============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 6 rings ring int. center anis. iso. HIS 8 0.900 3.777 -9.880 -7.220 -99.200 -91.000 HIS 13 0.900 6.523 -3.927 3.102 -99.200 -91.000 TRP 22 1.040 1.594 -1.290 -0.636 -99.200 -91.000 TRP6 22 1.020 1.824 -0.658 -2.933 -99.200 -91.000 HIS 31 0.900 -10.220 7.282 -5.313 -99.200 -91.000 PHE 33 1.000 -8.605 13.033 -0.520 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 1zwbA10 VAL 1 HA -0.00 -0.08 0.17 -0.75 4.13 3.46 1zwbA10 VAL 1 HB -0.00 -0.00 0.03 -0.04 2.12 2.10 1zwbA10 VAL 1 HG13 -0.00 -0.01 0.03 -0.04 0.97 0.95 1zwbA10 VAL 1 HG23 0.00 -0.01 -0.06 -0.04 0.95 0.85 1zwbA10 SER 2 H -0.01 0.04 0.06 -0.55 8.46 8.00 1zwbA10 SER 2 HA -0.01 0.12 0.53 -0.75 4.49 4.37 1zwbA10 SER 2 HB2 -0.01 0.03 0.09 -0.04 3.95 4.02 1zwbA10 SER 2 HB3 -0.01 0.03 0.03 -0.04 3.93 3.93 1zwbA10 GLU 3 H -0.02 0.10 0.11 -0.55 8.60 8.25 1zwbA10 GLU 3 HA -0.04 0.00 0.26 -0.75 4.29 3.77 1zwbA10 GLU 3 HB2 -0.01 0.22 -0.18 -0.04 2.09 2.07 1zwbA10 GLU 3 HB3 -0.02 -0.04 0.19 -0.04 1.99 2.08 1zwbA10 GLU 3 HG2 -0.02 0.03 -0.03 -0.04 2.34 2.29 1zwbA10 GLU 3 HG3 -0.03 -0.00 0.02 -0.04 2.34 2.28 1zwbA10 ILE 4 H -0.03 0.07 -0.10 -0.55 8.25 7.65 1zwbA10 ILE 4 HA -0.01 0.13 0.54 -0.75 4.18 4.08 1zwbA10 ILE 4 HB -0.01 -0.07 0.05 -0.04 1.89 1.82 1zwbA10 ILE 4 HG12 -0.03 0.06 0.07 -0.04 1.49 1.55 1zwbA10 ILE 4 HG13 -0.04 -0.08 0.16 -0.04 1.21 1.22 1zwbA10 ILE 4 HG23 -0.01 0.05 -0.05 -0.04 0.93 0.88 1zwbA10 ILE 4 HD13 -0.02 0.00 0.02 -0.04 0.88 0.84 1zwbA10 GLN 5 H -0.02 0.39 0.17 -0.55 8.47 8.46 1zwbA10 GLN 5 HA -0.12 0.08 0.66 -0.75 4.36 4.24 1zwbA10 GLN 5 HB2 -0.02 0.09 0.14 -0.04 2.15 2.31 1zwbA10 GLN 5 HB3 -0.11 0.34 0.06 -0.04 2.02 2.27 1zwbA10 GLN 5 HG2 -0.14 0.07 -0.25 -0.04 2.40 2.04 1zwbA10 GLN 5 HG3 -0.20 -0.33 -0.25 -0.04 2.39 1.56 1zwbA10 GLN 5 HE21 -0.09 0.05 -0.45 -0.04 6.97 6.44 1zwbA10 GLN 5 HE22 -0.06 -0.08 -0.31 -0.04 7.69 7.20 1zwbA10 LEU 6 H 0.03 0.21 0.15 -0.55 8.37 8.23 1zwbA10 LEU 6 HA 0.09 0.02 0.40 -0.75 4.35 4.11 1zwbA10 LEU 6 HB2 0.11 0.06 0.11 -0.04 1.64 1.88 1zwbA10 LEU 6 HB3 0.15 0.05 0.15 -0.04 1.64 1.95 1zwbA10 LEU 6 HG 0.04 -0.18 0.03 -0.04 1.64 1.49 1zwbA10 LEU 6 HD13 0.04 0.03 -0.18 -0.04 0.93 0.78 1zwbA10 LEU 6 HD23 0.06 0.02 0.04 -0.04 0.89 0.98 1zwbA10 MET 7 H 0.01 -0.03 -0.85 -0.55 8.47 7.05 1zwbA10 MET 7 HA 0.03 0.10 0.36 -0.75 4.52 4.25 1zwbA10 MET 7 HB2 0.01 0.00 -0.12 -0.04 2.15 2.00 1zwbA10 MET 7 HB3 0.03 0.05 -0.05 -0.04 2.03 2.02 1zwbA10 MET 7 HG2 0.02 -0.06 -0.05 -0.04 2.63 2.49 1zwbA10 MET 7 HG3 0.01 0.03 -0.02 -0.04 2.56 2.54 1zwbA10 MET 7 HE3 0.01 0.01 -0.01 -0.04 2.10 2.07 1zwbA10 HIS 8 H 0.05 0.35 -0.25 -0.55 8.41 8.01 1zwbA10 HIS 8 HA -0.03 0.18 0.71 -0.75 4.63 4.75 1zwbA10 HIS 8 HB2 -0.05 -0.01 -0.01 -0.04 3.26 3.15 1zwbA10 HIS 8 HB3 -0.10 -0.03 0.04 -0.04 3.20 3.07 1zwbA10 HIS 8 HD2 -0.08 -0.07 0.08 -0.04 6.97 6.86 1zwbA10 HIS 8 HE1 -0.02 -0.00 0.03 -0.04 7.75 7.72 1zwbA10 ASN 9 H -0.01 0.38 -0.61 -0.55 8.53 7.75 1zwbA10 ASN 9 HA 0.09 -0.03 0.32 -0.75 4.76 4.38 1zwbA10 ASN 9 HB2 0.06 0.05 0.04 -0.04 2.88 2.99 1zwbA10 ASN 9 HB3 -0.06 0.05 -0.21 -0.04 2.79 2.52 1zwbA10 ASN 9 HD21 0.43 0.02 0.04 -0.04 7.03 7.47 1zwbA10 ASN 9 HD22 0.45 -0.07 0.03 -0.04 7.74 8.11 1zwbA10 LEU 10 H -0.26 0.41 -0.37 -0.55 8.37 7.59 1zwbA10 LEU 10 HA -0.52 0.12 0.69 -0.75 4.35 3.89 1zwbA10 LEU 10 HB2 -0.06 0.08 -0.13 -0.04 1.64 1.48 1zwbA10 LEU 10 HB3 -0.21 -0.14 0.14 -0.04 1.64 1.39 1zwbA10 LEU 10 HG -0.24 -0.38 0.04 -0.04 1.64 1.02 1zwbA10 LEU 10 HD13 0.03 0.09 0.08 -0.04 0.93 1.08 1zwbA10 LEU 10 HD23 -0.12 0.03 -0.01 -0.04 0.89 0.75 1zwbA10 GLY 11 H -0.66 0.10 -0.06 -0.55 8.43 7.26 1zwbA10 GLY 11 HA2 -0.41 0.24 0.72 -0.51 4.01 4.05 1zwbA10 GLY 11 HA3 -0.60 0.05 0.23 -0.51 4.01 3.18 1zwbA10 LYS 12 H -0.33 0.07 -0.26 -0.55 8.42 7.36 1zwbA10 LYS 12 HA -0.20 0.02 0.20 -0.75 4.32 3.59 1zwbA10 LYS 12 HB2 -0.23 -0.01 -0.37 -0.04 1.87 1.22 1zwbA10 LYS 12 HB3 -0.40 0.08 0.26 -0.04 1.79 1.69 1zwbA10 LYS 12 HG2 -0.12 0.01 0.09 -0.04 1.46 1.39 1zwbA10 LYS 12 HG3 -0.11 -0.05 -0.01 -0.04 1.46 1.24 1zwbA10 LYS 12 HD2 -0.10 0.05 -0.00 -0.04 1.69 1.59 1zwbA10 LYS 12 HD3 -0.07 -0.00 0.02 -0.04 1.68 1.59 1zwbA10 LYS 12 HE2 -0.04 0.01 -0.01 -0.04 2.99 2.92 1zwbA10 LYS 12 HE3 -0.05 -0.06 -0.02 -0.04 2.99 2.82 1zwbA10 HIS 13 H -0.16 -0.11 -0.29 -0.55 8.41 7.31 1zwbA10 HIS 13 HA -0.06 0.09 0.29 -0.75 4.63 4.19 1zwbA10 HIS 13 HB2 -0.03 -0.00 0.10 -0.04 3.26 3.29 1zwbA10 HIS 13 HB3 -0.03 0.19 0.19 -0.04 3.20 3.51 1zwbA10 HIS 13 HD2 -0.16 -0.17 -0.28 -0.04 6.97 6.31 1zwbA10 HIS 13 HE1 0.06 -0.00 -0.03 -0.04 7.75 7.73 1zwbA10 LEU 14 H -0.01 0.20 0.00 -0.55 8.37 8.02 1zwbA10 LEU 14 HA -0.03 -0.00 0.20 -0.75 4.35 3.76 1zwbA10 LEU 14 HB2 -0.09 0.17 -0.02 -0.04 1.64 1.65 1zwbA10 LEU 14 HB3 -0.04 -0.05 0.22 -0.04 1.64 1.72 1zwbA10 LEU 14 HG -0.23 -0.16 -0.16 -0.04 1.64 1.04 1zwbA10 LEU 14 HD13 -0.68 0.09 0.07 -0.04 0.93 0.37 1zwbA10 LEU 14 HD23 0.12 0.01 -0.35 -0.04 0.89 0.63 1zwbA10 ASN 15 H 0.01 0.18 0.27 -0.55 8.53 8.45 1zwbA10 ASN 15 HA 0.05 0.00 0.47 -0.75 4.76 4.53 1zwbA10 ASN 15 HB2 0.01 -0.00 0.03 -0.04 2.88 2.88 1zwbA10 ASN 15 HB3 0.01 0.04 0.05 -0.04 2.79 2.86 1zwbA10 ASN 15 HD21 0.00 -0.08 0.10 -0.04 7.03 7.01 1zwbA10 ASN 15 HD22 -0.00 -0.04 -0.04 -0.04 7.74 7.62 1zwbA10 SER 16 H 0.04 0.16 0.15 -0.55 8.46 8.27 1zwbA10 SER 16 HA 0.02 0.11 0.32 -0.75 4.49 4.18 1zwbA10 SER 16 HB2 0.01 0.04 -0.18 -0.04 3.95 3.79 1zwbA10 SER 16 HB3 0.01 0.10 0.42 -0.04 3.93 4.42 1zwbA10 MET 17 H 0.01 0.24 0.16 -0.55 8.47 8.34 1zwbA10 MET 17 HA 0.03 0.05 0.37 -0.75 4.52 4.21 1zwbA10 MET 17 HB2 0.01 0.04 0.14 -0.04 2.15 2.30 1zwbA10 MET 17 HB3 0.02 0.04 0.09 -0.04 2.03 2.14 1zwbA10 MET 17 HG2 0.01 -0.04 0.04 -0.04 2.63 2.61 1zwbA10 MET 17 HG3 0.01 0.05 0.06 -0.04 2.56 2.65 1zwbA10 MET 17 HE3 0.01 0.02 0.02 -0.04 2.10 2.10 1zwbA10 GLU 18 H 0.02 0.21 -0.72 -0.55 8.60 7.57 1zwbA10 GLU 18 HA 0.03 0.12 0.54 -0.75 4.29 4.23 1zwbA10 GLU 18 HB2 -0.01 -0.02 -0.08 -0.04 2.09 1.94 1zwbA10 GLU 18 HB3 -0.04 -0.04 0.06 -0.04 1.99 1.93 1zwbA10 GLU 18 HG2 -0.00 -0.01 0.06 -0.04 2.34 2.34 1zwbA10 GLU 18 HG3 -0.03 0.11 0.10 -0.04 2.34 2.48 1zwbA10 ARG 19 H 0.03 0.17 -0.56 -0.55 8.46 7.54 1zwbA10 ARG 19 HA 0.02 0.01 0.35 -0.75 4.34 3.97 1zwbA10 ARG 19 HB2 0.01 -0.26 0.09 -0.04 1.90 1.70 1zwbA10 ARG 19 HB3 0.02 0.19 0.03 -0.04 1.80 1.99 1zwbA10 ARG 19 HG2 -0.07 0.16 0.27 -0.04 1.67 1.98 1zwbA10 ARG 19 HG3 -0.02 -0.06 0.16 -0.04 1.67 1.71 1zwbA10 ARG 19 HD2 -0.08 -0.09 0.01 -0.04 3.22 3.02 1zwbA10 ARG 19 HD3 -0.00 -0.04 -0.19 -0.04 3.22 2.94 1zwbA10 VAL 20 H 0.06 0.16 -0.76 -0.55 8.24 7.15 1zwbA10 VAL 20 HA 0.09 0.20 0.82 -0.75 4.13 4.48 1zwbA10 VAL 20 HB 0.04 0.02 -0.01 -0.04 2.12 2.13 1zwbA10 VAL 20 HG13 0.03 0.06 -0.11 -0.04 0.97 0.91 1zwbA10 VAL 20 HG23 0.04 0.00 0.04 -0.04 0.95 0.99 1zwbA10 GLU 21 H 0.08 0.45 -0.02 -0.55 8.60 8.57 1zwbA10 GLU 21 HA 0.05 0.01 0.38 -0.75 4.29 3.97 1zwbA10 GLU 21 HB2 0.05 0.04 0.20 -0.04 2.09 2.33 1zwbA10 GLU 21 HB3 0.08 0.10 0.22 -0.04 1.99 2.35 1zwbA10 GLU 21 HG2 0.03 0.00 0.03 -0.04 2.34 2.37 1zwbA10 GLU 21 HG3 0.05 -0.01 -0.11 -0.04 2.34 2.23 1zwbA10 TRP 22 H 0.28 0.41 -0.51 -0.55 7.97 7.60 1zwbA10 TRP 22 HA 0.03 0.02 0.33 -0.75 4.62 4.24 1zwbA10 TRP 22 HB2 0.03 0.04 -0.02 -0.04 3.23 3.25 1zwbA10 TRP 22 HB3 0.03 0.18 0.03 -0.04 3.23 3.43 1zwbA10 TRP 22 HD1 0.09 0.00 -0.07 -0.04 7.22 7.21 1zwbA10 TRP 22 HE1 0.09 0.04 -0.05 -0.04 10.20 10.25 1zwbA10 TRP 22 HE3 0.02 0.11 -0.28 -0.04 7.59 7.39 1zwbA10 TRP 22 HZ2 0.02 -0.02 -0.06 -0.04 7.44 7.34 1zwbA10 TRP 22 HZ3 0.01 -0.03 -0.16 -0.04 7.13 6.91 1zwbA10 TRP 22 HH2 0.01 -0.06 -0.09 -0.04 7.19 7.01 1zwbA10 LEU 23 H 0.38 0.37 -0.09 -0.55 8.37 8.47 1zwbA10 LEU 23 HA 0.13 -0.02 0.36 -0.75 4.35 4.08 1zwbA10 LEU 23 HB2 0.14 -0.04 0.13 -0.04 1.64 1.83 1zwbA10 LEU 23 HB3 0.21 0.18 0.26 -0.04 1.64 2.25 1zwbA10 LEU 23 HG 0.07 0.18 -0.00 -0.04 1.64 1.85 1zwbA10 LEU 23 HD13 0.03 -0.03 -0.13 -0.04 0.93 0.76 1zwbA10 LEU 23 HD23 0.05 -0.01 0.05 -0.04 0.89 0.95 1zwbA10 ARG 24 H 0.06 0.53 -0.45 -0.55 8.46 8.05 1zwbA10 ARG 24 HA -0.01 0.04 0.51 -0.75 4.34 4.13 1zwbA10 ARG 24 HB2 0.02 0.02 0.00 -0.04 1.90 1.91 1zwbA10 ARG 24 HB3 0.01 0.07 0.09 -0.04 1.80 1.93 1zwbA10 ARG 24 HG2 -0.01 -0.03 0.01 -0.04 1.67 1.59 1zwbA10 ARG 24 HG3 -0.00 -0.02 -0.00 -0.04 1.67 1.61 1zwbA10 ARG 24 HD2 -0.00 -0.02 -0.03 -0.04 3.22 3.14 1zwbA10 ARG 24 HD3 0.01 -0.01 -0.02 -0.04 3.22 3.15 1zwbA10 LYS 25 H -0.04 0.77 0.08 -0.55 8.42 8.68 1zwbA10 LYS 25 HA -0.05 0.01 0.46 -0.75 4.32 3.98 1zwbA10 LYS 25 HB2 -0.04 0.01 0.14 -0.04 1.87 1.93 1zwbA10 LYS 25 HB3 -0.16 0.05 0.16 -0.04 1.79 1.79 1zwbA10 LYS 25 HG2 -0.07 -0.03 -0.03 -0.04 1.46 1.29 1zwbA10 LYS 25 HG3 -0.11 -0.01 -0.13 -0.04 1.46 1.16 1zwbA10 LYS 25 HD2 -0.03 -0.02 0.05 -0.04 1.69 1.66 1zwbA10 LYS 25 HD3 -0.02 -0.02 0.01 -0.04 1.68 1.61 1zwbA10 LYS 25 HE2 -0.00 0.01 -0.01 -0.04 2.99 2.94 1zwbA10 LYS 25 HE3 -0.03 -0.01 -0.03 -0.04 2.99 2.88 1zwbA10 LYS 26 H -0.24 0.64 -0.18 -0.55 8.42 8.08 1zwbA10 LYS 26 HA -0.26 0.03 0.40 -0.75 4.32 3.73 1zwbA10 LYS 26 HB2 -0.40 0.14 0.09 -0.04 1.87 1.66 1zwbA10 LYS 26 HB3 -0.22 0.00 -0.05 -0.04 1.79 1.48 1zwbA10 LYS 26 HG2 -0.65 -0.03 -0.04 -0.04 1.46 0.70 1zwbA10 LYS 26 HG3 -0.47 -0.02 0.02 -0.04 1.46 0.95 1zwbA10 LYS 26 HD2 -1.30 0.30 -0.05 -0.04 1.69 0.60 1zwbA10 LYS 26 HD3 -3.48 -0.06 -0.14 -0.04 1.68 -2.04 1zwbA10 LYS 26 HE2 -1.26 -0.04 -0.07 -0.04 2.99 1.57 1zwbA10 LYS 26 HE3 -0.62 -0.01 -0.05 -0.04 2.99 2.27 1zwbA10 LEU 27 H -0.08 0.33 -0.28 -0.55 8.37 7.80 1zwbA10 LEU 27 HA 0.04 0.05 0.43 -0.75 4.35 4.11 1zwbA10 LEU 27 HB2 -0.05 0.19 0.21 -0.04 1.64 1.96 1zwbA10 LEU 27 HB3 -0.09 0.01 -0.00 -0.04 1.64 1.52 1zwbA10 LEU 27 HG -0.08 -0.02 0.03 -0.04 1.64 1.53 1zwbA10 LEU 27 HD13 -0.23 -0.01 0.00 -0.04 0.93 0.65 1zwbA10 LEU 27 HD23 -0.00 0.01 0.00 -0.04 0.89 0.85 1zwbA10 GLN 28 H -0.03 0.52 -0.17 -0.55 8.47 8.26 1zwbA10 GLN 28 HA 0.06 -0.06 0.42 -0.75 4.36 4.03 1zwbA10 GLN 28 HB2 -0.01 0.06 0.12 -0.04 2.15 2.28 1zwbA10 GLN 28 HB3 -0.01 0.05 0.14 -0.04 2.02 2.16 1zwbA10 GLN 28 HG2 0.03 0.08 0.12 -0.04 2.40 2.60 1zwbA10 GLN 28 HG3 0.01 -0.06 0.11 -0.04 2.39 2.41 1zwbA10 GLN 28 HE21 -0.00 -0.01 0.01 -0.04 6.97 6.92 1zwbA10 GLN 28 HE22 -0.00 -0.03 -0.01 -0.04 7.69 7.61 1zwbA10 ASP 29 H 0.00 0.29 -0.62 -0.55 8.40 7.52 1zwbA10 ASP 29 HA 0.05 0.07 0.48 -0.75 4.63 4.48 1zwbA10 ASP 29 HB2 -0.07 0.17 0.22 -0.04 2.71 2.99 1zwbA10 ASP 29 HB3 -0.06 -0.06 -0.04 -0.04 2.70 2.50 1zwbA10 VAL 30 H 0.08 0.35 -0.13 -0.55 8.24 7.99 1zwbA10 VAL 30 HA -0.18 0.12 0.56 -0.75 4.13 3.88 1zwbA10 VAL 30 HB 0.04 0.03 0.10 -0.04 2.12 2.26 1zwbA10 VAL 30 HG13 -0.15 -0.02 0.10 -0.04 0.97 0.86 1zwbA10 VAL 30 HG23 -0.06 0.04 0.01 -0.04 0.95 0.90 1zwbA10 HIS 31 H 0.33 0.14 -0.88 -0.55 8.41 7.45 1zwbA10 HIS 31 HA 0.23 0.11 0.74 -0.75 4.63 4.95 1zwbA10 HIS 31 HB2 0.05 0.10 0.03 -0.04 3.26 3.40 1zwbA10 HIS 31 HB3 0.02 -0.08 -0.06 -0.04 3.20 3.04 1zwbA10 HIS 31 HD2 0.03 -0.06 0.01 -0.04 6.97 6.90 1zwbA10 HIS 31 HE1 0.02 -0.06 -0.02 -0.04 7.75 7.63 1zwbA10 ASN 32 H 0.19 0.37 0.06 -0.55 8.53 8.59 1zwbA10 ASN 32 HA -0.15 0.06 0.77 -0.75 4.76 4.69 1zwbA10 ASN 32 HB2 0.04 0.12 0.30 -0.04 2.88 3.29 1zwbA10 ASN 32 HB3 -0.02 -0.07 0.11 -0.04 2.79 2.77 1zwbA10 ASN 32 HD21 0.06 0.01 0.07 -0.04 7.03 7.13 1zwbA10 ASN 32 HD22 0.01 0.00 -0.06 -0.04 7.74 7.65 1zwbA10 PHE 33 H -0.71 0.23 -0.20 -0.55 8.34 7.11 1zwbA10 PHE 33 HA -0.01 0.15 0.81 -0.75 4.62 4.82 1zwbA10 PHE 33 HB2 -0.02 -0.04 0.09 -0.04 3.15 3.14 1zwbA10 PHE 33 HB3 -0.02 0.21 -0.01 -0.04 3.06 3.19 1zwbA10 PHE 33 HD2 -0.02 -0.00 -0.29 -0.04 7.28 6.92 1zwbA10 PHE 33 HE2 -0.07 0.04 -0.34 -0.04 7.38 6.97 1zwbA10 PHE 33 HZ -0.07 -0.03 -0.06 -0.04 7.32 7.12 1zwbA10 VAL 34 H -0.01 0.15 -0.10 -0.55 8.24 7.73 1zwbA10 VAL 34 HA -0.04 -0.00 0.34 -0.75 4.13 3.67 1zwbA10 VAL 34 HB 0.00 0.00 0.13 -0.04 2.12 2.22 1zwbA10 VAL 34 HG13 0.01 -0.00 0.03 -0.04 0.97 0.96 1zwbA10 VAL 34 HG23 0.07 0.01 -0.18 -0.04 0.95 0.81 1zwbA10 ALA 35 H -0.14 0.06 -0.06 -0.55 8.40 7.71 1zwbA10 ALA 35 HA -0.08 0.16 0.61 -0.75 4.34 4.28 1zwbA10 ALA 35 HB3 -0.30 0.05 -0.06 -0.04 1.41 1.06 1zwbA10 LEU 36 H -0.11 0.13 0.04 -0.55 8.37 7.88 1zwbA10 LEU 36 HA -0.06 0.18 0.51 -0.75 4.35 4.23 1zwbA10 LEU 36 HB2 -0.04 -0.02 -0.21 -0.04 1.64 1.33 1zwbA10 LEU 36 HB3 -0.04 0.01 0.05 -0.04 1.64 1.62 1zwbA10 LEU 36 HG -0.04 0.11 0.09 -0.04 1.64 1.76 1zwbA10 LEU 36 HD13 -0.02 -0.00 -0.03 -0.04 0.93 0.83 1zwbA10 LEU 36 HD23 -0.03 -0.01 0.04 -0.04 0.89 0.85