	93.2	Very high	70 Å²	70	76.1 Å²	76.1	42%	0.424	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130.5	172.6	-178.3	0	0	0	0	108.2	V335 M336	V329-V335 CarbonylContact O-C 3.57Å; V329-V335 WeakPolarHBondContact O-CA 3.01Å; V329-M336 HydrophobicContact CB-CE 4.08Å; V329-M336 HydrophobicContact CG1-CE 3.74Å; V329-M336 PolarHBondContact N-O 3.01Å; V329-M336 PolarHBondContact O-N 3.42Å
330	I	91.1	Very high	93.1	Very high	115 Å²	115	77.6 Å²	77.6	59%	0.59	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.4	175.1	-59.4	173.5	0	0	0	107.7	F334 V335	I330-F334 WeakPolarHBondContact CA-O 3.4Å; I330-V335 HydrophobicContact CG1-CG1 4.07Å; I330-V335 HydrophobicContact CG1-CG2 4.28Å
331	S	90.4	Very high	93.1	Very high	45 Å²	45	77 Å²	77	32%	0.315	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	135.9	-179.5	-171	0	0	0	0	111.1	G333 F334	S331-G333 VanDerWaalsContact C-N 3.28Å; S331-G333 PolarHBondContact O-N 3.13Å; S331-G333 VanDerWaalsContact O-N 3.1Å; S331-F334 PolarHBondContact N-O 2.94Å; S331-F334 WeakPolarHBondContact O-CA 3.5Å; S331-F334 WeakPolarHBondContact O-CB 3.26Å; S331-F334 PolarHBondContact O-N 2.88Å
332	F	88.4	Confident	93.1	Very high	195 Å²	195	73.4 Å²	73.4	86%	0.855	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.8	44.4	175.6	-62.9	-76.4	0	0	0	115.4	F334	F332-F334 VanDerWaalsContact C-N 3.3Å; F332-F334 WeakPolarHBondContact O-CD2 3.22Å; F332-F334 PolarHBondContact O-N 3.43Å
333	G	90.4	Very high	93.1	Very high	41 Å²	41	77.9 Å²	77.9	42%	0.423	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	11.3	179.6	0	0	0	0	0	114.9	S331 A350	S331-G333 VanDerWaalsContact C-N 3.28Å; S331-G333 PolarHBondContact O-N 3.13Å; S331-G333 VanDerWaalsContact O-N 3.1Å; G333-A350 WeakPolarHBondContact O-CA 3.22Å; G333-A350 WeakPolarHBondContact O-CB 3.25Å; G333-A350 PolarHBondContact O-N 2.71Å
334	F	92.4	Very high	93.1	Very high	71 Å²	71	78.1 Å²	78.1	31%	0.311	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	153.9	173	-63.2	-88.9	0	0	0	111.3	I330 S331 F332 K347 V348	I330-F334 WeakPolarHBondContact CA-O 3.4Å; S331-F334 PolarHBondContact N-O 2.94Å; S331-F334 WeakPolarHBondContact O-CA 3.5Å; S331-F334 WeakPolarHBondContact O-CB 3.26Å; S331-F334 PolarHBondContact O-N 2.88Å; F332-F334 VanDerWaalsContact C-N 3.3Å; F332-F334 WeakPolarHBondContact O-CD2 3.22Å; F332-F334 PolarHBondContact O-N 3.43Å; F334-K347 HydrophobicContact CB-CD 4.42Å; F334-K347 HydrophobicContact CB-CG 3.95Å; F334-K347 HydrophobicContact CD1-CD 4.16Å; F334-K347 HydrophobicContact CD1-CG 3.86Å; F334-K347 HydrophobicContact CG-CD 4.2Å; F334-K347 HydrophobicContact CG-CG 4.06Å; F334-V348 CarbonylContact C-O 3.56Å; F334-V348 WeakPolarHBondContact CA-O 3.45Å
335	V	93.6	Very high	93.1	Very high	2 Å²	2	73 Å²	73	1%	0.012	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.9	166.1	-164.2	0	0	0	0	107.4	V322 R323 R328 V329 I330 V348 A350	V322-V335 HydrophobicContact CB-CG1 4.48Å; V322-V335 HydrophobicContact CG1-CB 4.18Å; V322-V335 HydrophobicContact CG1-CG1 3.54Å; R323-V335 HydrophobicContact CG-CG1 4.32Å; R323-V335 HydrophobicContact CG-CG2 4.19Å; R328-V335 HydrophobicContact CB-CG1 4.35Å; V329-V335 CarbonylContact O-C 3.57Å; V329-V335 WeakPolarHBondContact O-CA 3.01Å; I330-V335 HydrophobicContact CG1-CG1 4.07Å; I330-V335 HydrophobicContact CG1-CG2 4.28Å; V335-V348 PolarHBondContact N-O 3.2Å; V335-V348 WeakPolarHBondContact O-CG1 3.23Å; V335-V348 PolarHBondContact O-N 2.97Å; V335-A350 HydrophobicContact CG2-CB 3.61Å
336	M	94.6	Very high	93.1	Very high	45 Å²	45	71.1 Å²	71.1	22%	0.222	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	149.8	178	-56.5	171.6	-72.6	0	0	109.7	V322 R328 V329 M345 I346 K347	V322-M336 WeakPolarHBondContact CG1-O 3.26Å; R328-M336 CarbonylContact C-O 3.52Å; R328-M336 VanDerWaalsContact CA-O 3.27Å; R328-M336 WeakPolarHBondContact CA-O 3.38Å; V329-M336 HydrophobicContact CB-CE 4.08Å; V329-M336 HydrophobicContact CG1-CE 3.74Å; V329-M336 PolarHBondContact N-O 3.01Å; V329-M336 PolarHBondContact O-N 3.42Å; M336-M345 HydrophobicContact CB-CE 3.47Å; M336-M345 VanDerWaalsContact CB-CE 3.47Å; M336-I346 WeakPolarHBondContact CA-O 3.24Å; M336-K347 HydrophobicContact CG-CB 3.89Å; M336-K347 HydrophobicContact CG-CG 3.84Å; M336-K347 HydrophobicContact SD-CG 4.42Å
337	G	94.8	Very high	93.1	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.9	-174.5	176.2	0	0	0	0	0	110.7	M345 I346	G337-M345 CarbonylContact O-C 3.59Å; G337-M345 WeakPolarHBondContact O-CA 3.33Å; G337-I346 PolarHBondContact N-O 3.3Å; G337-I346 VanDerWaalsContact N-O 3.1Å; G337-I346 VanDerWaalsContact O-CG2 3.32Å; G337-I346 WeakPolarHBondContact O-CG2 3.34Å; G337-I346 PolarHBondContact O-N 3.29Å
338	P	95.8	Very high	93.3	Very high	9 Å²	9	64.7 Å²	64.7	6%	0.058	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	134.4	-174.7	26.4	-30.8	0	0	0	112	W321 H325 S343	W321-P338 PolarHBondContact NE1-O 3.41Å; H325-P338 WeakPolarHBondContact CE1-CG 3.47Å; H325-P338 WeakPolarHBondContact ND1-CD 3.28Å; H325-P338 VanDerWaalsContact ND1-CG 3.3Å; H325-P338 WeakPolarHBondContact ND1-CG 3.3Å; H325-P338 WeakPolarHBondContact NE2-CG 3.48Å; P338-S343 WeakPolarHBondContact CB-O 3.17Å
339	C	95.4	Very high	93.2	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.014	33%	0.33	C	S	.	.			trans	-57.3	130.8	169.6	174.8	0	0	0	0	109.9	C306 C309 Y313 H341 S343 K344 I346	C306-C339 HydrophobicContact CB-CB 4.49Å; C306-C339 VanDerWaalsContact SG-SG 3.68Å; C309-C339 VanDerWaalsContact SG-SG 3.66Å; Y313-C339 PolarHBondContact OH-SG 3.16Å; C339-H341 PolarHBondContact O-N 3.27Å; C339-H341 VanDerWaalsContact O-N 3.13Å; C339-S343 VanDerWaalsContact O-CA 3.28Å; C339-S343 WeakPolarHBondContact O-CA 3.47Å; C339-S343 PolarHBondContact O-N 3.43Å; C339-K344 VanDerWaalsContact CB-O 3.24Å; C339-K344 WeakPolarHBondContact CB-O 3.42Å; C339-K344 PolarHBondContact N-O 3.28Å; C339-I346 HydrophobicContact CB-CB 4.43Å; C339-I346 HydrophobicContact CB-CG2 4.42Å
340	P	94.5	Very high	93	Very high	46 Å²	46	59.2 Å²	59.2	30%	0.299	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-33.4	177.4	-23.6	27.8	0	0	0	113.9	I290 Y313 I318 W321	I290-P340 HydrophobicContact CD1-CG 4.11Å; I290-P340 HydrophobicContact CG1-CG 4.21Å; Y313-P340 HydrophobicContact CE1-CB 4.24Å; Y313-P340 HydrophobicContact CE1-CG 3.7Å; I318-P340 VanDerWaalsContact CD1-CD 3.45Å; I318-P340 HydrophobicContact CD1-CG 3.76Å; W321-P340 HydrophobicContact CD2-CG 4.07Å; W321-P340 HydrophobicContact CG-CG 3.91Å; W321-P340 HydrophobicContact CZ2-CB 4.33Å
341	H	93.6	Very high	92.6	Very high	120 Å²	120	63.4 Å²	63.4	56%	0.556	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-55.3	-175.8	-176.8	-127.3	0	0	0	113.1	L289 S311 Y313 C339	L289-H341 HydrophobicContact CD1-CB 3.99Å; S311-H341 PolarHBondContact OG-ND1 3.08Å; S311-H341 VanDerWaalsContact OG-ND1 3.12Å; Y313-H341 WeakPolarHBondContact OH-CB 3.42Å; C339-H341 PolarHBondContact O-N 3.27Å; C339-H341 VanDerWaalsContact O-N 3.13Å
342	C	94.9	Very high	91.8	Very high	40 Å²	40	66.3 Å²	66.3	27%	0.27	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	0.2	-170.9	73.6	0	0	0	0	114.9	C306 C309 K344	C306-C342 VanDerWaalsContact SG-SG 3.65Å; C309-C342 HydrophobicContact CB-CB 3.71Å; C309-C342 PolarHBondContact SG-SG 2.86Å; C342-K344 PolarHBondContact O-N 3.45Å
343	S	94.6	Very high	91.9	Very high	94 Å²	94	59.9 Å²	59.9	66%	0.657	33%	0.329	S	S	*	.			trans	60.6	0.9	-177.1	-57.8	0	0	0	0	116.7	P338 C339	P338-S343 WeakPolarHBondContact CB-O 3.17Å; C339-S343 VanDerWaalsContact O-CA 3.28Å; C339-S343 WeakPolarHBondContact O-CA 3.47Å; C339-S343 PolarHBondContact O-N 3.43Å
344	K	94.5	Very high	92	Very high	117 Å²	117	60.8 Å²	60.8	51%	0.509	32%	0.324	S	S	.	.	S	Bend	trans	-74.4	158.3	171.8	-65.8	173.3	176.5	179.5	0	110.9	S308 C339 C342 I346	S308-K344 VanDerWaalsContact OG-CD 3.23Å; S308-K344 WeakPolarHBondContact OG-CD 3.41Å; C339-K344 VanDerWaalsContact CB-O 3.24Å; C339-K344 WeakPolarHBondContact CB-O 3.42Å; C339-K344 PolarHBondContact N-O 3.28Å; C342-K344 PolarHBondContact O-N 3.45Å; K344-I346 PolarHBondContact O-N 2.84Å
345	M	93.8	Very high	92	Very high	102 Å²	102	60.3 Å²	60.3	50%	0.502	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	128.7	-175.9	-74.1	-67	-78.5	0	0	112	M336 G337	M336-M345 HydrophobicContact CB-CE 3.47Å; M336-M345 VanDerWaalsContact CB-CE 3.47Å; G337-M345 CarbonylContact O-C 3.59Å; G337-M345 WeakPolarHBondContact O-CA 3.33Å
346	I	93.8	Very high	91.9	Very high	7 Å²	7	63.7 Å²	63.7	4%	0.036	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	145.9	170.5	-168	159.5	0	0	0	109.2	L304 C306 Y313 I318 V322 M336 G337 C339 K344	L304-I346 HydrophobicContact CD2-CD1 3.53Å; L304-I346 HydrophobicContact CD2-CG1 3.81Å; C306-I346 HydrophobicContact CB-CD1 3.99Å; Y313-I346 HydrophobicContact CD2-CD1 3.99Å; Y313-I346 HydrophobicContact CE2-CD1 4.02Å; I318-I346 HydrophobicContact CD1-CD1 4.37Å; I318-I346 HydrophobicContact CD1-CG2 4.19Å; I318-I346 HydrophobicContact CG1-CD1 4.11Å; I318-I346 HydrophobicContact CG1-CG2 4.22Å; V322-I346 HydrophobicContact CG2-CG2 3.92Å; M336-I346 WeakPolarHBondContact CA-O 3.24Å; G337-I346 PolarHBondContact N-O 3.3Å; G337-I346 VanDerWaalsContact N-O 3.1Å; G337-I346 VanDerWaalsContact O-CG2 3.32Å; G337-I346 WeakPolarHBondContact O-CG2 3.34Å; G337-I346 PolarHBondContact O-N 3.29Å; C339-I346 HydrophobicContact CB-CB 4.43Å; C339-I346 HydrophobicContact CB-CG2 4.42Å; K344-I346 PolarHBondContact O-N 2.84Å
347	K	92.5	Very high	91.8	Very high	115 Å²	115	64.9 Å²	64.9	50%	0.5	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.3	-178.3	179.4	-177.5	172.2	-168.6	0	109.4	F334 M336	F334-K347 HydrophobicContact CB-CD 4.42Å; F334-K347 HydrophobicContact CB-CG 3.95Å; F334-K347 HydrophobicContact CD1-CD 4.16Å; F334-K347 HydrophobicContact CD1-CG 3.86Å; F334-K347 HydrophobicContact CG-CD 4.2Å; F334-K347 HydrophobicContact CG-CG 4.06Å; M336-K347 HydrophobicContact CG-CB 3.89Å; M336-K347 HydrophobicContact CG-CG 3.84Å; M336-K347 HydrophobicContact SD-CG 4.42Å
348	V	93.6	Very high	91.6	Very high	4 Å²	4	69.2 Å²	69.2	2%	0.024	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	146.5	176.5	58.2	0	0	0	0	110.7	L304 I318 R319 V322 F334 V335 A350	L304-V348 HydrophobicContact CD1-CB 3.75Å; L304-V348 HydrophobicContact CD1-CG2 3.54Å; I318-V348 HydrophobicContact CG2-CB 4.15Å; I318-V348 HydrophobicContact CG2-CG1 4.5Å; I318-V348 HydrophobicContact CG2-CG2 3.93Å; R319-V348 HydrophobicContact CB-CG1 4.13Å; R319-V348 HydrophobicContact CB-CG2 3.91Å; R319-V348 HydrophobicContact CG-CG1 4.38Å; R319-V348 HydrophobicContact CG-CG2 4.41Å; V322-V348 HydrophobicContact CB-CG1 4.49Å; F334-V348 CarbonylContact C-O 3.56Å; F334-V348 WeakPolarHBondContact CA-O 3.45Å; V335-V348 PolarHBondContact N-O 3.2Å; V335-V348 WeakPolarHBondContact O-CG1 3.23Å; V335-V348 PolarHBondContact O-N 2.97Å; V348-A350 PolarHBondContact O-N 3.25Å
349	S	92.1	Very high	91.2	Very high	49 Å²	49	73.5 Å²	73.5	34%	0.343	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	132.3	175.5	176.6	0	0	0	0	110.9	R319 R351	R319-S349 WeakPolarHBondContact CD-O 3.36Å; R319-S349 PolarHBondContact NE-O 3.05Å; S349-R351 PolarHBondContact O-N 3.5Å; S349-R351 PolarHBondContact OG-N 3.36Å; S349-R351 PolarHBondContact OG-O 3.12Å
350	A	87.9	Confident	90.9	Very high	25 Å²	25	79 Å²	79	21%	0.207	43%	0.426	C	S	.	.	S	Bend	trans	-74.6	-7.2	175.6	0	0	0	0	0	112.5	R323 G333 V335 V348	R323-A350 PolarHBondContact NH2-O 2.84Å; G333-A350 WeakPolarHBondContact O-CA 3.22Å; G333-A350 WeakPolarHBondContact O-CB 3.25Å; G333-A350 PolarHBondContact O-N 2.71Å; V335-A350 HydrophobicContact CG2-CB 3.61Å; V348-A350 PolarHBondContact O-N 3.25Å
351	R	83.6	Confident	90.6	Very high	202 Å²	202	81.8 Å²	81.8	76%	0.762	44%	0.437	S	S	*	.			trans	-105.1	150.2	174.4	-63.6	-177.5	-177	176.2	1.2	110.1	R319 S349	R319-R351 PolarHBondContact NE-O 3.12Å; R319-R351 PolarHBondContact NH2-O 3.06Å; S349-R351 PolarHBondContact O-N 3.5Å; S349-R351 PolarHBondContact OG-N 3.36Å; S349-R351 PolarHBondContact OG-O 3.12Å
352	A	72.9	Confident	90.4	Very high	106 Å²	106	78.3 Å²	78.3	88%	0.876	43%	0.426	S	S	*	.			trans	-66.5	0	-175.2	0	0	0	0	0	112.2	R300 R319	R300-A352 PolarHBondContact NH1-OXT 3.09Å; R319-A352 PolarHBondContact NH2-OXT 3.12Å

Retrieved 352 of 352 residues in 78.3 ms (Link to these results)

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