============================================================================= 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 11.093 3.533 -4.461 -99.200 -91.000 TRP 16 1.040 -3.998 -0.545 -2.575 -99.200 -91.000 TRP6 16 1.020 -6.139 -1.107 -3.238 -99.200 -91.000 TYR 26 0.840 -6.590 -6.696 -4.676 -99.200 -91.000 TYR 28 0.840 -2.349 -5.222 -0.595 -99.200 -91.000 TYR 33 0.840 -2.529 1.590 6.215 -99.200 -91.000 TRP 35 1.040 -6.741 8.312 4.921 -99.200 -91.000 TRP6 35 1.020 -8.494 9.685 5.563 -99.200 -91.000 TYR 41 0.840 5.399 -1.825 1.148 -99.200 -91.000 HIS 43 0.900 7.738 -4.983 -1.570 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 2bdsA11 ALA 1 HA -0.10 -0.04 0.14 -0.75 4.34 3.59 2bdsA11 ALA 1 HB3 -0.09 -0.09 0.09 -0.04 1.41 1.28 2bdsA11 ALA 2 H -0.12 -0.17 0.23 -0.55 8.40 7.79 2bdsA11 ALA 2 HA -0.10 0.06 0.36 -0.75 4.34 3.91 2bdsA11 ALA 2 HB3 -0.12 -0.05 0.24 -0.04 1.41 1.44 2bdsA11 PRO 3 HA -0.12 0.19 0.76 -0.51 4.44 4.76 2bdsA11 PRO 3 HB2 -0.09 -0.01 0.23 -0.04 2.28 2.37 2bdsA11 PRO 3 HB3 -0.03 0.05 0.15 -0.04 2.02 2.15 2bdsA11 PRO 3 HG2 -0.11 -0.01 0.05 -0.04 2.03 1.91 2bdsA11 PRO 3 HG3 -0.05 0.03 0.07 -0.04 2.03 2.04 2bdsA11 PRO 3 HD2 -0.13 0.03 0.17 -0.04 3.68 3.72 2bdsA11 PRO 3 HD3 -0.08 0.18 0.14 -0.04 3.65 3.84 2bdsA11 CYS 4 H -0.19 0.28 -0.74 -0.55 8.50 7.30 2bdsA11 CYS 4 HA -0.55 0.01 0.36 -0.75 4.58 3.65 2bdsA11 CYS 4 HB2 -0.15 -0.03 0.02 -0.04 2.97 2.76 2bdsA11 CYS 4 HB3 -0.12 0.02 0.05 -0.04 2.97 2.88 2bdsA11 PHE 5 H -1.17 0.07 0.19 -0.55 8.34 6.88 2bdsA11 PHE 5 HA 0.13 0.15 0.32 -0.75 4.62 4.45 2bdsA11 PHE 5 HB2 0.04 -0.05 -0.10 -0.04 3.15 3.00 2bdsA11 PHE 5 HB3 0.06 0.07 -0.03 -0.04 3.06 3.12 2bdsA11 PHE 5 HD2 0.01 0.11 -0.05 -0.04 7.28 7.31 2bdsA11 PHE 5 HE2 0.00 -0.05 0.06 -0.04 7.38 7.36 2bdsA11 PHE 5 HZ 0.00 -0.07 0.05 -0.04 7.32 7.26 2bdsA11 CYS 6 H 0.26 0.52 0.11 -0.55 8.50 8.84 2bdsA11 CYS 6 HA 0.08 0.16 0.78 -0.75 4.58 4.84 2bdsA11 CYS 6 HB2 -0.25 0.11 -0.08 -0.04 2.97 2.70 2bdsA11 CYS 6 HB3 -0.20 -0.01 -0.02 -0.04 2.97 2.70 2bdsA11 SER 7 H -0.02 0.14 0.10 -0.55 8.46 8.13 2bdsA11 SER 7 HA 0.02 0.06 0.40 -0.75 4.49 4.21 2bdsA11 SER 7 HB2 0.00 0.02 0.02 -0.04 3.95 3.95 2bdsA11 SER 7 HB3 0.01 0.02 0.09 -0.04 3.93 4.01 2bdsA11 GLY 8 H 0.00 0.17 0.15 -0.55 8.43 8.21 2bdsA11 GLY 8 HA2 -0.00 -0.02 0.34 -0.51 4.01 3.82 2bdsA11 GLY 8 HA3 -0.02 0.11 0.49 -0.51 4.01 4.08 2bdsA11 LYS 9 H -0.03 0.14 -1.12 -0.55 8.42 6.86 2bdsA11 LYS 9 HA 0.04 0.18 0.85 -0.75 4.32 4.64 2bdsA11 LYS 9 HB2 -0.27 -0.14 -0.09 -0.04 1.87 1.33 2bdsA11 LYS 9 HB3 0.09 0.17 -0.04 -0.04 1.79 1.97 2bdsA11 LYS 9 HG2 -0.06 0.04 -0.06 -0.04 1.46 1.34 2bdsA11 LYS 9 HG3 -0.09 -0.01 -0.40 -0.04 1.46 0.91 2bdsA11 LYS 9 HD2 -0.36 0.01 -0.13 -0.04 1.69 1.17 2bdsA11 LYS 9 HD3 -1.13 0.01 -0.10 -0.04 1.68 0.42 2bdsA11 LYS 9 HE2 -0.09 0.01 -0.08 -0.04 2.99 2.79 2bdsA11 LYS 9 HE3 -0.15 -0.04 -0.11 -0.04 2.99 2.65 2bdsA11 PRO 10 HA 0.06 0.09 0.43 -0.51 4.44 4.51 2bdsA11 PRO 10 HB2 0.07 -0.04 0.15 -0.04 2.28 2.42 2bdsA11 PRO 10 HB3 0.01 0.02 0.11 -0.04 2.02 2.11 2bdsA11 PRO 10 HG2 0.06 0.03 0.03 -0.04 2.03 2.11 2bdsA11 PRO 10 HG3 0.03 0.02 0.03 -0.04 2.03 2.06 2bdsA11 PRO 10 HD2 0.09 0.12 0.15 -0.04 3.68 4.00 2bdsA11 PRO 10 HD3 0.04 0.28 -0.00 -0.04 3.65 3.93 2bdsA11 GLY 11 H 0.08 0.05 0.09 -0.55 8.43 8.11 2bdsA11 GLY 11 HA2 0.13 -0.03 0.35 -0.51 4.01 3.95 2bdsA11 GLY 11 HA3 0.34 0.06 0.34 -0.51 4.01 4.23 2bdsA11 ARG 12 H -0.97 0.26 0.25 -0.55 8.46 7.46 2bdsA11 ARG 12 HA 0.04 0.11 0.25 -0.75 4.34 3.99 2bdsA11 ARG 12 HB2 -0.18 0.10 -0.00 -0.04 1.90 1.78 2bdsA11 ARG 12 HB3 -0.08 0.04 -0.33 -0.04 1.80 1.40 2bdsA11 ARG 12 HG2 -0.26 -0.09 -0.16 -0.04 1.67 1.12 2bdsA11 ARG 12 HG3 -1.09 0.01 -0.11 -0.04 1.67 0.44 2bdsA11 ARG 12 HD2 -0.09 0.05 -0.13 -0.04 3.22 3.01 2bdsA11 ARG 12 HD3 -0.05 -0.11 -0.12 -0.04 3.22 2.90 2bdsA11 GLY 13 H -0.17 0.13 -0.15 -0.55 8.43 7.69 2bdsA11 GLY 13 HA2 -0.89 0.14 0.53 -0.51 4.01 3.28 2bdsA11 GLY 13 HA3 -0.18 0.03 0.12 -0.51 4.01 3.47 2bdsA11 ASP 14 H -0.16 0.48 0.08 -0.55 8.40 8.25 2bdsA11 ASP 14 HA -0.04 0.11 0.56 -0.75 4.63 4.50 2bdsA11 ASP 14 HB2 0.30 -0.05 0.28 -0.04 2.71 3.19 2bdsA11 ASP 14 HB3 0.20 -0.03 -0.00 -0.04 2.70 2.83 2bdsA11 LEU 15 H -0.11 -0.06 0.29 -0.55 8.37 7.94 2bdsA11 LEU 15 HA 0.02 0.24 0.61 -0.75 4.35 4.47 2bdsA11 LEU 15 HB2 -0.07 0.02 0.08 -0.04 1.64 1.63 2bdsA11 LEU 15 HB3 -0.11 -0.08 0.28 -0.04 1.64 1.69 2bdsA11 LEU 15 HG -0.06 -0.06 -0.21 -0.04 1.64 1.27 2bdsA11 LEU 15 HD13 0.01 0.07 -0.22 -0.04 0.93 0.76 2bdsA11 LEU 15 HD23 -0.05 -0.00 -0.03 -0.04 0.89 0.77 2bdsA11 TRP 16 H 0.27 0.71 0.57 -0.55 7.97 8.97 2bdsA11 TRP 16 HA -0.05 0.01 0.65 -0.75 4.62 4.48 2bdsA11 TRP 16 HB2 -0.11 0.19 0.19 -0.04 3.23 3.46 2bdsA11 TRP 16 HB3 -0.06 -0.06 -0.06 -0.04 3.23 3.01 2bdsA11 TRP 16 HD1 -0.15 0.25 0.08 -0.04 7.22 7.36 2bdsA11 TRP 16 HE1 0.23 0.01 -0.03 -0.04 10.20 10.37 2bdsA11 TRP 16 HE3 -0.05 -0.03 -0.02 -0.04 7.59 7.45 2bdsA11 TRP 16 HZ2 -0.38 -0.01 -0.01 -0.04 7.44 6.99 2bdsA11 TRP 16 HZ3 -0.07 0.02 0.02 -0.04 7.13 7.06 2bdsA11 TRP 16 HH2 -0.29 -0.02 0.02 -0.04 7.19 6.85 2bdsA11 ILE 17 H 0.01 0.15 0.18 -0.55 8.25 8.04 2bdsA11 ILE 17 HA -0.00 0.08 0.39 -0.75 4.18 3.90 2bdsA11 ILE 17 HB -0.04 -0.00 0.09 -0.04 1.89 1.89 2bdsA11 ILE 17 HG12 -0.07 -0.01 0.01 -0.04 1.49 1.38 2bdsA11 ILE 17 HG13 -0.07 0.06 -0.20 -0.04 1.21 0.95 2bdsA11 ILE 17 HG23 -0.05 0.00 0.05 -0.04 0.93 0.89 2bdsA11 ILE 17 HD13 -0.15 -0.01 0.12 -0.04 0.88 0.80 2bdsA11 LEU 18 H 0.13 -0.02 -0.30 -0.55 8.37 7.64 2bdsA11 LEU 18 HA -0.14 0.39 0.89 -0.75 4.35 4.74 2bdsA11 LEU 18 HB2 0.02 -0.10 0.03 -0.04 1.64 1.55 2bdsA11 LEU 18 HB3 -0.03 -0.02 0.16 -0.04 1.64 1.71 2bdsA11 LEU 18 HG -0.08 0.31 -0.35 -0.04 1.64 1.48 2bdsA11 LEU 18 HD13 -0.04 -0.02 -0.05 -0.04 0.93 0.78 2bdsA11 LEU 18 HD23 -0.13 -0.01 0.03 -0.04 0.89 0.74 2bdsA11 ARG 19 H -0.01 0.52 0.03 -0.55 8.46 8.44 2bdsA11 ARG 19 HA 0.09 0.03 0.49 -0.75 4.34 4.19 2bdsA11 ARG 19 HB2 0.15 -0.17 -0.47 -0.04 1.90 1.37 2bdsA11 ARG 19 HB3 0.03 0.03 -0.23 -0.04 1.80 1.60 2bdsA11 ARG 19 HG2 0.00 -0.08 0.21 -0.04 1.67 1.76 2bdsA11 ARG 19 HG3 0.06 0.18 0.28 -0.04 1.67 2.15 2bdsA11 ARG 19 HD2 0.03 -0.07 0.03 -0.04 3.22 3.18 2bdsA11 ARG 19 HD3 -0.41 -0.10 0.01 -0.04 3.22 2.68 2bdsA11 GLY 20 H 0.22 0.14 0.15 -0.55 8.43 8.39 2bdsA11 GLY 20 HA2 0.50 0.20 0.79 -0.51 4.01 5.00 2bdsA11 GLY 20 HA3 0.32 0.00 0.30 -0.51 4.01 4.12 2bdsA11 THR 21 H 0.12 0.01 0.09 -0.55 8.28 7.94 2bdsA11 THR 21 HA 0.18 0.16 0.59 -0.75 4.39 4.57 2bdsA11 THR 21 HB -0.01 0.13 -0.11 -0.04 4.32 4.28 2bdsA11 THR 21 HG23 -0.01 0.02 -0.03 -0.04 1.22 1.16 2bdsA11 CYS 22 H -0.02 0.15 0.06 -0.55 8.50 8.14 2bdsA11 CYS 22 HA -0.61 0.14 0.68 -0.75 4.58 4.04 2bdsA11 CYS 22 HB2 -0.27 -0.04 0.00 -0.04 2.97 2.62 2bdsA11 CYS 22 HB3 -0.13 0.10 -0.07 -0.04 2.97 2.82 2bdsA11 PRO 23 HA -0.11 0.10 0.29 -0.51 4.44 4.22 2bdsA11 PRO 23 HB2 -0.12 -0.14 0.09 -0.04 2.28 2.07 2bdsA11 PRO 23 HB3 -0.13 0.07 0.15 -0.04 2.02 2.07 2bdsA11 PRO 23 HG2 -0.77 0.01 0.04 -0.04 2.03 1.26 2bdsA11 PRO 23 HG3 -0.50 0.09 0.08 -0.04 2.03 1.65 2bdsA11 PRO 23 HD2 -0.88 0.08 0.16 -0.04 3.68 3.00 2bdsA11 PRO 23 HD3 -1.11 0.20 0.20 -0.04 3.65 2.91 2bdsA11 GLY 24 H 0.02 0.06 0.17 -0.55 8.43 8.13 2bdsA11 GLY 24 HA2 0.05 -0.10 0.19 -0.51 4.01 3.64 2bdsA11 GLY 24 HA3 0.05 -0.03 0.54 -0.51 4.01 4.06 2bdsA11 GLY 25 H 0.13 0.05 0.13 -0.55 8.43 8.20 2bdsA11 GLY 25 HA2 0.04 0.24 0.69 -0.51 4.01 4.48 2bdsA11 GLY 25 HA3 0.07 0.03 0.33 -0.51 4.01 3.93 2bdsA11 TYR 26 H 0.22 -0.07 -0.39 -0.55 8.29 7.50 2bdsA11 TYR 26 HA -0.09 0.16 0.55 -0.75 4.56 4.43 2bdsA11 TYR 26 HB2 -0.22 -0.09 -0.01 -0.04 3.06 2.70 2bdsA11 TYR 26 HB3 -0.58 0.08 -0.11 -0.04 2.98 2.33 2bdsA11 TYR 26 HD2 0.02 -0.08 -0.09 -0.04 7.15 6.96 2bdsA11 TYR 26 HE2 0.16 0.01 -0.02 -0.04 6.85 6.95 2bdsA11 GLY 27 H -0.05 -0.09 -0.07 -0.55 8.43 7.68 2bdsA11 GLY 27 HA2 -0.01 0.07 0.16 -0.51 4.01 3.72 2bdsA11 GLY 27 HA3 -0.06 0.18 0.72 -0.51 4.01 4.34 2bdsA11 TYR 28 H -0.10 -0.20 0.05 -0.55 8.29 7.48 2bdsA11 TYR 28 HA 0.06 0.15 0.59 -0.75 4.56 4.60 2bdsA11 TYR 28 HB2 -0.04 0.03 -0.06 -0.04 3.06 2.95 2bdsA11 TYR 28 HB3 0.00 0.07 0.05 -0.04 2.98 3.06 2bdsA11 TYR 28 HD2 -0.07 0.08 -0.23 -0.04 7.15 6.88 2bdsA11 TYR 28 HE2 -0.06 0.02 -0.11 -0.04 6.85 6.66 2bdsA11 THR 29 H 0.20 0.21 0.23 -0.55 8.28 8.38 2bdsA11 THR 29 HA 0.09 0.09 0.43 -0.75 4.39 4.23 2bdsA11 THR 29 HB 0.06 -0.03 -0.01 -0.04 4.32 4.30 2bdsA11 THR 29 HG23 0.06 0.03 -0.04 -0.04 1.22 1.23 2bdsA11 SER 30 H 0.13 0.08 0.14 -0.55 8.46 8.26 2bdsA11 SER 30 HA 0.07 0.16 0.79 -0.75 4.49 4.76 2bdsA11 SER 30 HB2 0.07 0.06 0.03 -0.04 3.95 4.06 2bdsA11 SER 30 HB3 0.08 -0.00 0.06 -0.04 3.93 4.02 2bdsA11 ASN 31 H 0.10 0.29 0.19 -0.55 8.53 8.56 2bdsA11 ASN 31 HA 0.06 -0.09 0.81 -0.75 4.76 4.79 2bdsA11 ASN 31 HB2 -0.59 0.09 -0.15 -0.04 2.88 2.19 2bdsA11 ASN 31 HB3 -0.27 -0.00 0.01 -0.04 2.79 2.49 2bdsA11 ASN 31 HD21 0.09 0.09 -0.20 -0.04 7.03 6.96 2bdsA11 ASN 31 HD22 -0.14 -0.02 -0.23 -0.04 7.74 7.31 2bdsA11 CYS 32 H -0.07 0.45 0.29 -0.55 8.50 8.62 2bdsA11 CYS 32 HA 0.12 0.16 0.95 -0.75 4.58 5.06 2bdsA11 CYS 32 HB2 0.00 -0.01 -0.06 -0.04 2.97 2.86 2bdsA11 CYS 32 HB3 -0.04 0.02 0.10 -0.04 2.97 3.00 2bdsA11 TYR 33 H 0.25 0.19 0.18 -0.55 8.29 8.36 2bdsA11 TYR 33 HA 0.08 0.11 0.90 -0.75 4.56 4.90 2bdsA11 TYR 33 HB2 0.01 -0.02 0.09 -0.04 3.06 3.09 2bdsA11 TYR 33 HB3 0.09 0.07 0.01 -0.04 2.98 3.12 2bdsA11 TYR 33 HD2 0.03 0.01 -0.14 -0.04 7.15 7.01 2bdsA11 TYR 33 HE2 -0.04 0.04 -0.31 -0.04 6.85 6.49 2bdsA11 LYS 34 H 0.19 0.38 -0.02 -0.55 8.42 8.41 2bdsA11 LYS 34 HA 0.15 0.10 0.67 -0.75 4.32 4.48 2bdsA11 LYS 34 HB2 0.09 0.05 0.09 -0.04 1.87 2.06 2bdsA11 LYS 34 HB3 0.08 0.03 -0.03 -0.04 1.79 1.83 2bdsA11 LYS 34 HG2 0.09 -0.00 -0.24 -0.04 1.46 1.26 2bdsA11 LYS 34 HG3 0.06 0.02 -0.11 -0.04 1.46 1.39 2bdsA11 LYS 34 HD2 0.07 -0.05 -0.60 -0.04 1.69 1.06 2bdsA11 LYS 34 HD3 0.05 -0.10 -0.17 -0.04 1.68 1.41 2bdsA11 LYS 34 HE2 0.04 0.02 -0.10 -0.04 2.99 2.91 2bdsA11 LYS 34 HE3 0.05 0.01 -0.13 -0.04 2.99 2.89 2bdsA11 TRP 35 H 0.35 0.07 -0.02 -0.55 7.97 7.82 2bdsA11 TRP 35 HA 0.06 0.15 0.20 -0.75 4.62 4.28 2bdsA11 TRP 35 HB2 0.04 -0.03 0.11 -0.04 3.23 3.31 2bdsA11 TRP 35 HB3 0.03 0.03 -0.05 -0.04 3.23 3.20 2bdsA11 TRP 35 HD1 0.10 0.19 -0.03 -0.04 7.22 7.43 2bdsA11 TRP 35 HE1 0.04 -0.09 -0.31 -0.04 10.20 9.81 2bdsA11 TRP 35 HE3 0.02 0.01 -0.03 -0.04 7.59 7.54 2bdsA11 TRP 35 HZ2 0.01 -0.04 -0.05 -0.04 7.44 7.32 2bdsA11 TRP 35 HZ3 0.01 -0.01 -0.01 -0.04 7.13 7.07 2bdsA11 TRP 35 HH2 0.01 -0.01 -0.02 -0.04 7.19 7.12 2bdsA11 PRO 36 HA -1.00 0.00 0.32 -0.51 4.44 3.26 2bdsA11 PRO 36 HB2 -0.32 0.13 0.18 -0.04 2.28 2.22 2bdsA11 PRO 36 HB3 -0.56 -0.03 0.15 -0.04 2.02 1.54 2bdsA11 PRO 36 HG2 -0.11 0.06 0.10 -0.04 2.03 2.05 2bdsA11 PRO 36 HG3 -0.12 -0.02 0.11 -0.04 2.03 1.96 2bdsA11 PRO 36 HD2 -0.01 0.12 0.34 -0.04 3.68 4.09 2bdsA11 PRO 36 HD3 0.03 0.06 0.21 -0.04 3.65 3.91 2bdsA11 ASN 37 H 0.05 0.30 -0.15 -0.55 8.53 8.19 2bdsA11 ASN 37 HA 0.03 -0.00 0.42 -0.75 4.76 4.45 2bdsA11 ASN 37 HB2 0.05 0.09 -0.04 -0.04 2.88 2.94 2bdsA11 ASN 37 HB3 0.03 0.04 0.12 -0.04 2.79 2.94 2bdsA11 ASN 37 HD21 -0.03 -0.03 -0.00 -0.04 7.03 6.93 2bdsA11 ASN 37 HD22 -0.02 -0.03 -0.05 -0.04 7.74 7.60 2bdsA11 ILE 38 H 0.09 0.57 0.21 -0.55 8.25 8.57 2bdsA11 ILE 38 HA 0.04 -0.17 0.55 -0.75 4.18 3.84 2bdsA11 ILE 38 HB 0.02 0.04 0.02 -0.04 1.89 1.93 2bdsA11 ILE 38 HG12 -0.17 -0.14 -0.41 -0.04 1.49 0.73 2bdsA11 ILE 38 HG13 -0.40 0.36 -0.26 -0.04 1.21 0.86 2bdsA11 ILE 38 HG23 0.13 0.10 -0.34 -0.04 0.93 0.77 2bdsA11 ILE 38 HD13 -0.79 -0.02 -0.36 -0.04 0.88 -0.33 2bdsA11 CYS 39 H -0.01 0.28 0.09 -0.55 8.50 8.31 2bdsA11 CYS 39 HA 0.09 0.47 0.93 -0.75 4.58 5.31 2bdsA11 CYS 39 HB2 0.19 -0.01 -0.05 -0.04 2.97 3.06 2bdsA11 CYS 39 HB3 0.06 -0.03 -0.39 -0.04 2.97 2.56 2bdsA11 CYS 40 H 0.10 0.62 0.25 -0.55 8.50 8.92 2bdsA11 CYS 40 HA -0.24 -0.03 0.57 -0.75 4.58 4.13 2bdsA11 CYS 40 HB2 -0.52 -0.00 0.04 -0.04 2.97 2.45 2bdsA11 CYS 40 HB3 -0.89 -0.03 0.13 -0.04 2.97 2.13 2bdsA11 TYR 41 H 0.13 0.09 0.47 -0.55 8.29 8.43 2bdsA11 TYR 41 HA 0.19 0.15 0.49 -0.75 4.56 4.63 2bdsA11 TYR 41 HB2 0.03 -0.06 -0.11 -0.04 3.06 2.88 2bdsA11 TYR 41 HB3 0.09 0.04 0.11 -0.04 2.98 3.17 2bdsA11 TYR 41 HD2 0.12 0.07 -0.03 -0.04 7.15 7.28 2bdsA11 TYR 41 HE2 0.18 0.02 -0.14 -0.04 6.85 6.87 2bdsA11 PRO 42 HA 0.21 0.05 0.35 -0.51 4.44 4.53 2bdsA11 PRO 42 HB2 0.07 0.02 0.02 -0.04 2.28 2.34 2bdsA11 PRO 42 HB3 0.06 0.04 0.07 -0.04 2.02 2.15 2bdsA11 PRO 42 HG2 0.09 0.11 0.11 -0.04 2.03 2.31 2bdsA11 PRO 42 HG3 0.10 -0.02 0.15 -0.04 2.03 2.22 2bdsA11 PRO 42 HD2 0.25 0.14 0.09 -0.04 3.68 4.12 2bdsA11 PRO 42 HD3 0.19 -0.34 0.61 -0.04 3.65 4.08 2bdsA11 HIS 43 H 0.18 0.09 -0.06 -0.55 8.41 8.08 2bdsA11 HIS 43 HA 0.03 0.05 0.16 -0.75 4.63 4.12 2bdsA11 HIS 43 HB2 -0.15 -0.02 -0.03 -0.04 3.26 3.03 2bdsA11 HIS 43 HB3 -0.36 -0.03 -0.38 -0.04 3.20 2.39 2bdsA11 HIS 43 HD2 0.03 -0.05 0.02 -0.04 6.97 6.92 2bdsA11 HIS 43 HE1 0.28 0.25 0.02 -0.04 7.75 8.25