============================================================================= 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 10.685 4.223 -3.337 -99.200 -91.000 TRP 16 1.040 -3.767 -0.643 -2.663 -99.200 -91.000 TRP6 16 1.020 -5.885 -1.177 -3.404 -99.200 -91.000 TYR 26 0.840 -5.700 -6.543 -5.116 -99.200 -91.000 TYR 28 0.840 -2.140 -5.294 -0.658 -99.200 -91.000 TYR 33 0.840 -3.132 1.686 5.875 -99.200 -91.000 TRP 35 1.040 -6.818 8.345 5.132 -99.200 -91.000 TRP6 35 1.020 -8.355 10.069 5.295 -99.200 -91.000 TYR 41 0.840 6.222 -3.060 1.340 -99.200 -91.000 HIS 43 0.900 7.729 -5.096 -1.693 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 2bdsA20 ALA 1 HA -0.16 -0.04 0.16 -0.75 4.34 3.54 2bdsA20 ALA 1 HB3 -0.08 -0.03 0.04 -0.04 1.41 1.29 2bdsA20 ALA 2 H -0.12 -0.21 0.26 -0.55 8.40 7.78 2bdsA20 ALA 2 HA -0.07 0.13 0.47 -0.75 4.34 4.12 2bdsA20 ALA 2 HB3 -0.09 0.10 0.31 -0.04 1.41 1.70 2bdsA20 PRO 3 HA -0.02 0.14 0.79 -0.51 4.44 4.84 2bdsA20 PRO 3 HB2 0.09 0.04 0.26 -0.04 2.28 2.62 2bdsA20 PRO 3 HB3 0.02 0.02 0.18 -0.04 2.02 2.19 2bdsA20 PRO 3 HG2 0.01 -0.01 0.07 -0.04 2.03 2.06 2bdsA20 PRO 3 HG3 0.00 0.03 0.09 -0.04 2.03 2.12 2bdsA20 PRO 3 HD2 -0.04 0.03 0.21 -0.04 3.68 3.83 2bdsA20 PRO 3 HD3 -0.03 0.27 0.22 -0.04 3.65 4.06 2bdsA20 CYS 4 H -0.06 0.22 -0.68 -0.55 8.50 7.43 2bdsA20 CYS 4 HA -0.49 0.03 0.42 -0.75 4.58 3.78 2bdsA20 CYS 4 HB2 -0.24 -0.04 0.02 -0.04 2.97 2.67 2bdsA20 CYS 4 HB3 -0.11 -0.06 0.07 -0.04 2.97 2.84 2bdsA20 PHE 5 H -1.34 0.02 0.05 -0.55 8.34 6.52 2bdsA20 PHE 5 HA 0.11 0.11 0.01 -0.75 4.62 4.10 2bdsA20 PHE 5 HB2 0.03 0.01 -0.02 -0.04 3.15 3.13 2bdsA20 PHE 5 HB3 0.06 0.27 0.10 -0.04 3.06 3.46 2bdsA20 PHE 5 HD2 0.01 0.10 -0.22 -0.04 7.28 7.13 2bdsA20 PHE 5 HE2 0.00 0.05 0.04 -0.04 7.38 7.43 2bdsA20 PHE 5 HZ 0.00 -0.04 0.02 -0.04 7.32 7.26 2bdsA20 CYS 6 H 0.21 0.49 0.08 -0.55 8.50 8.74 2bdsA20 CYS 6 HA -0.00 0.16 0.70 -0.75 4.58 4.68 2bdsA20 CYS 6 HB2 -0.66 0.10 -0.11 -0.04 2.97 2.26 2bdsA20 CYS 6 HB3 -0.34 -0.05 0.01 -0.04 2.97 2.54 2bdsA20 SER 7 H -0.08 0.14 0.09 -0.55 8.46 8.06 2bdsA20 SER 7 HA 0.01 0.05 0.46 -0.75 4.49 4.26 2bdsA20 SER 7 HB2 -0.00 0.03 0.07 -0.04 3.95 4.00 2bdsA20 SER 7 HB3 -0.02 -0.01 0.15 -0.04 3.93 4.02 2bdsA20 GLY 8 H 0.02 0.19 0.24 -0.55 8.43 8.33 2bdsA20 GLY 8 HA2 0.01 -0.01 0.34 -0.51 4.01 3.84 2bdsA20 GLY 8 HA3 -0.00 0.03 0.35 -0.51 4.01 3.88 2bdsA20 LYS 9 H -0.03 0.05 -1.33 -0.55 8.42 6.56 2bdsA20 LYS 9 HA 0.04 0.18 0.81 -0.75 4.32 4.60 2bdsA20 LYS 9 HB2 -0.34 -0.14 -0.19 -0.04 1.87 1.16 2bdsA20 LYS 9 HB3 -0.10 0.10 -0.16 -0.04 1.79 1.59 2bdsA20 LYS 9 HG2 -0.24 0.01 -0.03 -0.04 1.46 1.16 2bdsA20 LYS 9 HG3 0.02 0.02 0.01 -0.04 1.46 1.47 2bdsA20 LYS 9 HD2 -0.09 0.12 -0.19 -0.04 1.69 1.48 2bdsA20 LYS 9 HD3 -0.28 -0.09 -0.09 -0.04 1.68 1.19 2bdsA20 LYS 9 HE2 -0.01 0.01 -0.03 -0.04 2.99 2.91 2bdsA20 LYS 9 HE3 -0.04 -0.02 -0.04 -0.04 2.99 2.85 2bdsA20 PRO 10 HA 0.07 0.03 0.19 -0.51 4.44 4.22 2bdsA20 PRO 10 HB2 0.33 0.05 -0.04 -0.04 2.28 2.58 2bdsA20 PRO 10 HB3 0.13 -0.01 0.13 -0.04 2.02 2.23 2bdsA20 PRO 10 HG2 0.26 0.12 0.05 -0.04 2.03 2.43 2bdsA20 PRO 10 HG3 0.12 0.02 0.09 -0.04 2.03 2.22 2bdsA20 PRO 10 HD2 0.30 0.13 0.16 -0.04 3.68 4.22 2bdsA20 PRO 10 HD3 0.12 0.16 0.23 -0.04 3.65 4.11 2bdsA20 GLY 11 H 0.02 0.09 0.10 -0.55 8.43 8.09 2bdsA20 GLY 11 HA2 -0.35 0.06 0.23 -0.51 4.01 3.45 2bdsA20 GLY 11 HA3 -0.19 -0.02 0.38 -0.51 4.01 3.67 2bdsA20 ARG 12 H 0.14 0.36 -0.65 -0.55 8.46 7.76 2bdsA20 ARG 12 HA 0.11 0.12 -0.24 -0.75 4.34 3.58 2bdsA20 ARG 12 HB2 -0.09 -0.01 0.09 -0.04 1.90 1.84 2bdsA20 ARG 12 HB3 -0.12 -0.09 -0.56 -0.04 1.80 0.99 2bdsA20 ARG 12 HG2 -0.49 -0.09 -0.15 -0.04 1.67 0.90 2bdsA20 ARG 12 HG3 -1.43 0.04 -0.39 -0.04 1.67 -0.15 2bdsA20 ARG 12 HD2 -0.09 -0.01 -0.08 -0.04 3.22 3.00 2bdsA20 ARG 12 HD3 -0.10 -0.11 -0.12 -0.04 3.22 2.85 2bdsA20 GLY 13 H -0.02 0.11 -0.16 -0.55 8.43 7.82 2bdsA20 GLY 13 HA2 -0.17 0.03 0.30 -0.51 4.01 3.66 2bdsA20 GLY 13 HA3 0.22 0.02 0.11 -0.51 4.01 3.85 2bdsA20 ASP 14 H 0.07 0.46 0.18 -0.55 8.40 8.56 2bdsA20 ASP 14 HA -0.01 0.11 0.57 -0.75 4.63 4.54 2bdsA20 ASP 14 HB2 0.30 -0.01 0.28 -0.04 2.71 3.23 2bdsA20 ASP 14 HB3 0.07 -0.03 0.01 -0.04 2.70 2.70 2bdsA20 LEU 15 H -0.10 -0.11 0.36 -0.55 8.37 7.98 2bdsA20 LEU 15 HA 0.01 0.25 0.91 -0.75 4.35 4.77 2bdsA20 LEU 15 HB2 -0.08 0.00 0.12 -0.04 1.64 1.64 2bdsA20 LEU 15 HB3 -0.10 -0.06 0.25 -0.04 1.64 1.68 2bdsA20 LEU 15 HG -0.03 0.07 -0.21 -0.04 1.64 1.43 2bdsA20 LEU 15 HD13 -0.08 -0.01 -0.05 -0.04 0.93 0.75 2bdsA20 LEU 15 HD23 -0.06 0.02 -0.38 -0.04 0.89 0.43 2bdsA20 TRP 16 H 0.25 0.53 0.48 -0.55 7.97 8.68 2bdsA20 TRP 16 HA -0.08 -0.01 0.59 -0.75 4.62 4.36 2bdsA20 TRP 16 HB2 -0.16 0.16 0.13 -0.04 3.23 3.33 2bdsA20 TRP 16 HB3 -0.10 -0.05 -0.07 -0.04 3.23 2.97 2bdsA20 TRP 16 HD1 -0.18 0.25 0.07 -0.04 7.22 7.32 2bdsA20 TRP 16 HE1 0.14 0.00 -0.02 -0.04 10.20 10.28 2bdsA20 TRP 16 HE3 -0.07 -0.03 -0.02 -0.04 7.59 7.42 2bdsA20 TRP 16 HZ2 -0.87 -0.02 -0.00 -0.04 7.44 6.51 2bdsA20 TRP 16 HZ3 -0.08 0.02 0.02 -0.04 7.13 7.05 2bdsA20 TRP 16 HH2 -0.30 -0.02 0.02 -0.04 7.19 6.85 2bdsA20 ILE 17 H -0.02 0.14 0.18 -0.55 8.25 8.00 2bdsA20 ILE 17 HA -0.03 0.11 0.42 -0.75 4.18 3.92 2bdsA20 ILE 17 HB -0.06 0.00 0.05 -0.04 1.89 1.84 2bdsA20 ILE 17 HG12 -0.10 -0.01 0.04 -0.04 1.49 1.38 2bdsA20 ILE 17 HG13 -0.11 0.15 -0.06 -0.04 1.21 1.16 2bdsA20 ILE 17 HG23 -0.06 -0.00 0.07 -0.04 0.93 0.89 2bdsA20 ILE 17 HD13 -0.16 -0.01 0.11 -0.04 0.88 0.78 2bdsA20 LEU 18 H 0.10 0.00 -0.30 -0.55 8.37 7.62 2bdsA20 LEU 18 HA -0.15 0.26 0.70 -0.75 4.35 4.41 2bdsA20 LEU 18 HB2 0.01 -0.09 0.02 -0.04 1.64 1.54 2bdsA20 LEU 18 HB3 -0.04 -0.01 0.12 -0.04 1.64 1.67 2bdsA20 LEU 18 HG -0.09 0.29 -0.44 -0.04 1.64 1.36 2bdsA20 LEU 18 HD13 -0.04 -0.02 -0.06 -0.04 0.93 0.77 2bdsA20 LEU 18 HD23 -0.14 -0.01 0.01 -0.04 0.89 0.71 2bdsA20 ARG 19 H -0.07 0.82 0.14 -0.55 8.46 8.80 2bdsA20 ARG 19 HA 0.06 0.00 0.61 -0.75 4.34 4.25 2bdsA20 ARG 19 HB2 0.12 -0.18 -0.40 -0.04 1.90 1.40 2bdsA20 ARG 19 HB3 0.02 0.05 -0.22 -0.04 1.80 1.60 2bdsA20 ARG 19 HG2 0.00 -0.02 0.17 -0.04 1.67 1.79 2bdsA20 ARG 19 HG3 0.07 0.20 0.22 -0.04 1.67 2.12 2bdsA20 ARG 19 HD2 -0.28 -0.12 -0.04 -0.04 3.22 2.73 2bdsA20 ARG 19 HD3 -0.38 0.10 0.14 -0.04 3.22 3.05 2bdsA20 GLY 20 H 0.21 0.14 0.13 -0.55 8.43 8.36 2bdsA20 GLY 20 HA2 0.69 0.15 0.66 -0.51 4.01 5.00 2bdsA20 GLY 20 HA3 0.41 -0.01 0.32 -0.51 4.01 4.22 2bdsA20 THR 21 H 0.16 0.05 -0.07 -0.55 8.28 7.87 2bdsA20 THR 21 HA 0.27 0.15 0.60 -0.75 4.39 4.66 2bdsA20 THR 21 HB 0.03 0.13 -0.06 -0.04 4.32 4.38 2bdsA20 THR 21 HG23 -0.03 0.03 -0.19 -0.04 1.22 0.99 2bdsA20 CYS 22 H 0.13 0.14 0.04 -0.55 8.50 8.27 2bdsA20 CYS 22 HA -0.47 0.14 0.65 -0.75 4.58 4.14 2bdsA20 CYS 22 HB2 -0.12 -0.03 -0.01 -0.04 2.97 2.77 2bdsA20 CYS 22 HB3 -0.05 0.09 -0.09 -0.04 2.97 2.88 2bdsA20 PRO 23 HA -0.07 0.13 0.30 -0.51 4.44 4.29 2bdsA20 PRO 23 HB2 0.04 -0.30 0.14 -0.04 2.28 2.12 2bdsA20 PRO 23 HB3 -0.04 0.10 0.16 -0.04 2.02 2.21 2bdsA20 PRO 23 HG2 -0.31 -0.01 0.04 -0.04 2.03 1.70 2bdsA20 PRO 23 HG3 -0.52 0.10 0.08 -0.04 2.03 1.66 2bdsA20 PRO 23 HD2 -0.63 0.10 0.15 -0.04 3.68 3.25 2bdsA20 PRO 23 HD3 -1.09 0.21 0.20 -0.04 3.65 2.92 2bdsA20 GLY 24 H 0.03 0.04 0.22 -0.55 8.43 8.17 2bdsA20 GLY 24 HA2 0.03 0.30 0.82 -0.51 4.01 4.65 2bdsA20 GLY 24 HA3 0.02 0.09 0.32 -0.51 4.01 3.93 2bdsA20 GLY 25 H 0.08 -0.10 0.18 -0.55 8.43 8.05 2bdsA20 GLY 25 HA2 0.01 0.24 0.68 -0.51 4.01 4.43 2bdsA20 GLY 25 HA3 0.06 0.04 0.32 -0.51 4.01 3.92 2bdsA20 TYR 26 H 0.16 -0.07 -0.15 -0.55 8.29 7.67 2bdsA20 TYR 26 HA -0.12 0.18 0.54 -0.75 4.56 4.41 2bdsA20 TYR 26 HB2 -0.33 -0.09 0.02 -0.04 3.06 2.61 2bdsA20 TYR 26 HB3 -0.85 0.06 -0.11 -0.04 2.98 2.05 2bdsA20 TYR 26 HD2 0.00 -0.07 -0.05 -0.04 7.15 6.99 2bdsA20 TYR 26 HE2 0.13 0.02 -0.02 -0.04 6.85 6.95 2bdsA20 GLY 27 H -0.05 -0.06 -0.36 -0.55 8.43 7.42 2bdsA20 GLY 27 HA2 -0.01 0.09 0.16 -0.51 4.01 3.73 2bdsA20 GLY 27 HA3 -0.05 0.19 0.68 -0.51 4.01 4.31 2bdsA20 TYR 28 H -0.16 -0.13 -0.15 -0.55 8.29 7.30 2bdsA20 TYR 28 HA 0.07 0.11 0.52 -0.75 4.56 4.50 2bdsA20 TYR 28 HB2 -0.02 0.01 -0.11 -0.04 3.06 2.90 2bdsA20 TYR 28 HB3 0.03 0.11 0.05 -0.04 2.98 3.13 2bdsA20 TYR 28 HD2 -0.06 0.04 -0.23 -0.04 7.15 6.86 2bdsA20 TYR 28 HE2 -0.07 -0.01 -0.11 -0.04 6.85 6.61 2bdsA20 THR 29 H 0.21 0.20 0.19 -0.55 8.28 8.33 2bdsA20 THR 29 HA 0.10 0.10 0.48 -0.75 4.39 4.31 2bdsA20 THR 29 HB 0.07 -0.04 -0.01 -0.04 4.32 4.30 2bdsA20 THR 29 HG23 0.07 0.05 -0.13 -0.04 1.22 1.16 2bdsA20 SER 30 H 0.14 0.07 0.10 -0.55 8.46 8.23 2bdsA20 SER 30 HA 0.08 0.17 0.81 -0.75 4.49 4.79 2bdsA20 SER 30 HB2 0.15 0.01 -0.04 -0.04 3.95 4.03 2bdsA20 SER 30 HB3 0.08 0.05 0.05 -0.04 3.93 4.07 2bdsA20 ASN 31 H 0.07 0.30 0.21 -0.55 8.53 8.57 2bdsA20 ASN 31 HA 0.01 -0.07 0.80 -0.75 4.76 4.75 2bdsA20 ASN 31 HB2 -0.28 0.09 -0.15 -0.04 2.88 2.50 2bdsA20 ASN 31 HB3 -0.21 -0.02 0.03 -0.04 2.79 2.55 2bdsA20 ASN 31 HD21 0.00 -0.00 -0.42 -0.04 7.03 6.56 2bdsA20 ASN 31 HD22 0.11 0.06 -0.25 -0.04 7.74 7.63 2bdsA20 CYS 32 H -0.10 0.53 0.34 -0.55 8.50 8.73 2bdsA20 CYS 32 HA 0.08 0.15 0.99 -0.75 4.58 5.04 2bdsA20 CYS 32 HB2 -0.00 0.02 0.05 -0.04 2.97 3.00 2bdsA20 CYS 32 HB3 -0.06 -0.05 0.11 -0.04 2.97 2.92 2bdsA20 TYR 33 H 0.19 0.16 0.17 -0.55 8.29 8.26 2bdsA20 TYR 33 HA 0.05 0.13 0.73 -0.75 4.56 4.71 2bdsA20 TYR 33 HB2 0.03 -0.03 0.14 -0.04 3.06 3.15 2bdsA20 TYR 33 HB3 0.10 0.02 -0.02 -0.04 2.98 3.05 2bdsA20 TYR 33 HD2 0.07 0.04 -0.16 -0.04 7.15 7.07 2bdsA20 TYR 33 HE2 -0.01 -0.06 -0.52 -0.04 6.85 6.22 2bdsA20 LYS 34 H 0.09 0.34 0.08 -0.55 8.42 8.38 2bdsA20 LYS 34 HA 0.13 0.14 0.77 -0.75 4.32 4.61 2bdsA20 LYS 34 HB2 0.03 -0.06 -0.10 -0.04 1.87 1.70 2bdsA20 LYS 34 HB3 0.04 0.04 0.01 -0.04 1.79 1.84 2bdsA20 LYS 34 HG2 0.01 -0.13 -0.49 -0.04 1.46 0.81 2bdsA20 LYS 34 HG3 -0.01 0.02 -0.16 -0.04 1.46 1.27 2bdsA20 LYS 34 HD2 0.03 0.01 -0.06 -0.04 1.69 1.63 2bdsA20 LYS 34 HD3 0.05 0.21 -0.27 -0.04 1.68 1.63 2bdsA20 LYS 34 HE2 -0.01 0.02 -0.13 -0.04 2.99 2.83 2bdsA20 LYS 34 HE3 0.01 -0.02 -0.10 -0.04 2.99 2.84 2bdsA20 TRP 35 H 0.36 0.06 -0.13 -0.55 7.97 7.71 2bdsA20 TRP 35 HA 0.07 0.16 0.08 -0.75 4.62 4.16 2bdsA20 TRP 35 HB2 0.05 -0.02 0.09 -0.04 3.23 3.30 2bdsA20 TRP 35 HB3 0.03 0.01 -0.07 -0.04 3.23 3.15 2bdsA20 TRP 35 HD1 0.12 0.15 -0.04 -0.04 7.22 7.41 2bdsA20 TRP 35 HE1 0.04 -0.11 -0.05 -0.04 10.20 10.04 2bdsA20 TRP 35 HE3 0.02 0.01 -0.09 -0.04 7.59 7.49 2bdsA20 TRP 35 HZ2 0.01 -0.03 -0.01 -0.04 7.44 7.37 2bdsA20 TRP 35 HZ3 0.01 -0.01 -0.02 -0.04 7.13 7.07 2bdsA20 TRP 35 HH2 0.01 -0.01 -0.01 -0.04 7.19 7.14 2bdsA20 PRO 36 HA -1.83 0.00 0.30 -0.51 4.44 2.41 2bdsA20 PRO 36 HB2 -0.44 0.10 0.07 -0.04 2.28 1.96 2bdsA20 PRO 36 HB3 -0.97 -0.03 0.12 -0.04 2.02 1.09 2bdsA20 PRO 36 HG2 -0.20 0.07 0.11 -0.04 2.03 1.98 2bdsA20 PRO 36 HG3 -0.27 -0.02 0.10 -0.04 2.03 1.80 2bdsA20 PRO 36 HD2 -0.08 0.12 0.39 -0.04 3.68 4.07 2bdsA20 PRO 36 HD3 -0.03 0.07 0.15 -0.04 3.65 3.80 2bdsA20 ASN 37 H -0.08 0.29 -0.26 -0.55 8.53 7.94 2bdsA20 ASN 37 HA -0.04 -0.09 0.11 -0.75 4.76 3.98 2bdsA20 ASN 37 HB2 -0.01 0.13 0.02 -0.04 2.88 2.98 2bdsA20 ASN 37 HB3 -0.02 0.02 0.17 -0.04 2.79 2.92 2bdsA20 ASN 37 HD21 -0.15 -0.17 -0.17 -0.04 7.03 6.50 2bdsA20 ASN 37 HD22 -0.08 -0.01 0.03 -0.04 7.74 7.64 2bdsA20 ILE 38 H 0.02 0.55 0.20 -0.55 8.25 8.47 2bdsA20 ILE 38 HA -0.04 -0.22 0.54 -0.75 4.18 3.70 2bdsA20 ILE 38 HB -0.21 0.04 0.06 -0.04 1.89 1.73 2bdsA20 ILE 38 HG12 -0.24 -0.15 -0.47 -0.04 1.49 0.59 2bdsA20 ILE 38 HG13 -0.43 0.38 -0.20 -0.04 1.21 0.91 2bdsA20 ILE 38 HG23 0.04 0.11 -0.35 -0.04 0.93 0.68 2bdsA20 ILE 38 HD13 -1.32 -0.02 -0.34 -0.04 0.88 -0.84 2bdsA20 CYS 39 H -0.08 0.31 0.17 -0.55 8.50 8.36 2bdsA20 CYS 39 HA 0.07 0.36 1.03 -0.75 4.58 5.29 2bdsA20 CYS 39 HB2 0.02 0.03 -0.04 -0.04 2.97 2.93 2bdsA20 CYS 39 HB3 0.06 0.03 -0.40 -0.04 2.97 2.62 2bdsA20 CYS 40 H 0.10 0.63 0.25 -0.55 8.50 8.94 2bdsA20 CYS 40 HA -0.23 -0.01 0.70 -0.75 4.58 4.29 2bdsA20 CYS 40 HB2 -0.43 -0.01 0.02 -0.04 2.97 2.51 2bdsA20 CYS 40 HB3 -1.09 -0.03 0.08 -0.04 2.97 1.88 2bdsA20 TYR 41 H 0.05 0.14 0.49 -0.55 8.29 8.42 2bdsA20 TYR 41 HA 0.15 0.15 0.46 -0.75 4.56 4.57 2bdsA20 TYR 41 HB2 0.02 -0.14 -0.15 -0.04 3.06 2.75 2bdsA20 TYR 41 HB3 0.06 -0.08 0.06 -0.04 2.98 2.99 2bdsA20 TYR 41 HD2 0.05 -0.15 -0.24 -0.04 7.15 6.76 2bdsA20 TYR 41 HE2 0.14 -0.07 -0.17 -0.04 6.85 6.71 2bdsA20 PRO 42 HA 0.22 0.05 0.34 -0.51 4.44 4.55 2bdsA20 PRO 42 HB2 0.02 0.01 0.03 -0.04 2.28 2.30 2bdsA20 PRO 42 HB3 0.05 0.04 0.07 -0.04 2.02 2.13 2bdsA20 PRO 42 HG2 0.09 0.08 0.08 -0.04 2.03 2.25 2bdsA20 PRO 42 HG3 0.10 0.01 0.13 -0.04 2.03 2.22 2bdsA20 PRO 42 HD2 0.29 0.11 0.07 -0.04 3.68 4.11 2bdsA20 PRO 42 HD3 0.21 -0.21 0.54 -0.04 3.65 4.14 2bdsA20 HIS 43 H 0.10 0.10 -0.05 -0.55 8.41 8.01 2bdsA20 HIS 43 HA -0.04 0.05 0.15 -0.75 4.63 4.04 2bdsA20 HIS 43 HB2 -0.20 -0.03 -0.04 -0.04 3.26 2.95 2bdsA20 HIS 43 HB3 -0.67 -0.02 -0.42 -0.04 3.20 2.05 2bdsA20 HIS 43 HD2 -0.08 -0.07 -0.04 -0.04 6.97 6.73 2bdsA20 HIS 43 HE1 0.20 -0.14 -0.04 -0.04 7.75 7.73