============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. PHE 5 1.000 10.765 3.610 -3.214 -99.200 -91.000 TRP 16 1.040 -3.645 -0.421 -3.041 -99.200 -91.000 TRP6 16 1.020 -5.703 -0.873 -3.998 -99.200 -91.000 TYR 26 0.840 -9.593 -8.723 -2.788 -99.200 -91.000 TYR 28 0.840 -1.894 -5.264 -1.214 -99.200 -91.000 TYR 33 0.840 -3.277 1.191 5.758 -99.200 -91.000 TRP 35 1.040 -7.459 7.589 4.941 -99.200 -91.000 TRP6 35 1.020 -9.314 8.967 5.112 -99.200 -91.000 TYR 41 0.840 6.482 -2.793 1.152 -99.200 -91.000 HIS 43 0.900 8.164 -4.584 -2.089 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 2bdsA23 ALA 1 HA -0.10 -0.05 0.18 -0.75 4.34 3.61 2bdsA23 ALA 1 HB3 -0.04 -0.05 0.08 -0.04 1.41 1.36 2bdsA23 ALA 2 H -0.12 -0.20 0.26 -0.55 8.40 7.79 2bdsA23 ALA 2 HA -0.09 0.06 0.42 -0.75 4.34 3.97 2bdsA23 ALA 2 HB3 -0.11 -0.15 0.27 -0.04 1.41 1.38 2bdsA23 PRO 3 HA -0.03 0.17 0.80 -0.51 4.44 4.87 2bdsA23 PRO 3 HB2 0.08 0.00 0.23 -0.04 2.28 2.56 2bdsA23 PRO 3 HB3 0.03 0.04 0.19 -0.04 2.02 2.24 2bdsA23 PRO 3 HG2 -0.03 -0.02 0.06 -0.04 2.03 1.99 2bdsA23 PRO 3 HG3 -0.01 0.04 0.09 -0.04 2.03 2.10 2bdsA23 PRO 3 HD2 -0.09 0.02 0.21 -0.04 3.68 3.78 2bdsA23 PRO 3 HD3 -0.05 0.21 0.16 -0.04 3.65 3.92 2bdsA23 CYS 4 H -0.15 0.06 -0.75 -0.55 8.50 7.10 2bdsA23 CYS 4 HA -0.77 0.00 0.42 -0.75 4.58 3.49 2bdsA23 CYS 4 HB2 -0.23 0.02 -0.02 -0.04 2.97 2.70 2bdsA23 CYS 4 HB3 -0.20 -0.09 0.08 -0.04 2.97 2.72 2bdsA23 PHE 5 H -1.72 0.06 0.10 -0.55 8.34 6.22 2bdsA23 PHE 5 HA 0.12 0.07 -0.13 -0.75 4.62 3.93 2bdsA23 PHE 5 HB2 0.03 0.08 -0.05 -0.04 3.15 3.16 2bdsA23 PHE 5 HB3 0.07 0.03 0.08 -0.04 3.06 3.20 2bdsA23 PHE 5 HD2 -0.01 0.07 -0.25 -0.04 7.28 7.05 2bdsA23 PHE 5 HE2 -0.01 0.02 0.08 -0.04 7.38 7.44 2bdsA23 PHE 5 HZ -0.00 -0.04 0.04 -0.04 7.32 7.27 2bdsA23 CYS 6 H 0.15 0.40 0.08 -0.55 8.50 8.58 2bdsA23 CYS 6 HA -0.05 0.18 0.77 -0.75 4.58 4.73 2bdsA23 CYS 6 HB2 -1.22 0.09 0.01 -0.04 2.97 1.81 2bdsA23 CYS 6 HB3 -0.39 -0.05 0.05 -0.04 2.97 2.53 2bdsA23 SER 7 H -0.10 0.13 0.10 -0.55 8.46 8.04 2bdsA23 SER 7 HA 0.00 0.06 0.45 -0.75 4.49 4.25 2bdsA23 SER 7 HB2 -0.03 -0.01 0.18 -0.04 3.95 4.04 2bdsA23 SER 7 HB3 -0.01 0.04 -0.01 -0.04 3.93 3.91 2bdsA23 GLY 8 H 0.01 0.18 0.16 -0.55 8.43 8.23 2bdsA23 GLY 8 HA2 0.00 -0.01 0.34 -0.51 4.01 3.83 2bdsA23 GLY 8 HA3 -0.01 0.11 0.49 -0.51 4.01 4.08 2bdsA23 LYS 9 H -0.03 0.14 -1.07 -0.55 8.42 6.91 2bdsA23 LYS 9 HA 0.06 0.23 0.84 -0.75 4.32 4.69 2bdsA23 LYS 9 HB2 -0.28 -0.17 -0.06 -0.04 1.87 1.33 2bdsA23 LYS 9 HB3 0.24 0.11 -0.04 -0.04 1.79 2.06 2bdsA23 LYS 9 HG2 0.07 0.03 -0.06 -0.04 1.46 1.46 2bdsA23 LYS 9 HG3 -0.04 0.00 -0.44 -0.04 1.46 0.94 2bdsA23 LYS 9 HD2 -0.28 0.01 -0.11 -0.04 1.69 1.26 2bdsA23 LYS 9 HD3 -0.73 0.02 -0.06 -0.04 1.68 0.87 2bdsA23 LYS 9 HE2 0.09 0.01 -0.03 -0.04 2.99 3.02 2bdsA23 LYS 9 HE3 0.01 0.02 -0.06 -0.04 2.99 2.92 2bdsA23 PRO 10 HA -0.14 0.05 0.57 -0.51 4.44 4.42 2bdsA23 PRO 10 HB2 -0.08 0.04 -0.06 -0.04 2.28 2.13 2bdsA23 PRO 10 HB3 -0.17 0.00 0.07 -0.04 2.02 1.88 2bdsA23 PRO 10 HG2 -0.01 0.03 0.05 -0.04 2.03 2.06 2bdsA23 PRO 10 HG3 -0.03 0.01 0.00 -0.04 2.03 1.97 2bdsA23 PRO 10 HD2 0.06 0.11 0.24 -0.04 3.68 4.04 2bdsA23 PRO 10 HD3 0.02 0.29 -0.14 -0.04 3.65 3.77 2bdsA23 GLY 11 H -0.31 0.13 0.07 -0.55 8.43 7.77 2bdsA23 GLY 11 HA2 0.04 -0.03 0.34 -0.51 4.01 3.85 2bdsA23 GLY 11 HA3 0.20 0.20 0.84 -0.51 4.01 4.75 2bdsA23 ARG 12 H -0.65 0.30 -0.02 -0.55 8.46 7.53 2bdsA23 ARG 12 HA 0.04 0.15 0.04 -0.75 4.34 3.81 2bdsA23 ARG 12 HB2 -0.06 0.08 -0.01 -0.04 1.90 1.87 2bdsA23 ARG 12 HB3 -0.35 -0.12 -0.21 -0.04 1.80 1.08 2bdsA23 ARG 12 HG2 -0.23 -0.13 -0.46 -0.04 1.67 0.81 2bdsA23 ARG 12 HG3 -0.12 0.24 0.04 -0.04 1.67 1.79 2bdsA23 ARG 12 HD2 0.02 -0.10 -0.13 -0.04 3.22 2.97 2bdsA23 ARG 12 HD3 -0.02 0.16 -0.08 -0.04 3.22 3.24 2bdsA23 GLY 13 H -0.11 0.08 -0.29 -0.55 8.43 7.58 2bdsA23 GLY 13 HA2 -0.15 0.04 0.36 -0.51 4.01 3.75 2bdsA23 GLY 13 HA3 0.18 0.06 0.14 -0.51 4.01 3.88 2bdsA23 ASP 14 H 0.08 0.69 0.19 -0.55 8.40 8.81 2bdsA23 ASP 14 HA -0.00 0.05 0.64 -0.75 4.63 4.56 2bdsA23 ASP 14 HB2 0.33 -0.01 0.21 -0.04 2.71 3.20 2bdsA23 ASP 14 HB3 0.25 -0.04 -0.02 -0.04 2.70 2.86 2bdsA23 LEU 15 H -0.15 -0.09 0.30 -0.55 8.37 7.89 2bdsA23 LEU 15 HA -0.02 0.24 0.92 -0.75 4.35 4.73 2bdsA23 LEU 15 HB2 -0.10 0.04 0.08 -0.04 1.64 1.61 2bdsA23 LEU 15 HB3 -0.14 -0.08 0.28 -0.04 1.64 1.65 2bdsA23 LEU 15 HG -0.12 -0.07 -0.24 -0.04 1.64 1.16 2bdsA23 LEU 15 HD13 -0.04 0.06 -0.21 -0.04 0.93 0.70 2bdsA23 LEU 15 HD23 -0.09 -0.00 -0.02 -0.04 0.89 0.73 2bdsA23 TRP 16 H 0.19 0.74 0.49 -0.55 7.97 8.84 2bdsA23 TRP 16 HA -0.05 0.06 0.74 -0.75 4.62 4.62 2bdsA23 TRP 16 HB2 -0.13 0.17 0.16 -0.04 3.23 3.39 2bdsA23 TRP 16 HB3 -0.07 -0.04 -0.05 -0.04 3.23 3.03 2bdsA23 TRP 16 HD1 -0.14 0.18 -0.09 -0.04 7.22 7.13 2bdsA23 TRP 16 HE1 0.24 0.01 -0.05 -0.04 10.20 10.35 2bdsA23 TRP 16 HE3 -0.03 -0.04 -0.02 -0.04 7.59 7.47 2bdsA23 TRP 16 HZ2 0.12 0.01 -0.00 -0.04 7.44 7.52 2bdsA23 TRP 16 HZ3 -0.02 0.02 0.01 -0.04 7.13 7.10 2bdsA23 TRP 16 HH2 -0.01 0.01 0.02 -0.04 7.19 7.17 2bdsA23 ILE 17 H -0.02 0.17 0.16 -0.55 8.25 8.01 2bdsA23 ILE 17 HA -0.04 0.09 0.42 -0.75 4.18 3.90 2bdsA23 ILE 17 HB -0.06 0.02 0.03 -0.04 1.89 1.84 2bdsA23 ILE 17 HG12 -0.10 0.03 -0.06 -0.04 1.49 1.31 2bdsA23 ILE 17 HG13 -0.14 -0.00 0.13 -0.04 1.21 1.15 2bdsA23 ILE 17 HG23 -0.07 0.00 0.05 -0.04 0.93 0.87 2bdsA23 ILE 17 HD13 -0.10 0.00 0.03 -0.04 0.88 0.77 2bdsA23 LEU 18 H 0.09 -0.01 -0.29 -0.55 8.37 7.62 2bdsA23 LEU 18 HA -0.21 0.28 0.72 -0.75 4.35 4.38 2bdsA23 LEU 18 HB2 -0.01 -0.08 0.04 -0.04 1.64 1.55 2bdsA23 LEU 18 HB3 -0.08 -0.01 0.13 -0.04 1.64 1.63 2bdsA23 LEU 18 HG -0.10 0.16 -0.62 -0.04 1.64 1.04 2bdsA23 LEU 18 HD13 -0.05 -0.02 -0.05 -0.04 0.93 0.77 2bdsA23 LEU 18 HD23 -0.18 -0.00 0.01 -0.04 0.89 0.67 2bdsA23 ARG 19 H -0.07 0.75 0.18 -0.55 8.46 8.76 2bdsA23 ARG 19 HA 0.08 0.03 0.65 -0.75 4.34 4.35 2bdsA23 ARG 19 HB2 0.14 -0.16 -0.31 -0.04 1.90 1.52 2bdsA23 ARG 19 HB3 0.05 0.06 -0.23 -0.04 1.80 1.64 2bdsA23 ARG 19 HG2 0.02 -0.07 0.16 -0.04 1.67 1.74 2bdsA23 ARG 19 HG3 0.07 0.22 0.16 -0.04 1.67 2.07 2bdsA23 ARG 19 HD2 -0.15 -0.11 -0.05 -0.04 3.22 2.87 2bdsA23 ARG 19 HD3 -0.32 0.13 0.07 -0.04 3.22 3.06 2bdsA23 GLY 20 H 0.30 0.13 0.14 -0.55 8.43 8.46 2bdsA23 GLY 20 HA2 0.77 0.17 0.71 -0.51 4.01 5.15 2bdsA23 GLY 20 HA3 0.43 -0.00 0.31 -0.51 4.01 4.24 2bdsA23 THR 21 H 0.18 0.06 0.02 -0.55 8.28 7.98 2bdsA23 THR 21 HA 0.27 0.15 0.55 -0.75 4.39 4.62 2bdsA23 THR 21 HB 0.02 0.10 -0.05 -0.04 4.32 4.34 2bdsA23 THR 21 HG23 -0.06 0.03 -0.10 -0.04 1.22 1.05 2bdsA23 CYS 22 H 0.11 0.12 0.00 -0.55 8.50 8.19 2bdsA23 CYS 22 HA -0.49 0.15 0.48 -0.75 4.58 3.97 2bdsA23 CYS 22 HB2 -0.12 -0.01 -0.00 -0.04 2.97 2.80 2bdsA23 CYS 22 HB3 -0.03 -0.01 -0.10 -0.04 2.97 2.79 2bdsA23 PRO 23 HA -0.32 0.03 0.24 -0.51 4.44 3.88 2bdsA23 PRO 23 HB2 -1.14 0.01 0.05 -0.04 2.28 1.17 2bdsA23 PRO 23 HB3 -0.56 0.07 0.08 -0.04 2.02 1.56 2bdsA23 PRO 23 HG2 -0.29 -0.01 0.09 -0.04 2.03 1.79 2bdsA23 PRO 23 HG3 -0.65 0.08 0.09 -0.04 2.03 1.51 2bdsA23 PRO 23 HD2 -0.39 0.05 0.14 -0.04 3.68 3.44 2bdsA23 PRO 23 HD3 -1.35 0.17 0.19 -0.04 3.65 2.62 2bdsA23 GLY 24 H -0.13 0.10 0.13 -0.55 8.43 7.98 2bdsA23 GLY 24 HA2 0.00 -0.10 0.42 -0.51 4.01 3.83 2bdsA23 GLY 24 HA3 0.05 0.01 0.21 -0.51 4.01 3.78 2bdsA23 GLY 25 H 0.05 0.10 -0.09 -0.55 8.43 7.95 2bdsA23 GLY 25 HA2 0.09 0.04 0.26 -0.51 4.01 3.88 2bdsA23 GLY 25 HA3 0.08 0.03 0.38 -0.51 4.01 3.99 2bdsA23 TYR 26 H 0.21 0.18 -0.08 -0.55 8.29 8.05 2bdsA23 TYR 26 HA -0.03 0.15 0.52 -0.75 4.56 4.45 2bdsA23 TYR 26 HB2 -0.08 -0.01 0.18 -0.04 3.06 3.11 2bdsA23 TYR 26 HB3 -0.11 -0.02 0.06 -0.04 2.98 2.87 2bdsA23 TYR 26 HD2 -0.01 0.07 -0.29 -0.04 7.15 6.87 2bdsA23 TYR 26 HE2 0.01 -0.00 -0.08 -0.04 6.85 6.74 2bdsA23 GLY 27 H -0.02 -0.11 0.15 -0.55 8.43 7.91 2bdsA23 GLY 27 HA2 -0.02 0.26 0.82 -0.51 4.01 4.55 2bdsA23 GLY 27 HA3 -0.12 -0.02 0.26 -0.51 4.01 3.62 2bdsA23 TYR 28 H -0.08 -0.20 0.12 -0.55 8.29 7.58 2bdsA23 TYR 28 HA 0.06 0.16 0.59 -0.75 4.56 4.62 2bdsA23 TYR 28 HB2 -0.00 -0.08 -0.05 -0.04 3.06 2.88 2bdsA23 TYR 28 HB3 0.04 0.09 0.06 -0.04 2.98 3.13 2bdsA23 TYR 28 HD2 -0.04 0.04 -0.12 -0.04 7.15 6.99 2bdsA23 TYR 28 HE2 0.00 0.01 -0.09 -0.04 6.85 6.73 2bdsA23 THR 29 H 0.22 0.19 0.17 -0.55 8.28 8.32 2bdsA23 THR 29 HA 0.10 0.07 0.45 -0.75 4.39 4.26 2bdsA23 THR 29 HB 0.07 -0.02 -0.04 -0.04 4.32 4.30 2bdsA23 THR 29 HG23 0.07 0.05 -0.10 -0.04 1.22 1.19 2bdsA23 SER 30 H 0.15 0.07 0.10 -0.55 8.46 8.24 2bdsA23 SER 30 HA 0.09 0.16 0.76 -0.75 4.49 4.75 2bdsA23 SER 30 HB2 0.17 0.04 -0.03 -0.04 3.95 4.09 2bdsA23 SER 30 HB3 0.11 0.05 0.04 -0.04 3.93 4.09 2bdsA23 ASN 31 H 0.09 0.31 0.20 -0.55 8.53 8.58 2bdsA23 ASN 31 HA 0.01 -0.04 0.90 -0.75 4.76 4.88 2bdsA23 ASN 31 HB2 -0.31 0.10 -0.20 -0.04 2.88 2.43 2bdsA23 ASN 31 HB3 -0.20 -0.03 -0.01 -0.04 2.79 2.50 2bdsA23 ASN 31 HD21 0.08 -0.12 -0.61 -0.04 7.03 6.35 2bdsA23 ASN 31 HD22 0.11 -0.06 -0.21 -0.04 7.74 7.54 2bdsA23 CYS 32 H -0.09 0.47 0.25 -0.55 8.50 8.58 2bdsA23 CYS 32 HA 0.05 0.16 0.98 -0.75 4.58 5.01 2bdsA23 CYS 32 HB2 -0.02 0.03 -0.00 -0.04 2.97 2.94 2bdsA23 CYS 32 HB3 -0.06 -0.07 0.13 -0.04 2.97 2.93 2bdsA23 TYR 33 H 0.16 0.18 0.18 -0.55 8.29 8.25 2bdsA23 TYR 33 HA 0.06 0.14 0.80 -0.75 4.56 4.81 2bdsA23 TYR 33 HB2 0.02 -0.02 0.11 -0.04 3.06 3.12 2bdsA23 TYR 33 HB3 0.07 0.02 -0.04 -0.04 2.98 2.99 2bdsA23 TYR 33 HD2 0.07 0.06 -0.17 -0.04 7.15 7.07 2bdsA23 TYR 33 HE2 -0.00 -0.07 -0.51 -0.04 6.85 6.23 2bdsA23 LYS 34 H 0.14 0.41 0.05 -0.55 8.42 8.48 2bdsA23 LYS 34 HA 0.14 0.08 0.68 -0.75 4.32 4.47 2bdsA23 LYS 34 HB2 0.04 -0.08 -0.13 -0.04 1.87 1.66 2bdsA23 LYS 34 HB3 0.06 0.04 0.01 -0.04 1.79 1.86 2bdsA23 LYS 34 HG2 0.04 -0.01 -0.06 -0.04 1.46 1.38 2bdsA23 LYS 34 HG3 0.06 0.25 -0.10 -0.04 1.46 1.63 2bdsA23 LYS 34 HD2 0.01 -0.12 -0.49 -0.04 1.69 1.05 2bdsA23 LYS 34 HD3 0.00 0.01 -0.18 -0.04 1.68 1.47 2bdsA23 LYS 34 HE2 0.02 0.01 -0.10 -0.04 2.99 2.88 2bdsA23 LYS 34 HE3 0.02 -0.02 -0.13 -0.04 2.99 2.82 2bdsA23 TRP 35 H 0.36 0.05 -0.00 -0.55 7.97 7.83 2bdsA23 TRP 35 HA 0.06 0.19 0.09 -0.75 4.62 4.21 2bdsA23 TRP 35 HB2 0.04 -0.03 0.11 -0.04 3.23 3.31 2bdsA23 TRP 35 HB3 0.03 0.01 -0.06 -0.04 3.23 3.17 2bdsA23 TRP 35 HD1 0.12 0.16 -0.05 -0.04 7.22 7.41 2bdsA23 TRP 35 HE1 0.05 -0.15 -0.25 -0.04 10.20 9.81 2bdsA23 TRP 35 HE3 0.02 0.01 -0.05 -0.04 7.59 7.53 2bdsA23 TRP 35 HZ2 0.02 -0.04 -0.03 -0.04 7.44 7.34 2bdsA23 TRP 35 HZ3 0.01 -0.01 -0.02 -0.04 7.13 7.08 2bdsA23 TRP 35 HH2 0.01 -0.01 -0.01 -0.04 7.19 7.13 2bdsA23 PRO 36 HA -1.60 -0.00 0.32 -0.51 4.44 2.65 2bdsA23 PRO 36 HB2 -0.44 0.10 0.12 -0.04 2.28 2.02 2bdsA23 PRO 36 HB3 -0.87 -0.03 0.13 -0.04 2.02 1.20 2bdsA23 PRO 36 HG2 -0.17 0.07 0.13 -0.04 2.03 2.02 2bdsA23 PRO 36 HG3 -0.21 -0.02 0.10 -0.04 2.03 1.87 2bdsA23 PRO 36 HD2 -0.06 0.11 0.38 -0.04 3.68 4.07 2bdsA23 PRO 36 HD3 -0.02 0.07 0.17 -0.04 3.65 3.83 2bdsA23 ASN 37 H -0.07 0.23 -0.18 -0.55 8.53 7.96 2bdsA23 ASN 37 HA -0.03 -0.10 0.07 -0.75 4.76 3.94 2bdsA23 ASN 37 HB2 -0.01 0.06 0.02 -0.04 2.88 2.91 2bdsA23 ASN 37 HB3 -0.02 0.01 0.20 -0.04 2.79 2.95 2bdsA23 ASN 37 HD21 -0.04 0.09 -0.11 -0.04 7.03 6.92 2bdsA23 ASN 37 HD22 -0.05 -0.06 0.04 -0.04 7.74 7.62 2bdsA23 ILE 38 H 0.03 0.54 0.26 -0.55 8.25 8.53 2bdsA23 ILE 38 HA -0.04 -0.11 0.51 -0.75 4.18 3.78 2bdsA23 ILE 38 HB -0.19 0.03 0.05 -0.04 1.89 1.74 2bdsA23 ILE 38 HG12 -0.18 -0.16 -0.38 -0.04 1.49 0.73 2bdsA23 ILE 38 HG13 -0.40 0.31 -0.22 -0.04 1.21 0.86 2bdsA23 ILE 38 HG23 0.08 0.10 -0.32 -0.04 0.93 0.75 2bdsA23 ILE 38 HD13 -1.22 -0.02 -0.32 -0.04 0.88 -0.73 2bdsA23 CYS 39 H -0.08 0.31 0.08 -0.55 8.50 8.26 2bdsA23 CYS 39 HA 0.05 0.33 1.09 -0.75 4.58 5.30 2bdsA23 CYS 39 HB2 -0.01 -0.05 0.03 -0.04 2.97 2.90 2bdsA23 CYS 39 HB3 0.04 0.12 -0.24 -0.04 2.97 2.86 2bdsA23 CYS 40 H 0.13 0.62 0.22 -0.55 8.50 8.92 2bdsA23 CYS 40 HA -0.24 -0.08 0.51 -0.75 4.58 4.02 2bdsA23 CYS 40 HB2 -0.38 0.00 0.08 -0.04 2.97 2.62 2bdsA23 CYS 40 HB3 -0.98 -0.03 0.09 -0.04 2.97 2.00 2bdsA23 TYR 41 H 0.03 0.13 0.55 -0.55 8.29 8.45 2bdsA23 TYR 41 HA 0.14 0.16 0.53 -0.75 4.56 4.63 2bdsA23 TYR 41 HB2 0.03 -0.17 -0.07 -0.04 3.06 2.81 2bdsA23 TYR 41 HB3 0.08 -0.09 0.07 -0.04 2.98 3.00 2bdsA23 TYR 41 HD2 0.08 -0.12 -0.16 -0.04 7.15 6.91 2bdsA23 TYR 41 HE2 0.15 -0.07 -0.17 -0.04 6.85 6.72 2bdsA23 PRO 42 HA 0.27 0.05 0.37 -0.51 4.44 4.62 2bdsA23 PRO 42 HB2 -0.02 0.09 -0.02 -0.04 2.28 2.29 2bdsA23 PRO 42 HB3 0.06 0.03 0.08 -0.04 2.02 2.15 2bdsA23 PRO 42 HG2 0.07 0.06 0.11 -0.04 2.03 2.23 2bdsA23 PRO 42 HG3 0.10 0.01 0.14 -0.04 2.03 2.23 2bdsA23 PRO 42 HD2 0.26 0.09 0.12 -0.04 3.68 4.11 2bdsA23 PRO 42 HD3 0.21 -0.18 0.56 -0.04 3.65 4.20 2bdsA23 HIS 43 H 0.06 0.07 -0.04 -0.55 8.41 7.95 2bdsA23 HIS 43 HA -0.06 0.04 0.14 -0.75 4.63 3.99 2bdsA23 HIS 43 HB2 -0.19 -0.04 -0.14 -0.04 3.26 2.84 2bdsA23 HIS 43 HB3 -0.67 -0.03 -0.45 -0.04 3.20 2.00 2bdsA23 HIS 43 HD2 -0.07 -0.05 -0.04 -0.04 6.97 6.76 2bdsA23 HIS 43 HE1 0.18 0.03 0.01 -0.04 7.75 7.92