A0A4W5KRN4_9TELE Loading...

RAB2A, member RAS oncogene family

AlphaFold DB , UniProt , Accession A0A4W5KRN4, Species 9TELE (Hucho hucho, huchen), Gene n/a, Length 212 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	55.3	Low	89.4	Confident	219 Å²	219	33.4 Å²	33.4	100%	1.079	17%	0.17	S	C	*	.				0	122.4	0	-67.3	-175.7	-126.4	0	0	107.8
2	A	83.1	Confident	89.9	Confident	38 Å²	38	30.7 Å²	30.7	31%	0.314	16%	0.156	S	C	.	.			trans	-89.7	147.4	-179.4	0	0	0	0	0	110.5	Q190	A2-Q190 HydrophobicContact CB-CB 4.46Å; A2-Q190 VanDerWaalsContact CB-CD 3.42Å; A2-Q190 HydrophobicContact CB-CG 3.57Å
3	Y	88.1	Confident	90.3	Very high	51 Å²	51	28.3 Å²	28.3	20%	0.2	14%	0.144	C	C	.	.			trans	-125.5	154.4	178.5	54.3	-94.7	0	0	0	109.2	Y5 L6 Q54 K56 G188	Y3-Y5 WeakPolarHBondContact CD2-O 3.43Å; Y3-L6 HydrophobicContact CD2-CB 4.16Å; Y3-L6 HydrophobicContact CE2-CB 3.7Å; Y3-L6 HydrophobicContact CE2-CD1 4.39Å; Y3-Q54 CarbonylContact C-O 3.6Å; Y3-Q54 WeakPolarHBondContact CA-O 3.11Å; Y3-K56 HydrophobicContact CD1-CB 4.15Å; Y3-K56 HydrophobicContact CD1-CD 4.11Å; Y3-K56 HydrophobicContact CD2-CB 4.41Å; Y3-K56 HydrophobicContact CE1-CD 4.01Å; Y3-K56 HydrophobicContact CG-CB 4.03Å; Y3-G188 CarbonylContact O-C 3.44Å; Y3-G188 WeakPolarHBondContact O-CA 3.14Å
4	A	90.2	Very high	90.6	Very high	3 Å²	3	27.7 Å²	27.7	3%	0.025	14%	0.141	C	C	.	.	S	Bend	trans	-81.4	-46	173.9	0	0	0	0	0	110.9	K53 Q54 G188	A4-K53 HydrophobicContact CB-CB 4.09Å; A4-K53 HydrophobicContact CB-CD 4.06Å; A4-Q54 PolarHBondContact N-O 3.47Å; A4-G188 PolarHBondContact O-N 3.12Å
5	Y	92.8	Very high	90.8	Very high	12 Å²	12	28.7 Å²	28.7	5%	0.047	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152.1	179.7	-59.5	-79.8	0	0	0	111	Y3 F7 I55 K56 Y168 I171 I178 I185 K186	Y3-Y5 WeakPolarHBondContact CD2-O 3.43Å; Y5-F7 HydrophobicContact CG-CE1 4.18Å; Y5-I55 WeakPolarHBondContact O-CA 3.46Å; Y5-K56 PolarHBondContact O-N 3.47Å; Y5-Y168 HydrophobicContact CD2-CD2 4.33Å; Y5-Y168 HydrophobicContact CD2-CE2 4.17Å; Y5-Y168 HydrophobicContact CE2-CD2 4.27Å; Y5-Y168 AromaticContact CE2-CE2 3.75Å; Y5-Y168 HydrophobicContact CE2-CE2 3.75Å; Y5-I171 HydrophobicContact CD1-CD1 4.49Å; Y5-I171 HydrophobicContact CE1-CG2 4.49Å; Y5-I178 HydrophobicContact CD1-CG2 4.47Å; Y5-I178 HydrophobicContact CE1-CD1 4.34Å; Y5-I178 HydrophobicContact CE1-CG2 4.14Å; Y5-I185 HydrophobicContact CD1-CG2 4.14Å; Y5-K186 CarbonylContact C-O 3.46Å; Y5-K186 WeakPolarHBondContact CA-O 3.38Å
6	L	94.5	Very high	90.9	Very high	11 Å²	11	29.9 Å²	29.9	6%	0.058	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	126.3	166.2	175.3	164.7	0	0	0	107.9	Y3 K56 Q58 I185 K186	Y3-L6 HydrophobicContact CD2-CB 4.16Å; Y3-L6 HydrophobicContact CE2-CB 3.7Å; Y3-L6 HydrophobicContact CE2-CD1 4.39Å; L6-K56 CarbonylContact C-O 3.56Å; L6-K56 VanDerWaalsContact CA-O 3.24Å; L6-K56 WeakPolarHBondContact CA-O 3.31Å; L6-K56 HydrophobicContact CB-CB 4.37Å; L6-K56 HydrophobicContact CD1-CD 4.37Å; L6-K56 HydrophobicContact CG-CB 4.46Å; L6-Q58 HydrophobicContact CD1-CG 4.16Å; L6-Q58 HydrophobicContact CD2-CG 4.26Å; L6-Q58 HydrophobicContact CG-CG 4.15Å; L6-I185 WeakPolarHBondContact O-CA 3.14Å; L6-K186 HydrophobicContact CB-CB 4.23Å; L6-K186 PolarHBondContact N-O 3.04Å; L6-K186 PolarHBondContact O-N 3.24Å
7	F	95.7	Very high	91.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.5	176.1	-59.7	-23	0	0	0	110.5	Y5 Y9 I55 K56 L57 Q58 A164 I167 I171 I185	Y5-F7 HydrophobicContact CG-CE1 4.18Å; F7-Y9 HydrophobicContact CB-CD1 4.16Å; F7-Y9 HydrophobicContact CB-CE1 3.81Å; F7-I55 HydrophobicContact CD2-CG2 3.66Å; F7-I55 HydrophobicContact CE2-CD1 3.88Å; F7-I55 HydrophobicContact CE2-CG2 3.78Å; F7-I55 HydrophobicContact CG-CG2 4.08Å; F7-I55 HydrophobicContact CZ-CD1 4.09Å; F7-I55 HydrophobicContact CZ-CG2 4.28Å; F7-K56 PolarHBondContact N-O 2.84Å; F7-L57 HydrophobicContact CB-CD2 3.92Å; F7-L57 HydrophobicContact CD2-CD2 4.01Å; F7-L57 HydrophobicContact CG-CD2 4.41Å; F7-Q58 PolarHBondContact O-N 2.95Å; F7-A164 HydrophobicContact CD2-CB 4.23Å; F7-A164 HydrophobicContact CE2-CB 4.37Å; F7-I167 HydrophobicContact CD1-CG2 4.09Å; F7-I167 HydrophobicContact CD2-CB 4.31Å; F7-I167 HydrophobicContact CD2-CD1 4.38Å; F7-I167 HydrophobicContact CD2-CG2 4.04Å; F7-I167 HydrophobicContact CE1-CG2 3.88Å; F7-I167 HydrophobicContact CE2-CB 4.04Å; F7-I167 HydrophobicContact CE2-CG2 3.8Å; F7-I167 HydrophobicContact CG-CG2 4.19Å; F7-I167 HydrophobicContact CZ-CB 4.38Å; F7-I167 HydrophobicContact CZ-CG2 3.73Å; F7-I171 HydrophobicContact CE1-CD1 3.52Å; F7-I171 HydrophobicContact CZ-CD1 3.68Å; F7-I185 HydrophobicContact CD1-CB 4.44Å; F7-I185 HydrophobicContact CD1-CG1 3.91Å; F7-I185 HydrophobicContact CD1-CG2 4.16Å; F7-I185 HydrophobicContact CE1-CG1 4.08Å; F7-I185 HydrophobicContact CE1-CG2 3.93Å
8	K	95.3	Very high	91.4	Very high	33 Å²	33	27.3 Å²	27.3	14%	0.143	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	123.1	173	165.4	161.9	177.3	-154.4	0	111.3	Q58 W60 Y75 R77 G78 A79 A80 G81 G184	K8-Q58 CarbonylContact C-O 3.52Å; K8-W60 HydrophobicContact CB-CE3 4.44Å; K8-W60 HydrophobicContact CB-CH2 4.06Å; K8-W60 HydrophobicContact CB-CZ3 3.59Å; K8-W60 HydrophobicContact CD-CD2 4.49Å; K8-W60 HydrophobicContact CD-CE3 4.02Å; K8-W60 HydrophobicContact CD-CH2 3.57Å; K8-W60 HydrophobicContact CD-CZ2 4.1Å; K8-W60 HydrophobicContact CD-CZ3 3.55Å; K8-W60 HydrophobicContact CG-CE3 3.65Å; K8-W60 HydrophobicContact CG-CH2 3.75Å; K8-W60 HydrophobicContact CG-CZ3 3.19Å; K8-Y75 WeakPolarHBondContact CE-O 3.33Å; K8-Y75 PolarHBondContact NZ-O 3.23Å; K8-R77 PolarHBondContact NZ-O 2.94Å; K8-G78 VanDerWaalsContact CD-O 3.25Å; K8-G78 WeakPolarHBondContact CD-O 3.26Å; K8-G78 WeakPolarHBondContact CG-O 3.42Å; K8-A79 HydrophobicContact CG-CB 4.45Å; K8-A80 PolarHBondContact O-N 3.46Å; K8-G81 PolarHBondContact O-N 3.18Å; K8-G184 PolarHBondContact N-O 3.22Å
9	Y	96.7	Very high	91.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.5	-178.5	-83.3	33.8	0	0	0	110.5	F7 L57 Q58 I59 W60 G81 F160 T163 A164 I167	F7-Y9 HydrophobicContact CB-CD1 4.16Å; F7-Y9 HydrophobicContact CB-CE1 3.81Å; Y9-L57 HydrophobicContact CE1-CD2 4.04Å; Y9-L57 HydrophobicContact CE2-CD1 4.35Å; Y9-Q58 PolarHBondContact N-O 3.35Å; Y9-I59 HydrophobicContact CG-CG1 4.46Å; Y9-I59 WeakPolarHBondContact O-CA 3.34Å; Y9-W60 VanDerWaalsContact O-CE3 3.27Å; Y9-W60 PolarHBondContact O-N 3Å; Y9-G81 VanDerWaalsContact CA-O 3.28Å; Y9-G81 WeakPolarHBondContact CA-O 3.35Å; Y9-F160 HydrophobicContact CD2-CD1 4.2Å; Y9-F160 HydrophobicContact CE2-CD1 4.42Å; Y9-T163 HydrophobicContact CE2-CG2 3.75Å; Y9-T163 WeakPolarHBondContact OH-CB 3.14Å; Y9-T163 WeakPolarHBondContact OH-CG2 3.43Å; Y9-T163 PolarHBondContact OH-O 2.93Å; Y9-A164 WeakPolarHBondContact OH-CA 3.27Å; Y9-A164 VanDerWaalsContact OH-CB 3.26Å; Y9-A164 WeakPolarHBondContact OH-CB 3.41Å; Y9-A164 PolarHBondContact OH-N 3.31Å; Y9-I167 HydrophobicContact CD1-CD1 4.49Å; Y9-I167 HydrophobicContact CE1-CD1 3.46Å; Y9-I167 VanDerWaalsContact CE1-CD1 3.46Å
10	I	95.5	Very high	91.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	145.4	166.2	59.2	175.7	0	0	0	109.6	I12 W60 Y76 A79 G81 A82 L83 M112	I10-I12 HydrophobicContact CB-CG2 4.43Å; I10-I12 HydrophobicContact CD1-CG2 4.02Å; I10-I12 HydrophobicContact CG1-CG2 4.26Å; I10-W60 WeakPolarHBondContact CA-O 3.24Å; I10-W60 HydrophobicContact CG2-CB 4.31Å; I10-Y76 HydrophobicContact CD1-CD1 3.66Å; I10-Y76 HydrophobicContact CD1-CD2 4.46Å; I10-Y76 HydrophobicContact CD1-CE1 3.94Å; I10-Y76 HydrophobicContact CD1-CG 3.94Å; I10-A79 HydrophobicContact CD1-CB 4.24Å; I10-A79 HydrophobicContact CG1-CB 4.17Å; I10-A79 HydrophobicContact CG2-CB 4.1Å; I10-G81 PolarHBondContact N-O 3.32Å; I10-G81 VanDerWaalsContact N-O 3.09Å; I10-A82 HydrophobicContact CD1-CB 4.1Å; I10-A82 HydrophobicContact CG1-CB 3.63Å; I10-A82 CarbonylContact O-C 3.53Å; I10-A82 WeakPolarHBondContact O-CA 3.45Å; I10-L83 PolarHBondContact O-N 3.47Å; I10-M112 HydrophobicContact CD1-SD 4.48Å
11	I	96.5	Very high	92	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.1	168.7	-44.5	-177.1	0	0	0	107.6	K19 L23 I59 W60 T62 L83 V85 F160	I11-K19 HydrophobicContact CB-CB 4.36Å; I11-K19 HydrophobicContact CG2-CB 3.61Å; I11-K19 HydrophobicContact CG2-CD 3.93Å; I11-K19 HydrophobicContact CG2-CG 3.73Å; I11-L23 HydrophobicContact CD1-CB 3.93Å; I11-I59 HydrophobicContact CD1-CG2 3.75Å; I11-I59 HydrophobicContact CG1-CG2 3.7Å; I11-W60 PolarHBondContact N-O 2.9Å; I11-T62 WeakPolarHBondContact O-CB 3.49Å; I11-T62 PolarHBondContact O-N 2.92Å; I11-T62 PolarHBondContact O-OG1 3.28Å; I11-L83 WeakPolarHBondContact CA-O 3.47Å; I11-L83 HydrophobicContact CD1-CD1 4.46Å; I11-L83 HydrophobicContact CG1-CB 4.38Å; I11-L83 HydrophobicContact CG1-CD1 4.32Å; I11-L83 HydrophobicContact CG2-CB 4.12Å; I11-V85 HydrophobicContact CG2-CG2 3.64Å; I11-F160 HydrophobicContact CD1-CE1 4.31Å; I11-F160 HydrophobicContact CD1-CZ 4.03Å
12	I	95.4	Very high	94	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.005	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	159.9	-174.1	60.4	171.2	0	0	0	110.9	I10 K19 T62 Y76 L83 L84 V85 W100 A104	I10-I12 HydrophobicContact CB-CG2 4.43Å; I10-I12 HydrophobicContact CD1-CG2 4.02Å; I10-I12 HydrophobicContact CG1-CG2 4.26Å; I12-K19 VanDerWaalsContact C-CD 3.49Å; I12-T62 HydrophobicContact CG2-CG2 4.5Å; I12-Y76 HydrophobicContact CG2-CE1 3.72Å; I12-Y76 WeakPolarHBondContact CG2-OH 3.4Å; I12-L83 PolarHBondContact N-O 3.49Å; I12-L84 HydrophobicContact CD1-CD1 3.98Å; I12-L84 HydrophobicContact CG1-CB 4.33Å; I12-L84 HydrophobicContact CG1-CD1 3.86Å; I12-V85 PolarHBondContact O-N 2.89Å; I12-W100 HydrophobicContact CB-CE3 4.06Å; I12-W100 HydrophobicContact CB-CZ3 4.36Å; I12-A104 HydrophobicContact CD1-CB 3.8Å
13	G	95.5	Very high	94.6	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.083	C	C	.	.			trans	132.1	173.4	-175	0	0	0	0	0	112.1	K19 G64 W100	G13-K19 WeakPolarHBondContact O-CE 3.48Å; G13-K19 PolarHBondContact O-NZ 3.5Å; G13-G64 WeakPolarHBondContact O-CA 3.49Å; G13-W100 WeakPolarHBondContact O-CZ2 3.21Å
14	D	94.4	Very high	94.9	Very high	20 Å²	20	12.2 Å²	12.2	11%	0.107	8%	0.08	C	C	.	.			trans	-61.1	164.5	-171.4	-82.1	13	0	0	0	114.3	V17 K19 G64 T93 H96 W100	D14-V17 HydrophobicContact CB-CG1 3.74Å; D14-V17 WeakPolarHBondContact O-CG2 3.35Å; D14-K19 PolarHBondContact O-NZ 2.76Å; D14-G64 CarbonylContact C-O 3.56Å; D14-T93 HydrophobicContact CB-CG2 3.94Å; D14-H96 IonicContact OD1-ND1 2.71Å; D14-H96 IonicContact OD2-CE1 3.24Å; D14-H96 IonicContact OD2-CG 3.37Å; D14-H96 IonicContact OD2-ND1 3.46Å; D14-H96 PolarHBondContact OD2-ND1 3.23Å; D14-W100 PolarHBondContact OD1-NE1 2.84Å
15	T	92.6	Very high	95.2	Very high	43 Å²	43	12.7 Å²	12.7	26%	0.264	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	139.3	172.2	-61.8	0	0	0	0	110.4	V17 L37 G64 Q65 R90	T15-V17 VanDerWaalsContact C-N 3.26Å; T15-V17 PolarHBondContact O-N 3.39Å; T15-L37 HydrophobicContact CG2-CD2 3.47Å; T15-L37 VanDerWaalsContact CG2-CD2 3.47Å; T15-G64 PolarHBondContact N-O 3.13Å; T15-G64 PolarHBondContact OG1-O 3.21Å; T15-Q65 HydrophobicContact CG2-CG 4.26Å; T15-Q65 WeakPolarHBondContact OG1-CA 3.48Å; T15-Q65 WeakPolarHBondContact OG1-CG 3.41Å; T15-Q65 PolarHBondContact OG1-N 3.29Å; T15-Q65 VanDerWaalsContact OG1-N 3.08Å; T15-R90 PolarHBondContact O-NH2 2.81Å
16	G	92.9	Very high	95.4	Very high	47 Å²	47	12.1 Å²	12.1	49%	0.485	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	75	4.4	175.4	0	0	0	0	0	115.6	G18 R90 K120	G16-G18 PolarHBondContact O-N 3.15Å; G16-R90 VanDerWaalsContact C-NH2 3.29Å; G16-R90 PolarHBondContact O-NH2 2.94Å; G16-K120 WeakPolarHBondContact O-CE 3.47Å; G16-K120 PolarHBondContact O-NZ 3.1Å
17	V	96.1	Very high	95.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.089	C	C	.	.	S	Bend	trans	-72.1	-15.3	174.4	-56.4	0	0	0	0	113	D14 T15 K19 V85 D87 T93 N119	D14-V17 HydrophobicContact CB-CG1 3.74Å; D14-V17 WeakPolarHBondContact O-CG2 3.35Å; T15-V17 VanDerWaalsContact C-N 3.26Å; T15-V17 PolarHBondContact O-N 3.39Å; V17-K19 HydrophobicContact CG2-CD 4.27Å; V17-K19 HydrophobicContact CG2-CG 3.59Å; V17-V85 HydrophobicContact CB-CG1 4.25Å; V17-V85 HydrophobicContact CG2-CB 3.9Å; V17-V85 HydrophobicContact CG2-CG1 3.81Å; V17-D87 HydrophobicContact CB-CB 4.31Å; V17-D87 HydrophobicContact CG1-CB 4.13Å; V17-T93 HydrophobicContact CG1-CG2 3.83Å; V17-N119 PolarHBondContact O-ND2 3.47Å
18	G	95.4	Very high	95.2	Very high	13 Å²	13	17 Å²	17	13%	0.134	11%	0.108	C	C	.	.	S	Bend	trans	100.4	26.7	174.7	0	0	0	0	0	115.5	G16 C21 L22	G16-G18 PolarHBondContact O-N 3.15Å; G18-C21 WeakPolarHBondContact O-CB 3.29Å; G18-C21 PolarHBondContact O-N 2.99Å; G18-L22 WeakPolarHBondContact O-CG 3.4Å; G18-L22 PolarHBondContact O-N 3.38Å
19	K	95.6	Very high	95.1	Very high	9 Å²	9	20.7 Å²	20.7	4%	0.039	12%	0.124	C	C	.	.	H	α-helix	trans	-55.9	-53	177.3	-57.4	-170.9	-61	-73.9	0	113	I11 I12 G13 D14 V17 C21 L22 L23 D61 T62 G64 V85	I11-K19 HydrophobicContact CB-CB 4.36Å; I11-K19 HydrophobicContact CG2-CB 3.61Å; I11-K19 HydrophobicContact CG2-CD 3.93Å; I11-K19 HydrophobicContact CG2-CG 3.73Å; I12-K19 VanDerWaalsContact C-CD 3.49Å; G13-K19 WeakPolarHBondContact O-CE 3.48Å; G13-K19 PolarHBondContact O-NZ 3.5Å; D14-K19 PolarHBondContact O-NZ 2.76Å; V17-K19 HydrophobicContact CG2-CD 4.27Å; V17-K19 HydrophobicContact CG2-CG 3.59Å; K19-C21 VanDerWaalsContact C-N 3.32Å; K19-C21 PolarHBondContact O-N 3.39Å; K19-L22 WeakPolarHBondContact O-CB 3.19Å; K19-L22 PolarHBondContact O-N 3.37Å; K19-L22 VanDerWaalsContact O-N 3.15Å; K19-L23 PolarHBondContact O-N 3.22Å; K19-D61 WeakPolarHBondContact CB-OD1 3.4Å; K19-T62 WeakPolarHBondContact CE-O 3.43Å; K19-G64 VanDerWaalsContact NZ-CA 3.31Å; K19-V85 HydrophobicContact CG-CB 4.21Å; K19-V85 HydrophobicContact CG-CG2 4.24Å
20	S	94.7	Very high	94.7	Very high	11 Å²	11	27.8 Å²	27.8	8%	0.077	15%	0.15	C	C	.	.	H	α-helix	trans	-62.2	-38.9	177.1	-39.5	0	0	0	0	112.1	L22 L23 L24 H35 T38 D61	S20-L22 PolarHBondContact O-N 3.24Å; S20-L23 PolarHBondContact O-N 3.13Å; S20-L24 WeakPolarHBondContact O-CB 3.45Å; S20-L24 PolarHBondContact O-N 3.48Å; S20-H35 WeakPolarHBondContact CB-CE1 3.18Å; S20-T38 PolarHBondContact OG-OG1 3.27Å; S20-D61 VanDerWaalsContact CA-OD2 3.26Å; S20-D61 WeakPolarHBondContact CA-OD2 3.46Å; S20-D61 WeakPolarHBondContact CB-OD2 3.45Å; S20-D61 PolarHBondContact N-OD2 3.42Å; S20-D61 PolarHBondContact OG-OD2 3.02Å
21	C	95.4	Very high	94.2	Very high	15 Å²	15	31.7 Å²	31.7	10%	0.101	17%	0.167	C	C	.	.	H	α-helix	trans	-63.6	-39.5	175.1	-57	0	0	0	0	112.3	G18 K19 Q25 F31 H35 A150	G18-C21 WeakPolarHBondContact O-CB 3.29Å; G18-C21 PolarHBondContact O-N 2.99Å; K19-C21 VanDerWaalsContact C-N 3.32Å; K19-C21 PolarHBondContact O-N 3.39Å; C21-Q25 WeakPolarHBondContact O-CB 3.25Å; C21-Q25 PolarHBondContact O-N 2.8Å; C21-F31 HydrophobicContact CB-CD2 4.46Å; C21-F31 HydrophobicContact CB-CE2 4.39Å; C21-H35 PolarHBondContact SG-CD2 3Å; C21-A150 HydrophobicContact CB-CB 3.61Å
22	L	97.2	Very high	93.5	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-65.2	-44.2	175.3	-73.6	168.9	0	0	0	111	G18 K19 S20 Q25 F26 V85 I117 N119 A150 V156	G18-L22 WeakPolarHBondContact O-CG 3.4Å; G18-L22 PolarHBondContact O-N 3.38Å; K19-L22 WeakPolarHBondContact O-CB 3.19Å; K19-L22 PolarHBondContact O-N 3.37Å; K19-L22 VanDerWaalsContact O-N 3.15Å; S20-L22 PolarHBondContact O-N 3.24Å; L22-Q25 PolarHBondContact O-N 3.42Å; L22-F26 VanDerWaalsContact O-CB 3.3Å; L22-F26 WeakPolarHBondContact O-CB 3.16Å; L22-F26 PolarHBondContact O-N 2.82Å; L22-V85 HydrophobicContact CD1-CG1 3.84Å; L22-V85 HydrophobicContact CD1-CG2 4.07Å; L22-I117 HydrophobicContact CD1-CD1 4.48Å; L22-I117 HydrophobicContact CD1-CG2 4.16Å; L22-N119 HydrophobicContact CD1-CB 4.37Å; L22-A150 HydrophobicContact CD2-CB 3.96Å; L22-A150 HydrophobicContact CG-CB 4.2Å; L22-V156 HydrophobicContact CD2-CG1 4.27Å; L22-V156 HydrophobicContact CD2-CG2 3.82Å
23	L	96.4	Very high	92.3	Very high	10 Å²	10	41 Å²	41	5%	0.052	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-52.4	175.1	178.3	59.1	0	0	0	111.1	I11 K19 S20 Q25 F26 T27 I59 D61	I11-L23 HydrophobicContact CD1-CB 3.93Å; K19-L23 PolarHBondContact O-N 3.22Å; S20-L23 PolarHBondContact O-N 3.13Å; L23-Q25 PolarHBondContact O-N 2.97Å; L23-F26 WeakPolarHBondContact O-CB 3.48Å; L23-F26 PolarHBondContact O-N 3.32Å; L23-F26 VanDerWaalsContact O-N 3.14Å; L23-T27 HydrophobicContact CD1-CG2 3.85Å; L23-T27 HydrophobicContact CG-CG2 4.49Å; L23-T27 WeakPolarHBondContact O-CG2 3.34Å; L23-T27 PolarHBondContact O-N 3.3Å; L23-T27 PolarHBondContact O-OG1 2.99Å; L23-I59 HydrophobicContact CD1-CB 3.84Å; L23-I59 HydrophobicContact CD1-CD1 3.83Å; L23-I59 HydrophobicContact CD1-CG1 4.47Å; L23-I59 HydrophobicContact CD1-CG2 3.74Å; L23-D61 HydrophobicContact CD2-CB 3.64Å
24	L	94.7	Very high	91.2	Very high	28 Å²	28	46.2 Å²	46.2	15%	0.147	25%	0.252	C	S	.	.	H	α-helix	trans	-61.7	-42	-179.2	-175.8	67.9	0	0	0	112	S20 F26 T27 D28 K29 R30 Q32	S20-L24 WeakPolarHBondContact O-CB 3.45Å; S20-L24 PolarHBondContact O-N 3.48Å; L24-F26 VanDerWaalsContact C-N 3.28Å; L24-F26 PolarHBondContact O-N 2.68Å; L24-T27 PolarHBondContact O-N 2.98Å; L24-D28 HydrophobicContact CD1-CB 3.92Å; L24-D28 WeakPolarHBondContact CD1-OD2 3.22Å; L24-D28 WeakPolarHBondContact O-CA 3.43Å; L24-D28 WeakPolarHBondContact O-CB 3.16Å; L24-D28 PolarHBondContact O-N 3.17Å; L24-K29 PolarHBondContact O-N 2.99Å; L24-R30 HydrophobicContact CD2-CB 4.37Å; L24-R30 HydrophobicContact CG-CB 4.27Å; L24-Q32 HydrophobicContact CD2-CB 3.92Å
25	Q	96.4	Very high	89.9	Confident	12 Å²	12	48.2 Å²	48.2	6%	0.056	26%	0.261	C	S	.	.	H	α-helix	trans	-66.4	-34.8	177.2	-175.5	66.6	-67.5	0	0	111.2	C21 L22 L23 K29 R30 A150 A153 V156	C21-Q25 WeakPolarHBondContact O-CB 3.25Å; C21-Q25 PolarHBondContact O-N 2.8Å; L22-Q25 PolarHBondContact O-N 3.42Å; L23-Q25 PolarHBondContact O-N 2.97Å; Q25-K29 WeakPolarHBondContact O-CA 3.39Å; Q25-K29 PolarHBondContact O-N 3.17Å; Q25-K29 PolarHBondContact OE1-O 3.1Å; Q25-R30 WeakPolarHBondContact CA-O 3.43Å; Q25-R30 PolarHBondContact N-O 3.18Å; Q25-R30 VanDerWaalsContact OE1-N 3.1Å; Q25-A150 WeakPolarHBondContact CG-O 2.81Å; Q25-A150 PolarHBondContact NE2-O 3.49Å; Q25-A153 HydrophobicContact CG-CB 4.02Å; Q25-V156 HydrophobicContact CB-CG1 4.17Å; Q25-V156 HydrophobicContact CG-CB 4.31Å; Q25-V156 HydrophobicContact CG-CG1 4.07Å; Q25-V156 HydrophobicContact CG-CG2 4.12Å
26	F	97	Very high	89	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-71.7	-43.4	175	180	-110.6	0	0	0	112.8	L22 L23 L24 R46 I48 L57 I59 V156 F160	L22-F26 VanDerWaalsContact O-CB 3.3Å; L22-F26 WeakPolarHBondContact O-CB 3.16Å; L22-F26 PolarHBondContact O-N 2.82Å; L23-F26 WeakPolarHBondContact O-CB 3.48Å; L23-F26 PolarHBondContact O-N 3.32Å; L23-F26 VanDerWaalsContact O-N 3.14Å; L24-F26 VanDerWaalsContact C-N 3.28Å; L24-F26 PolarHBondContact O-N 2.68Å; F26-R46 HydrophobicContact CD1-CB 4.41Å; F26-R46 HydrophobicContact CE1-CB 3.72Å; F26-R46 HydrophobicContact CE1-CG 4.19Å; F26-R46 HydrophobicContact CZ-CB 4.28Å; F26-R46 HydrophobicContact CZ-CG 4.32Å; F26-R46 VanDerWaalsContact O-CD 3.3Å; F26-R46 WeakPolarHBondContact O-CD 3.4Å; F26-R46 PolarHBondContact O-NH1 3.29Å; F26-I48 HydrophobicContact CZ-CG2 4Å; F26-L57 HydrophobicContact CE1-CD1 4.1Å; F26-L57 HydrophobicContact CZ-CD1 3.96Å; F26-I59 HydrophobicContact CD1-CD1 3.76Å; F26-I59 HydrophobicContact CE1-CD1 3.75Å; F26-V156 HydrophobicContact CB-CG1 4.11Å; F26-F160 HydrophobicContact CB-CD2 3.86Å; F26-F160 HydrophobicContact CB-CE2 3.62Å; F26-F160 HydrophobicContact CB-CG 4.46Å; F26-F160 HydrophobicContact CB-CZ 4.02Å; F26-F160 HydrophobicContact CD1-CB 4.46Å; F26-F160 AromaticContact CD1-CD1 3.84Å; F26-F160 HydrophobicContact CD1-CD1 3.84Å; F26-F160 HydrophobicContact CD1-CD2 4.16Å; F26-F160 HydrophobicContact CD1-CE1 4.06Å; F26-F160 HydrophobicContact CD1-CE2 4.37Å; F26-F160 AromaticContact CD1-CG 3.9Å; F26-F160 HydrophobicContact CD1-CG 3.9Å; F26-F160 HydrophobicContact CD1-CZ 4.31Å; F26-F160 HydrophobicContact CD2-CB 3.85Å; F26-F160 AromaticContact CD2-CD2 3.63Å; F26-F160 HydrophobicContact CD2-CD2 3.63Å; F26-F160 HydrophobicContact CD2-CE2 4.29Å; F26-F160 AromaticContact CD2-CG 3.76Å; F26-F160 HydrophobicContact CD2-CG 3.76Å; F26-F160 HydrophobicContact CE1-CB 4.14Å; F26-F160 AromaticContact CE1-CD1 3.94Å; F26-F160 HydrophobicContact CE1-CD1 3.94Å; F26-F160 HydrophobicContact CE1-CG 4.01Å; F26-F160 HydrophobicContact CE2-CB 3.5Å; F26-F160 HydrophobicContact CE2-CD2 4.2Å; F26-F160 AromaticContact CE2-CG 3.9Å; F26-F160 HydrophobicContact CE2-CG 3.9Å; F26-F160 HydrophobicContact CG-CB 4.32Å; F26-F160 HydrophobicContact CG-CD1 4.15Å; F26-F160 AromaticContact CG-CD2 3.61Å; F26-F160 HydrophobicContact CG-CD2 3.61Å; F26-F160 HydrophobicContact CG-CE1 4.36Å; F26-F160 AromaticContact CG-CE2 3.85Å; F26-F160 HydrophobicContact CG-CE2 3.85Å; F26-F160 AromaticContact CG-CG 3.77Å; F26-F160 HydrophobicContact CG-CG 3.77Å; F26-F160 HydrophobicContact CG-CZ 4.21Å; F26-F160 HydrophobicContact CZ-CB 3.66Å; F26-F160 HydrophobicContact CZ-CD1 4.35Å; F26-F160 HydrophobicContact CZ-CG 4.02Å
27	T	94.3	Very high	88.3	Confident	40 Å²	40	55.3 Å²	55.3	25%	0.245	29%	0.285	C	S	.	.	H	α-helix	trans	-82	-43	-176	60.1	0	0	0	0	112.8	L23 L24	L23-T27 HydrophobicContact CD1-CG2 3.85Å; L23-T27 HydrophobicContact CG-CG2 4.49Å; L23-T27 WeakPolarHBondContact O-CG2 3.34Å; L23-T27 PolarHBondContact O-N 3.3Å; L23-T27 PolarHBondContact O-OG1 2.99Å; L24-T27 PolarHBondContact O-N 2.98Å
28	D	92.3	Very high	87.2	Confident	75 Å²	75	56.3 Å²	56.3	40%	0.401	29%	0.291	S	S	.	.	H	α-helix	trans	-115.4	-6.7	-164.7	-64.8	15.6	0	0	0	113.1	L24 R30	L24-D28 HydrophobicContact CD1-CB 3.92Å; L24-D28 WeakPolarHBondContact CD1-OD2 3.22Å; L24-D28 WeakPolarHBondContact O-CA 3.43Å; L24-D28 WeakPolarHBondContact O-CB 3.16Å; L24-D28 PolarHBondContact O-N 3.17Å; D28-R30 HydrophobicContact CB-CB 4.35Å; D28-R30 HydrophobicContact CB-CG 4.28Å; D28-R30 PolarHBondContact O-N 2.97Å; D28-R30 IonicContact OD2-CZ 3.72Å; D28-R30 IonicContact OD2-NE 3.76Å; D28-R30 IonicContact OD2-NH2 3.67Å; D28-R30 PolarHBondContact OD2-NH2 2.87Å
29	K	92.4	Very high	86	Confident	110 Å²	110	62.5 Å²	62.5	48%	0.478	32%	0.32	S	S	.	.	S	Bend	trans	56	36	-174.2	-54.5	-66.5	168.4	-167.8	0	112.5	L24 Q25 E157	L24-K29 PolarHBondContact O-N 2.99Å; Q25-K29 WeakPolarHBondContact O-CA 3.39Å; Q25-K29 PolarHBondContact O-N 3.17Å; Q25-K29 PolarHBondContact OE1-O 3.1Å; K29-E157 IonicContact NZ-OE2 2.72Å; K29-E157 PolarHBondContact NZ-OE2 3.17Å
30	R	88	Confident	84.8	Confident	148 Å²	148	62.8 Å²	62.8	56%	0.558	33%	0.325	S	S	*	.			trans	-122.5	148.9	179.4	-67.6	-173.1	-63.6	161.4	0.1	111.1	L24 Q25 D28	L24-R30 HydrophobicContact CD2-CB 4.37Å; L24-R30 HydrophobicContact CG-CB 4.27Å; Q25-R30 WeakPolarHBondContact CA-O 3.43Å; Q25-R30 PolarHBondContact N-O 3.18Å; Q25-R30 VanDerWaalsContact OE1-N 3.1Å; D28-R30 HydrophobicContact CB-CB 4.35Å; D28-R30 HydrophobicContact CB-CG 4.28Å; D28-R30 PolarHBondContact O-N 2.97Å; D28-R30 IonicContact OD2-CZ 3.72Å; D28-R30 IonicContact OD2-NE 3.76Å; D28-R30 IonicContact OD2-NH2 3.67Å; D28-R30 PolarHBondContact OD2-NH2 2.87Å
31	F	85.2	Confident	84.2	Confident	82 Å²	82	63.9 Å²	63.9	36%	0.36	33%	0.331	S	S	.	.			trans	-117.9	130.3	169.4	174.8	-105.1	0	0	0	109.8	C21 P33 A150 K151	C21-F31 HydrophobicContact CB-CD2 4.46Å; C21-F31 HydrophobicContact CB-CE2 4.39Å; F31-P33 HydrophobicContact CE1-CB 3.85Å; F31-P33 HydrophobicContact CZ-CB 4.42Å; F31-A150 HydrophobicContact CD2-CB 4.4Å; F31-K151 HydrophobicContact CD1-CB 4.45Å; F31-K151 HydrophobicContact CD1-CG 4.07Å; F31-K151 HydrophobicContact CD2-CB 4.17Å; F31-K151 HydrophobicContact CE1-CB 4.27Å; F31-K151 HydrophobicContact CE1-CG 3.88Å; F31-K151 HydrophobicContact CE2-CB 3.99Å; F31-K151 HydrophobicContact CE2-CG 4.49Å; F31-K151 HydrophobicContact CG-CB 4.39Å; F31-K151 HydrophobicContact CG-CG 4.45Å; F31-K151 HydrophobicContact CZ-CB 4.04Å; F31-K151 HydrophobicContact CZ-CG 4.11Å
32	Q	81.6	Confident	83.8	Confident	88 Å²	88	67.6 Å²	67.6	41%	0.411	35%	0.347	S	S	.	.			trans	-113.7	112.5	176.5	-171.6	172.3	-34.6	0	0	109.4	L24 V34	L24-Q32 HydrophobicContact CD2-CB 3.92Å; Q32-V34 WeakPolarHBondContact CG-O 3.11Å; Q32-V34 PolarHBondContact NE2-O 3.03Å
33	P	70.9	Confident	83.4	Confident	108 Å²	108	72.8 Å²	72.8	70%	0.701	37%	0.37	S	S	*	.	S	Bend	trans	-73.3	-29.1	-175.5	25.3	-31.6	0	0	0	113.4	F31	F31-P33 HydrophobicContact CE1-CB 3.85Å; F31-P33 HydrophobicContact CZ-CB 4.42Å
34	V	71.8	Confident	83.3	Confident	110 Å²	110	72.8 Å²	72.8	67%	0.667	37%	0.373	S	S	*	.	S	Bend	trans	-104.2	99.3	175	-176.4	0	0	0	0	107.4	Q32	Q32-V34 WeakPolarHBondContact CG-O 3.11Å; Q32-V34 PolarHBondContact NE2-O 3.03Å
35	H	66.3	Low	83.3	Confident	63 Å²	63	73.6 Å²	73.6	29%	0.292	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-101.3	123	173	-114.9	-78.5	0	0	0	109.2	S20 C21	S20-H35 WeakPolarHBondContact CB-CE1 3.18Å; C21-H35 PolarHBondContact SG-CD2 3Å
36	D	73.9	Confident	83.3	Confident	132 Å²	132	75.9 Å²	75.9	71%	0.706	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-62.1	150.8	165.7	-67.5	-37.5	0	0	0	109.2	T38	D36-T38 PolarHBondContact O-N 3Å
37	L	79.1	Confident	83.2	Confident	106 Å²	106	78.7 Å²	78.7	56%	0.555	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-58.8	125.8	175.4	-67.7	169.5	0	0	0	109.1	T15 I39	T15-L37 HydrophobicContact CG2-CD2 3.47Å; T15-L37 VanDerWaalsContact CG2-CD2 3.47Å; L37-I39 PolarHBondContact O-N 3.03Å
38	T	73.1	Confident	83.3	Confident	21 Å²	21	77.2 Å²	77.2	13%	0.129	40%	0.395	C	S	.	.			trans	-62.6	112.1	174	-40.4	0	0	0	0	109.1	S20 D36 E42 A63	S20-T38 PolarHBondContact OG-OG1 3.27Å; D36-T38 PolarHBondContact O-N 3Å; T38-E42 HydrophobicContact CG2-CG 4.12Å; T38-A63 VanDerWaalsContact O-CB 3.31Å; T38-A63 WeakPolarHBondContact O-CB 3.48Å
39	I	71	Confident	83.5	Confident	143 Å²	143	77.4 Å²	77.4	73%	0.733	40%	0.399	S	S	*	.			trans	-93.2	111.3	174.1	-58.6	175.8	0	0	0	107.4	L37	L37-I39 PolarHBondContact O-N 3.03Å
40	G	70.4	Confident	83.6	Confident	15 Å²	15	72.4 Å²	72.4	16%	0.155	38%	0.378	C	S	.	.	S	Bend	trans	80.2	-119.7	-177.4	0	0	0	0	0	112.7	A63	G40-A63 WeakPolarHBondContact O-CB 3.41Å; G40-A63 PolarHBondContact O-N 3.38Å
41	V	80.6	Confident	83.7	Confident	34 Å²	34	71.5 Å²	71.5	21%	0.206	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	131.6	-173.3	177.4	0	0	0	0	111.1	W60 D61 T62 Y75	V41-W60 HydrophobicContact CG1-CB 3.87Å; V41-W60 HydrophobicContact CG1-CG 4.24Å; V41-D61 CarbonylContact C-O 3.56Å; V41-D61 VanDerWaalsContact CA-O 3.24Å; V41-D61 WeakPolarHBondContact CA-O 3.47Å; V41-D61 WeakPolarHBondContact CG1-O 3.31Å; V41-T62 HydrophobicContact CG2-CG2 4.3Å; V41-Y75 HydrophobicContact CB-CD2 4.5Å; V41-Y75 HydrophobicContact CB-CE1 4.14Å; V41-Y75 HydrophobicContact CB-CE2 4.05Å; V41-Y75 HydrophobicContact CG1-CD1 4.06Å; V41-Y75 HydrophobicContact CG1-CE1 3.89Å; V41-Y75 HydrophobicContact CG1-CE2 4.49Å; V41-Y75 HydrophobicContact CG1-CG 4.39Å; V41-Y75 HydrophobicContact CG2-CD1 4.43Å; V41-Y75 HydrophobicContact CG2-CD2 3.58Å; V41-Y75 HydrophobicContact CG2-CE1 4.22Å; V41-Y75 HydrophobicContact CG2-CE2 3.35Å; V41-Y75 HydrophobicContact CG2-CG 4.11Å
42	E	86.5	Confident	84	Confident	94 Å²	94	70.9 Å²	70.9	44%	0.439	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	150.1	171.7	-72.6	-175.9	-174.1	0	0	111	T38 W60 D61	T38-E42 HydrophobicContact CG2-CG 4.12Å; E42-W60 CarbonylContact O-C 3.59Å; E42-W60 WeakPolarHBondContact O-CA 3.43Å; E42-D61 HydrophobicContact CB-CB 4.25Å; E42-D61 PolarHBondContact N-O 3.46Å; E42-D61 PolarHBondContact O-N 3.07Å
43	F	90.8	Very high	84.5	Confident	110 Å²	110	70.2 Å²	70.2	48%	0.482	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.7	-177.7	175.3	-95.1	0	0	0	111.1	A45 Q58 I59 W60	F43-A45 HydrophobicContact CE1-CB 3.94Å; F43-A45 HydrophobicContact CZ-CB 3.91Å; F43-Q58 HydrophobicContact CE2-CB 3.83Å; F43-Q58 HydrophobicContact CE2-CG 3.99Å; F43-Q58 HydrophobicContact CZ-CB 4.18Å; F43-Q58 HydrophobicContact CZ-CG 3.88Å; F43-I59 WeakPolarHBondContact CA-O 3.42Å; F43-W60 HydrophobicContact CD2-CD2 4.23Å; F43-W60 AromaticContact CD2-CE2 3.97Å; F43-W60 HydrophobicContact CD2-CZ2 4.26Å; F43-W60 HydrophobicContact CE2-CH2 4.18Å; F43-W60 HydrophobicContact CE2-CZ2 4.05Å; F43-W60 HydrophobicContact CE2-CZ3 4.43Å
44	G	93.6	Very high	85.6	Confident	10 Å²	10	68.5 Å²	68.5	10%	0.103	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	154.7	168.3	0	0	0	0	0	111.5	I59	G44-I59 PolarHBondContact N-O 3.04Å; G44-I59 PolarHBondContact O-N 3.3Å
45	A	95.1	Very high	86.8	Confident	44 Å²	44	63.2 Å²	63.2	36%	0.364	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	140.7	173.2	0	0	0	0	0	111.1	F43 L57	F43-A45 HydrophobicContact CE1-CB 3.94Å; F43-A45 HydrophobicContact CZ-CB 3.91Å; A45-L57 CarbonylContact C-O 3.6Å; A45-L57 WeakPolarHBondContact CA-O 3.28Å; A45-L57 WeakPolarHBondContact CB-O 3.15Å
46	R	95.6	Very high	88.2	Confident	61 Å²	61	63.3 Å²	63.3	23%	0.23	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	140.7	177.3	-172.2	164.9	172.8	-140.7	-14	111.5	F26 L57 E157	F26-R46 HydrophobicContact CD1-CB 4.41Å; F26-R46 HydrophobicContact CE1-CB 3.72Å; F26-R46 HydrophobicContact CE1-CG 4.19Å; F26-R46 HydrophobicContact CZ-CB 4.28Å; F26-R46 HydrophobicContact CZ-CG 4.32Å; F26-R46 VanDerWaalsContact O-CD 3.3Å; F26-R46 WeakPolarHBondContact O-CD 3.4Å; F26-R46 PolarHBondContact O-NH1 3.29Å; R46-L57 PolarHBondContact N-O 3.09Å; R46-L57 PolarHBondContact O-N 2.87Å; R46-E157 IonicContact CZ-OE1 3.46Å; R46-E157 IonicContact CZ-OE2 3.61Å; R46-E157 IonicContact NH1-OE1 3.74Å; R46-E157 PolarHBondContact NH1-OE1 3.16Å; R46-E157 IonicContact NH1-OE2 2.78Å; R46-E157 PolarHBondContact NH1-OE2 2.99Å; R46-E157 IonicContact NH2-OE1 3.63Å; R46-E157 PolarHBondContact NH2-OE1 3.42Å; R46-E157 IonicContact NH2-OE2 3.21Å
47	M	95.8	Very high	89.3	Confident	58 Å²	58	57 Å²	57	29%	0.286	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	131	171	-69.5	-57.4	-58.6	0	0	109.5	Q54 I55 K56	M47-Q54 HydrophobicContact CE-CB 3.74Å; M47-I55 WeakPolarHBondContact CA-O 3.33Å; M47-K56 HydrophobicContact CE-CB 4.44Å; M47-K56 HydrophobicContact SD-CB 3.54Å; M47-K56 VanDerWaalsContact SD-CB 3.54Å; M47-K56 HydrophobicContact SD-CD 4.26Å; M47-K56 HydrophobicContact SD-CG 3.77Å
48	I	96.3	Very high	90.1	Very high	9 Å²	9	54 Å²	54	5%	0.046	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	164.2	172.6	64.9	167.4	0	0	0	109.9	F26 I50 I55 L57 A164	F26-I48 HydrophobicContact CZ-CG2 4Å; I48-I50 HydrophobicContact CD1-CD1 3.85Å; I48-I50 HydrophobicContact CD1-CG1 4.09Å; I48-I55 HydrophobicContact CG1-CB 4.02Å; I48-I55 HydrophobicContact CG1-CG2 4.46Å; I48-I55 PolarHBondContact N-O 2.83Å; I48-I55 PolarHBondContact O-N 3.37Å; I48-L57 HydrophobicContact CD1-CD1 3.87Å; I48-L57 HydrophobicContact CD1-CD2 4.14Å; I48-L57 HydrophobicContact CD1-CG 3.99Å; I48-L57 HydrophobicContact CG1-CD1 4.43Å; I48-L57 HydrophobicContact CG1-CG 4.19Å; I48-L57 HydrophobicContact CG2-CD1 4.36Å; I48-A164 HydrophobicContact CD1-CB 3.58Å
49	T	94.8	Very high	91.3	Very high	79 Å²	79	53 Å²	53	49%	0.485	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.3	175.6	-52.8	0	0	0	0	109.7	K53 Q54	T49-K53 WeakPolarHBondContact CA-O 3.37Å; T49-Q54 PolarHBondContact OG1-NE2 2.95Å
50	I	94.4	Very high	92.4	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.026	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	124.2	173.6	-60	-173.3	0	0	0	107.1	I48 G52 K53 I55 A164 K165 Y168	I48-I50 HydrophobicContact CD1-CD1 3.85Å; I48-I50 HydrophobicContact CD1-CG1 4.09Å; I50-G52 PolarHBondContact O-N 2.84Å; I50-G52 VanDerWaalsContact O-N 3.13Å; I50-K53 PolarHBondContact N-O 2.95Å; I50-K53 WeakPolarHBondContact O-CA 3.36Å; I50-K53 WeakPolarHBondContact O-CB 3.38Å; I50-K53 PolarHBondContact O-N 3.05Å; I50-I55 HydrophobicContact CB-CD1 3.9Å; I50-I55 HydrophobicContact CD1-CD1 3.95Å; I50-I55 HydrophobicContact CG1-CD1 4.08Å; I50-A164 HydrophobicContact CD1-CB 3.5Å; I50-A164 VanDerWaalsContact CD1-CB 3.5Å; I50-K165 HydrophobicContact CD1-CG 3.82Å; I50-K165 HydrophobicContact CG1-CG 4.38Å; I50-K165 HydrophobicContact CG2-CG 4.06Å; I50-Y168 HydrophobicContact CG2-CD1 3.91Å; I50-Y168 HydrophobicContact CG2-CE1 4.42Å; I50-Y168 HydrophobicContact CG2-CG 4.3Å
51	D	91.5	Very high	93.4	Very high	130 Å²	130	47.4 Å²	47.4	70%	0.695	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	42.6	-179.8	-58.1	-13.8	0	0	0	114	K53 Y168	D51-K53 PolarHBondContact O-N 2.83Å; D51-Y168 HydrophobicContact CB-CE1 4.26Å
52	G	90.6	Very high	93.8	Very high	68 Å²	68	45.8 Å²	45.8	70%	0.701	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.2	-1.1	-178	0	0	0	0	0	115	I50	I50-G52 PolarHBondContact O-N 2.84Å; I50-G52 VanDerWaalsContact O-N 3.13Å
53	K	91.9	Very high	93.6	Very high	74 Å²	74	41.4 Å²	41.4	32%	0.322	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	131.1	175.4	-59.6	-72	-178.6	166.1	0	110.6	A4 T49 I50 D51 H191	A4-K53 HydrophobicContact CB-CB 4.09Å; A4-K53 HydrophobicContact CB-CD 4.06Å; T49-K53 WeakPolarHBondContact CA-O 3.37Å; I50-K53 PolarHBondContact N-O 2.95Å; I50-K53 WeakPolarHBondContact O-CA 3.36Å; I50-K53 WeakPolarHBondContact O-CB 3.38Å; I50-K53 PolarHBondContact O-N 3.05Å; D51-K53 PolarHBondContact O-N 2.83Å; K53-H191 PolarHBondContact NZ-NE2 2.71Å
54	Q	95.1	Very high	92.8	Very high	72 Å²	72	36.5 Å²	36.5	34%	0.336	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	121.1	171.3	-70.3	-62	-33.8	0	0	109.7	Y3 A4 M47 T49	Y3-Q54 CarbonylContact C-O 3.6Å; Y3-Q54 WeakPolarHBondContact CA-O 3.11Å; A4-Q54 PolarHBondContact N-O 3.47Å; M47-Q54 HydrophobicContact CE-CB 3.74Å; T49-Q54 PolarHBondContact OG1-NE2 2.95Å
55	I	95.8	Very high	91.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.6	179.2	-60.8	178.6	0	0	0	108.8	Y5 F7 M47 I48 I50 L57 Y168	Y5-I55 WeakPolarHBondContact O-CA 3.46Å; F7-I55 HydrophobicContact CD2-CG2 3.66Å; F7-I55 HydrophobicContact CE2-CD1 3.88Å; F7-I55 HydrophobicContact CE2-CG2 3.78Å; F7-I55 HydrophobicContact CG-CG2 4.08Å; F7-I55 HydrophobicContact CZ-CD1 4.09Å; F7-I55 HydrophobicContact CZ-CG2 4.28Å; M47-I55 WeakPolarHBondContact CA-O 3.33Å; I48-I55 HydrophobicContact CG1-CB 4.02Å; I48-I55 HydrophobicContact CG1-CG2 4.46Å; I48-I55 PolarHBondContact N-O 2.83Å; I48-I55 PolarHBondContact O-N 3.37Å; I50-I55 HydrophobicContact CB-CD1 3.9Å; I50-I55 HydrophobicContact CD1-CD1 3.95Å; I50-I55 HydrophobicContact CG1-CD1 4.08Å; I55-L57 HydrophobicContact CG2-CD2 4.1Å; I55-Y168 HydrophobicContact CD1-CD2 4.22Å
56	K	96.5	Very high	90.5	Very high	64 Å²	64	42.8 Å²	42.8	28%	0.278	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	113	174.3	-171.1	172.9	-177.9	-179.2	0	109.6	Y3 Y5 L6 F7 M47	Y3-K56 HydrophobicContact CD1-CB 4.15Å; Y3-K56 HydrophobicContact CD1-CD 4.11Å; Y3-K56 HydrophobicContact CD2-CB 4.41Å; Y3-K56 HydrophobicContact CE1-CD 4.01Å; Y3-K56 HydrophobicContact CG-CB 4.03Å; Y5-K56 PolarHBondContact O-N 3.47Å; L6-K56 CarbonylContact C-O 3.56Å; L6-K56 VanDerWaalsContact CA-O 3.24Å; L6-K56 WeakPolarHBondContact CA-O 3.31Å; L6-K56 HydrophobicContact CB-CB 4.37Å; L6-K56 HydrophobicContact CD1-CD 4.37Å; L6-K56 HydrophobicContact CG-CB 4.46Å; F7-K56 PolarHBondContact N-O 2.84Å; M47-K56 HydrophobicContact CE-CB 4.44Å; M47-K56 HydrophobicContact SD-CB 3.54Å; M47-K56 VanDerWaalsContact SD-CB 3.54Å; M47-K56 HydrophobicContact SD-CD 4.26Å; M47-K56 HydrophobicContact SD-CG 3.77Å
57	L	97.4	Very high	88.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	128.4	167.9	-57.7	-171.8	0	0	0	109	F7 Y9 F26 A45 R46 I48 I55 I59 F160 A164	F7-L57 HydrophobicContact CB-CD2 3.92Å; F7-L57 HydrophobicContact CD2-CD2 4.01Å; F7-L57 HydrophobicContact CG-CD2 4.41Å; Y9-L57 HydrophobicContact CE1-CD2 4.04Å; Y9-L57 HydrophobicContact CE2-CD1 4.35Å; F26-L57 HydrophobicContact CE1-CD1 4.1Å; F26-L57 HydrophobicContact CZ-CD1 3.96Å; A45-L57 CarbonylContact C-O 3.6Å; A45-L57 WeakPolarHBondContact CA-O 3.28Å; A45-L57 WeakPolarHBondContact CB-O 3.15Å; R46-L57 PolarHBondContact N-O 3.09Å; R46-L57 PolarHBondContact O-N 2.87Å; I48-L57 HydrophobicContact CD1-CD1 3.87Å; I48-L57 HydrophobicContact CD1-CD2 4.14Å; I48-L57 HydrophobicContact CD1-CG 3.99Å; I48-L57 HydrophobicContact CG1-CD1 4.43Å; I48-L57 HydrophobicContact CG1-CG 4.19Å; I48-L57 HydrophobicContact CG2-CD1 4.36Å; I55-L57 HydrophobicContact CG2-CD2 4.1Å; L57-I59 HydrophobicContact CB-CD1 4.29Å; L57-I59 HydrophobicContact CB-CG1 4.25Å; L57-F160 HydrophobicContact CD1-CB 4.41Å; L57-A164 HydrophobicContact CD2-CB 4.14Å
58	Q	96.4	Very high	87.5	Confident	43 Å²	43	44.6 Å²	44.6	20%	0.201	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.1	165.8	-74.3	-165.3	-41.1	0	0	107.3	L6 F7 K8 Y9 F43 W60	L6-Q58 HydrophobicContact CD1-CG 4.16Å; L6-Q58 HydrophobicContact CD2-CG 4.26Å; L6-Q58 HydrophobicContact CG-CG 4.15Å; F7-Q58 PolarHBondContact O-N 2.95Å; K8-Q58 CarbonylContact C-O 3.52Å; Y9-Q58 PolarHBondContact N-O 3.35Å; F43-Q58 HydrophobicContact CE2-CB 3.83Å; F43-Q58 HydrophobicContact CE2-CG 3.99Å; F43-Q58 HydrophobicContact CZ-CB 4.18Å; F43-Q58 HydrophobicContact CZ-CG 3.88Å; Q58-W60 VanDerWaalsContact C-CZ3 3.43Å; Q58-W60 HydrophobicContact CB-CE3 4.21Å; Q58-W60 HydrophobicContact CB-CH2 3.53Å; Q58-W60 HydrophobicContact CB-CZ3 3.25Å; Q58-W60 HydrophobicContact CG-CH2 4.39Å; Q58-W60 HydrophobicContact CG-CZ3 4.5Å; Q58-W60 WeakPolarHBondContact O-CZ3 3.44Å
59	I	96.4	Very high	86.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126.2	-168.1	-54.3	155	0	0	0	108.3	Y9 I11 L23 F26 F43 G44 L57 F160	Y9-I59 HydrophobicContact CG-CG1 4.46Å; Y9-I59 WeakPolarHBondContact O-CA 3.34Å; I11-I59 HydrophobicContact CD1-CG2 3.75Å; I11-I59 HydrophobicContact CG1-CG2 3.7Å; L23-I59 HydrophobicContact CD1-CB 3.84Å; L23-I59 HydrophobicContact CD1-CD1 3.83Å; L23-I59 HydrophobicContact CD1-CG1 4.47Å; L23-I59 HydrophobicContact CD1-CG2 3.74Å; F26-I59 HydrophobicContact CD1-CD1 3.76Å; F26-I59 HydrophobicContact CE1-CD1 3.75Å; F43-I59 WeakPolarHBondContact CA-O 3.42Å; G44-I59 PolarHBondContact N-O 3.04Å; G44-I59 PolarHBondContact O-N 3.3Å; L57-I59 HydrophobicContact CB-CD1 4.29Å; L57-I59 HydrophobicContact CB-CG1 4.25Å; I59-F160 HydrophobicContact CD1-CD1 3.83Å; I59-F160 HydrophobicContact CD1-CE1 3.62Å; I59-F160 HydrophobicContact CG1-CE1 4.24Å; I59-F160 HydrophobicContact CG2-CE1 4.21Å
60	W	94.3	Very high	84.9	Confident	41 Å²	41	46.3 Å²	46.3	16%	0.155	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	107.6	176	-71.9	-100.3	0	0	0	108.3	K8 Y9 I10 I11 V41 E42 F43 Q58 Y75	K8-W60 HydrophobicContact CB-CE3 4.44Å; K8-W60 HydrophobicContact CB-CH2 4.06Å; K8-W60 HydrophobicContact CB-CZ3 3.59Å; K8-W60 HydrophobicContact CD-CD2 4.49Å; K8-W60 HydrophobicContact CD-CE3 4.02Å; K8-W60 HydrophobicContact CD-CH2 3.57Å; K8-W60 HydrophobicContact CD-CZ2 4.1Å; K8-W60 HydrophobicContact CD-CZ3 3.55Å; K8-W60 HydrophobicContact CG-CE3 3.65Å; K8-W60 HydrophobicContact CG-CH2 3.75Å; K8-W60 HydrophobicContact CG-CZ3 3.19Å; Y9-W60 VanDerWaalsContact O-CE3 3.27Å; Y9-W60 PolarHBondContact O-N 3Å; I10-W60 WeakPolarHBondContact CA-O 3.24Å; I10-W60 HydrophobicContact CG2-CB 4.31Å; I11-W60 PolarHBondContact N-O 2.9Å; V41-W60 HydrophobicContact CG1-CB 3.87Å; V41-W60 HydrophobicContact CG1-CG 4.24Å; E42-W60 CarbonylContact O-C 3.59Å; E42-W60 WeakPolarHBondContact O-CA 3.43Å; F43-W60 HydrophobicContact CD2-CD2 4.23Å; F43-W60 AromaticContact CD2-CE2 3.97Å; F43-W60 HydrophobicContact CD2-CZ2 4.26Å; F43-W60 HydrophobicContact CE2-CH2 4.18Å; F43-W60 HydrophobicContact CE2-CZ2 4.05Å; F43-W60 HydrophobicContact CE2-CZ3 4.43Å; Q58-W60 VanDerWaalsContact C-CZ3 3.43Å; Q58-W60 HydrophobicContact CB-CE3 4.21Å; Q58-W60 HydrophobicContact CB-CH2 3.53Å; Q58-W60 HydrophobicContact CB-CZ3 3.25Å; Q58-W60 HydrophobicContact CG-CH2 4.39Å; Q58-W60 HydrophobicContact CG-CZ3 4.5Å; Q58-W60 WeakPolarHBondContact O-CZ3 3.44Å; W60-Y75 AromaticContact CD1-CD1 3.33Å; W60-Y75 AromaticContact CD1-CE1 3.64Å; W60-Y75 HydrophobicContact CG-CD1 4.05Å; W60-Y75 AromaticContact NE1-CD1 3.8Å; W60-Y75 AromaticContact NE1-CE1 3.97Å
61	D	92.1	Very high	83.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	125	170.8	175.6	41	0	0	0	109.5	K19 S20 L23 V41 E42	K19-D61 WeakPolarHBondContact CB-OD1 3.4Å; S20-D61 VanDerWaalsContact CA-OD2 3.26Å; S20-D61 WeakPolarHBondContact CA-OD2 3.46Å; S20-D61 WeakPolarHBondContact CB-OD2 3.45Å; S20-D61 PolarHBondContact N-OD2 3.42Å; S20-D61 PolarHBondContact OG-OD2 3.02Å; L23-D61 HydrophobicContact CD2-CB 3.64Å; V41-D61 CarbonylContact C-O 3.56Å; V41-D61 VanDerWaalsContact CA-O 3.24Å; V41-D61 WeakPolarHBondContact CA-O 3.47Å; V41-D61 WeakPolarHBondContact CG1-O 3.31Å; E42-D61 HydrophobicContact CB-CB 4.25Å; E42-D61 PolarHBondContact N-O 3.46Å; E42-D61 PolarHBondContact O-N 3.07Å
62	T	88.1	Confident	82.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	149.5	-170	68.9	0	0	0	0	112.1	I11 I12 K19 V41 G64 T72	I11-T62 WeakPolarHBondContact O-CB 3.49Å; I11-T62 PolarHBondContact O-N 2.92Å; I11-T62 PolarHBondContact O-OG1 3.28Å; I12-T62 HydrophobicContact CG2-CG2 4.5Å; K19-T62 WeakPolarHBondContact CE-O 3.43Å; V41-T62 HydrophobicContact CG2-CG2 4.3Å; T62-G64 PolarHBondContact O-N 2.96Å; T62-T72 HydrophobicContact CG2-CG2 3.81Å
63	A	82.3	Confident	82.2	Confident	1 Å²	1	45 Å²	45	1%	0.008	23%	0.225	C	C	.	.			trans	-58.3	129.7	170.6	0	0	0	0	0	110.6	T38 G40 Q65 F68	T38-A63 VanDerWaalsContact O-CB 3.31Å; T38-A63 WeakPolarHBondContact O-CB 3.48Å; G40-A63 WeakPolarHBondContact O-CB 3.41Å; G40-A63 PolarHBondContact O-N 3.38Å; A63-Q65 VanDerWaalsContact C-N 3.32Å; A63-F68 HydrophobicContact CB-CB 3.76Å; A63-F68 HydrophobicContact CB-CD2 3.94Å; A63-F68 HydrophobicContact CB-CG 4.16Å
64	G	74.6	Confident	81.7	Confident	7 Å²	7	45.4 Å²	45.4	7%	0.072	24%	0.237	C	C	.	.			trans	-89.2	7.5	177.8	0	0	0	0	0	114.3	G13 D14 T15 K19 T62	G13-G64 WeakPolarHBondContact O-CA 3.49Å; D14-G64 CarbonylContact C-O 3.56Å; T15-G64 PolarHBondContact N-O 3.13Å; T15-G64 PolarHBondContact OG1-O 3.21Å; K19-G64 VanDerWaalsContact NZ-CA 3.31Å; T62-G64 PolarHBondContact O-N 2.96Å
65	Q	74.2	Confident	81.3	Confident	64 Å²	64	45.4 Å²	45.4	30%	0.299	23%	0.234	S	C	.	.	S	Bend	trans	-90.8	138.3	178.8	-69.2	-171.5	-4.2	0	0	109.4	T15 A63 S67 F68	T15-Q65 HydrophobicContact CG2-CG 4.26Å; T15-Q65 WeakPolarHBondContact OG1-CA 3.48Å; T15-Q65 WeakPolarHBondContact OG1-CG 3.41Å; T15-Q65 PolarHBondContact OG1-N 3.29Å; T15-Q65 VanDerWaalsContact OG1-N 3.08Å; A63-Q65 VanDerWaalsContact C-N 3.32Å; Q65-S67 PolarHBondContact O-N 3.07Å; Q65-F68 HydrophobicContact CB-CD2 3.96Å; Q65-F68 PolarHBondContact O-N 3.42Å
66	E	65.6	Low	80.8	Confident	122 Å²	122	45.5 Å²	45.5	57%	0.57	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-59.6	-35.7	-179.1	-57.2	-164.3	135.9	0	0	112.5	F68 R69	E66-F68 PolarHBondContact O-N 2.94Å; E66-R69 WeakPolarHBondContact O-CB 3.46Å; E66-R69 PolarHBondContact O-N 2.97Å; E66-R69 IonicContact OE1-CZ 3.58Å; E66-R69 IonicContact OE1-NH1 2.72Å; E66-R69 PolarHBondContact OE1-NH1 2.84Å; E66-R69 IonicContact OE1-NH2 2.68Å
67	S	62.8	Low	80.3	Confident	103 Å²	103	51.3 Å²	51.3	72%	0.72	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-58.7	-18.7	176	-52.8	0	0	0	0	114	Q65	Q65-S67 PolarHBondContact O-N 3.07Å
68	F	67.4	Low	79.7	Confident	55 Å²	55	51.8 Å²	51.8	24%	0.241	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-107.8	2.7	177.2	-61.5	-58.7	0	0	0	113.6	A63 Q65 E66 S70 I71 T72	A63-F68 HydrophobicContact CB-CB 3.76Å; A63-F68 HydrophobicContact CB-CD2 3.94Å; A63-F68 HydrophobicContact CB-CG 4.16Å; Q65-F68 HydrophobicContact CB-CD2 3.96Å; Q65-F68 PolarHBondContact O-N 3.42Å; E66-F68 PolarHBondContact O-N 2.94Å; F68-S70 PolarHBondContact O-N 3.25Å; F68-S70 VanDerWaalsContact O-N 3.17Å; F68-I71 HydrophobicContact CD1-CD1 3.92Å; F68-I71 WeakPolarHBondContact O-CB 3.28Å; F68-I71 PolarHBondContact O-N 3.36Å; F68-T72 PolarHBondContact O-N 3.37Å; F68-T72 PolarHBondContact O-OG1 2.94Å
69	R	68.6	Low	79.5	Confident	35 Å²	35	49.7 Å²	49.7	13%	0.132	25%	0.25	C	C	.	.	H	α-helix	trans	-55.7	-35.8	-179.1	-87.5	-179.3	170.5	151.6	2.3	113.3	E66 I71 T72 R73 W100	E66-R69 WeakPolarHBondContact O-CB 3.46Å; E66-R69 PolarHBondContact O-N 2.97Å; E66-R69 IonicContact OE1-CZ 3.58Å; E66-R69 IonicContact OE1-NH1 2.72Å; E66-R69 PolarHBondContact OE1-NH1 2.84Å; E66-R69 IonicContact OE1-NH2 2.68Å; R69-I71 VanDerWaalsContact C-N 3.33Å; R69-I71 PolarHBondContact O-N 3.08Å; R69-T72 PolarHBondContact O-N 3.32Å; R69-R73 WeakPolarHBondContact O-CG 3.33Å; R69-R73 PolarHBondContact O-N 2.88Å; R69-R73 VanDerWaalsContact O-N 3.07Å; R69-W100 HydrophobicContact CG-CH2 4.02Å; R69-W100 HydrophobicContact CG-CZ3 4.38Å
70	S	67.4	Low	79.4	Confident	89 Å²	89	49.7 Å²	49.7	62%	0.622	25%	0.25	S	C	*	.	H	α-helix	trans	-63.8	-37.3	177.2	57.5	0	0	0	0	112.8	F68	F68-S70 PolarHBondContact O-N 3.25Å; F68-S70 VanDerWaalsContact O-N 3.17Å
71	I	69.2	Low	79.5	Confident	77 Å²	77	47.8 Å²	47.8	40%	0.395	24%	0.242	S	C	.	.	H	α-helix	trans	-70.9	-40.9	175.3	-56.4	-179.2	0	0	0	109.7	F68 R69 R73 S74 Y75	F68-I71 HydrophobicContact CD1-CD1 3.92Å; F68-I71 WeakPolarHBondContact O-CB 3.28Å; F68-I71 PolarHBondContact O-N 3.36Å; R69-I71 VanDerWaalsContact C-N 3.33Å; R69-I71 PolarHBondContact O-N 3.08Å; I71-R73 VanDerWaalsContact C-N 3.33Å; I71-R73 PolarHBondContact O-N 2.65Å; I71-S74 PolarHBondContact O-N 2.76Å; I71-S74 PolarHBondContact O-OG 2.72Å; I71-Y75 HydrophobicContact CG2-CE2 4.33Å; I71-Y75 VanDerWaalsContact O-CD2 3.29Å; I71-Y75 WeakPolarHBondContact O-CD2 3.24Å; I71-Y75 WeakPolarHBondContact O-CE2 3.38Å
72	T	72	Confident	79.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.8	-37.5	-179.7	-61.5	0	0	0	0	112.4	T62 F68 R69 S74 Y75 Y76 W100	T62-T72 HydrophobicContact CG2-CG2 3.81Å; F68-T72 PolarHBondContact O-N 3.37Å; F68-T72 PolarHBondContact O-OG1 2.94Å; R69-T72 PolarHBondContact O-N 3.32Å; T72-S74 VanDerWaalsContact C-N 3.3Å; T72-S74 PolarHBondContact O-N 2.91Å; T72-Y75 WeakPolarHBondContact O-CB 3.46Å; T72-Y75 PolarHBondContact O-N 2.85Å; T72-Y76 HydrophobicContact CG2-CD1 4.37Å; T72-Y76 HydrophobicContact CG2-CE1 3.39Å; T72-Y76 WeakPolarHBondContact O-CD1 3.32Å; T72-Y76 WeakPolarHBondContact O-CE1 3.46Å; T72-W100 HydrophobicContact CG2-CZ3 4.45Å
73	R	78.8	Confident	80.2	Confident	99 Å²	99	47.8 Å²	47.8	37%	0.374	24%	0.242	S	C	.	.	H	α-helix	trans	-59.2	-32.2	-179.9	-75.9	172	-177.9	179.8	-2.5	114.4	R69 I71 Y75 Y76 D103	R69-R73 WeakPolarHBondContact O-CG 3.33Å; R69-R73 PolarHBondContact O-N 2.88Å; R69-R73 VanDerWaalsContact O-N 3.07Å; I71-R73 VanDerWaalsContact C-N 3.33Å; I71-R73 PolarHBondContact O-N 2.65Å; R73-Y75 PolarHBondContact O-N 3.09Å; R73-Y75 VanDerWaalsContact O-N 3.16Å; R73-Y76 WeakPolarHBondContact O-CB 3.21Å; R73-Y76 PolarHBondContact O-N 2.91Å; R73-Y76 VanDerWaalsContact O-N 3.15Å; R73-D103 IonicContact CZ-OD1 3.59Å; R73-D103 IonicContact NE-OD1 3.64Å; R73-D103 IonicContact NE-OD2 3.86Å; R73-D103 IonicContact NH2-OD1 2.84Å; R73-D103 PolarHBondContact NH2-OD1 2.88Å; R73-D103 IonicContact NH2-OD2 3.42Å; R73-D103 PolarHBondContact NH2-OD2 2.79Å
74	S	81.6	Confident	80.9	Confident	82 Å²	82	47.7 Å²	47.7	57%	0.573	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.3	177.8	58.4	0	0	0	0	113.1	I71 T72	I71-S74 PolarHBondContact O-N 2.76Å; I71-S74 PolarHBondContact O-OG 2.72Å; T72-S74 VanDerWaalsContact C-N 3.3Å; T72-S74 PolarHBondContact O-N 2.91Å
75	Y	84.8	Confident	82.1	Confident	71 Å²	71	47.4 Å²	47.4	28%	0.278	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-14.9	179.9	-64.2	-89.3	0	0	0	113.2	K8 V41 W60 I71 T72 R73 R77	K8-Y75 WeakPolarHBondContact CE-O 3.33Å; K8-Y75 PolarHBondContact NZ-O 3.23Å; V41-Y75 HydrophobicContact CB-CD2 4.5Å; V41-Y75 HydrophobicContact CB-CE1 4.14Å; V41-Y75 HydrophobicContact CB-CE2 4.05Å; V41-Y75 HydrophobicContact CG1-CD1 4.06Å; V41-Y75 HydrophobicContact CG1-CE1 3.89Å; V41-Y75 HydrophobicContact CG1-CE2 4.49Å; V41-Y75 HydrophobicContact CG1-CG 4.39Å; V41-Y75 HydrophobicContact CG2-CD1 4.43Å; V41-Y75 HydrophobicContact CG2-CD2 3.58Å; V41-Y75 HydrophobicContact CG2-CE1 4.22Å; V41-Y75 HydrophobicContact CG2-CE2 3.35Å; V41-Y75 HydrophobicContact CG2-CG 4.11Å; W60-Y75 AromaticContact CD1-CD1 3.33Å; W60-Y75 AromaticContact CD1-CE1 3.64Å; W60-Y75 HydrophobicContact CG-CD1 4.05Å; W60-Y75 AromaticContact NE1-CD1 3.8Å; W60-Y75 AromaticContact NE1-CE1 3.97Å; I71-Y75 HydrophobicContact CG2-CE2 4.33Å; I71-Y75 VanDerWaalsContact O-CD2 3.29Å; I71-Y75 WeakPolarHBondContact O-CD2 3.24Å; I71-Y75 WeakPolarHBondContact O-CE2 3.38Å; T72-Y75 WeakPolarHBondContact O-CB 3.46Å; T72-Y75 PolarHBondContact O-N 2.85Å; R73-Y75 PolarHBondContact O-N 3.09Å; R73-Y75 VanDerWaalsContact O-N 3.16Å; Y75-R77 VanDerWaalsContact C-N 3.33Å
76	Y	86.4	Confident	83.2	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.008	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-33.4	-177.7	-71.2	25.2	0	0	0	111.3	I10 I12 T72 R73 G78 A79 W100 D103 A104 H107	I10-Y76 HydrophobicContact CD1-CD1 3.66Å; I10-Y76 HydrophobicContact CD1-CD2 4.46Å; I10-Y76 HydrophobicContact CD1-CE1 3.94Å; I10-Y76 HydrophobicContact CD1-CG 3.94Å; I12-Y76 HydrophobicContact CG2-CE1 3.72Å; I12-Y76 WeakPolarHBondContact CG2-OH 3.4Å; T72-Y76 HydrophobicContact CG2-CD1 4.37Å; T72-Y76 HydrophobicContact CG2-CE1 3.39Å; T72-Y76 WeakPolarHBondContact O-CD1 3.32Å; T72-Y76 WeakPolarHBondContact O-CE1 3.46Å; R73-Y76 WeakPolarHBondContact O-CB 3.21Å; R73-Y76 PolarHBondContact O-N 2.91Å; R73-Y76 VanDerWaalsContact O-N 3.15Å; Y76-G78 PolarHBondContact O-N 2.78Å; Y76-A79 WeakPolarHBondContact O-CB 3.47Å; Y76-A79 PolarHBondContact O-N 3.46Å; Y76-W100 WeakPolarHBondContact OH-CZ3 3.46Å; Y76-D103 WeakPolarHBondContact CD2-O 3.19Å; Y76-D103 HydrophobicContact CE2-CB 4.16Å; Y76-A104 HydrophobicContact CD2-CB 4.46Å; Y76-A104 VanDerWaalsContact CE2-CA 3.46Å; Y76-A104 HydrophobicContact CE2-CB 4.17Å; Y76-H107 CarbonylContact C-O 3.56Å; Y76-H107 HydrophobicContact CD2-CB 3.97Å; Y76-H107 HydrophobicContact CG-CB 4.34Å
77	R	85.3	Confident	84.8	Confident	187 Å²	187	38.6 Å²	38.6	71%	0.706	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	124.9	178.2	-174.1	178	176	88.5	1	110.3	K8 Y75 A79 H107	K8-R77 PolarHBondContact NZ-O 2.94Å; Y75-R77 VanDerWaalsContact C-N 3.33Å; R77-A79 VanDerWaalsContact C-N 3.32Å; R77-A79 PolarHBondContact O-N 2.88Å; R77-H107 PolarHBondContact N-O 2.88Å
78	G	84.5	Confident	86.5	Confident	9 Å²	9	33.7 Å²	33.7	9%	0.093	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	30.5	-179	0	0	0	0	0	113.7	K8 Y76 A182 G184	K8-G78 VanDerWaalsContact CD-O 3.25Å; K8-G78 WeakPolarHBondContact CD-O 3.26Å; K8-G78 WeakPolarHBondContact CG-O 3.42Å; Y76-G78 PolarHBondContact O-N 2.78Å; G78-A182 VanDerWaalsContact CA-O 3.26Å; G78-A182 WeakPolarHBondContact CA-O 3.46Å; G78-G184 WeakPolarHBondContact O-CA 3.48Å; G78-G184 PolarHBondContact O-N 3.16Å
79	A	92.3	Very high	88	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.			trans	-81.4	129.2	161.5	0	0	0	0	0	110.3	K8 I10 Y76 R77 M112	K8-A79 HydrophobicContact CG-CB 4.45Å; I10-A79 HydrophobicContact CD1-CB 4.24Å; I10-A79 HydrophobicContact CG1-CB 4.17Å; I10-A79 HydrophobicContact CG2-CB 4.1Å; Y76-A79 WeakPolarHBondContact O-CB 3.47Å; Y76-A79 PolarHBondContact O-N 3.46Å; R77-A79 VanDerWaalsContact C-N 3.32Å; R77-A79 PolarHBondContact O-N 2.88Å; A79-M112 HydrophobicContact CB-SD 3.68Å
80	A	94.4	Very high	89.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	-84.9	-32.3	172.7	0	0	0	0	0	110.8	K8 V113 I167 N183 I185	K8-A80 PolarHBondContact O-N 3.46Å; A80-V113 PolarHBondContact O-N 3.35Å; A80-I167 HydrophobicContact CB-CD1 4.06Å; A80-I167 HydrophobicContact CB-CG2 4.3Å; A80-I167 WeakPolarHBondContact O-CD1 3.2Å; A80-N183 WeakPolarHBondContact CB-O 3.26Å; A80-I185 HydrophobicContact CB-CD1 4.48Å; A80-I185 HydrophobicContact CB-CG1 3.86Å
81	G	96.3	Very high	90.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.4	178.2	0	0	0	0	0	112.8	K8 Y9 I10 V113	K8-G81 PolarHBondContact O-N 3.18Å; Y9-G81 VanDerWaalsContact CA-O 3.28Å; Y9-G81 WeakPolarHBondContact CA-O 3.35Å; I10-G81 PolarHBondContact N-O 3.32Å; I10-G81 VanDerWaalsContact N-O 3.09Å; G81-V113 CarbonylContact C-O 3.57Å; G81-V113 WeakPolarHBondContact CA-O 3.47Å
82	A	96.9	Very high	92.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.8	169.2	0	0	0	0	0	111.1	I10 M112 V113 I114 M115	I10-A82 HydrophobicContact CD1-CB 4.1Å; I10-A82 HydrophobicContact CG1-CB 3.63Å; I10-A82 CarbonylContact O-C 3.53Å; I10-A82 WeakPolarHBondContact O-CA 3.45Å; A82-M112 HydrophobicContact CB-CE 3.83Å; A82-M112 HydrophobicContact CB-SD 3.88Å; A82-V113 PolarHBondContact N-O 3.46Å; A82-I114 HydrophobicContact CB-CG1 4.29Å; A82-I114 HydrophobicContact CB-CG2 4.5Å; A82-I114 WeakPolarHBondContact O-CA 3.43Å; A82-M115 PolarHBondContact O-N 3.49Å
83	L	98.3	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	109.9	166.8	-56.1	-171	0	0	0	108	I10 I11 I12 V85 M115 I117 F160 T163	I10-L83 PolarHBondContact O-N 3.47Å; I11-L83 WeakPolarHBondContact CA-O 3.47Å; I11-L83 HydrophobicContact CD1-CD1 4.46Å; I11-L83 HydrophobicContact CG1-CB 4.38Å; I11-L83 HydrophobicContact CG1-CD1 4.32Å; I11-L83 HydrophobicContact CG2-CB 4.12Å; I12-L83 PolarHBondContact N-O 3.49Å; L83-V85 HydrophobicContact CB-CG2 4.42Å; L83-M115 WeakPolarHBondContact CA-O 3.33Å; L83-M115 HydrophobicContact CD2-CB 3.7Å; L83-M115 HydrophobicContact CD2-CG 4.04Å; L83-I117 HydrophobicContact CB-CD1 4.01Å; L83-I117 HydrophobicContact CD1-CD1 3.99Å; L83-I117 HydrophobicContact CD2-CD1 4.17Å; L83-I117 HydrophobicContact CG-CD1 4.28Å; L83-F160 HydrophobicContact CD1-CD1 3.75Å; L83-F160 HydrophobicContact CD1-CD2 4.14Å; L83-F160 HydrophobicContact CD1-CE1 3.33Å; L83-F160 HydrophobicContact CD1-CE2 3.78Å; L83-F160 HydrophobicContact CD1-CG 4.15Å; L83-F160 HydrophobicContact CD1-CZ 3.35Å; L83-T163 HydrophobicContact CD2-CG2 4.36Å
84	L	98.1	Very high	94.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	110	178.9	175.2	60.3	0	0	0	108.8	I12 L97 W100 L101 I114 M115 L116 I117	I12-L84 HydrophobicContact CD1-CD1 3.98Å; I12-L84 HydrophobicContact CG1-CB 4.33Å; I12-L84 HydrophobicContact CG1-CD1 3.86Å; L84-L97 HydrophobicContact CD1-CD2 3.8Å; L84-L97 HydrophobicContact CD2-CD2 3.83Å; L84-L97 HydrophobicContact CG-CD2 3.55Å; L84-W100 HydrophobicContact CD1-CB 3.53Å; L84-W100 HydrophobicContact CD1-CG 4.28Å; L84-L101 HydrophobicContact CD2-CB 4.13Å; L84-L101 HydrophobicContact CD2-CD1 4.44Å; L84-I114 HydrophobicContact CB-CG2 4.04Å; L84-M115 PolarHBondContact N-O 2.89Å; L84-L116 HydrophobicContact CD2-CD1 4.18Å; L84-L116 HydrophobicContact CG-CD1 4.11Å; L84-L116 CarbonylContact O-C 3.59Å; L84-L116 WeakPolarHBondContact O-CA 3.43Å; L84-I117 PolarHBondContact O-N 2.84Å
85	V	98.6	Very high	95.2	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.4	-165.6	-167.5	0	0	0	0	111.5	I11 I12 V17 K19 L22 L83 I117 N119	I11-V85 HydrophobicContact CG2-CG2 3.64Å; I12-V85 PolarHBondContact O-N 2.89Å; V17-V85 HydrophobicContact CB-CG1 4.25Å; V17-V85 HydrophobicContact CG2-CB 3.9Å; V17-V85 HydrophobicContact CG2-CG1 3.81Å; K19-V85 HydrophobicContact CG-CB 4.21Å; K19-V85 HydrophobicContact CG-CG2 4.24Å; L22-V85 HydrophobicContact CD1-CG1 3.84Å; L22-V85 HydrophobicContact CD1-CG2 4.07Å; L83-V85 HydrophobicContact CB-CG2 4.42Å; V85-I117 WeakPolarHBondContact CA-O 3.45Å; V85-I117 HydrophobicContact CG1-CB 4.33Å; V85-I117 HydrophobicContact CG1-CG2 4.26Å; V85-I117 HydrophobicContact CG2-CB 4.25Å; V85-I117 HydrophobicContact CG2-CD1 4.49Å; V85-N119 HydrophobicContact CG1-CB 3.84Å
86	Y	98.7	Very high	95.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	168.1	165.7	73.6	-83	0	0	0	111.1	I88 F94 L97 L116 I117 G118 N119 V129 F145	Y86-I88 HydrophobicContact CE2-CG2 3.87Å; Y86-F94 HydrophobicContact CD1-CD2 4.16Å; Y86-F94 HydrophobicContact CD2-CB 4Å; Y86-F94 AromaticContact CD2-CD2 3.88Å; Y86-F94 HydrophobicContact CD2-CD2 3.88Å; Y86-F94 HydrophobicContact CD2-CG 4.45Å; Y86-F94 HydrophobicContact CE1-CD2 4.02Å; Y86-F94 HydrophobicContact CE1-CE2 4.36Å; Y86-F94 HydrophobicContact CE2-CB 4.49Å; Y86-F94 AromaticContact CE2-CD2 3.74Å; Y86-F94 HydrophobicContact CE2-CD2 3.74Å; Y86-F94 HydrophobicContact CG-CB 4.4Å; Y86-F94 HydrophobicContact CG-CD2 4.09Å; Y86-F94 AromaticContact CZ-CD2 3.8Å; Y86-L97 HydrophobicContact CD1-CD1 3.86Å; Y86-L97 HydrophobicContact CD1-CD2 4.29Å; Y86-L97 HydrophobicContact CE1-CD1 4.4Å; Y86-L97 HydrophobicContact CG-CD1 4.24Å; Y86-L116 HydrophobicContact CD1-CD1 3.9Å; Y86-L116 HydrophobicContact CD1-CG 4.43Å; Y86-L116 HydrophobicContact CE1-CD1 4.08Å; Y86-L116 HydrophobicContact CE1-CD2 4.37Å; Y86-L116 HydrophobicContact CE1-CG 4.12Å; Y86-I117 VanDerWaalsContact CD1-O 3.26Å; Y86-I117 WeakPolarHBondContact CD1-O 3.19Å; Y86-I117 PolarHBondContact N-O 3.27Å; Y86-G118 VanDerWaalsContact CZ-CA 3.44Å; Y86-N119 PolarHBondContact O-N 2.82Å; Y86-V129 HydrophobicContact CD2-CG2 4.46Å; Y86-V129 HydrophobicContact CE2-CB 3.97Å; Y86-V129 HydrophobicContact CE2-CG1 3.79Å; Y86-V129 HydrophobicContact CE2-CG2 4.17Å; Y86-F145 HydrophobicContact CE1-CE2 4.19Å
87	D	98.4	Very high	96.3	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.3	177.6	-178.8	-16	0	0	0	109.3	V17 T89 R90 T93 K120	V17-D87 HydrophobicContact CB-CB 4.31Å; V17-D87 HydrophobicContact CG1-CB 4.13Å; D87-T89 PolarHBondContact O-N 3.06Å; D87-T89 WeakPolarHBondContact OD1-CB 3.26Å; D87-T89 PolarHBondContact OD1-N 3Å; D87-T89 PolarHBondContact OD1-OG1 3.38Å; D87-R90 HydrophobicContact CB-CB 4.21Å; D87-R90 PolarHBondContact O-N 3.2Å; D87-R90 IonicContact OD2-CZ 3.74Å; D87-R90 IonicContact OD2-NE 3.55Å; D87-R90 PolarHBondContact OD2-NE 3.16Å; D87-R90 IonicContact OD2-NH2 3.75Å; D87-T93 HydrophobicContact CB-CG2 4.42Å; D87-T93 PolarHBondContact N-OG1 3.04Å; D87-T93 PolarHBondContact O-OG1 3.23Å; D87-K120 VanDerWaalsContact OD2-CE 3.26Å; D87-K120 WeakPolarHBondContact OD2-CE 3.17Å; D87-K120 IonicContact OD2-NZ 3.58Å; D87-K120 PolarHBondContact OD2-NZ 3.07Å
88	I	98.8	Very high	96.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-17.6	-177.3	67.2	156.6	0	0	0	113.2	Y86 N119 R127 E128 V129	Y86-I88 HydrophobicContact CE2-CG2 3.87Å; I88-N119 WeakPolarHBondContact CG1-O 3.19Å; I88-N119 PolarHBondContact N-O 3.13Å; I88-N119 VanDerWaalsContact N-O 3.1Å; I88-R127 HydrophobicContact CD1-CG 4.47Å; I88-E128 PolarHBondContact O-N 2.92Å; I88-V129 PolarHBondContact O-N 2.87Å; I88-V129 VanDerWaalsContact O-N 3.08Å
89	T	98.6	Very high	97.2	Very high	18 Å²	18	27.2 Å²	27.2	11%	0.11	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	2.6	179.3	71.1	0	0	0	0	113.4	D87 L123 R126	D87-T89 PolarHBondContact O-N 3.06Å; D87-T89 WeakPolarHBondContact OD1-CB 3.26Å; D87-T89 PolarHBondContact OD1-N 3Å; D87-T89 PolarHBondContact OD1-OG1 3.38Å; T89-L123 HydrophobicContact CG2-CB 3.58Å; T89-L123 HydrophobicContact CG2-CD1 4.11Å; T89-R126 WeakPolarHBondContact CA-O 3.42Å; T89-R126 WeakPolarHBondContact CB-O 3.08Å; T89-R126 HydrophobicContact CG2-CB 3.89Å
90	R	98.3	Very high	97.3	Very high	90 Å²	90	27.3 Å²	27.3	34%	0.34	14%	0.136	S	C	.	.			trans	-138.4	100.5	179.6	-64.4	-168.8	-63.8	144.6	0.8	111.4	T15 G16 D87 D92 T93 E128	T15-R90 PolarHBondContact O-NH2 2.81Å; G16-R90 VanDerWaalsContact C-NH2 3.29Å; G16-R90 PolarHBondContact O-NH2 2.94Å; D87-R90 HydrophobicContact CB-CB 4.21Å; D87-R90 PolarHBondContact O-N 3.2Å; D87-R90 IonicContact OD2-CZ 3.74Å; D87-R90 IonicContact OD2-NE 3.55Å; D87-R90 PolarHBondContact OD2-NE 3.16Å; D87-R90 IonicContact OD2-NH2 3.75Å; R90-D92 VanDerWaalsContact C-N 3.28Å; R90-D92 PolarHBondContact O-N 3.05Å; R90-T93 HydrophobicContact CB-CG2 3.92Å; R90-T93 VanDerWaalsContact CZ-CG2 3.45Å; R90-T93 PolarHBondContact O-N 3.07Å; R90-T93 VanDerWaalsContact O-N 3.13Å; R90-T93 PolarHBondContact O-OG1 2.55Å; R90-E128 WeakPolarHBondContact CA-OE2 3.48Å
91	R	98.3	Very high	97.3	Very high	62 Å²	62	27.5 Å²	27.5	23%	0.234	14%	0.137	C	C	.	.	H	α-helix	trans	-54.3	-39.5	-177.9	177.8	55.7	64.9	164.4	12.2	113.7	T93 F94 N95 E128 E133	R91-T93 PolarHBondContact O-N 3.43Å; R91-F94 WeakPolarHBondContact O-CB 3.19Å; R91-F94 PolarHBondContact O-N 2.81Å; R91-N95 PolarHBondContact O-N 3.46Å; R91-E128 HydrophobicContact CB-CB 4.3Å; R91-E128 WeakPolarHBondContact CB-OE2 3.45Å; R91-E128 PolarHBondContact N-OE2 3.47Å; R91-E128 PolarHBondContact NE-O 3.04Å; R91-E128 PolarHBondContact NH2-O 3.32Å; R91-E133 IonicContact CZ-OE1 2.68Å; R91-E133 VanDerWaalsContact CZ-OE1 3.28Å; R91-E133 IonicContact CZ-OE2 3.02Å; R91-E133 IonicContact NH1-OE1 2.65Å; R91-E133 PolarHBondContact NH1-OE1 3.42Å; R91-E133 IonicContact NH1-OE2 2.68Å; R91-E133 VanDerWaalsContact NH2-CD 3.28Å; R91-E133 IonicContact NH2-OE1 3.79Å; R91-E133 PolarHBondContact NH2-OE1 3.36Å; R91-E133 IonicContact NH2-OE2 3.83Å; R91-E133 PolarHBondContact NH2-OE2 3.04Å
92	D	97.8	Very high	97.1	Very high	110 Å²	110	32.9 Å²	32.9	59%	0.588	16%	0.162	S	C	*	.	H	α-helix	trans	-58.6	-37.3	-178.7	-64.6	-30	0	0	0	112.3	R90 F94 N95 H96	R90-D92 VanDerWaalsContact C-N 3.28Å; R90-D92 PolarHBondContact O-N 3.05Å; D92-F94 PolarHBondContact O-N 2.93Å; D92-N95 PolarHBondContact O-N 2.66Å; D92-N95 VanDerWaalsContact O-N 3.11Å; D92-H96 VanDerWaalsContact O-CG 3.29Å; D92-H96 PolarHBondContact O-N 3.5Å; D92-H96 PolarHBondContact O-ND1 3.31Å
93	T	98.1	Very high	96.8	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-66.9	-26.2	179	70.7	0	0	0	0	113	D14 V17 D87 R90 R91	D14-T93 HydrophobicContact CB-CG2 3.94Å; V17-T93 HydrophobicContact CG1-CG2 3.83Å; D87-T93 HydrophobicContact CB-CG2 4.42Å; D87-T93 PolarHBondContact N-OG1 3.04Å; D87-T93 PolarHBondContact O-OG1 3.23Å; R90-T93 HydrophobicContact CB-CG2 3.92Å; R90-T93 VanDerWaalsContact CZ-CG2 3.45Å; R90-T93 PolarHBondContact O-N 3.07Å; R90-T93 VanDerWaalsContact O-N 3.13Å; R90-T93 PolarHBondContact O-OG1 2.55Å; R91-T93 PolarHBondContact O-N 3.43Å
94	F	98.6	Very high	96.4	Very high	22 Å²	22	33.5 Å²	33.5	10%	0.096	17%	0.166	C	C	.	.	H	α-helix	trans	-76.8	-42	172.1	-178.6	-92	0	0	0	111	Y86 R91 D92 H96 L97 V129 E133 F137	Y86-F94 HydrophobicContact CD1-CD2 4.16Å; Y86-F94 HydrophobicContact CD2-CB 4Å; Y86-F94 AromaticContact CD2-CD2 3.88Å; Y86-F94 HydrophobicContact CD2-CD2 3.88Å; Y86-F94 HydrophobicContact CD2-CG 4.45Å; Y86-F94 HydrophobicContact CE1-CD2 4.02Å; Y86-F94 HydrophobicContact CE1-CE2 4.36Å; Y86-F94 HydrophobicContact CE2-CB 4.49Å; Y86-F94 AromaticContact CE2-CD2 3.74Å; Y86-F94 HydrophobicContact CE2-CD2 3.74Å; Y86-F94 HydrophobicContact CG-CB 4.4Å; Y86-F94 HydrophobicContact CG-CD2 4.09Å; Y86-F94 AromaticContact CZ-CD2 3.8Å; R91-F94 WeakPolarHBondContact O-CB 3.19Å; R91-F94 PolarHBondContact O-N 2.81Å; D92-F94 PolarHBondContact O-N 2.93Å; F94-H96 PolarHBondContact O-N 2.88Å; F94-L97 HydrophobicContact CB-CD1 4.42Å; F94-L97 HydrophobicContact CD2-CD1 3.37Å; F94-L97 HydrophobicContact CE2-CD1 3.68Å; F94-L97 HydrophobicContact CG-CD1 3.94Å; F94-L97 HydrophobicContact CZ-CD1 4.46Å; F94-L97 WeakPolarHBondContact O-CB 2.85Å; F94-L97 WeakPolarHBondContact O-CD1 3.1Å; F94-L97 WeakPolarHBondContact O-CG 3.47Å; F94-L97 PolarHBondContact O-N 2.89Å; F94-V129 HydrophobicContact CB-CG1 4.45Å; F94-V129 HydrophobicContact CB-CG2 3.8Å; F94-V129 HydrophobicContact CD1-CG1 4.47Å; F94-V129 HydrophobicContact CD2-CG1 3.68Å; F94-V129 HydrophobicContact CE2-CG1 3.98Å; F94-V129 HydrophobicContact CG-CG1 3.95Å; F94-V129 HydrophobicContact CG-CG2 4.18Å; F94-V129 HydrophobicContact CZ-CG1 4.48Å; F94-E133 HydrophobicContact CZ-CB 4.12Å; F94-F137 HydrophobicContact CE2-CB 4.42Å; F94-F137 HydrophobicContact CZ-CB 4.02Å; F94-F137 HydrophobicContact CZ-CD2 4.42Å; F94-F137 HydrophobicContact CZ-CG 4.4Å
95	N	97.9	Very high	96.1	Very high	83 Å²	83	39.3 Å²	39.3	44%	0.444	19%	0.188	S	C	.	.	H	α-helix	trans	-61.8	-31.8	178.3	-64.4	-19.3	0	0	0	112.3	R91 D92 L97 T98	R91-N95 PolarHBondContact O-N 3.46Å; D92-N95 PolarHBondContact O-N 2.66Å; D92-N95 VanDerWaalsContact O-N 3.11Å; N95-L97 VanDerWaalsContact C-N 3.27Å; N95-L97 PolarHBondContact O-N 2.79Å; N95-T98 PolarHBondContact O-OG1 2.86Å
96	H	96.8	Very high	95.7	Very high	69 Å²	69	45.8 Å²	45.8	32%	0.319	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-4.5	176.6	-59.3	150.1	0	0	0	114.5	D14 D92 F94 T98 T99 W100	D14-H96 IonicContact OD1-ND1 2.71Å; D14-H96 IonicContact OD2-CE1 3.24Å; D14-H96 IonicContact OD2-CG 3.37Å; D14-H96 IonicContact OD2-ND1 3.46Å; D14-H96 PolarHBondContact OD2-ND1 3.23Å; D92-H96 VanDerWaalsContact O-CG 3.29Å; D92-H96 PolarHBondContact O-N 3.5Å; D92-H96 PolarHBondContact O-ND1 3.31Å; F94-H96 PolarHBondContact O-N 2.88Å; H96-T98 VanDerWaalsContact C-N 3.26Å; H96-T98 PolarHBondContact O-N 2.87Å; H96-T99 PolarHBondContact O-N 3.02Å; H96-W100 VanDerWaalsContact O-CD1 3.24Å; H96-W100 PolarHBondContact O-N 2.87Å; H96-W100 VanDerWaalsContact O-N 3.16Å
97	L	97.3	Very high	95.1	Very high	1 Å²	1	49 Å²	49	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-59	-36.5	-179.6	-73.7	171.5	0	0	0	112.7	L84 Y86 F94 N95 W100 L101 L116 F137	L84-L97 HydrophobicContact CD1-CD2 3.8Å; L84-L97 HydrophobicContact CD2-CD2 3.83Å; L84-L97 HydrophobicContact CG-CD2 3.55Å; Y86-L97 HydrophobicContact CD1-CD1 3.86Å; Y86-L97 HydrophobicContact CD1-CD2 4.29Å; Y86-L97 HydrophobicContact CE1-CD1 4.4Å; Y86-L97 HydrophobicContact CG-CD1 4.24Å; F94-L97 HydrophobicContact CB-CD1 4.42Å; F94-L97 HydrophobicContact CD2-CD1 3.37Å; F94-L97 HydrophobicContact CE2-CD1 3.68Å; F94-L97 HydrophobicContact CG-CD1 3.94Å; F94-L97 HydrophobicContact CZ-CD1 4.46Å; F94-L97 WeakPolarHBondContact O-CB 2.85Å; F94-L97 WeakPolarHBondContact O-CD1 3.1Å; F94-L97 WeakPolarHBondContact O-CG 3.47Å; F94-L97 PolarHBondContact O-N 2.89Å; N95-L97 VanDerWaalsContact C-N 3.27Å; N95-L97 PolarHBondContact O-N 2.79Å; L97-W100 PolarHBondContact O-N 2.9Å; L97-L101 WeakPolarHBondContact O-CB 3.37Å; L97-L101 PolarHBondContact O-N 2.99Å; L97-L116 HydrophobicContact CD1-CD1 3.7Å; L97-L116 HydrophobicContact CD2-CD1 3.62Å; L97-L116 HydrophobicContact CG-CD1 4.31Å; L97-F137 HydrophobicContact CB-CE1 4.02Å; L97-F137 HydrophobicContact CB-CE2 4.11Å; L97-F137 HydrophobicContact CB-CZ 3.6Å; L97-F137 HydrophobicContact CD1-CD1 4.41Å; L97-F137 HydrophobicContact CD1-CE1 4.31Å; L97-F137 HydrophobicContact CD1-CZ 4.49Å
98	T	95.7	Very high	94.5	Very high	58 Å²	58	50 Å²	50	36%	0.356	24%	0.239	S	C	.	.	H	α-helix	trans	-58.8	-49.4	177.7	48.1	0	0	0	0	111	N95 H96 W100 L101 E102 F137	N95-T98 PolarHBondContact O-OG1 2.86Å; H96-T98 VanDerWaalsContact C-N 3.26Å; H96-T98 PolarHBondContact O-N 2.87Å; T98-W100 PolarHBondContact O-N 2.87Å; T98-L101 PolarHBondContact O-N 2.92Å; T98-E102 WeakPolarHBondContact O-CB 3.42Å; T98-E102 VanDerWaalsContact O-CG 3.31Å; T98-E102 WeakPolarHBondContact O-CG 3.31Å; T98-E102 PolarHBondContact O-N 3.03Å; T98-F137 HydrophobicContact CG2-CE2 3.82Å; T98-F137 HydrophobicContact CG2-CZ 4.3Å
99	T	93.6	Very high	93.7	Very high	54 Å²	54	51.8 Å²	51.8	33%	0.331	25%	0.249	S	C	.	.	H	α-helix	trans	-61.3	-44.8	177.6	-51.5	0	0	0	0	111.9	H96 L101 E102 D103	H96-T99 PolarHBondContact O-N 3.02Å; T99-L101 PolarHBondContact O-N 2.74Å; T99-E102 PolarHBondContact O-N 2.78Å; T99-D103 WeakPolarHBondContact O-CB 3.39Å; T99-D103 PolarHBondContact O-N 3.04Å
100	W	94	Very high	92.8	Very high	1 Å²	1	56.2 Å²	56.2	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-64.5	-39.5	177.5	-78.1	110.4	0	0	0	112.7	I12 G13 D14 R69 T72 Y76 L84 H96 L97 T98 A104	I12-W100 HydrophobicContact CB-CE3 4.06Å; I12-W100 HydrophobicContact CB-CZ3 4.36Å; G13-W100 WeakPolarHBondContact O-CZ2 3.21Å; D14-W100 PolarHBondContact OD1-NE1 2.84Å; R69-W100 HydrophobicContact CG-CH2 4.02Å; R69-W100 HydrophobicContact CG-CZ3 4.38Å; T72-W100 HydrophobicContact CG2-CZ3 4.45Å; Y76-W100 WeakPolarHBondContact OH-CZ3 3.46Å; L84-W100 HydrophobicContact CD1-CB 3.53Å; L84-W100 HydrophobicContact CD1-CG 4.28Å; H96-W100 VanDerWaalsContact O-CD1 3.24Å; H96-W100 PolarHBondContact O-N 2.87Å; H96-W100 VanDerWaalsContact O-N 3.16Å; L97-W100 PolarHBondContact O-N 2.9Å; T98-W100 PolarHBondContact O-N 2.87Å; W100-A104 VanDerWaalsContact O-CB 3.32Å; W100-A104 WeakPolarHBondContact O-CB 3.48Å; W100-A104 PolarHBondContact O-N 3.3Å
101	L	94.6	Very high	92.3	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-68.8	-42.6	178.8	179.3	63.3	0	0	0	111.8	L84 L97 T98 T99 A104 R105 I114 F137 H141 L143	L84-L101 HydrophobicContact CD2-CB 4.13Å; L84-L101 HydrophobicContact CD2-CD1 4.44Å; L97-L101 WeakPolarHBondContact O-CB 3.37Å; L97-L101 PolarHBondContact O-N 2.99Å; T98-L101 PolarHBondContact O-N 2.92Å; T99-L101 PolarHBondContact O-N 2.74Å; L101-A104 WeakPolarHBondContact O-CB 3.32Å; L101-A104 PolarHBondContact O-N 3.25Å; L101-R105 HydrophobicContact CD1-CG 4.41Å; L101-R105 WeakPolarHBondContact O-CG 3.48Å; L101-R105 PolarHBondContact O-N 3.24Å; L101-I114 HydrophobicContact CD1-CD1 3.59Å; L101-F137 HydrophobicContact CD2-CE1 4.26Å; L101-F137 HydrophobicContact CD2-CZ 4.23Å; L101-H141 HydrophobicContact CD2-CB 3.72Å; L101-L143 HydrophobicContact CD1-CD1 4.38Å; L101-L143 HydrophobicContact CD1-CD2 3.92Å; L101-L143 HydrophobicContact CD2-CD1 4.28Å
102	E	92.8	Very high	92	Very high	114 Å²	114	52 Å²	52	53%	0.533	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-49.3	174.7	-75.9	174.8	-178.5	0	0	111	T98 T99 A104 R105 Q106	T98-E102 WeakPolarHBondContact O-CB 3.42Å; T98-E102 VanDerWaalsContact O-CG 3.31Å; T98-E102 WeakPolarHBondContact O-CG 3.31Å; T98-E102 PolarHBondContact O-N 3.03Å; T99-E102 PolarHBondContact O-N 2.78Å; E102-A104 VanDerWaalsContact C-N 3.27Å; E102-A104 PolarHBondContact O-N 3.27Å; E102-R105 PolarHBondContact O-N 3.41Å; E102-Q106 WeakPolarHBondContact O-CB 3.34Å; E102-Q106 VanDerWaalsContact O-CG 3.27Å; E102-Q106 WeakPolarHBondContact O-CG 3.5Å; E102-Q106 PolarHBondContact O-N 2.85Å
103	D	89.9	Confident	91.9	Very high	13 Å²	13	47 Å²	47	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-57.5	-42.8	175.5	-93.6	-15.1	0	0	0	111	R73 Y76 T99 H107	R73-D103 IonicContact CZ-OD1 3.59Å; R73-D103 IonicContact NE-OD1 3.64Å; R73-D103 IonicContact NE-OD2 3.86Å; R73-D103 IonicContact NH2-OD1 2.84Å; R73-D103 PolarHBondContact NH2-OD1 2.88Å; R73-D103 IonicContact NH2-OD2 3.42Å; R73-D103 PolarHBondContact NH2-OD2 2.79Å; Y76-D103 WeakPolarHBondContact CD2-O 3.19Å; Y76-D103 HydrophobicContact CE2-CB 4.16Å; T99-D103 WeakPolarHBondContact O-CB 3.39Å; T99-D103 PolarHBondContact O-N 3.04Å; D103-H107 PolarHBondContact O-N 2.79Å; D103-H107 PolarHBondContact O-ND1 3.18Å
104	A	90.9	Very high	91.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.7	-53.6	178.1	0	0	0	0	0	111	I12 Y76 W100 L101 E102 Q106 H107 S108 M112	I12-A104 HydrophobicContact CD1-CB 3.8Å; Y76-A104 HydrophobicContact CD2-CB 4.46Å; Y76-A104 VanDerWaalsContact CE2-CA 3.46Å; Y76-A104 HydrophobicContact CE2-CB 4.17Å; W100-A104 VanDerWaalsContact O-CB 3.32Å; W100-A104 WeakPolarHBondContact O-CB 3.48Å; W100-A104 PolarHBondContact O-N 3.3Å; L101-A104 WeakPolarHBondContact O-CB 3.32Å; L101-A104 PolarHBondContact O-N 3.25Å; E102-A104 VanDerWaalsContact C-N 3.27Å; E102-A104 PolarHBondContact O-N 3.27Å; A104-Q106 PolarHBondContact O-N 3.05Å; A104-H107 PolarHBondContact O-N 2.9Å; A104-S108 WeakPolarHBondContact O-CB 3.26Å; A104-S108 PolarHBondContact O-N 2.81Å; A104-S108 PolarHBondContact O-OG 3.36Å; A104-M112 HydrophobicContact CB-CE 3.92Å
105	R	91.1	Very high	91.9	Very high	121 Å²	121	46.3 Å²	46.3	46%	0.457	24%	0.24	S	C	.	.	H	α-helix	trans	-65.9	-33.9	-178	-73.1	178.6	168.9	179.8	-3.2	113.8	L101 E102 H107 H141	L101-R105 HydrophobicContact CD1-CG 4.41Å; L101-R105 WeakPolarHBondContact O-CG 3.48Å; L101-R105 PolarHBondContact O-N 3.24Å; E102-R105 PolarHBondContact O-N 3.41Å; R105-H107 VanDerWaalsContact C-N 3.33Å; R105-H141 PolarHBondContact NH2-O 3.32Å
106	Q	90.2	Very high	91.9	Very high	137 Å²	137	42.3 Å²	42.3	64%	0.64	22%	0.219	S	C	*	.	H	α-helix	trans	-70.7	-29	179.4	-75.2	177.8	15.7	0	0	113	E102 A104	E102-Q106 WeakPolarHBondContact O-CB 3.34Å; E102-Q106 VanDerWaalsContact O-CG 3.27Å; E102-Q106 WeakPolarHBondContact O-CG 3.5Å; E102-Q106 PolarHBondContact O-N 2.85Å; A104-Q106 PolarHBondContact O-N 3.05Å
107	H	86.4	Confident	92	Very high	68 Å²	68	39 Å²	39	32%	0.315	20%	0.204	S	C	.	.	H	α-helix	trans	-115.5	0.2	-172.2	-53.9	86.5	0	0	0	113.8	Y76 R77 D103 A104 R105	Y76-H107 CarbonylContact C-O 3.56Å; Y76-H107 HydrophobicContact CD2-CB 3.97Å; Y76-H107 HydrophobicContact CG-CB 4.34Å; R77-H107 PolarHBondContact N-O 2.88Å; D103-H107 PolarHBondContact O-N 2.79Å; D103-H107 PolarHBondContact O-ND1 3.18Å; A104-H107 PolarHBondContact O-N 2.9Å; R105-H107 VanDerWaalsContact C-N 3.33Å
108	S	85.6	Confident	92.1	Very high	21 Å²	21	39 Å²	39	15%	0.147	20%	0.203	C	C	.	.	S	Bend	trans	-111.3	178.4	174.5	78.4	0	0	0	0	112.4	A104 M112	A104-S108 WeakPolarHBondContact O-CB 3.26Å; A104-S108 PolarHBondContact O-N 2.81Å; A104-S108 PolarHBondContact O-OG 3.36Å; S108-M112 VanDerWaalsContact CB-SD 3.56Å; S108-M112 WeakPolarHBondContact OG-CE 3.3Å
109	N	81.2	Confident	92.3	Very high	39 Å²	39	36.4 Å²	36.4	21%	0.209	19%	0.187	C	C	.	.			trans	-69.3	144	166.5	-169.8	-45.7	0	0	0	109.8	N111 M112 N183	N109-N111 PolarHBondContact O-N 2.7Å; N109-N111 PolarHBondContact OD1-N 3.03Å; N109-M112 VanDerWaalsContact O-CB 3.28Å; N109-M112 WeakPolarHBondContact O-CB 2.99Å; N109-M112 PolarHBondContact O-N 3.33Å; N109-M112 VanDerWaalsContact O-N 3.13Å; N109-N183 PolarHBondContact ND2-OD1 3.42Å
110	S	80.9	Confident	92.5	Very high	110 Å²	110	36.2 Å²	36.2	77%	0.769	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.6	173.7	55.7	0	0	0	0	113.6	M112	S110-M112 VanDerWaalsContact C-N 3.32Å
111	N	85.8	Confident	92.7	Very high	50 Å²	50	37.4 Å²	37.4	27%	0.267	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-2.7	-178.5	-64	-9.5	0	0	0	113.2	N109 V113 V175 F176	N109-N111 PolarHBondContact O-N 2.7Å; N109-N111 PolarHBondContact OD1-N 3.03Å; N111-V113 PolarHBondContact O-N 3.39Å; N111-V175 HydrophobicContact CB-CG1 4.38Å; N111-V175 PolarHBondContact ND2-O 3.18Å; N111-V175 VanDerWaalsContact ND2-O 3.1Å; N111-F176 HydrophobicContact CB-CD1 4.2Å; N111-F176 HydrophobicContact CB-CE1 3.61Å; N111-F176 HydrophobicContact CB-CZ 3.95Å; N111-F176 WeakPolarHBondContact O-CZ 3.3Å
112	M	92.6	Very high	92.9	Very high	13 Å²	13	39.7 Å²	39.7	6%	0.064	20%	0.203	C	C	.	.			trans	-54.4	128.4	179.3	-177.8	171.8	72.2	0	0	110.8	I10 A79 A82 A104 S108 N109 S110 I114	I10-M112 HydrophobicContact CD1-SD 4.48Å; A79-M112 HydrophobicContact CB-SD 3.68Å; A82-M112 HydrophobicContact CB-CE 3.83Å; A82-M112 HydrophobicContact CB-SD 3.88Å; A104-M112 HydrophobicContact CB-CE 3.92Å; S108-M112 VanDerWaalsContact CB-SD 3.56Å; S108-M112 WeakPolarHBondContact OG-CE 3.3Å; N109-M112 VanDerWaalsContact O-CB 3.28Å; N109-M112 WeakPolarHBondContact O-CB 2.99Å; N109-M112 PolarHBondContact O-N 3.33Å; N109-M112 VanDerWaalsContact O-N 3.13Å; S110-M112 VanDerWaalsContact C-N 3.32Å; M112-I114 HydrophobicContact CE-CD1 3.76Å; M112-I114 HydrophobicContact CE-CG1 3.91Å; M112-I114 HydrophobicContact CG-CG1 4.38Å
113	V	96.4	Very high	93.1	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.03	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	131	174.7	173.9	0	0	0	0	108.8	A80 G81 A82 N111 I144 T163 E166 I167 K170	A80-V113 PolarHBondContact O-N 3.35Å; G81-V113 CarbonylContact C-O 3.57Å; G81-V113 WeakPolarHBondContact CA-O 3.47Å; A82-V113 PolarHBondContact N-O 3.46Å; N111-V113 PolarHBondContact O-N 3.39Å; V113-I144 HydrophobicContact CG1-CD1 4.04Å; V113-T163 HydrophobicContact CG1-CG2 3.95Å; V113-E166 HydrophobicContact CB-CG 4.29Å; V113-E166 HydrophobicContact CG1-CB 3.88Å; V113-E166 HydrophobicContact CG1-CG 3.6Å; V113-E166 HydrophobicContact CG2-CB 4.28Å; V113-E166 HydrophobicContact CG2-CG 3.64Å; V113-I167 HydrophobicContact CB-CD1 4.34Å; V113-I167 HydrophobicContact CB-CG1 3.69Å; V113-I167 HydrophobicContact CG1-CG1 4.43Å; V113-I167 HydrophobicContact CG2-CB 4.46Å; V113-I167 HydrophobicContact CG2-CG1 3.52Å; V113-K170 HydrophobicContact CG2-CD 3.88Å
114	I	97.8	Very high	93.4	Very high	11 Å²	11	41.1 Å²	41.1	6%	0.056	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.2	-179.3	-53.3	-178.3	0	0	0	109.4	A82 L84 L101 M112 L143 I144	A82-I114 HydrophobicContact CB-CG1 4.29Å; A82-I114 HydrophobicContact CB-CG2 4.5Å; A82-I114 WeakPolarHBondContact O-CA 3.43Å; L84-I114 HydrophobicContact CB-CG2 4.04Å; L101-I114 HydrophobicContact CD1-CD1 3.59Å; M112-I114 HydrophobicContact CE-CD1 3.76Å; M112-I114 HydrophobicContact CE-CG1 3.91Å; M112-I114 HydrophobicContact CG-CG1 4.38Å; I114-L143 HydrophobicContact CB-CD2 3.88Å; I114-L143 HydrophobicContact CD1-CD2 4.43Å; I114-L143 HydrophobicContact CG2-CD2 4.06Å; I114-I144 PolarHBondContact O-N 3.07Å; I114-I144 VanDerWaalsContact O-N 3.1Å
115	M	98.6	Very high	93.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	115.3	172.2	171.5	71.6	71	0	0	108.9	A82 L83 L84 I117 I144 M146 N162 T163	A82-M115 PolarHBondContact O-N 3.49Å; L83-M115 WeakPolarHBondContact CA-O 3.33Å; L83-M115 HydrophobicContact CD2-CB 3.7Å; L83-M115 HydrophobicContact CD2-CG 4.04Å; L84-M115 PolarHBondContact N-O 2.89Å; M115-I117 HydrophobicContact CG-CD1 4.21Å; M115-I117 HydrophobicContact CG-CG1 3.76Å; M115-I144 CarbonylContact C-O 3.57Å; M115-I144 HydrophobicContact CE-CB 3.73Å; M115-I144 HydrophobicContact CE-CD1 4.22Å; M115-I144 HydrophobicContact CE-CG2 3.36Å; M115-I144 HydrophobicContact SD-CB 3.78Å; M115-I144 HydrophobicContact SD-CG2 3.66Å; M115-M146 HydrophobicContact SD-CB 3.98Å; M115-N162 HydrophobicContact CE-CB 4.09Å; M115-T163 VanDerWaalsContact CB-OG1 3.31Å; M115-T163 WeakPolarHBondContact CB-OG1 3.5Å
116	L	98.8	Very high	94.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	127.1	168.6	180	67.8	0	0	0	109.8	L84 Y86 L97 G134 F137 A138 L143 I144 F145 M146	L84-L116 HydrophobicContact CD2-CD1 4.18Å; L84-L116 HydrophobicContact CG-CD1 4.11Å; L84-L116 CarbonylContact O-C 3.59Å; L84-L116 WeakPolarHBondContact O-CA 3.43Å; Y86-L116 HydrophobicContact CD1-CD1 3.9Å; Y86-L116 HydrophobicContact CD1-CG 4.43Å; Y86-L116 HydrophobicContact CE1-CD1 4.08Å; Y86-L116 HydrophobicContact CE1-CD2 4.37Å; Y86-L116 HydrophobicContact CE1-CG 4.12Å; L97-L116 HydrophobicContact CD1-CD1 3.7Å; L97-L116 HydrophobicContact CD2-CD1 3.62Å; L97-L116 HydrophobicContact CG-CD1 4.31Å; L116-G134 WeakPolarHBondContact CD2-O 3.39Å; L116-F137 HydrophobicContact CD2-CB 4.46Å; L116-F137 HydrophobicContact CD2-CD1 3.79Å; L116-A138 HydrophobicContact CD2-CB 4.07Å; L116-L143 HydrophobicContact CB-CD1 4.26Å; L116-I144 WeakPolarHBondContact CB-O 3.44Å; L116-I144 PolarHBondContact N-O 3.34Å; L116-F145 HydrophobicContact CB-CD2 4.11Å; L116-F145 HydrophobicContact CD2-CD2 3.71Å; L116-F145 HydrophobicContact CD2-CE2 4.21Å; L116-F145 HydrophobicContact CG-CD2 3.83Å; L116-F145 HydrophobicContact CG-CE2 4.33Å; L116-F145 WeakPolarHBondContact O-CA 3.44Å; L116-F145 WeakPolarHBondContact O-CD2 3.29Å; L116-M146 PolarHBondContact O-N 2.95Å
117	I	98.9	Very high	94.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	116.7	-179.1	-59.7	-176.3	0	0	0	110.5	L22 L83 L84 V85 Y86 M115 N119 M146 T148 A159	L22-I117 HydrophobicContact CD1-CD1 4.48Å; L22-I117 HydrophobicContact CD1-CG2 4.16Å; L83-I117 HydrophobicContact CB-CD1 4.01Å; L83-I117 HydrophobicContact CD1-CD1 3.99Å; L83-I117 HydrophobicContact CD2-CD1 4.17Å; L83-I117 HydrophobicContact CG-CD1 4.28Å; L84-I117 PolarHBondContact O-N 2.84Å; V85-I117 WeakPolarHBondContact CA-O 3.45Å; V85-I117 HydrophobicContact CG1-CB 4.33Å; V85-I117 HydrophobicContact CG1-CG2 4.26Å; V85-I117 HydrophobicContact CG2-CB 4.25Å; V85-I117 HydrophobicContact CG2-CD1 4.49Å; Y86-I117 VanDerWaalsContact CD1-O 3.26Å; Y86-I117 WeakPolarHBondContact CD1-O 3.19Å; Y86-I117 PolarHBondContact N-O 3.27Å; M115-I117 HydrophobicContact CG-CD1 4.21Å; M115-I117 HydrophobicContact CG-CG1 3.76Å; I117-N119 HydrophobicContact CG2-CB 4.3Å; I117-N119 PolarHBondContact O-N 3.49Å; I117-M146 VanDerWaalsContact CA-O 3.29Å; I117-M146 WeakPolarHBondContact CA-O 3.16Å; I117-T148 HydrophobicContact CG2-CG2 3.75Å; I117-T148 WeakPolarHBondContact CG2-OG1 3.43Å; I117-A159 HydrophobicContact CD1-CB 3.9Å
118	G	98.8	Very high	95	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	98.1	163.1	0	0	0	0	0	110	Y86 M146 E147 T148	Y86-G118 VanDerWaalsContact CZ-CA 3.44Å; G118-M146 PolarHBondContact N-O 3.01Å; G118-E147 CarbonylContact O-C 3.51Å; G118-E147 WeakPolarHBondContact O-CA 3.42Å; G118-T148 PolarHBondContact O-N 3Å
119	N	98.7	Very high	95.6	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	164	-176.4	-168.9	27.7	0	0	0	112	V17 L22 V85 Y86 I88 I117 T148 A150	V17-N119 PolarHBondContact O-ND2 3.47Å; L22-N119 HydrophobicContact CD1-CB 4.37Å; V85-N119 HydrophobicContact CG1-CB 3.84Å; Y86-N119 PolarHBondContact O-N 2.82Å; I88-N119 WeakPolarHBondContact CG1-O 3.19Å; I88-N119 PolarHBondContact N-O 3.13Å; I88-N119 VanDerWaalsContact N-O 3.1Å; I117-N119 HydrophobicContact CG2-CB 4.3Å; I117-N119 PolarHBondContact O-N 3.49Å; N119-T148 CarbonylContact C-O 3.41Å; N119-T148 WeakPolarHBondContact CA-O 3.17Å; N119-T148 PolarHBondContact OD1-O 3.13Å; N119-T148 PolarHBondContact OD1-OG1 3.48Å; N119-A150 PolarHBondContact OD1-N 3.04Å
120	K	98.2	Very high	96.5	Very high	50 Å²	50	50.8 Å²	50.8	22%	0.217	26%	0.259	C	S	.	.			trans	70.6	36.3	-178.6	-45.7	-171.9	-167.9	171	0	113.8	G16 D87 D122 L123 T148	G16-K120 WeakPolarHBondContact O-CE 3.47Å; G16-K120 PolarHBondContact O-NZ 3.1Å; D87-K120 VanDerWaalsContact OD2-CE 3.26Å; D87-K120 WeakPolarHBondContact OD2-CE 3.17Å; D87-K120 IonicContact OD2-NZ 3.58Å; D87-K120 PolarHBondContact OD2-NZ 3.07Å; K120-D122 PolarHBondContact O-N 3.18Å; K120-L123 HydrophobicContact CB-CD1 4.18Å; K120-L123 HydrophobicContact CB-CG 4.45Å; K120-L123 HydrophobicContact CD-CD1 4.22Å; K120-L123 PolarHBondContact O-N 2.75Å; K120-T148 PolarHBondContact N-O 2.81Å
121	S	98.4	Very high	97.3	Very high	26 Å²	26	49.9 Å²	49.9	18%	0.182	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-59.2	-16.2	174.4	63.1	0	0	0	0	114.3	L123 T148	S121-L123 PolarHBondContact O-N 3.29Å; S121-T148 PolarHBondContact N-O 2.88Å; S121-T148 VanDerWaalsContact OG-C 3.3Å; S121-T148 PolarHBondContact OG-O 2.94Å
122	D	98.2	Very high	97.9	Very high	53 Å²	53	53.3 Å²	53.3	28%	0.283	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-68.4	-14.3	171.1	62.4	-76.9	0	0	0	114	K120 S149 K151 T152	K120-D122 PolarHBondContact O-N 3.18Å; D122-S149 VanDerWaalsContact CG-OG 3.28Å; D122-S149 WeakPolarHBondContact OD1-CB 3.46Å; D122-S149 PolarHBondContact OD1-OG 3.45Å; D122-K151 WeakPolarHBondContact OD2-CD 3.4Å; D122-K151 IonicContact OD2-NZ 3.04Å; D122-T152 HydrophobicContact CB-CG2 3.94Å
123	L	97.1	Very high	98.2	Very high	49 Å²	49	55.7 Å²	55.7	26%	0.257	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-101.2	40.6	-179.9	-58.9	-179.1	0	0	0	112.6	T89 K120 S121 S125 R126	T89-L123 HydrophobicContact CG2-CB 3.58Å; T89-L123 HydrophobicContact CG2-CD1 4.11Å; K120-L123 HydrophobicContact CB-CD1 4.18Å; K120-L123 HydrophobicContact CB-CG 4.45Å; K120-L123 HydrophobicContact CD-CD1 4.22Å; K120-L123 PolarHBondContact O-N 2.75Å; S121-L123 PolarHBondContact O-N 3.29Å; L123-S125 PolarHBondContact O-N 3.08Å; L123-S125 VanDerWaalsContact O-N 3.11Å; L123-R126 PolarHBondContact O-N 2.79Å
124	E	97.1	Very high	98.3	Very high	107 Å²	107	55.5 Å²	55.5	50%	0.5	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-52.3	-36.4	-175	-169.8	59.3	-149.2	0	0	113.9	R126 R127	E124-R126 PolarHBondContact O-N 2.88Å; E124-R126 VanDerWaalsContact O-N 3.14Å; E124-R127 VanDerWaalsContact CD-NE 3.25Å; E124-R127 VanDerWaalsContact O-CB 3.25Å; E124-R127 WeakPolarHBondContact O-CB 3.41Å; E124-R127 PolarHBondContact O-N 3.3Å; E124-R127 VanDerWaalsContact O-N 3.12Å; E124-R127 WeakPolarHBondContact OE1-CD 3.48Å; E124-R127 IonicContact OE1-CZ 2.7Å; E124-R127 IonicContact OE1-NE 2.75Å; E124-R127 PolarHBondContact OE1-NE 3.4Å; E124-R127 IonicContact OE1-NH2 2.98Å; E124-R127 IonicContact OE2-CZ 3.31Å; E124-R127 VanDerWaalsContact OE2-CZ 3.31Å; E124-R127 IonicContact OE2-NE 3.03Å; E124-R127 PolarHBondContact OE2-NE 3.46Å; E124-R127 IonicContact OE2-NH2 2.75Å; E124-R127 PolarHBondContact OE2-NH2 3.41Å
125	S	97.8	Very high	98.3	Very high	121 Å²	121	58.1 Å²	58.1	85%	0.846	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-66.7	-14	178.7	60	0	0	0	0	114.6	L123	L123-S125 PolarHBondContact O-N 3.08Å; L123-S125 VanDerWaalsContact O-N 3.11Å
126	R	97.8	Very high	98.3	Very high	175 Å²	175	60.6 Å²	60.6	66%	0.66	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-112.3	14.1	177.6	-59.1	-175.8	-178	-175.2	-0.1	112	T89 L123 E124 E128	T89-R126 WeakPolarHBondContact CA-O 3.42Å; T89-R126 WeakPolarHBondContact CB-O 3.08Å; T89-R126 HydrophobicContact CG2-CB 3.89Å; L123-R126 PolarHBondContact O-N 2.79Å; E124-R126 PolarHBondContact O-N 2.88Å; E124-R126 VanDerWaalsContact O-N 3.14Å; R126-E128 PolarHBondContact O-N 2.72Å
127	R	98.5	Very high	98.3	Very high	54 Å²	54	61.5 Å²	61.5	20%	0.204	30%	0.301	C	S	.	.			trans	-60.8	125.2	-178.7	179	-179.6	-72.1	-87.1	6.4	110.5	I88 E124 V129 E147	I88-R127 HydrophobicContact CD1-CG 4.47Å; E124-R127 VanDerWaalsContact CD-NE 3.25Å; E124-R127 VanDerWaalsContact O-CB 3.25Å; E124-R127 WeakPolarHBondContact O-CB 3.41Å; E124-R127 PolarHBondContact O-N 3.3Å; E124-R127 VanDerWaalsContact O-N 3.12Å; E124-R127 WeakPolarHBondContact OE1-CD 3.48Å; E124-R127 IonicContact OE1-CZ 2.7Å; E124-R127 IonicContact OE1-NE 2.75Å; E124-R127 PolarHBondContact OE1-NE 3.4Å; E124-R127 IonicContact OE1-NH2 2.98Å; E124-R127 IonicContact OE2-CZ 3.31Å; E124-R127 VanDerWaalsContact OE2-CZ 3.31Å; E124-R127 IonicContact OE2-NE 3.03Å; E124-R127 PolarHBondContact OE2-NE 3.46Å; E124-R127 IonicContact OE2-NH2 2.75Å; E124-R127 PolarHBondContact OE2-NH2 3.41Å; R127-V129 VanDerWaalsContact CD-O 3.26Å; R127-V129 WeakPolarHBondContact CD-O 3.38Å; R127-V129 WeakPolarHBondContact CG-O 3.38Å; R127-V129 PolarHBondContact NH1-O 3.3Å; R127-E147 IonicContact CZ-OE1 3.68Å; R127-E147 IonicContact CZ-OE2 3.51Å; R127-E147 IonicContact NH1-OE1 3.8Å; R127-E147 PolarHBondContact NH1-OE1 2.76Å; R127-E147 IonicContact NH1-OE2 3.28Å; R127-E147 IonicContact NH2-OE1 2.82Å; R127-E147 PolarHBondContact NH2-OE1 3.35Å; R127-E147 IonicContact NH2-OE2 3.62Å; R127-E147 PolarHBondContact NH2-OE2 3.35Å
128	E	98.6	Very high	98.3	Very high	106 Å²	106	61.7 Å²	61.7	50%	0.495	30%	0.302	S	S	.	.			trans	-107.5	-22.4	172.5	-65.7	-173.2	179	0	0	112	I88 R90 R91 R126	I88-E128 PolarHBondContact O-N 2.92Å; R90-E128 WeakPolarHBondContact CA-OE2 3.48Å; R91-E128 HydrophobicContact CB-CB 4.3Å; R91-E128 WeakPolarHBondContact CB-OE2 3.45Å; R91-E128 PolarHBondContact N-OE2 3.47Å; R91-E128 PolarHBondContact NE-O 3.04Å; R91-E128 PolarHBondContact NH2-O 3.32Å; R126-E128 PolarHBondContact O-N 2.72Å
129	V	98.6	Very high	98.2	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.337	C	S	.	.	S	Bend	trans	-114	120.2	179.8	-173.5	0	0	0	0	109.8	Y86 I88 F94 R127 E133	Y86-V129 HydrophobicContact CD2-CG2 4.46Å; Y86-V129 HydrophobicContact CE2-CB 3.97Å; Y86-V129 HydrophobicContact CE2-CG1 3.79Å; Y86-V129 HydrophobicContact CE2-CG2 4.17Å; I88-V129 PolarHBondContact O-N 2.87Å; I88-V129 VanDerWaalsContact O-N 3.08Å; F94-V129 HydrophobicContact CB-CG1 4.45Å; F94-V129 HydrophobicContact CB-CG2 3.8Å; F94-V129 HydrophobicContact CD1-CG1 4.47Å; F94-V129 HydrophobicContact CD2-CG1 3.68Å; F94-V129 HydrophobicContact CE2-CG1 3.98Å; F94-V129 HydrophobicContact CG-CG1 3.95Å; F94-V129 HydrophobicContact CG-CG2 4.18Å; F94-V129 HydrophobicContact CZ-CG1 4.48Å; R127-V129 VanDerWaalsContact CD-O 3.26Å; R127-V129 WeakPolarHBondContact CD-O 3.38Å; R127-V129 WeakPolarHBondContact CG-O 3.38Å; R127-V129 PolarHBondContact NH1-O 3.3Å; V129-E133 HydrophobicContact CG1-CB 4.22Å
130	K	98.5	Very high	98.2	Very high	134 Å²	134	78 Å²	78	58%	0.583	37%	0.37	S	S	*	.			trans	-72.7	149.1	176.8	-62.3	-175.6	178.9	179.6	0	110.6	E132 E133	K130-E132 WeakPolarHBondContact CB-OE2 3.33Å; K130-E132 PolarHBondContact O-N 2.82Å; K130-E133 HydrophobicContact CB-CG 4.16Å; K130-E133 WeakPolarHBondContact CB-OE2 3.38Å; K130-E133 PolarHBondContact N-OE2 2.85Å; K130-E133 WeakPolarHBondContact O-CB 3.5Å; K130-E133 PolarHBondContact O-N 3.23Å
131	K	98.3	Very high	98.1	Very high	91 Å²	91	77.8 Å²	77.8	40%	0.396	37%	0.37	S	S	.	.	H	α-helix	trans	-58.2	-38.5	179.5	-171.4	-176.9	178	-148.9	0	111.7	E133 G134 E135 F145 E147	K131-E133 PolarHBondContact O-N 2.83Å; K131-G134 PolarHBondContact O-N 3.27Å; K131-G134 VanDerWaalsContact O-N 3.14Å; K131-E135 WeakPolarHBondContact CE-OE1 3.45Å; K131-E135 IonicContact NZ-OE1 2.79Å; K131-E135 PolarHBondContact NZ-OE1 2.92Å; K131-E135 PolarHBondContact O-N 3.15Å; K131-F145 HydrophobicContact CG-CE1 3.8Å; K131-F145 HydrophobicContact CG-CZ 4.28Å; K131-E147 HydrophobicContact CG-CG 4.28Å
132	E	98.5	Very high	98	Very high	121 Å²	121	79.9 Å²	79.9	57%	0.565	40%	0.396	S	S	*	.	H	α-helix	trans	-62.8	-29.1	179.8	-60.3	75.4	-163.4	0	0	112.4	K130 A136	K130-E132 WeakPolarHBondContact CB-OE2 3.33Å; K130-E132 PolarHBondContact O-N 2.82Å; E132-A136 VanDerWaalsContact O-CB 3.25Å; E132-A136 WeakPolarHBondContact O-CB 3.49Å; E132-A136 PolarHBondContact O-N 3.4Å
133	E	98.3	Very high	98	Very high	64 Å²	64	78.3 Å²	78.3	30%	0.299	39%	0.387	S	S	.	.	H	α-helix	trans	-70.9	-41	176.2	-61.9	177	81	0	0	111	R91 F94 V129 K130 K131 A136 F137	R91-E133 IonicContact CZ-OE1 2.68Å; R91-E133 VanDerWaalsContact CZ-OE1 3.28Å; R91-E133 IonicContact CZ-OE2 3.02Å; R91-E133 IonicContact NH1-OE1 2.65Å; R91-E133 PolarHBondContact NH1-OE1 3.42Å; R91-E133 IonicContact NH1-OE2 2.68Å; R91-E133 VanDerWaalsContact NH2-CD 3.28Å; R91-E133 IonicContact NH2-OE1 3.79Å; R91-E133 PolarHBondContact NH2-OE1 3.36Å; R91-E133 IonicContact NH2-OE2 3.83Å; R91-E133 PolarHBondContact NH2-OE2 3.04Å; F94-E133 HydrophobicContact CZ-CB 4.12Å; V129-E133 HydrophobicContact CG1-CB 4.22Å; K130-E133 HydrophobicContact CB-CG 4.16Å; K130-E133 WeakPolarHBondContact CB-OE2 3.38Å; K130-E133 PolarHBondContact N-OE2 2.85Å; K130-E133 WeakPolarHBondContact O-CB 3.5Å; K130-E133 PolarHBondContact O-N 3.23Å; K131-E133 PolarHBondContact O-N 2.83Å; E133-A136 PolarHBondContact O-N 3.3Å; E133-F137 WeakPolarHBondContact O-CB 3.3Å; E133-F137 PolarHBondContact O-N 2.99Å
134	G	98.4	Very high	98	Very high	0 Å²	0	78.3 Å²	78.3	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-63.7	-43.2	172.4	0	0	0	0	0	112.5	L116 K131 F137 A138	L116-G134 WeakPolarHBondContact CD2-O 3.39Å; K131-G134 PolarHBondContact O-N 3.27Å; K131-G134 VanDerWaalsContact O-N 3.14Å; G134-F137 PolarHBondContact O-N 3.14Å; G134-A138 WeakPolarHBondContact O-CB 3.5Å; G134-A138 PolarHBondContact O-N 3.39Å
135	E	98.5	Very high	98.1	Very high	67 Å²	67	74.9 Å²	74.9	31%	0.313	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-41	175.4	-71.2	175.4	-179.4	0	0	112.2	K131 R139 F145	K131-E135 WeakPolarHBondContact CE-OE1 3.45Å; K131-E135 IonicContact NZ-OE1 2.79Å; K131-E135 PolarHBondContact NZ-OE1 2.92Å; K131-E135 PolarHBondContact O-N 3.15Å; E135-R139 WeakPolarHBondContact O-CB 3.3Å; E135-R139 PolarHBondContact O-N 2.71Å; E135-F145 HydrophobicContact CB-CD1 4.33Å; E135-F145 HydrophobicContact CG-CD1 3.41Å; E135-F145 VanDerWaalsContact CG-CD1 3.41Å; E135-F145 HydrophobicContact CG-CE1 3.6Å; E135-F145 HydrophobicContact CG-CG 4.44Å
136	A	98.6	Very high	98.1	Very high	51 Å²	51	70.5 Å²	70.5	42%	0.421	34%	0.337	S	S	.	.	H	α-helix	trans	-65.2	-48.7	177	0	0	0	0	0	111.6	E132 E133 A138 R139 E140	E132-A136 VanDerWaalsContact O-CB 3.25Å; E132-A136 WeakPolarHBondContact O-CB 3.49Å; E132-A136 PolarHBondContact O-N 3.4Å; E133-A136 PolarHBondContact O-N 3.3Å; A136-A138 VanDerWaalsContact C-N 3.35Å; A136-A138 PolarHBondContact O-N 3.48Å; A136-R139 PolarHBondContact O-N 3.02Å; A136-E140 WeakPolarHBondContact O-CB 3.38Å; A136-E140 PolarHBondContact O-N 2.68Å
137	F	98.6	Very high	98.2	Very high	20 Å²	20	63.2 Å²	63.2	9%	0.088	31%	0.31	C	S	.	.	H	α-helix	trans	-59	-45.7	177.6	-176.5	-83.7	0	0	0	111.7	F94 L97 T98 L101 L116 E133 G134 R139 E140 H141 L143	F94-F137 HydrophobicContact CE2-CB 4.42Å; F94-F137 HydrophobicContact CZ-CB 4.02Å; F94-F137 HydrophobicContact CZ-CD2 4.42Å; F94-F137 HydrophobicContact CZ-CG 4.4Å; L97-F137 HydrophobicContact CB-CE1 4.02Å; L97-F137 HydrophobicContact CB-CE2 4.11Å; L97-F137 HydrophobicContact CB-CZ 3.6Å; L97-F137 HydrophobicContact CD1-CD1 4.41Å; L97-F137 HydrophobicContact CD1-CE1 4.31Å; L97-F137 HydrophobicContact CD1-CZ 4.49Å; T98-F137 HydrophobicContact CG2-CE2 3.82Å; T98-F137 HydrophobicContact CG2-CZ 4.3Å; L101-F137 HydrophobicContact CD2-CE1 4.26Å; L101-F137 HydrophobicContact CD2-CZ 4.23Å; L116-F137 HydrophobicContact CD2-CB 4.46Å; L116-F137 HydrophobicContact CD2-CD1 3.79Å; E133-F137 WeakPolarHBondContact O-CB 3.3Å; E133-F137 PolarHBondContact O-N 2.99Å; G134-F137 PolarHBondContact O-N 3.14Å; F137-R139 VanDerWaalsContact C-N 3.34Å; F137-R139 PolarHBondContact O-N 3.44Å; F137-E140 PolarHBondContact O-N 2.85Å; F137-H141 AromaticContact CD1-CD2 3.79Å; F137-H141 AromaticContact CD2-CD2 3.81Å; F137-H141 AromaticContact CD2-NE2 3.96Å; F137-H141 AromaticContact CE1-CD2 3.55Å; F137-H141 AromaticContact CE2-CD2 3.55Å; F137-H141 AromaticContact CE2-NE2 3.48Å; F137-H141 WeakPolarHBondContact CE2-NE2 3.34Å; F137-H141 AromaticContact CG-CD2 3.93Å; F137-H141 AromaticContact CZ-CD2 3.42Å; F137-H141 VanDerWaalsContact CZ-CD2 3.42Å; F137-H141 WeakPolarHBondContact CZ-CD2 3.28Å; F137-H141 AromaticContact CZ-NE2 3.66Å; F137-H141 PolarHBondContact O-CD2 3.43Å; F137-H141 VanDerWaalsContact O-CD2 3.29Å; F137-H141 PolarHBondContact O-N 2.93Å; F137-H141 VanDerWaalsContact O-N 3.08Å; F137-L143 HydrophobicContact CD1-CD1 4.14Å; F137-L143 HydrophobicContact CE1-CD1 3.88Å
138	A	98.3	Very high	98.2	Very high	3 Å²	3	60.6 Å²	60.6	3%	0.025	30%	0.301	C	S	.	.	H	α-helix	trans	-62.1	-42.7	178.1	0	0	0	0	0	111.8	L116 G134 A136 H141 G142 L143 F145	L116-A138 HydrophobicContact CD2-CB 4.07Å; G134-A138 WeakPolarHBondContact O-CB 3.5Å; G134-A138 PolarHBondContact O-N 3.39Å; A136-A138 VanDerWaalsContact C-N 3.35Å; A136-A138 PolarHBondContact O-N 3.48Å; A138-H141 CarbonylContact O-C 3.59Å; A138-H141 PolarHBondContact O-N 2.81Å; A138-G142 CarbonylContact O-C 3.6Å; A138-G142 WeakPolarHBondContact O-CA 3.26Å; A138-G142 PolarHBondContact O-N 3.11Å; A138-L143 HydrophobicContact CB-CB 4.08Å; A138-L143 PolarHBondContact O-N 3.23Å; A138-F145 HydrophobicContact CB-CB 3.64Å; A138-F145 HydrophobicContact CB-CG 4.46Å
139	R	98.1	Very high	98.2	Very high	193 Å²	193	55.6 Å²	55.6	73%	0.728	28%	0.277	S	S	*	.	H	α-helix	trans	-64	-45.7	177.2	-169.4	-174.3	-48.8	168	8.2	112.5	E135 A136 F137 H141 G142	E135-R139 WeakPolarHBondContact O-CB 3.3Å; E135-R139 PolarHBondContact O-N 2.71Å; A136-R139 PolarHBondContact O-N 3.02Å; F137-R139 VanDerWaalsContact C-N 3.34Å; F137-R139 PolarHBondContact O-N 3.44Å; R139-H141 PolarHBondContact O-N 2.98Å; R139-G142 PolarHBondContact O-N 3.28Å
140	E	97.9	Very high	98.1	Very high	152 Å²	152	55.8 Å²	55.8	71%	0.71	28%	0.279	S	S	*	.	H	α-helix	trans	-58.7	-38.9	178.6	-178.6	175.5	176.6	0	0	111.7	A136 F137	A136-E140 WeakPolarHBondContact O-CB 3.38Å; A136-E140 PolarHBondContact O-N 2.68Å; F137-E140 PolarHBondContact O-N 2.85Å
141	H	96.8	Very high	98	Very high	47 Å²	47	54.9 Å²	54.9	22%	0.218	28%	0.275	C	S	.	.	H	α-helix	trans	-97.8	2	-178.2	-66.5	-61.3	0	0	0	114.5	L101 R105 F137 A138 R139 L143	L101-H141 HydrophobicContact CD2-CB 3.72Å; R105-H141 PolarHBondContact NH2-O 3.32Å; F137-H141 AromaticContact CD1-CD2 3.79Å; F137-H141 AromaticContact CD2-CD2 3.81Å; F137-H141 AromaticContact CD2-NE2 3.96Å; F137-H141 AromaticContact CE1-CD2 3.55Å; F137-H141 AromaticContact CE2-CD2 3.55Å; F137-H141 AromaticContact CE2-NE2 3.48Å; F137-H141 WeakPolarHBondContact CE2-NE2 3.34Å; F137-H141 AromaticContact CG-CD2 3.93Å; F137-H141 AromaticContact CZ-CD2 3.42Å; F137-H141 VanDerWaalsContact CZ-CD2 3.42Å; F137-H141 WeakPolarHBondContact CZ-CD2 3.28Å; F137-H141 AromaticContact CZ-NE2 3.66Å; F137-H141 PolarHBondContact O-CD2 3.43Å; F137-H141 VanDerWaalsContact O-CD2 3.29Å; F137-H141 PolarHBondContact O-N 2.93Å; F137-H141 VanDerWaalsContact O-N 3.08Å; A138-H141 CarbonylContact O-C 3.59Å; A138-H141 PolarHBondContact O-N 2.81Å; R139-H141 PolarHBondContact O-N 2.98Å; H141-L143 HydrophobicContact CB-CD1 4.06Å; H141-L143 HydrophobicContact CB-CD2 4.09Å; H141-L143 HydrophobicContact CB-CG 3.81Å
142	G	95.9	Very high	98	Very high	70 Å²	70	54.7 Å²	54.7	72%	0.722	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	41.9	-178.6	0	0	0	0	0	113.6	A138 R139	A138-G142 CarbonylContact O-C 3.6Å; A138-G142 WeakPolarHBondContact O-CA 3.26Å; A138-G142 PolarHBondContact O-N 3.11Å; R139-G142 PolarHBondContact O-N 3.28Å
143	L	97.7	Very high	97.9	Very high	20 Å²	20	50.9 Å²	50.9	11%	0.105	27%	0.271	C	S	.	.			trans	-105.1	158.1	177.1	-38.5	177.7	0	0	0	109.9	L101 I114 L116 F137 A138 H141	L101-L143 HydrophobicContact CD1-CD1 4.38Å; L101-L143 HydrophobicContact CD1-CD2 3.92Å; L101-L143 HydrophobicContact CD2-CD1 4.28Å; I114-L143 HydrophobicContact CB-CD2 3.88Å; I114-L143 HydrophobicContact CD1-CD2 4.43Å; I114-L143 HydrophobicContact CG2-CD2 4.06Å; L116-L143 HydrophobicContact CB-CD1 4.26Å; F137-L143 HydrophobicContact CD1-CD1 4.14Å; F137-L143 HydrophobicContact CE1-CD1 3.88Å; A138-L143 HydrophobicContact CB-CB 4.08Å; A138-L143 PolarHBondContact O-N 3.23Å; H141-L143 HydrophobicContact CB-CD1 4.06Å; H141-L143 HydrophobicContact CB-CD2 4.09Å; H141-L143 HydrophobicContact CB-CG 3.81Å
144	I	97.8	Very high	97.9	Very high	48 Å²	48	50.1 Å²	50.1	25%	0.246	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	149.7	165.1	-47.8	168.1	0	0	0	107.8	V113 I114 M115 L116 E166	V113-I144 HydrophobicContact CG1-CD1 4.04Å; I114-I144 PolarHBondContact O-N 3.07Å; I114-I144 VanDerWaalsContact O-N 3.1Å; M115-I144 CarbonylContact C-O 3.57Å; M115-I144 HydrophobicContact CE-CB 3.73Å; M115-I144 HydrophobicContact CE-CD1 4.22Å; M115-I144 HydrophobicContact CE-CG2 3.36Å; M115-I144 HydrophobicContact SD-CB 3.78Å; M115-I144 HydrophobicContact SD-CG2 3.66Å; L116-I144 WeakPolarHBondContact CB-O 3.44Å; L116-I144 PolarHBondContact N-O 3.34Å; I144-E166 HydrophobicContact CD1-CB 3.89Å; I144-E166 HydrophobicContact CD1-CG 3.94Å
145	F	98.6	Very high	97.9	Very high	35 Å²	35	53.1 Å²	53.1	15%	0.154	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	140.3	178.6	176.4	-112.6	0	0	0	112.9	Y86 L116 K131 E135 A138 E147	Y86-F145 HydrophobicContact CE1-CE2 4.19Å; L116-F145 HydrophobicContact CB-CD2 4.11Å; L116-F145 HydrophobicContact CD2-CD2 3.71Å; L116-F145 HydrophobicContact CD2-CE2 4.21Å; L116-F145 HydrophobicContact CG-CD2 3.83Å; L116-F145 HydrophobicContact CG-CE2 4.33Å; L116-F145 WeakPolarHBondContact O-CA 3.44Å; L116-F145 WeakPolarHBondContact O-CD2 3.29Å; K131-F145 HydrophobicContact CG-CE1 3.8Å; K131-F145 HydrophobicContact CG-CZ 4.28Å; E135-F145 HydrophobicContact CB-CD1 4.33Å; E135-F145 HydrophobicContact CG-CD1 3.41Å; E135-F145 VanDerWaalsContact CG-CD1 3.41Å; E135-F145 HydrophobicContact CG-CE1 3.6Å; E135-F145 HydrophobicContact CG-CG 4.44Å; A138-F145 HydrophobicContact CB-CB 3.64Å; A138-F145 HydrophobicContact CB-CG 4.46Å; F145-E147 HydrophobicContact CE1-CG 4.13Å; F145-E147 HydrophobicContact CE2-CG 4.43Å; F145-E147 HydrophobicContact CZ-CG 3.61Å
146	M	98.5	Very high	97.9	Very high	30 Å²	30	50 Å²	50	15%	0.148	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	140.2	172.2	-170.4	163.7	-78	0	0	111.3	M115 L116 I117 G118 T148 N155 E158 A159	M115-M146 HydrophobicContact SD-CB 3.98Å; L116-M146 PolarHBondContact O-N 2.95Å; I117-M146 VanDerWaalsContact CA-O 3.29Å; I117-M146 WeakPolarHBondContact CA-O 3.16Å; G118-M146 PolarHBondContact N-O 3.01Å; M146-T148 HydrophobicContact CG-CG2 4.15Å; M146-N155 HydrophobicContact CG-CB 3.85Å; M146-N155 HydrophobicContact SD-CB 3.71Å; M146-E158 HydrophobicContact CE-CB 3.96Å; M146-E158 HydrophobicContact SD-CB 3.81Å; M146-A159 HydrophobicContact SD-CB 3.93Å; M146-A159 PolarHBondContact SD-N 2.81Å
147	E	98.8	Very high	97.8	Very high	21 Å²	21	49.6 Å²	49.6	10%	0.098	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	139	164.5	-67.5	-164.9	161.6	0	0	110.4	G118 R127 K131 F145 N155	G118-E147 CarbonylContact O-C 3.51Å; G118-E147 WeakPolarHBondContact O-CA 3.42Å; R127-E147 IonicContact CZ-OE1 3.68Å; R127-E147 IonicContact CZ-OE2 3.51Å; R127-E147 IonicContact NH1-OE1 3.8Å; R127-E147 PolarHBondContact NH1-OE1 2.76Å; R127-E147 IonicContact NH1-OE2 3.28Å; R127-E147 IonicContact NH2-OE1 2.82Å; R127-E147 PolarHBondContact NH2-OE1 3.35Å; R127-E147 IonicContact NH2-OE2 3.62Å; R127-E147 PolarHBondContact NH2-OE2 3.35Å; K131-E147 HydrophobicContact CG-CG 4.28Å; F145-E147 HydrophobicContact CE1-CG 4.13Å; F145-E147 HydrophobicContact CE2-CG 4.43Å; F145-E147 HydrophobicContact CZ-CG 3.61Å; E147-N155 WeakPolarHBondContact O-CB 3.32Å; E147-N155 PolarHBondContact O-ND2 3.23Å
148	T	98.7	Very high	97.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	159.8	-175.6	63.8	0	0	0	0	111.8	I117 G118 N119 K120 S121 M146 S154 N155 A159	I117-T148 HydrophobicContact CG2-CG2 3.75Å; I117-T148 WeakPolarHBondContact CG2-OG1 3.43Å; G118-T148 PolarHBondContact O-N 3Å; N119-T148 CarbonylContact C-O 3.41Å; N119-T148 WeakPolarHBondContact CA-O 3.17Å; N119-T148 PolarHBondContact OD1-O 3.13Å; N119-T148 PolarHBondContact OD1-OG1 3.48Å; K120-T148 PolarHBondContact N-O 2.81Å; S121-T148 PolarHBondContact N-O 2.88Å; S121-T148 VanDerWaalsContact OG-C 3.3Å; S121-T148 PolarHBondContact OG-O 2.94Å; M146-T148 HydrophobicContact CG-CG2 4.15Å; T148-S154 WeakPolarHBondContact CA-O 3.34Å; T148-N155 HydrophobicContact CG2-CB 3.94Å; T148-A159 HydrophobicContact CG2-CB 4.14Å
149	S	98.4	Very high	97.8	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.			trans	-131.1	110	163.4	172.1	0	0	0	0	109.7	D122 K151 T152 A153 S154 V156	D122-S149 VanDerWaalsContact CG-OG 3.28Å; D122-S149 WeakPolarHBondContact OD1-CB 3.46Å; D122-S149 PolarHBondContact OD1-OG 3.45Å; S149-K151 PolarHBondContact O-N 3.49Å; S149-K151 PolarHBondContact OG-N 3.01Å; S149-T152 VanDerWaalsContact CB-OG1 3.25Å; S149-T152 WeakPolarHBondContact CB-OG1 3.5Å; S149-T152 PolarHBondContact O-N 3.48Å; S149-T152 PolarHBondContact OG-N 2.96Å; S149-T152 VanDerWaalsContact OG-N 3.12Å; S149-T152 PolarHBondContact OG-OG1 3.47Å; S149-A153 CarbonylContact O-C 3.51Å; S149-A153 VanDerWaalsContact O-CA 3.3Å; S149-A153 WeakPolarHBondContact O-CA 3.48Å; S149-A153 PolarHBondContact O-N 3.42Å; S149-S154 PolarHBondContact N-O 2.84Å; S149-S154 PolarHBondContact O-N 2.97Å; S149-V156 WeakPolarHBondContact O-CG2 3.34Å
150	A	97.1	Very high	97.8	Very high	4 Å²	4	43.3 Å²	43.3	3%	0.033	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.7	169.7	0	0	0	0	0	112.3	C21 L22 Q25 F31 N119	C21-A150 HydrophobicContact CB-CB 3.61Å; L22-A150 HydrophobicContact CD2-CB 3.96Å; L22-A150 HydrophobicContact CG-CB 4.2Å; Q25-A150 WeakPolarHBondContact CG-O 2.81Å; Q25-A150 PolarHBondContact NE2-O 3.49Å; F31-A150 HydrophobicContact CD2-CB 4.4Å; N119-A150 PolarHBondContact OD1-N 3.04Å
151	K	96.4	Very high	97.8	Very high	116 Å²	116	37.8 Å²	37.8	50%	0.504	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-44.5	-179.4	-174.3	-172.2	-178.1	-177.6	0	112.6	F31 D122 S149	F31-K151 HydrophobicContact CD1-CB 4.45Å; F31-K151 HydrophobicContact CD1-CG 4.07Å; F31-K151 HydrophobicContact CD2-CB 4.17Å; F31-K151 HydrophobicContact CE1-CB 4.27Å; F31-K151 HydrophobicContact CE1-CG 3.88Å; F31-K151 HydrophobicContact CE2-CB 3.99Å; F31-K151 HydrophobicContact CE2-CG 4.49Å; F31-K151 HydrophobicContact CG-CB 4.39Å; F31-K151 HydrophobicContact CG-CG 4.45Å; F31-K151 HydrophobicContact CZ-CB 4.04Å; F31-K151 HydrophobicContact CZ-CG 4.11Å; D122-K151 WeakPolarHBondContact OD2-CD 3.4Å; D122-K151 IonicContact OD2-NZ 3.04Å; S149-K151 PolarHBondContact O-N 3.49Å; S149-K151 PolarHBondContact OG-N 3.01Å
152	T	97.3	Very high	97.9	Very high	87 Å²	87	38.3 Å²	38.3	53%	0.534	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-1.3	-177.5	66.6	0	0	0	0	113.3	D122 S149 S154	D122-T152 HydrophobicContact CB-CG2 3.94Å; S149-T152 VanDerWaalsContact CB-OG1 3.25Å; S149-T152 WeakPolarHBondContact CB-OG1 3.5Å; S149-T152 PolarHBondContact O-N 3.48Å; S149-T152 PolarHBondContact OG-N 2.96Å; S149-T152 VanDerWaalsContact OG-N 3.12Å; S149-T152 PolarHBondContact OG-OG1 3.47Å; T152-S154 PolarHBondContact O-N 3.04Å; T152-S154 WeakPolarHBondContact OG1-CB 3.41Å; T152-S154 PolarHBondContact OG1-N 3.23Å
153	A	97.7	Very high	98	Very high	41 Å²	41	35 Å²	35	34%	0.339	19%	0.187	S	C	.	.			trans	64.6	5.3	-170.3	0	0	0	0	0	114.8	Q25 S149 N155 V156	Q25-A153 HydrophobicContact CG-CB 4.02Å; S149-A153 CarbonylContact O-C 3.51Å; S149-A153 VanDerWaalsContact O-CA 3.3Å; S149-A153 WeakPolarHBondContact O-CA 3.48Å; S149-A153 PolarHBondContact O-N 3.42Å; A153-N155 PolarHBondContact O-N 2.9Å; A153-V156 PolarHBondContact O-N 3.43Å
154	S	98.4	Very high	98	Very high	48 Å²	48	34 Å²	34	34%	0.336	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	124.6	-179.4	179.8	0	0	0	0	110.8	T148 S149 T152 V156	T148-S154 WeakPolarHBondContact CA-O 3.34Å; S149-S154 PolarHBondContact N-O 2.84Å; S149-S154 PolarHBondContact O-N 2.97Å; T152-S154 PolarHBondContact O-N 3.04Å; T152-S154 WeakPolarHBondContact OG1-CB 3.41Å; T152-S154 PolarHBondContact OG1-N 3.23Å; S154-V156 PolarHBondContact O-N 2.85Å
155	N	98.3	Very high	98	Very high	63 Å²	63	35.8 Å²	35.8	34%	0.337	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	7.1	177.1	-65.2	-21.2	0	0	0	115.5	M146 E147 T148 A153 E158 A159	M146-N155 HydrophobicContact CG-CB 3.85Å; M146-N155 HydrophobicContact SD-CB 3.71Å; E147-N155 WeakPolarHBondContact O-CB 3.32Å; E147-N155 PolarHBondContact O-ND2 3.23Å; T148-N155 HydrophobicContact CG2-CB 3.94Å; A153-N155 PolarHBondContact O-N 2.9Å; N155-E158 VanDerWaalsContact C-OE2 3.22Å; N155-E158 WeakPolarHBondContact CA-OE2 3.37Å; N155-A159 WeakPolarHBondContact O-CB 3.39Å; N155-A159 PolarHBondContact O-N 2.68Å
156	V	98.3	Very high	97.9	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-68.1	-47.1	-178.2	178.3	0	0	0	0	109.9	L22 Q25 F26 S149 A153 S154 E158 A159 F160	L22-V156 HydrophobicContact CD2-CG1 4.27Å; L22-V156 HydrophobicContact CD2-CG2 3.82Å; Q25-V156 HydrophobicContact CB-CG1 4.17Å; Q25-V156 HydrophobicContact CG-CB 4.31Å; Q25-V156 HydrophobicContact CG-CG1 4.07Å; Q25-V156 HydrophobicContact CG-CG2 4.12Å; F26-V156 HydrophobicContact CB-CG1 4.11Å; S149-V156 WeakPolarHBondContact O-CG2 3.34Å; A153-V156 PolarHBondContact O-N 3.43Å; S154-V156 PolarHBondContact O-N 2.85Å; V156-E158 VanDerWaalsContact C-N 3.33Å; V156-E158 PolarHBondContact O-N 3.36Å; V156-A159 PolarHBondContact O-N 3.29Å; V156-F160 HydrophobicContact CG1-CE2 4.28Å; V156-F160 VanDerWaalsContact O-CD2 3.28Å; V156-F160 WeakPolarHBondContact O-CD2 3.38Å
157	E	97.3	Very high	97.7	Very high	42 Å²	42	35.8 Å²	35.8	20%	0.196	19%	0.188	C	C	.	.	H	α-helix	trans	-62	-45.6	179.5	-168.7	75.2	-176.1	0	0	111.2	K29 R46 A159 F160 I161	K29-E157 IonicContact NZ-OE2 2.72Å; K29-E157 PolarHBondContact NZ-OE2 3.17Å; R46-E157 IonicContact CZ-OE1 3.46Å; R46-E157 IonicContact CZ-OE2 3.61Å; R46-E157 IonicContact NH1-OE1 3.74Å; R46-E157 PolarHBondContact NH1-OE1 3.16Å; R46-E157 IonicContact NH1-OE2 2.78Å; R46-E157 PolarHBondContact NH1-OE2 2.99Å; R46-E157 IonicContact NH2-OE1 3.63Å; R46-E157 PolarHBondContact NH2-OE1 3.42Å; R46-E157 IonicContact NH2-OE2 3.21Å; E157-A159 VanDerWaalsContact C-N 3.34Å; E157-A159 PolarHBondContact O-N 3.45Å; E157-F160 PolarHBondContact O-N 3.44Å; E157-I161 HydrophobicContact CG-CD1 3.64Å; E157-I161 HydrophobicContact CG-CG1 4.35Å; E157-I161 WeakPolarHBondContact O-CG1 3.39Å; E157-I161 PolarHBondContact O-N 3.41Å
158	E	98.2	Very high	97.5	Very high	84 Å²	84	35.8 Å²	35.8	39%	0.393	19%	0.187	S	C	.	.	H	α-helix	trans	-62.3	-39.6	-176.7	-64.8	81.4	176	0	0	111.4	M146 N155 V156 F160 I161 N162	M146-E158 HydrophobicContact CE-CB 3.96Å; M146-E158 HydrophobicContact SD-CB 3.81Å; N155-E158 VanDerWaalsContact C-OE2 3.22Å; N155-E158 WeakPolarHBondContact CA-OE2 3.37Å; V156-E158 VanDerWaalsContact C-N 3.33Å; V156-E158 PolarHBondContact O-N 3.36Å; E158-F160 PolarHBondContact O-N 3.5Å; E158-I161 PolarHBondContact O-N 2.88Å; E158-N162 WeakPolarHBondContact O-CB 3.44Å; E158-N162 PolarHBondContact O-N 2.65Å; E158-N162 PolarHBondContact O-ND2 3.29Å
159	A	98.4	Very high	97.2	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-46.4	177.7	0	0	0	0	0	112.2	I117 M146 T148 N155 V156 E157 T163	I117-A159 HydrophobicContact CD1-CB 3.9Å; M146-A159 HydrophobicContact SD-CB 3.93Å; M146-A159 PolarHBondContact SD-N 2.81Å; T148-A159 HydrophobicContact CG2-CB 4.14Å; N155-A159 WeakPolarHBondContact O-CB 3.39Å; N155-A159 PolarHBondContact O-N 2.68Å; V156-A159 PolarHBondContact O-N 3.29Å; E157-A159 VanDerWaalsContact C-N 3.34Å; E157-A159 PolarHBondContact O-N 3.45Å; A159-T163 WeakPolarHBondContact O-CB 3.26Å; A159-T163 PolarHBondContact O-N 2.98Å; A159-T163 PolarHBondContact O-OG1 3.1Å
160	F	98.3	Very high	96.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-71.4	-42.6	178.5	-73.6	-95.6	0	0	0	111.9	Y9 I11 F26 L57 I59 L83 V156 E157 E158 A164	Y9-F160 HydrophobicContact CD2-CD1 4.2Å; Y9-F160 HydrophobicContact CE2-CD1 4.42Å; I11-F160 HydrophobicContact CD1-CE1 4.31Å; I11-F160 HydrophobicContact CD1-CZ 4.03Å; F26-F160 HydrophobicContact CB-CD2 3.86Å; F26-F160 HydrophobicContact CB-CE2 3.62Å; F26-F160 HydrophobicContact CB-CG 4.46Å; F26-F160 HydrophobicContact CB-CZ 4.02Å; F26-F160 HydrophobicContact CD1-CB 4.46Å; F26-F160 AromaticContact CD1-CD1 3.84Å; F26-F160 HydrophobicContact CD1-CD1 3.84Å; F26-F160 HydrophobicContact CD1-CD2 4.16Å; F26-F160 HydrophobicContact CD1-CE1 4.06Å; F26-F160 HydrophobicContact CD1-CE2 4.37Å; F26-F160 AromaticContact CD1-CG 3.9Å; F26-F160 HydrophobicContact CD1-CG 3.9Å; F26-F160 HydrophobicContact CD1-CZ 4.31Å; F26-F160 HydrophobicContact CD2-CB 3.85Å; F26-F160 AromaticContact CD2-CD2 3.63Å; F26-F160 HydrophobicContact CD2-CD2 3.63Å; F26-F160 HydrophobicContact CD2-CE2 4.29Å; F26-F160 AromaticContact CD2-CG 3.76Å; F26-F160 HydrophobicContact CD2-CG 3.76Å; F26-F160 HydrophobicContact CE1-CB 4.14Å; F26-F160 AromaticContact CE1-CD1 3.94Å; F26-F160 HydrophobicContact CE1-CD1 3.94Å; F26-F160 HydrophobicContact CE1-CG 4.01Å; F26-F160 HydrophobicContact CE2-CB 3.5Å; F26-F160 HydrophobicContact CE2-CD2 4.2Å; F26-F160 AromaticContact CE2-CG 3.9Å; F26-F160 HydrophobicContact CE2-CG 3.9Å; F26-F160 HydrophobicContact CG-CB 4.32Å; F26-F160 HydrophobicContact CG-CD1 4.15Å; F26-F160 AromaticContact CG-CD2 3.61Å; F26-F160 HydrophobicContact CG-CD2 3.61Å; F26-F160 HydrophobicContact CG-CE1 4.36Å; F26-F160 AromaticContact CG-CE2 3.85Å; F26-F160 HydrophobicContact CG-CE2 3.85Å; F26-F160 AromaticContact CG-CG 3.77Å; F26-F160 HydrophobicContact CG-CG 3.77Å; F26-F160 HydrophobicContact CG-CZ 4.21Å; F26-F160 HydrophobicContact CZ-CB 3.66Å; F26-F160 HydrophobicContact CZ-CD1 4.35Å; F26-F160 HydrophobicContact CZ-CG 4.02Å; L57-F160 HydrophobicContact CD1-CB 4.41Å; I59-F160 HydrophobicContact CD1-CD1 3.83Å; I59-F160 HydrophobicContact CD1-CE1 3.62Å; I59-F160 HydrophobicContact CG1-CE1 4.24Å; I59-F160 HydrophobicContact CG2-CE1 4.21Å; L83-F160 HydrophobicContact CD1-CD1 3.75Å; L83-F160 HydrophobicContact CD1-CD2 4.14Å; L83-F160 HydrophobicContact CD1-CE1 3.33Å; L83-F160 HydrophobicContact CD1-CE2 3.78Å; L83-F160 HydrophobicContact CD1-CG 4.15Å; L83-F160 HydrophobicContact CD1-CZ 3.35Å; V156-F160 HydrophobicContact CG1-CE2 4.28Å; V156-F160 VanDerWaalsContact O-CD2 3.28Å; V156-F160 WeakPolarHBondContact O-CD2 3.38Å; E157-F160 PolarHBondContact O-N 3.44Å; E158-F160 PolarHBondContact O-N 3.5Å; F160-A164 PolarHBondContact O-N 3.28Å
161	I	97.8	Very high	96.5	Very high	36 Å²	36	43 Å²	43	19%	0.185	22%	0.22	C	C	.	.	H	α-helix	trans	-68.6	-43.4	-178.3	-68.5	-178.5	0	0	0	111.5	E157 E158 T163 A164 K165	E157-I161 HydrophobicContact CG-CD1 3.64Å; E157-I161 HydrophobicContact CG-CG1 4.35Å; E157-I161 WeakPolarHBondContact O-CG1 3.39Å; E157-I161 PolarHBondContact O-N 3.41Å; E158-I161 PolarHBondContact O-N 2.88Å; I161-T163 VanDerWaalsContact C-N 3.32Å; I161-T163 PolarHBondContact O-N 2.63Å; I161-A164 WeakPolarHBondContact O-CA 3.48Å; I161-A164 WeakPolarHBondContact O-CB 3.06Å; I161-A164 PolarHBondContact O-N 3.28Å; I161-K165 HydrophobicContact CG2-CD 4.23Å; I161-K165 HydrophobicContact CG2-CG 4.36Å; I161-K165 WeakPolarHBondContact O-CG 3.49Å; I161-K165 PolarHBondContact O-N 3.29Å
162	N	97.9	Very high	96.2	Very high	57 Å²	57	43 Å²	43	31%	0.305	22%	0.222	S	C	.	.	H	α-helix	trans	-67	-36.6	-178.9	-69.7	-8.3	0	0	0	111.6	M115 E158 A164 K165 E166	M115-N162 HydrophobicContact CE-CB 4.09Å; E158-N162 WeakPolarHBondContact O-CB 3.44Å; E158-N162 PolarHBondContact O-N 2.65Å; E158-N162 PolarHBondContact O-ND2 3.29Å; N162-A164 PolarHBondContact O-N 3.04Å; N162-K165 PolarHBondContact O-N 3.46Å; N162-E166 PolarHBondContact O-N 2.7Å
163	T	98.2	Very high	95.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-38.7	170.4	-52.4	0	0	0	0	110.9	Y9 L83 V113 M115 A159 I161 I167	Y9-T163 HydrophobicContact CE2-CG2 3.75Å; Y9-T163 WeakPolarHBondContact OH-CB 3.14Å; Y9-T163 WeakPolarHBondContact OH-CG2 3.43Å; Y9-T163 PolarHBondContact OH-O 2.93Å; L83-T163 HydrophobicContact CD2-CG2 4.36Å; V113-T163 HydrophobicContact CG1-CG2 3.95Å; M115-T163 VanDerWaalsContact CB-OG1 3.31Å; M115-T163 WeakPolarHBondContact CB-OG1 3.5Å; A159-T163 WeakPolarHBondContact O-CB 3.26Å; A159-T163 PolarHBondContact O-N 2.98Å; A159-T163 PolarHBondContact O-OG1 3.1Å; I161-T163 VanDerWaalsContact C-N 3.32Å; I161-T163 PolarHBondContact O-N 2.63Å; T163-I167 HydrophobicContact CG2-CD1 4.36Å; T163-I167 WeakPolarHBondContact O-CG1 3.44Å; T163-I167 PolarHBondContact O-N 2.94Å
164	A	97.5	Very high	95.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-75.3	-33.5	-177.8	0	0	0	0	0	112.1	F7 Y9 I48 I50 L57 F160 I161 N162 I167 Y168	F7-A164 HydrophobicContact CD2-CB 4.23Å; F7-A164 HydrophobicContact CE2-CB 4.37Å; Y9-A164 WeakPolarHBondContact OH-CA 3.27Å; Y9-A164 VanDerWaalsContact OH-CB 3.26Å; Y9-A164 WeakPolarHBondContact OH-CB 3.41Å; Y9-A164 PolarHBondContact OH-N 3.31Å; I48-A164 HydrophobicContact CD1-CB 3.58Å; I50-A164 HydrophobicContact CD1-CB 3.5Å; I50-A164 VanDerWaalsContact CD1-CB 3.5Å; L57-A164 HydrophobicContact CD2-CB 4.14Å; F160-A164 PolarHBondContact O-N 3.28Å; I161-A164 WeakPolarHBondContact O-CA 3.48Å; I161-A164 WeakPolarHBondContact O-CB 3.06Å; I161-A164 PolarHBondContact O-N 3.28Å; N162-A164 PolarHBondContact O-N 3.04Å; A164-I167 PolarHBondContact O-N 3.14Å; A164-Y168 VanDerWaalsContact O-CB 3.3Å; A164-Y168 WeakPolarHBondContact O-CB 3.35Å; A164-Y168 PolarHBondContact O-N 3.02Å
165	K	97.1	Very high	94.3	Very high	86 Å²	86	47.1 Å²	47.1	37%	0.374	24%	0.242	S	C	.	.	H	α-helix	trans	-62	-48.9	172.3	-73.1	176.8	176.5	175.9	0	111.1	I50 I161 N162 I167 Y168 E169	I50-K165 HydrophobicContact CD1-CG 3.82Å; I50-K165 HydrophobicContact CG1-CG 4.38Å; I50-K165 HydrophobicContact CG2-CG 4.06Å; I161-K165 HydrophobicContact CG2-CD 4.23Å; I161-K165 HydrophobicContact CG2-CG 4.36Å; I161-K165 WeakPolarHBondContact O-CG 3.49Å; I161-K165 PolarHBondContact O-N 3.29Å; N162-K165 PolarHBondContact O-N 3.46Å; K165-I167 VanDerWaalsContact C-N 3.33Å; K165-I167 PolarHBondContact O-N 2.81Å; K165-Y168 CarbonylContact O-C 3.59Å; K165-Y168 WeakPolarHBondContact O-CA 3.21Å; K165-Y168 WeakPolarHBondContact O-CB 3.12Å; K165-Y168 PolarHBondContact O-N 3.04Å; K165-E169 WeakPolarHBondContact O-CG 3.48Å; K165-E169 PolarHBondContact O-N 3.02Å
166	E	96.4	Very high	93.3	Very high	65 Å²	65	44.4 Å²	44.4	30%	0.304	23%	0.227	S	C	.	.	H	α-helix	trans	-58.8	-43.4	177.6	-177.4	73.3	-162.1	0	0	112.1	V113 I144 N162 Y168 E169 K170	V113-E166 HydrophobicContact CB-CG 4.29Å; V113-E166 HydrophobicContact CG1-CB 3.88Å; V113-E166 HydrophobicContact CG1-CG 3.6Å; V113-E166 HydrophobicContact CG2-CB 4.28Å; V113-E166 HydrophobicContact CG2-CG 3.64Å; I144-E166 HydrophobicContact CD1-CB 3.89Å; I144-E166 HydrophobicContact CD1-CG 3.94Å; N162-E166 PolarHBondContact O-N 2.7Å; E166-Y168 VanDerWaalsContact C-N 3.31Å; E166-Y168 PolarHBondContact O-N 2.87Å; E166-E169 PolarHBondContact O-N 2.84Å; E166-K170 WeakPolarHBondContact O-CG 3.47Å; E166-K170 PolarHBondContact O-N 3.47Å; E166-K170 WeakPolarHBondContact OE1-CE 3.25Å
167	I	95.1	Very high	92.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-43	175.2	-65.7	165.6	0	0	0	110.4	F7 Y9 A80 V113 T163 A164 K165 K170 I171 F176 I185	F7-I167 HydrophobicContact CD1-CG2 4.09Å; F7-I167 HydrophobicContact CD2-CB 4.31Å; F7-I167 HydrophobicContact CD2-CD1 4.38Å; F7-I167 HydrophobicContact CD2-CG2 4.04Å; F7-I167 HydrophobicContact CE1-CG2 3.88Å; F7-I167 HydrophobicContact CE2-CB 4.04Å; F7-I167 HydrophobicContact CE2-CG2 3.8Å; F7-I167 HydrophobicContact CG-CG2 4.19Å; F7-I167 HydrophobicContact CZ-CB 4.38Å; F7-I167 HydrophobicContact CZ-CG2 3.73Å; Y9-I167 HydrophobicContact CD1-CD1 4.49Å; Y9-I167 HydrophobicContact CE1-CD1 3.46Å; Y9-I167 VanDerWaalsContact CE1-CD1 3.46Å; A80-I167 HydrophobicContact CB-CD1 4.06Å; A80-I167 HydrophobicContact CB-CG2 4.3Å; A80-I167 WeakPolarHBondContact O-CD1 3.2Å; V113-I167 HydrophobicContact CB-CD1 4.34Å; V113-I167 HydrophobicContact CB-CG1 3.69Å; V113-I167 HydrophobicContact CG1-CG1 4.43Å; V113-I167 HydrophobicContact CG2-CB 4.46Å; V113-I167 HydrophobicContact CG2-CG1 3.52Å; T163-I167 HydrophobicContact CG2-CD1 4.36Å; T163-I167 WeakPolarHBondContact O-CG1 3.44Å; T163-I167 PolarHBondContact O-N 2.94Å; A164-I167 PolarHBondContact O-N 3.14Å; K165-I167 VanDerWaalsContact C-N 3.33Å; K165-I167 PolarHBondContact O-N 2.81Å; I167-K170 PolarHBondContact O-N 3.01Å; I167-I171 HydrophobicContact CG2-CD1 4.22Å; I167-I171 WeakPolarHBondContact O-CG1 3.36Å; I167-I171 PolarHBondContact O-N 2.7Å; I167-F176 HydrophobicContact CG2-CE2 4.13Å; I167-I185 HydrophobicContact CG2-CD1 4.11Å; I167-I185 HydrophobicContact CG2-CG1 4.35Å
168	Y	94.4	Very high	90.9	Very high	21 Å²	21	48.5 Å²	48.5	8%	0.082	25%	0.25	C	S	.	.	H	α-helix	trans	-64.7	-41.6	179.8	-177.7	-107.1	0	0	0	112.3	Y5 I50 D51 I55 A164 K165 E166 I171 Q172	Y5-Y168 HydrophobicContact CD2-CD2 4.33Å; Y5-Y168 HydrophobicContact CD2-CE2 4.17Å; Y5-Y168 HydrophobicContact CE2-CD2 4.27Å; Y5-Y168 AromaticContact CE2-CE2 3.75Å; Y5-Y168 HydrophobicContact CE2-CE2 3.75Å; I50-Y168 HydrophobicContact CG2-CD1 3.91Å; I50-Y168 HydrophobicContact CG2-CE1 4.42Å; I50-Y168 HydrophobicContact CG2-CG 4.3Å; D51-Y168 HydrophobicContact CB-CE1 4.26Å; I55-Y168 HydrophobicContact CD1-CD2 4.22Å; A164-Y168 VanDerWaalsContact O-CB 3.3Å; A164-Y168 WeakPolarHBondContact O-CB 3.35Å; A164-Y168 PolarHBondContact O-N 3.02Å; K165-Y168 CarbonylContact O-C 3.59Å; K165-Y168 WeakPolarHBondContact O-CA 3.21Å; K165-Y168 WeakPolarHBondContact O-CB 3.12Å; K165-Y168 PolarHBondContact O-N 3.04Å; E166-Y168 VanDerWaalsContact C-N 3.31Å; E166-Y168 PolarHBondContact O-N 2.87Å; Y168-I171 WeakPolarHBondContact O-CB 3.37Å; Y168-I171 PolarHBondContact O-N 2.75Å; Y168-I171 VanDerWaalsContact O-N 3.16Å; Y168-Q172 HydrophobicContact CD1-CG 4.48Å; Y168-Q172 HydrophobicContact CE1-CG 4.15Å; Y168-Q172 WeakPolarHBondContact O-CG 3.25Å; Y168-Q172 PolarHBondContact O-N 3.26Å
169	E	93.6	Very high	89.6	Confident	98 Å²	98	50.9 Å²	50.9	46%	0.458	27%	0.266	S	S	.	.	H	α-helix	trans	-60.4	-47.9	174.5	-73.8	172.8	-167.8	0	0	110.9	K165 E166 I171 Q172 E173	K165-E169 WeakPolarHBondContact O-CG 3.48Å; K165-E169 PolarHBondContact O-N 3.02Å; E166-E169 PolarHBondContact O-N 2.84Å; E169-I171 PolarHBondContact O-N 3.04Å; E169-Q172 WeakPolarHBondContact O-CA 3.4Å; E169-Q172 WeakPolarHBondContact O-CB 3.43Å; E169-Q172 PolarHBondContact O-N 2.98Å; E169-E173 WeakPolarHBondContact O-CG 3.36Å; E169-E173 PolarHBondContact O-N 3.14Å
170	K	91.4	Very high	88.6	Confident	48 Å²	48	54.2 Å²	54.2	21%	0.209	28%	0.283	C	S	.	.	H	α-helix	trans	-59.5	-30.1	174.2	-73.8	-175.4	-178.7	-172.2	0	113.8	V113 E166 I167 G174 V175 F176	V113-K170 HydrophobicContact CG2-CD 3.88Å; E166-K170 WeakPolarHBondContact O-CG 3.47Å; E166-K170 PolarHBondContact O-N 3.47Å; E166-K170 WeakPolarHBondContact OE1-CE 3.25Å; I167-K170 PolarHBondContact O-N 3.01Å; K170-G174 PolarHBondContact O-N 3.37Å; K170-V175 HydrophobicContact CB-CB 4.18Å; K170-V175 WeakPolarHBondContact O-CB 3.37Å; K170-V175 PolarHBondContact O-N 3.24Å; K170-F176 HydrophobicContact CB-CD2 3.57Å; K170-F176 HydrophobicContact CB-CE2 3.57Å; K170-F176 HydrophobicContact CD-CE2 3.9Å; K170-F176 HydrophobicContact CG-CE2 4.39Å
171	I	89	Confident	87.2	Confident	10 Å²	10	60.2 Å²	60.2	5%	0.051	31%	0.311	C	S	.	.	H	α-helix	trans	-68.4	-44.3	171.5	-68.7	165.3	0	0	0	110.4	Y5 F7 I167 Y168 E169 E173 G174 F176 I178 I185	Y5-I171 HydrophobicContact CD1-CD1 4.49Å; Y5-I171 HydrophobicContact CE1-CG2 4.49Å; F7-I171 HydrophobicContact CE1-CD1 3.52Å; F7-I171 HydrophobicContact CZ-CD1 3.68Å; I167-I171 HydrophobicContact CG2-CD1 4.22Å; I167-I171 WeakPolarHBondContact O-CG1 3.36Å; I167-I171 PolarHBondContact O-N 2.7Å; Y168-I171 WeakPolarHBondContact O-CB 3.37Å; Y168-I171 PolarHBondContact O-N 2.75Å; Y168-I171 VanDerWaalsContact O-N 3.16Å; E169-I171 PolarHBondContact O-N 3.04Å; I171-E173 VanDerWaalsContact C-N 3.27Å; I171-E173 PolarHBondContact O-N 2.68Å; I171-G174 PolarHBondContact O-N 3.06Å; I171-F176 HydrophobicContact CG1-CB 3.96Å; I171-F176 HydrophobicContact CG1-CD2 3.98Å; I171-F176 HydrophobicContact CG1-CG 4.35Å; I171-I178 HydrophobicContact CG2-CD1 3.46Å; I171-I178 VanDerWaalsContact CG2-CD1 3.46Å; I171-I178 HydrophobicContact CG2-CG1 4Å; I171-I185 HydrophobicContact CD1-CD1 3.77Å; I171-I185 HydrophobicContact CD1-CG1 4.3Å; I171-I185 HydrophobicContact CD1-CG2 3.96Å; I171-I185 HydrophobicContact CG1-CD1 3.87Å
172	Q	88.8	Confident	86.1	Confident	115 Å²	115	60.3 Å²	60.3	54%	0.537	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-34.4	178.6	-61.3	-45.6	-67.6	0	0	112.2	Y168 E169 G174	Y168-Q172 HydrophobicContact CD1-CG 4.48Å; Y168-Q172 HydrophobicContact CE1-CG 4.15Å; Y168-Q172 WeakPolarHBondContact O-CG 3.25Å; Y168-Q172 PolarHBondContact O-N 3.26Å; E169-Q172 WeakPolarHBondContact O-CA 3.4Å; E169-Q172 WeakPolarHBondContact O-CB 3.43Å; E169-Q172 PolarHBondContact O-N 2.98Å; Q172-G174 PolarHBondContact O-N 3.27Å
173	E	89.8	Confident	85.2	Confident	144 Å²	144	58 Å²	58	67%	0.673	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-7.6	175.1	-66.8	178.1	170.5	0	0	113.5	E169 I171 V175	E169-E173 WeakPolarHBondContact O-CG 3.36Å; E169-E173 PolarHBondContact O-N 3.14Å; I171-E173 VanDerWaalsContact C-N 3.27Å; I171-E173 PolarHBondContact O-N 2.68Å; E173-V175 VanDerWaalsContact C-N 3.32Å; E173-V175 HydrophobicContact CB-CG2 4.04Å
174	G	83.7	Confident	84.2	Confident	59 Å²	59	58.3 Å²	58.3	61%	0.608	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	14.3	-179	0	0	0	0	0	114.6	K170 I171 Q172 F176	K170-G174 PolarHBondContact O-N 3.37Å; I171-G174 PolarHBondContact O-N 3.06Å; Q172-G174 PolarHBondContact O-N 3.27Å; G174-F176 VanDerWaalsContact C-N 3.32Å
175	V	80.9	Confident	83.5	Confident	60 Å²	60	58.3 Å²	58.3	36%	0.364	31%	0.309	S	S	.	.			trans	-69.9	-31.6	177.3	178.1	0	0	0	0	111.4	N111 K170 E173	N111-V175 HydrophobicContact CB-CG1 4.38Å; N111-V175 PolarHBondContact ND2-O 3.18Å; N111-V175 VanDerWaalsContact ND2-O 3.1Å; K170-V175 HydrophobicContact CB-CB 4.18Å; K170-V175 WeakPolarHBondContact O-CB 3.37Å; K170-V175 PolarHBondContact O-N 3.24Å; E173-V175 VanDerWaalsContact C-N 3.32Å; E173-V175 HydrophobicContact CB-CG2 4.04Å
176	F	76.8	Confident	83	Confident	5 Å²	5	58.3 Å²	58.3	2%	0.022	31%	0.309	C	S	.	.	S	Bend	trans	-98.6	120.8	173.8	-75	-69.9	0	0	0	111.4	N111 I167 K170 I171 G174 I178 N183 I185	N111-F176 HydrophobicContact CB-CD1 4.2Å; N111-F176 HydrophobicContact CB-CE1 3.61Å; N111-F176 HydrophobicContact CB-CZ 3.95Å; N111-F176 WeakPolarHBondContact O-CZ 3.3Å; I167-F176 HydrophobicContact CG2-CE2 4.13Å; K170-F176 HydrophobicContact CB-CD2 3.57Å; K170-F176 HydrophobicContact CB-CE2 3.57Å; K170-F176 HydrophobicContact CD-CE2 3.9Å; K170-F176 HydrophobicContact CG-CE2 4.39Å; I171-F176 HydrophobicContact CG1-CB 3.96Å; I171-F176 HydrophobicContact CG1-CD2 3.98Å; I171-F176 HydrophobicContact CG1-CG 4.35Å; G174-F176 VanDerWaalsContact C-N 3.32Å; F176-I178 PolarHBondContact O-N 3.39Å; F176-N183 HydrophobicContact CD1-CB 4.06Å; F176-I185 HydrophobicContact CB-CD1 3.7Å; F176-I185 HydrophobicContact CD1-CD1 3.63Å; F176-I185 HydrophobicContact CD2-CD1 3.79Å; F176-I185 HydrophobicContact CE1-CD1 4.11Å; F176-I185 HydrophobicContact CE2-CD1 4.25Å; F176-I185 HydrophobicContact CG-CD1 3.44Å; F176-I185 VanDerWaalsContact CG-CD1 3.44Å; F176-I185 HydrophobicContact CZ-CD1 4.38Å
177	D	73.4	Confident	82.4	Confident	85 Å²	85	57.9 Å²	57.9	46%	0.455	31%	0.308	S	S	.	.			trans	-72.8	106.8	163.4	-177.8	3	0	0	0	109.2	N179 N180 N183	D177-N179 PolarHBondContact O-N 3.48Å; D177-N179 WeakPolarHBondContact OD1-CB 3.25Å; D177-N179 PolarHBondContact OD1-N 3.26Å; D177-N179 PolarHBondContact OD1-ND2 3.22Å; D177-N180 HydrophobicContact CB-CB 4.2Å; D177-N180 PolarHBondContact O-N 2.91Å; D177-N183 PolarHBondContact O-ND2 3.12Å
178	I	71.9	Confident	81.6	Confident	44 Å²	44	58 Å²	58	23%	0.226	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-15.2	-175.6	-33.7	176.5	0	0	0	111.7	Y5 I171 F176 N180 I185 I187	Y5-I178 HydrophobicContact CD1-CG2 4.47Å; Y5-I178 HydrophobicContact CE1-CD1 4.34Å; Y5-I178 HydrophobicContact CE1-CG2 4.14Å; I171-I178 HydrophobicContact CG2-CD1 3.46Å; I171-I178 VanDerWaalsContact CG2-CD1 3.46Å; I171-I178 HydrophobicContact CG2-CG1 4Å; F176-I178 PolarHBondContact O-N 3.39Å; I178-N180 VanDerWaalsContact C-N 3.35Å; I178-I185 HydrophobicContact CG2-CG2 3.87Å; I178-I187 HydrophobicContact CB-CD1 4.17Å; I178-I187 HydrophobicContact CB-CG1 4.37Å; I178-I187 HydrophobicContact CG2-CD1 3.67Å; I178-I187 HydrophobicContact CG2-CG1 3.36Å
179	N	72.2	Confident	80.5	Confident	134 Å²	134	61.3 Å²	61.3	72%	0.717	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-13.7	176	-55.7	-61.4	0	0	0	112.4	D177 E181	D177-N179 PolarHBondContact O-N 3.48Å; D177-N179 WeakPolarHBondContact OD1-CB 3.25Å; D177-N179 PolarHBondContact OD1-N 3.26Å; D177-N179 PolarHBondContact OD1-ND2 3.22Å; N179-E181 PolarHBondContact O-N 2.95Å
180	N	76.1	Confident	78.9	Confident	72 Å²	72	62 Å²	62	39%	0.385	34%	0.336	S	S	.	.			trans	-92.4	99.3	177.9	-172.8	-6.8	0	0	0	110.4	D177 I178 A182 N183	D177-N180 HydrophobicContact CB-CB 4.2Å; D177-N180 PolarHBondContact O-N 2.91Å; I178-N180 VanDerWaalsContact C-N 3.35Å; N180-A182 PolarHBondContact O-N 3.26Å; N180-A182 WeakPolarHBondContact OD1-CB 3.35Å; N180-A182 PolarHBondContact OD1-N 2.8Å; N180-N183 WeakPolarHBondContact O-CB 3.08Å; N180-N183 PolarHBondContact O-N 2.97Å
181	E	69.9	Low	77.3	Confident	125 Å²	125	61.5 Å²	61.5	58%	0.584	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-58	-18.3	178	-65.8	-154.8	148.2	0	0	113.6	N179 N183 G184 K186	N179-E181 PolarHBondContact O-N 2.95Å; E181-N183 PolarHBondContact O-N 3.06Å; E181-N183 VanDerWaalsContact O-N 3.13Å; E181-G184 PolarHBondContact O-N 2.59Å; E181-K186 IonicContact OE1-NZ 2.81Å; E181-K186 PolarHBondContact OE1-NZ 3.28Å; E181-K186 IonicContact OE2-NZ 2.94Å; E181-K186 PolarHBondContact OE2-NZ 2.84Å
182	A	73.5	Confident	75.6	Confident	39 Å²	39	63.9 Å²	63.9	32%	0.322	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-66.6	-8.3	174.6	0	0	0	0	0	113.6	G78 N180	G78-A182 VanDerWaalsContact CA-O 3.26Å; G78-A182 WeakPolarHBondContact CA-O 3.46Å; N180-A182 PolarHBondContact O-N 3.26Å; N180-A182 WeakPolarHBondContact OD1-CB 3.35Å; N180-A182 PolarHBondContact OD1-N 2.8Å
183	N	78.8	Confident	73.7	Confident	7 Å²	7	61.4 Å²	61.4	4%	0.037	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-87.7	-6.3	177.4	-64.7	-15.7	0	0	0	113.4	A80 N109 F176 D177 N180 E181 I185	A80-N183 WeakPolarHBondContact CB-O 3.26Å; N109-N183 PolarHBondContact ND2-OD1 3.42Å; F176-N183 HydrophobicContact CD1-CB 4.06Å; D177-N183 PolarHBondContact O-ND2 3.12Å; N180-N183 WeakPolarHBondContact O-CB 3.08Å; N180-N183 PolarHBondContact O-N 2.97Å; E181-N183 PolarHBondContact O-N 3.06Å; E181-N183 VanDerWaalsContact O-N 3.13Å; N183-I185 PolarHBondContact O-N 3.28Å
184	G	78.1	Confident	71.8	Confident	7 Å²	7	58.2 Å²	58.2	7%	0.072	35%	0.345	C	S	.	.	S	Bend	trans	75	12.3	-179.3	0	0	0	0	0	115.5	K8 G78 E181	K8-G184 PolarHBondContact N-O 3.22Å; G78-G184 WeakPolarHBondContact O-CA 3.48Å; G78-G184 PolarHBondContact O-N 3.16Å; E181-G184 PolarHBondContact O-N 2.59Å
185	I	82.8	Confident	69.9	Low	1 Å²	1	60.6 Å²	60.6	1%	0.005	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128	177.3	-61.6	157.8	0	0	0	107.2	Y5 L6 F7 A80 I167 I171 F176 I178 N183	Y5-I185 HydrophobicContact CD1-CG2 4.14Å; L6-I185 WeakPolarHBondContact O-CA 3.14Å; F7-I185 HydrophobicContact CD1-CB 4.44Å; F7-I185 HydrophobicContact CD1-CG1 3.91Å; F7-I185 HydrophobicContact CD1-CG2 4.16Å; F7-I185 HydrophobicContact CE1-CG1 4.08Å; F7-I185 HydrophobicContact CE1-CG2 3.93Å; A80-I185 HydrophobicContact CB-CD1 4.48Å; A80-I185 HydrophobicContact CB-CG1 3.86Å; I167-I185 HydrophobicContact CG2-CD1 4.11Å; I167-I185 HydrophobicContact CG2-CG1 4.35Å; I171-I185 HydrophobicContact CD1-CD1 3.77Å; I171-I185 HydrophobicContact CD1-CG1 4.3Å; I171-I185 HydrophobicContact CD1-CG2 3.96Å; I171-I185 HydrophobicContact CG1-CD1 3.87Å; F176-I185 HydrophobicContact CB-CD1 3.7Å; F176-I185 HydrophobicContact CD1-CD1 3.63Å; F176-I185 HydrophobicContact CD2-CD1 3.79Å; F176-I185 HydrophobicContact CE1-CD1 4.11Å; F176-I185 HydrophobicContact CE2-CD1 4.25Å; F176-I185 HydrophobicContact CG-CD1 3.44Å; F176-I185 VanDerWaalsContact CG-CD1 3.44Å; F176-I185 HydrophobicContact CZ-CD1 4.38Å; I178-I185 HydrophobicContact CG2-CG2 3.87Å; N183-I185 PolarHBondContact O-N 3.28Å
186	K	85.5	Confident	68.1	Low	86 Å²	86	61.5 Å²	61.5	37%	0.374	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.7	171.8	-62.4	-169	175.3	-133.7	0	110.6	Y5 L6 E181 G188	Y5-K186 CarbonylContact C-O 3.46Å; Y5-K186 WeakPolarHBondContact CA-O 3.38Å; L6-K186 HydrophobicContact CB-CB 4.23Å; L6-K186 PolarHBondContact N-O 3.04Å; L6-K186 PolarHBondContact O-N 3.24Å; E181-K186 IonicContact OE1-NZ 2.81Å; E181-K186 PolarHBondContact OE1-NZ 3.28Å; E181-K186 IonicContact OE2-NZ 2.94Å; E181-K186 PolarHBondContact OE2-NZ 2.84Å; K186-G188 PolarHBondContact O-N 3.08Å
187	I	84.3	Confident	66.2	Low	56 Å²	56	66.5 Å²	66.5	29%	0.287	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	126.5	172.2	-57.2	-178.7	0	0	0	108.4	I178 H191	I178-I187 HydrophobicContact CB-CD1 4.17Å; I178-I187 HydrophobicContact CB-CG1 4.37Å; I178-I187 HydrophobicContact CG2-CD1 3.67Å; I178-I187 HydrophobicContact CG2-CG1 3.36Å; I187-H191 HydrophobicContact CG2-CB 3.5Å; I187-H191 VanDerWaalsContact CG2-CB 3.5Å
188	G	79.1	Confident	64.7	Low	1 Å²	1	70 Å²	70	1%	0.01	40%	0.402	C	S	.	.			trans	-81.4	167.2	175.8	0	0	0	0	0	112.9	Y3 A4 K186 Q190 H191 A192	Y3-G188 CarbonylContact O-C 3.44Å; Y3-G188 WeakPolarHBondContact O-CA 3.14Å; A4-G188 PolarHBondContact O-N 3.12Å; K186-G188 PolarHBondContact O-N 3.08Å; G188-Q190 PolarHBondContact O-N 2.89Å; G188-H191 PolarHBondContact O-N 2.86Å; G188-H191 VanDerWaalsContact O-N 3.09Å; G188-A192 PolarHBondContact O-N 2.79Å
189	P	70.3	Confident	63.2	Low	91 Å²	91	73.2 Å²	73.2	59%	0.591	43%	0.428	S	S	*	.	H	α-helix	trans	-57.9	-23.9	-172.7	-22.6	31.7	0	0	0	114.6
190	Q	60.5	Low	61.8	Low	114 Å²	114	70.2 Å²	70.2	53%	0.533	43%	0.429	S	S	.	.	H	α-helix	trans	-73	-31	179.5	-96	175.1	-5.3	0	0	114	A2 G188	A2-Q190 HydrophobicContact CB-CB 4.46Å; A2-Q190 VanDerWaalsContact CB-CD 3.42Å; A2-Q190 HydrophobicContact CB-CG 3.57Å; G188-Q190 PolarHBondContact O-N 2.89Å
191	H	57	Low	60	Low	37 Å²	37	72.2 Å²	72.2	17%	0.171	45%	0.449	C	S	.	.	H	α-helix	trans	-93.5	-22.5	-177.7	-124.4	-80.5	0	0	0	113.1	K53 I187 G188 A193 T194	K53-H191 PolarHBondContact NZ-NE2 2.71Å; I187-H191 HydrophobicContact CG2-CB 3.5Å; I187-H191 VanDerWaalsContact CG2-CB 3.5Å; G188-H191 PolarHBondContact O-N 2.86Å; G188-H191 VanDerWaalsContact O-N 3.09Å; H191-A193 VanDerWaalsContact C-N 3.28Å; H191-A193 PolarHBondContact O-N 2.82Å; H191-T194 PolarHBondContact O-N 3.31Å; H191-T194 PolarHBondContact O-OG1 3.37Å
192	A	54.7	Low	58.6	Low	59 Å²	59	75.9 Å²	75.9	49%	0.488	47%	0.466	S	S	.	.	H	α-helix	trans	-63	-34.8	176.5	0	0	0	0	0	112.2	G188 T194 S196	G188-A192 PolarHBondContact O-N 2.79Å; A192-T194 VanDerWaalsContact C-N 3.3Å; A192-T194 PolarHBondContact O-N 3.14Å; A192-S196 PolarHBondContact O-OG 2.75Å
193	A	49.2	Very low	56.8	Low	64 Å²	64	78 Å²	78	53%	0.529	49%	0.492	S	S	.	.	H	α-helix	trans	-69.1	-24.2	-179.1	0	0	0	0	0	114	H191 S196	H191-A193 VanDerWaalsContact C-N 3.28Å; H191-A193 PolarHBondContact O-N 2.82Å; A193-S196 PolarHBondContact O-OG 3.03Å
194	T	49.8	Very low	54.5	Low	77 Å²	77	81.6 Å²	81.6	47%	0.472	53%	0.53	S	S	.	.	H	α-helix	trans	-87.4	-22.6	-179.5	35.6	0	0	0	0	114.1	H191 A192 T197	H191-T194 PolarHBondContact O-N 3.31Å; H191-T194 PolarHBondContact O-OG1 3.37Å; A192-T194 VanDerWaalsContact C-N 3.3Å; A192-T194 PolarHBondContact O-N 3.14Å; T194-T197 PolarHBondContact O-OG1 2.91Å
195	N	44.1	Very low	52.7	Low	108 Å²	108	90.4 Å²	90.4	58%	0.578	57%	0.57	S	S	*	*	H	α-helix	trans	-85.6	-15.2	175.9	-81.1	4.9	0	0	0	113	T197	N195-T197 VanDerWaalsContact C-N 3.31Å; N195-T197 PolarHBondContact O-N 3.11Å
196	S	41.4	Very low	50.5	Low	80 Å²	80	99.6 Å²	99.6	56%	0.559	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-4.2	176.8	43.8	0	0	0	0	114.8	A192 A193	A192-S196 PolarHBondContact O-OG 2.75Å; A193-S196 PolarHBondContact O-OG 3.03Å
197	T	38.2	Very low	48.3	Very low	109 Å²	109	100.3 Å²	100.3	67%	0.669	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	1	-179.1	38.9	0	0	0	0	114.8	T194 N195	T194-T197 PolarHBondContact O-OG1 2.91Å; N195-T197 VanDerWaalsContact C-N 3.31Å; N195-T197 PolarHBondContact O-N 3.11Å
198	L	41.1	Very low	46	Very low	159 Å²	159	101.5 Å²	101.5	83%	0.832	66%	0.66	S	S	*	*	S	Bend	trans	-106.8	4.8	179.6	-78.3	160.9	0	0	0	114.9
199	S	40.7	Very low	44.1	Very low	111 Å²	111	105.6 Å²	105.6	78%	0.776	70%	0.703	S	S	*	*	S	Bend	trans	-110	16.8	173.9	58	0	0	0	0	114.7
200	G	41.6	Very low	42.5	Very low	71 Å²	71	105 Å²	105	73%	0.732	71%	0.714	S	S	*	*			trans	-131	54	-176	0	0	0	0	0	114.4
201	S	40.3	Very low	41.6	Very low	115 Å²	115	105.9 Å²	105.9	80%	0.804	73%	0.731	S	S	*	*			trans	-155.7	91.9	166.8	-179	0	0	0	0	112.2
202	Q	38.9	Very low	41.2	Very low	201 Å²	201	114 Å²	114	94%	0.939	79%	0.789	S	S	*	*			trans	-179.1	112.6	147.2	-98.8	177.5	37.9	0	0	104
203	G	35.7	Very low	40.5	Very low	85 Å²	85	116.8 Å²	116.8	88%	0.876	80%	0.804	S	S	*	*			cis	115.3	95.1	38.7	0	0	0	0	0	106.6
204	G	31.7	Very low	40.1	Very low	81 Å²	81	119.5 Å²	119.5	84%	0.835	82%	0.819	S	S	*	*			trans	-164.1	82.1	179.6	0	0	0	0	0	112.2
205	Q	39.6	Very low	39.5	Very low	193 Å²	193	121.9 Å²	121.9	90%	0.902	84%	0.838	S	S	*	*			trans	-67.6	130.5	161	-83.6	171.7	-21.6	0	0	109.6
206	Q	36.8	Very low	39.3	Very low	193 Å²	193	122.7 Å²	122.7	90%	0.902	85%	0.853	S	S	*	*			trans	-164	126.2	133.1	-113.9	166.7	11.4	0	0	113.9
207	A	38.8	Very low	39.1	Very low	101 Å²	101	125.4 Å²	125.4	84%	0.835	87%	0.872	S	S	*	*			trans	-0.1	138.3	155.8	0	0	0	0	0	121.9
208	G	36.9	Very low	39.2	Very low	81 Å²	81	126.5 Å²	126.5	84%	0.835	89%	0.885	S	S	*	*				112.2	103.7	116.8	0	0	0	0	0	118.8
209	G	38.1	Very low	39.1	Very low	87 Å²	87	124.1 Å²	124.1	90%	0.897	89%	0.889	S	S	*	*			trans	97.7	127.6	132.2	0	0	0	0	0	119.5
210	G	37.7	Very low	38.9	Very low	80 Å²	80	125.2 Å²	125.2	83%	0.825	90%	0.898	S	S	*	*			trans	119.4	101	141.6	0	0	0	0	0	117
211	C	41.8	Very low	38.7	Very low	131 Å²	131	129.7 Å²	129.7	89%	0.885	91%	0.912	S	S	*	*			trans	-63.9	146.1	155.6	-66.9	0	0	0	0	111.1
212	C	48.5	Very low	38.6	Very low	208 Å²	208	131 Å²	131	100%	1.405	92%	0.921	S	S	*	*			trans	-165.3	0	131.9	-99.8	0	0	0	0	108.7

Retrieved 212 of 212 residues in 212.8 ms (Link to these results)

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