============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. TYR 8 0.840 -4.644 -16.186 -51.132 -99.200 -91.000 HIS 21 0.900 -11.553 -5.985 -64.305 -99.200 -91.000 PHE 38 1.000 1.922 -4.882 -60.033 -99.200 -91.000 HIS 44 0.900 2.821 -4.443 -66.034 -99.200 -91.000 TYR 52 0.840 -7.925 -2.156 -62.205 -99.200 -91.000 PHE 57 1.000 -5.636 0.462 -52.790 -99.200 -91.000 HIS 58 0.900 -10.124 7.360 -54.292 -99.200 -91.000 HIS 70 0.900 -7.999 4.125 -41.825 -99.200 -91.000 HIS 75 0.900 -5.694 -6.671 -41.197 -99.200 -91.000 HIS 83 0.900 -6.553 -10.242 -38.903 -99.200 -91.000 HIS 88 0.900 2.966 -11.820 -40.301 -99.200 -91.000 TYR 95 0.840 4.358 4.914 -41.588 -99.200 -91.000 PHE 106 1.000 3.690 0.509 -59.644 -99.200 -91.000 TRP 107 1.040 5.830 3.188 -51.913 -99.200 -91.000 TRP6 107 1.020 5.214 2.219 -49.840 -99.200 -91.000 HIS 109 0.900 -2.531 -3.042 -55.508 -99.200 -91.000 TRP 112 1.040 0.318 -4.254 -49.671 -99.200 -91.000 TRP6 112 1.020 -1.711 -3.384 -50.533 -99.200 -91.000 HIS 119 0.900 0.298 -16.738 -49.540 -99.200 -91.000 TYR 120 0.840 -0.061 -8.047 -55.617 -99.200 -91.000 PHE 121 1.000 -5.995 -11.224 -54.337 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 2erbB1 THR 3 HA 0.00 0.01 0.21 -0.75 4.39 3.86 2erbB1 THR 3 HB -0.01 -0.09 0.01 -0.04 4.32 4.20 2erbB1 THR 3 HG23 -0.00 0.04 -0.08 -0.04 1.22 1.14 2erbB1 PRO 4 HA -0.01 0.05 0.69 -0.51 4.44 4.66 2erbB1 PRO 4 HB2 0.07 0.05 0.01 -0.04 2.28 2.38 2erbB1 PRO 4 HB3 0.08 0.22 0.18 -0.04 2.02 2.46 2erbB1 PRO 4 HG2 0.03 -0.12 0.06 -0.04 2.03 1.97 2erbB1 PRO 4 HG3 0.05 0.07 0.16 -0.04 2.03 2.27 2erbB1 PRO 4 HD2 0.01 -0.06 0.19 -0.04 3.68 3.79 2erbB1 PRO 4 HD3 0.02 0.19 0.19 -0.04 3.65 4.01 2erbB1 ARG 5 H -0.09 0.81 0.37 -0.55 8.46 9.00 2erbB1 ARG 5 HA -0.03 -0.01 0.65 -0.75 4.34 4.19 2erbB1 ARG 5 HB2 -0.28 -0.04 0.06 -0.04 1.90 1.61 2erbB1 ARG 5 HB3 -0.22 0.07 0.13 -0.04 1.80 1.75 2erbB1 ARG 5 HG2 0.09 0.02 -0.28 -0.04 1.67 1.46 2erbB1 ARG 5 HG3 -0.03 -0.05 -0.03 -0.04 1.67 1.52 2erbB1 ARG 5 HD2 -0.09 -0.00 -0.04 -0.04 3.22 3.04 2erbB1 ARG 5 HD3 -0.26 0.01 -0.07 -0.04 3.22 2.86 2erbB1 ARG 6 H 0.01 0.17 0.08 -0.55 8.46 8.17 2erbB1 ARG 6 HA 0.01 0.29 0.85 -0.75 4.34 4.74 2erbB1 ARG 6 HB2 0.01 -0.06 0.16 -0.04 1.90 1.97 2erbB1 ARG 6 HB3 -0.01 -0.06 0.06 -0.04 1.80 1.75 2erbB1 ARG 6 HG2 0.03 0.04 -0.76 -0.04 1.67 0.94 2erbB1 ARG 6 HG3 0.02 -0.07 -0.11 -0.04 1.67 1.48 2erbB1 ARG 6 HD2 -0.01 -0.13 0.01 -0.04 3.22 3.04 2erbB1 ARG 6 HD3 0.02 0.30 0.09 -0.04 3.22 3.59 2erbB1 ASP 7 H 0.02 0.75 0.23 -0.55 8.40 8.85 2erbB1 ASP 7 HA -0.00 0.18 0.68 -0.75 4.63 4.73 2erbB1 ASP 7 HB2 0.01 -0.15 0.21 -0.04 2.71 2.74 2erbB1 ASP 7 HB3 0.01 0.14 -0.07 -0.04 2.70 2.73 2erbB1 ALA 8 H 0.00 0.13 0.14 -0.55 8.40 8.13 2erbB1 ALA 8 HA -0.02 0.13 0.34 -0.75 4.34 4.04 2erbB1 ALA 8 HB3 -0.00 -0.00 0.10 -0.04 1.41 1.47 2erbB1 GLU 9 H 0.02 -0.03 -0.32 -0.55 8.60 7.72 2erbB1 GLU 9 HA 0.00 0.21 0.90 -0.75 4.29 4.65 2erbB1 GLU 9 HB2 0.03 -0.07 -0.01 -0.04 2.09 2.00 2erbB1 GLU 9 HB3 0.07 0.04 -0.09 -0.04 1.99 1.97 2erbB1 GLU 9 HG2 0.03 -0.01 -0.00 -0.04 2.34 2.32 2erbB1 GLU 9 HG3 0.04 -0.01 0.08 -0.04 2.34 2.40 2erbB1 TYR 10 H 0.06 0.08 -0.17 -0.55 8.29 7.71 2erbB1 TYR 10 HA -0.08 -0.01 0.48 -0.75 4.56 4.20 2erbB1 TYR 10 HB2 0.01 -0.05 -0.28 -0.04 3.06 2.70 2erbB1 TYR 10 HB3 -0.01 -0.04 -0.07 -0.04 2.98 2.82 2erbB1 TYR 10 HD2 -0.00 0.07 -0.17 -0.04 7.15 7.01 2erbB1 TYR 10 HE2 0.12 0.08 0.03 -0.04 6.85 7.04 2erbB1 PRO 11 HA -1.85 0.09 0.34 -0.51 4.44 2.50 2erbB1 PRO 11 HB2 -0.93 -0.05 -0.10 -0.04 2.28 1.15 2erbB1 PRO 11 HB3 -2.01 0.03 0.02 -0.04 2.02 0.02 2erbB1 PRO 11 HG2 -0.89 -0.03 0.01 -0.04 2.03 1.08 2erbB1 PRO 11 HG3 -0.87 0.18 0.01 -0.04 2.03 1.31 2erbB1 PRO 11 HD2 -0.33 -0.01 0.23 -0.04 3.68 3.52 2erbB1 PRO 11 HD3 -0.18 0.35 0.41 -0.04 3.65 4.19 2erbB1 PRO 12 HA -0.10 0.29 0.46 -0.51 4.44 4.58 2erbB1 PRO 12 HB2 -0.08 -0.16 0.17 -0.04 2.28 2.17 2erbB1 PRO 12 HB3 -0.04 0.00 0.15 -0.04 2.02 2.09 2erbB1 PRO 12 HG2 -0.02 0.03 0.11 -0.04 2.03 2.11 2erbB1 PRO 12 HG3 -0.01 0.09 0.11 -0.04 2.03 2.18 2erbB1 PRO 12 HD2 -0.39 0.09 0.15 -0.04 3.68 3.49 2erbB1 PRO 12 HD3 -0.75 0.16 0.22 -0.04 3.65 3.25 2erbB1 PRO 13 HA -0.10 0.09 0.44 -0.51 4.44 4.36 2erbB1 PRO 13 HB2 -0.04 -0.03 0.03 -0.04 2.28 2.20 2erbB1 PRO 13 HB3 -0.06 0.11 0.12 -0.04 2.02 2.15 2erbB1 PRO 13 HG2 -0.03 -0.10 0.15 -0.04 2.03 2.00 2erbB1 PRO 13 HG3 -0.04 0.18 0.16 -0.04 2.03 2.29 2erbB1 PRO 13 HD2 -0.05 0.04 0.28 -0.04 3.68 3.91 2erbB1 PRO 13 HD3 -0.08 0.35 0.08 -0.04 3.65 3.97 2erbB1 GLU 14 H -0.04 0.14 -0.15 -0.55 8.60 8.00 2erbB1 GLU 14 HA -0.02 0.09 0.43 -0.75 4.29 4.04 2erbB1 GLU 14 HB2 -0.01 0.06 -0.09 -0.04 2.09 2.01 2erbB1 GLU 14 HB3 -0.01 0.04 0.09 -0.04 1.99 2.07 2erbB1 GLU 14 HG2 -0.01 0.03 0.04 -0.04 2.34 2.36 2erbB1 GLU 14 HG3 -0.02 0.01 0.07 -0.04 2.34 2.36 2erbB1 LEU 15 H -0.05 0.20 -0.31 -0.55 8.37 7.66 2erbB1 LEU 15 HA 0.01 0.12 0.54 -0.75 4.35 4.27 2erbB1 LEU 15 HB2 0.01 -0.04 0.10 -0.04 1.64 1.67 2erbB1 LEU 15 HB3 -0.06 0.15 0.12 -0.04 1.64 1.81 2erbB1 LEU 15 HG 0.11 -0.02 -0.27 -0.04 1.64 1.42 2erbB1 LEU 15 HD13 0.07 0.01 0.03 -0.04 0.93 0.99 2erbB1 LEU 15 HD23 0.17 0.00 -0.00 -0.04 0.89 1.02 2erbB1 LEU 16 H -0.09 0.47 -0.10 -0.55 8.37 8.09 2erbB1 LEU 16 HA -0.01 0.01 0.37 -0.75 4.35 3.97 2erbB1 LEU 16 HB2 -0.09 0.09 0.09 -0.04 1.64 1.69 2erbB1 LEU 16 HB3 -0.07 -0.04 -0.04 -0.04 1.64 1.46 2erbB1 LEU 16 HG -0.26 0.12 -0.21 -0.04 1.64 1.25 2erbB1 LEU 16 HD13 -0.19 0.01 -0.13 -0.04 0.93 0.57 2erbB1 LEU 16 HD23 -0.23 -0.01 -0.11 -0.04 0.89 0.50 2erbB1 GLU 17 H -0.03 0.53 -0.22 -0.55 8.60 8.33 2erbB1 GLU 17 HA -0.01 0.01 0.42 -0.75 4.29 3.96 2erbB1 GLU 17 HB2 -0.02 0.02 0.11 -0.04 2.09 2.16 2erbB1 GLU 17 HB3 -0.01 0.08 0.14 -0.04 1.99 2.16 2erbB1 GLU 17 HG2 0.00 0.02 -0.19 -0.04 2.34 2.13 2erbB1 GLU 17 HG3 -0.00 -0.04 0.04 -0.04 2.34 2.29 2erbB1 ALA 18 H 0.01 0.43 -0.19 -0.55 8.40 8.10 2erbB1 ALA 18 HA 0.02 0.00 0.46 -0.75 4.34 4.07 2erbB1 ALA 18 HB3 0.02 0.02 0.13 -0.04 1.41 1.55 2erbB1 LEU 19 H 0.03 0.40 -0.41 -0.55 8.37 7.86 2erbB1 LEU 19 HA 0.06 0.06 0.57 -0.75 4.35 4.28 2erbB1 LEU 19 HB2 0.07 0.16 0.12 -0.04 1.64 1.95 2erbB1 LEU 19 HB3 0.10 -0.15 0.03 -0.04 1.64 1.57 2erbB1 LEU 19 HG 0.08 0.13 -0.03 -0.04 1.64 1.78 2erbB1 LEU 19 HD13 0.18 -0.04 -0.11 -0.04 0.93 0.92 2erbB1 LEU 19 HD23 0.06 -0.02 -0.02 -0.04 0.89 0.87 2erbB1 LYS 20 H 0.04 0.41 -0.27 -0.55 8.42 8.04 2erbB1 LYS 20 HA 0.08 -0.02 0.31 -0.75 4.32 3.94 2erbB1 LYS 20 HB2 0.03 0.23 0.17 -0.04 1.87 2.26 2erbB1 LYS 20 HB3 0.04 -0.10 -0.00 -0.04 1.79 1.68 2erbB1 LYS 20 HG2 -0.02 -0.07 0.04 -0.04 1.46 1.37 2erbB1 LYS 20 HG3 0.00 0.24 0.12 -0.04 1.46 1.78 2erbB1 LYS 20 HD2 0.00 0.04 0.06 -0.04 1.69 1.75 2erbB1 LYS 20 HD3 0.00 -0.06 0.01 -0.04 1.68 1.59 2erbB1 LYS 20 HE2 -0.03 -0.03 -0.03 -0.04 2.99 2.86 2erbB1 LYS 20 HE3 -0.02 0.03 -0.11 -0.04 2.99 2.85 2erbB1 PRO 21 HA 0.06 0.02 0.49 -0.51 4.44 4.50 2erbB1 PRO 21 HB2 0.04 0.08 -0.03 -0.04 2.28 2.33 2erbB1 PRO 21 HB3 0.03 -0.01 0.08 -0.04 2.02 2.08 2erbB1 PRO 21 HG2 0.03 0.08 0.06 -0.04 2.03 2.17 2erbB1 PRO 21 HG3 0.03 -0.02 0.05 -0.04 2.03 2.06 2erbB1 PRO 21 HD2 0.04 0.43 -0.23 -0.04 3.68 3.88 2erbB1 PRO 21 HD3 0.04 0.22 0.10 -0.04 3.65 3.96 2erbB1 LEU 22 H 0.07 0.37 -0.30 -0.55 8.37 7.96 2erbB1 LEU 22 HA 0.03 0.03 0.51 -0.75 4.35 4.16 2erbB1 LEU 22 HB2 0.05 0.18 0.15 -0.04 1.64 1.98 2erbB1 LEU 22 HB3 -0.01 -0.08 0.00 -0.04 1.64 1.52 2erbB1 LEU 22 HG 0.03 -0.04 -0.05 -0.04 1.64 1.54 2erbB1 LEU 22 HD13 0.04 0.02 0.01 -0.04 0.93 0.95 2erbB1 LEU 22 HD23 0.03 0.03 -0.11 -0.04 0.89 0.79 2erbB1 HIS 23 H 0.19 0.62 -0.07 -0.55 8.41 8.60 2erbB1 HIS 23 HA 0.24 -0.04 0.40 -0.75 4.63 4.47 2erbB1 HIS 23 HB2 0.15 0.04 0.05 -0.04 3.26 3.47 2erbB1 HIS 23 HB3 0.08 0.20 0.18 -0.04 3.20 3.62 2erbB1 HIS 23 HD2 0.05 0.01 -0.16 -0.04 6.97 6.83 2erbB1 HIS 23 HE1 -0.08 -0.11 -0.08 -0.04 7.75 7.44 2erbB1 ASP 24 H 0.16 0.52 -0.14 -0.55 8.40 8.38 2erbB1 ASP 24 HA -0.02 -0.01 0.36 -0.75 4.63 4.20 2erbB1 ASP 24 HB2 0.06 0.14 0.16 -0.04 2.71 3.03 2erbB1 ASP 24 HB3 0.04 -0.04 0.01 -0.04 2.70 2.67 2erbB1 ILE 25 H 0.03 0.48 -0.16 -0.55 8.25 8.05 2erbB1 ILE 25 HA 0.01 0.01 0.41 -0.75 4.18 3.86 2erbB1 ILE 25 HB 0.01 0.10 0.20 -0.04 1.89 2.15 2erbB1 ILE 25 HG12 0.01 -0.06 0.05 -0.04 1.49 1.45 2erbB1 ILE 25 HG13 0.02 0.12 0.13 -0.04 1.21 1.43 2erbB1 ILE 25 HG23 0.00 -0.02 -0.13 -0.04 0.93 0.74 2erbB1 ILE 25 HD13 0.02 -0.01 0.00 -0.04 0.88 0.85 2erbB1 CYS 26 H -0.00 0.74 -0.06 -0.55 8.50 8.63 2erbB1 CYS 26 HA 0.00 0.01 0.43 -0.75 4.58 4.27 2erbB1 CYS 26 HB2 -0.13 0.12 0.11 -0.04 2.97 3.02 2erbB1 CYS 26 HB3 -0.20 -0.08 0.05 -0.04 2.97 2.70 2erbB1 LEU 27 H -0.01 0.86 -0.03 -0.55 8.37 8.64 2erbB1 LEU 27 HA -0.00 -0.09 0.47 -0.75 4.35 3.97 2erbB1 LEU 27 HB2 -0.48 -0.03 0.03 -0.04 1.64 1.12 2erbB1 LEU 27 HB3 -0.31 0.13 0.08 -0.04 1.64 1.50 2erbB1 LEU 27 HG -0.13 0.08 -0.01 -0.04 1.64 1.53 2erbB1 LEU 27 HD13 -0.12 -0.05 -0.16 -0.04 0.93 0.55 2erbB1 LEU 27 HD23 -0.06 0.00 -0.28 -0.04 0.89 0.51 2erbB1 GLY 28 H -0.04 0.53 -0.22 -0.55 8.43 8.16 2erbB1 GLY 28 HA2 -0.02 -0.01 0.41 -0.51 4.01 3.88 2erbB1 GLY 28 HA3 -0.01 0.09 0.33 -0.51 4.01 3.91 2erbB1 LYS 29 H 0.00 0.47 -0.13 -0.55 8.42 8.21 2erbB1 LYS 29 HA -0.00 0.06 0.47 -0.75 4.32 4.09 2erbB1 LYS 29 HB2 0.00 0.04 0.11 -0.04 1.87 1.98 2erbB1 LYS 29 HB3 -0.01 -0.07 -0.02 -0.04 1.79 1.65 2erbB1 LYS 29 HG2 -0.00 -0.05 0.02 -0.04 1.46 1.39 2erbB1 LYS 29 HG3 -0.00 0.20 0.07 -0.04 1.46 1.69 2erbB1 LYS 29 HD2 -0.01 -0.01 -0.06 -0.04 1.69 1.57 2erbB1 LYS 29 HD3 -0.01 -0.05 -0.01 -0.04 1.68 1.56 2erbB1 LYS 29 HE2 -0.00 -0.02 -0.01 -0.04 2.99 2.92 2erbB1 LYS 29 HE3 -0.00 0.01 -0.02 -0.04 2.99 2.94 2erbB1 THR 30 H 0.03 0.41 -0.16 -0.55 8.28 8.01 2erbB1 THR 30 HA 0.01 0.15 0.80 -0.75 4.39 4.59 2erbB1 THR 30 HB 0.03 -0.10 0.08 -0.04 4.32 4.30 2erbB1 THR 30 HG23 0.04 -0.01 -0.20 -0.04 1.22 1.02 2erbB1 GLY 31 H -0.01 0.61 -0.03 -0.55 8.43 8.46 2erbB1 GLY 31 HA2 -0.02 0.08 0.32 -0.51 4.01 3.89 2erbB1 GLY 31 HA3 -0.01 0.06 0.53 -0.51 4.01 4.08 2erbB1 VAL 32 H -0.03 0.06 -0.24 -0.55 8.24 7.48 2erbB1 VAL 32 HA -0.03 -0.02 0.40 -0.75 4.13 3.72 2erbB1 VAL 32 HB -0.05 0.04 -0.26 -0.04 2.12 1.81 2erbB1 VAL 32 HG13 -0.36 0.02 -0.19 -0.04 0.97 0.39 2erbB1 VAL 32 HG23 -0.10 0.00 -0.06 -0.04 0.95 0.75 2erbB1 THR 33 H -0.03 0.02 0.14 -0.55 8.28 7.86 2erbB1 THR 33 HA -0.03 0.35 0.91 -0.75 4.39 4.86 2erbB1 THR 33 HB -0.01 -0.07 0.13 -0.04 4.32 4.33 2erbB1 THR 33 HG23 -0.01 0.06 -0.00 -0.04 1.22 1.22 2erbB1 GLU 34 H 0.00 0.24 0.14 -0.55 8.60 8.44 2erbB1 GLU 34 HA 0.03 0.14 0.40 -0.75 4.29 4.11 2erbB1 GLU 34 HB2 0.02 -0.03 0.11 -0.04 2.09 2.15 2erbB1 GLU 34 HB3 0.02 0.07 0.01 -0.04 1.99 2.05 2erbB1 GLU 34 HG2 0.18 0.06 0.01 -0.04 2.34 2.55 2erbB1 GLU 34 HG3 0.07 -0.00 0.06 -0.04 2.34 2.42 2erbB1 GLU 35 H 0.01 0.08 -0.14 -0.55 8.60 8.00 2erbB1 GLU 35 HA 0.02 0.14 0.38 -0.75 4.29 4.07 2erbB1 GLU 35 HB2 0.00 0.04 0.07 -0.04 2.09 2.17 2erbB1 GLU 35 HB3 -0.00 -0.05 0.04 -0.04 1.99 1.94 2erbB1 GLU 35 HG2 -0.02 0.01 -0.20 -0.04 2.34 2.09 2erbB1 GLU 35 HG3 -0.00 0.04 0.02 -0.04 2.34 2.36 2erbB1 ALA 36 H 0.02 0.06 -0.34 -0.55 8.40 7.60 2erbB1 ALA 36 HA 0.09 0.10 0.34 -0.75 4.34 4.11 2erbB1 ALA 36 HB3 0.12 0.02 0.06 -0.04 1.41 1.57 2erbB1 ILE 37 H 0.02 0.32 -0.29 -0.55 8.25 7.75 2erbB1 ILE 37 HA 0.10 0.03 0.38 -0.75 4.18 3.93 2erbB1 ILE 37 HB -0.00 0.15 0.15 -0.04 1.89 2.14 2erbB1 ILE 37 HG12 -0.37 -0.03 -0.08 -0.04 1.49 0.97 2erbB1 ILE 37 HG13 -0.24 -0.05 -0.05 -0.04 1.21 0.83 2erbB1 ILE 37 HG23 0.09 0.02 -0.28 -0.04 0.93 0.73 2erbB1 ILE 37 HD13 -0.51 -0.01 -0.14 -0.04 0.88 0.18 2erbB1 LYS 38 H 0.07 0.53 -0.05 -0.55 8.42 8.42 2erbB1 LYS 38 HA 0.11 0.12 0.40 -0.75 4.32 4.19 2erbB1 LYS 38 HB2 0.04 0.01 0.09 -0.04 1.87 1.97 2erbB1 LYS 38 HB3 0.05 -0.00 0.07 -0.04 1.79 1.86 2erbB1 LYS 38 HG2 0.05 0.00 -0.14 -0.04 1.46 1.33 2erbB1 LYS 38 HG3 0.06 0.04 0.07 -0.04 1.46 1.59 2erbB1 LYS 38 HD2 0.02 -0.01 -0.02 -0.04 1.69 1.64 2erbB1 LYS 38 HD3 0.02 -0.05 -0.04 -0.04 1.68 1.57 2erbB1 LYS 38 HE2 0.02 0.02 -0.04 -0.04 2.99 2.95 2erbB1 LYS 38 HE3 0.02 0.05 -0.02 -0.04 2.99 3.00 2erbB1 LYS 39 H 0.12 0.52 -0.23 -0.55 8.42 8.28 2erbB1 LYS 39 HA 0.08 0.01 0.41 -0.75 4.32 4.06 2erbB1 LYS 39 HB2 -0.01 0.00 0.07 -0.04 1.87 1.90 2erbB1 LYS 39 HB3 0.06 0.03 0.06 -0.04 1.79 1.90 2erbB1 LYS 39 HG2 0.02 0.16 -0.17 -0.04 1.46 1.43 2erbB1 LYS 39 HG3 0.00 -0.06 0.04 -0.04 1.46 1.40 2erbB1 LYS 39 HD2 -0.09 -0.02 -0.03 -0.04 1.69 1.51 2erbB1 LYS 39 HD3 -0.12 -0.04 -0.04 -0.04 1.68 1.45 2erbB1 LYS 39 HE2 -0.41 -0.08 -0.06 -0.04 2.99 2.39 2erbB1 LYS 39 HE3 -0.99 0.06 -0.10 -0.04 2.99 1.92 2erbB1 PHE 40 H 0.44 0.39 -0.23 -0.55 8.34 8.38 2erbB1 PHE 40 HA 0.21 0.15 0.27 -0.75 4.62 4.50 2erbB1 PHE 40 HB2 0.09 -0.04 0.09 -0.04 3.15 3.24 2erbB1 PHE 40 HB3 0.15 0.04 0.02 -0.04 3.06 3.23 2erbB1 PHE 40 HD2 0.04 -0.01 -0.12 -0.04 7.28 7.15 2erbB1 PHE 40 HE2 -0.08 0.03 -0.08 -0.04 7.38 7.21 2erbB1 PHE 40 HZ -0.44 -0.04 -0.14 -0.04 7.32 6.66 2erbB1 SER 41 H 0.30 0.42 -0.22 -0.55 8.46 8.42 2erbB1 SER 41 HA 0.45 0.00 0.35 -0.75 4.49 4.54 2erbB1 SER 41 HB2 0.22 0.06 0.20 -0.04 3.95 4.39 2erbB1 SER 41 HB3 0.17 0.02 0.21 -0.04 3.93 4.29 2erbB1 ASP 42 H 0.13 0.48 -0.05 -0.55 8.40 8.41 2erbB1 ASP 42 HA 0.10 0.29 0.88 -0.75 4.63 5.15 2erbB1 ASP 42 HB2 0.06 -0.01 0.03 -0.04 2.71 2.74 2erbB1 ASP 42 HB3 0.05 -0.05 0.04 -0.04 2.70 2.70 2erbB1 GLU 43 H 0.07 0.44 -0.08 -0.55 8.60 8.48 2erbB1 GLU 43 HA 0.01 0.16 0.88 -0.75 4.29 4.59 2erbB1 GLU 43 HB2 0.03 0.09 0.20 -0.04 2.09 2.37 2erbB1 GLU 43 HB3 0.01 -0.17 0.21 -0.04 1.99 2.00 2erbB1 GLU 43 HG2 0.02 0.06 -0.08 -0.04 2.34 2.30 2erbB1 GLU 43 HG3 0.04 -0.03 -0.24 -0.04 2.34 2.06 2erbB1 GLU 44 H 0.01 -0.03 0.10 -0.55 8.60 8.14 2erbB1 GLU 44 HA -0.06 0.18 0.55 -0.75 4.29 4.21 2erbB1 GLU 44 HB2 0.02 -0.08 0.05 -0.04 2.09 2.03 2erbB1 GLU 44 HB3 0.00 0.10 0.01 -0.04 1.99 2.06 2erbB1 GLU 44 HG2 -0.02 0.07 -0.02 -0.04 2.34 2.33 2erbB1 GLU 44 HG3 -0.00 -0.05 0.02 -0.04 2.34 2.27 2erbB1 ILE 45 H -0.13 0.10 0.14 -0.55 8.25 7.81 2erbB1 ILE 45 HA -0.57 0.09 0.45 -0.75 4.18 3.39 2erbB1 ILE 45 HB -0.09 -0.05 0.12 -0.04 1.89 1.83 2erbB1 ILE 45 HG12 -0.63 0.01 0.05 -0.04 1.49 0.88 2erbB1 ILE 45 HG13 -0.39 0.10 0.06 -0.04 1.21 0.94 2erbB1 ILE 45 HG23 0.13 -0.03 -0.18 -0.04 0.93 0.82 2erbB1 ILE 45 HD13 -0.20 -0.00 0.00 -0.04 0.88 0.64 2erbB1 HIS 46 H 0.31 0.23 0.21 -0.55 8.41 8.62 2erbB1 HIS 46 HA 0.13 0.13 0.62 -0.75 4.63 4.75 2erbB1 HIS 46 HB2 0.09 -0.07 0.05 -0.04 3.26 3.29 2erbB1 HIS 46 HB3 0.09 0.16 -0.25 -0.04 3.20 3.15 2erbB1 HIS 46 HD2 0.20 0.31 -0.20 -0.04 6.97 7.23 2erbB1 HIS 46 HE1 0.07 -0.17 -0.08 -0.04 7.75 7.52 2erbB1 GLU 47 H 0.18 0.21 0.10 -0.55 8.60 8.55 2erbB1 GLU 47 HA -0.17 0.12 0.76 -0.75 4.29 4.24 2erbB1 GLU 47 HB2 0.03 0.02 0.16 -0.04 2.09 2.26 2erbB1 GLU 47 HB3 -0.08 -0.04 -0.01 -0.04 1.99 1.83 2erbB1 GLU 47 HG2 0.09 0.00 -0.15 -0.04 2.34 2.24 2erbB1 GLU 47 HG3 0.03 0.03 -0.02 -0.04 2.34 2.34 2erbB1 ASP 48 H -0.22 0.34 0.05 -0.55 8.40 8.02 2erbB1 ASP 48 HA 0.01 0.15 0.63 -0.75 4.63 4.67 2erbB1 ASP 48 HB2 0.25 0.17 -0.15 -0.04 2.71 2.93 2erbB1 ASP 48 HB3 -0.03 0.01 0.08 -0.04 2.70 2.72 2erbB1 GLU 49 H -0.05 0.26 0.10 -0.55 8.60 8.36 2erbB1 GLU 49 HA -0.14 0.09 0.46 -0.75 4.29 3.94 2erbB1 GLU 49 HB2 -0.04 0.04 0.12 -0.04 2.09 2.17 2erbB1 GLU 49 HB3 -0.05 0.04 0.04 -0.04 1.99 1.98 2erbB1 GLU 49 HG2 -0.07 -0.01 0.03 -0.04 2.34 2.25 2erbB1 GLU 49 HG3 -0.05 0.08 0.03 -0.04 2.34 2.36 2erbB1 LYS 50 H -0.03 0.12 -0.11 -0.55 8.42 7.85 2erbB1 LYS 50 HA -0.01 0.15 0.47 -0.75 4.32 4.17 2erbB1 LYS 50 HB2 -0.01 -0.08 -0.03 -0.04 1.87 1.71 2erbB1 LYS 50 HB3 -0.01 0.06 -0.18 -0.04 1.79 1.62 2erbB1 LYS 50 HG2 -0.01 0.15 0.04 -0.04 1.46 1.61 2erbB1 LYS 50 HG3 -0.01 -0.16 0.01 -0.04 1.46 1.25 2erbB1 LYS 50 HD2 -0.01 -0.09 -0.05 -0.04 1.69 1.50 2erbB1 LYS 50 HD3 -0.01 0.16 -0.17 -0.04 1.68 1.61 2erbB1 LYS 50 HE2 -0.01 0.10 0.03 -0.04 2.99 3.08 2erbB1 LYS 50 HE3 -0.01 -0.11 0.01 -0.04 2.99 2.84 2erbB1 LEU 51 H -0.04 0.08 -0.38 -0.55 8.37 7.48 2erbB1 LEU 51 HA -0.00 0.06 0.42 -0.75 4.35 4.08 2erbB1 LEU 51 HB2 -0.03 -0.08 0.01 -0.04 1.64 1.50 2erbB1 LEU 51 HB3 -0.12 0.18 0.10 -0.04 1.64 1.76 2erbB1 LEU 51 HG -0.19 -0.00 -0.22 -0.04 1.64 1.19 2erbB1 LEU 51 HD13 -0.06 -0.01 -0.11 -0.04 0.93 0.71 2erbB1 LEU 51 HD23 -0.33 0.04 -0.07 -0.04 0.89 0.49 2erbB1 LYS 52 H -0.10 0.33 -0.18 -0.55 8.42 7.92 2erbB1 LYS 52 HA 0.04 0.08 0.45 -0.75 4.32 4.13 2erbB1 LYS 52 HB2 -0.07 0.11 0.12 -0.04 1.87 1.98 2erbB1 LYS 52 HB3 0.00 0.07 -0.06 -0.04 1.79 1.77 2erbB1 LYS 52 HG2 -0.51 0.03 0.06 -0.04 1.46 1.00 2erbB1 LYS 52 HG3 -0.34 0.14 0.10 -0.04 1.46 1.32 2erbB1 LYS 52 HD2 -0.23 -0.05 -0.02 -0.04 1.69 1.34 2erbB1 LYS 52 HD3 -0.27 0.01 -0.02 -0.04 1.68 1.36 2erbB1 LYS 52 HE2 -1.94 0.08 -0.01 -0.04 2.99 1.08 2erbB1 LYS 52 HE3 -0.61 -0.11 -0.12 -0.04 2.99 2.11 2erbB1 CYS 53 H -0.00 0.39 -0.19 -0.55 8.50 8.15 2erbB1 CYS 53 HA 0.02 -0.03 0.55 -0.75 4.58 4.37 2erbB1 CYS 53 HB2 0.01 0.12 0.16 -0.04 2.97 3.22 2erbB1 CYS 53 HB3 0.00 0.03 0.06 -0.04 2.97 3.02 2erbB1 TYR 54 H 0.11 0.43 -0.25 -0.55 8.29 8.03 2erbB1 TYR 54 HA -0.05 0.06 0.42 -0.75 4.56 4.23 2erbB1 TYR 54 HB2 -0.06 -0.01 0.05 -0.04 3.06 3.00 2erbB1 TYR 54 HB3 -0.08 0.12 0.17 -0.04 2.98 3.15 2erbB1 TYR 54 HD2 -0.10 0.06 -0.31 -0.04 7.15 6.76 2erbB1 TYR 54 HE2 -0.09 0.01 -0.06 -0.04 6.85 6.67 2erbB1 MET 55 H -0.00 0.54 -0.23 -0.55 8.47 8.23 2erbB1 MET 55 HA -0.39 0.02 0.35 -0.75 4.52 3.75 2erbB1 MET 55 HB2 -0.02 0.15 0.12 -0.04 2.15 2.35 2erbB1 MET 55 HB3 -0.10 -0.00 -0.08 -0.04 2.03 1.80 2erbB1 MET 55 HG2 -0.82 -0.01 -0.01 -0.04 2.63 1.75 2erbB1 MET 55 HG3 -0.16 0.06 0.03 -0.04 2.56 2.45 2erbB1 MET 55 HE3 -0.99 0.01 -0.07 -0.04 2.10 1.01 2erbB1 ASN 56 H 0.02 0.40 -0.15 -0.55 8.53 8.25 2erbB1 ASN 56 HA 0.35 0.04 0.43 -0.75 4.76 4.82 2erbB1 ASN 56 HB2 0.13 -0.02 -0.02 -0.04 2.88 2.93 2erbB1 ASN 56 HB3 0.05 0.11 0.12 -0.04 2.79 3.03 2erbB1 ASN 56 HD21 -0.17 0.01 -0.09 -0.04 7.03 6.75 2erbB1 ASN 56 HD22 -0.05 0.03 -0.09 -0.04 7.74 7.60 2erbB1 CYS 57 H -0.05 0.61 -0.19 -0.55 8.50 8.32 2erbB1 CYS 57 HA 0.00 -0.02 0.39 -0.75 4.58 4.20 2erbB1 CYS 57 HB2 -0.05 0.03 0.13 -0.04 2.97 3.03 2erbB1 CYS 57 HB3 -0.17 0.14 0.21 -0.04 2.97 3.11 2erbB1 LEU 58 H -0.32 0.59 -0.16 -0.55 8.37 7.93 2erbB1 LEU 58 HA -0.14 0.00 0.36 -0.75 4.35 3.82 2erbB1 LEU 58 HB2 -0.43 0.13 0.10 -0.04 1.64 1.40 2erbB1 LEU 58 HB3 -0.19 -0.02 -0.03 -0.04 1.64 1.36 2erbB1 LEU 58 HG -0.97 0.15 -0.01 -0.04 1.64 0.77 2erbB1 LEU 58 HD13 -0.24 -0.02 -0.05 -0.04 0.93 0.58 2erbB1 LEU 58 HD23 -0.19 -0.01 -0.16 -0.04 0.89 0.50 2erbB1 PHE 59 H -0.05 0.43 -0.26 -0.55 8.34 7.90 2erbB1 PHE 59 HA 0.06 0.04 0.34 -0.75 4.62 4.31 2erbB1 PHE 59 HB2 0.10 0.15 0.12 -0.04 3.15 3.48 2erbB1 PHE 59 HB3 0.02 -0.08 -0.13 -0.04 3.06 2.83 2erbB1 PHE 59 HD2 0.13 -0.03 -0.03 -0.04 7.28 7.31 2erbB1 PHE 59 HE2 0.24 -0.01 -0.01 -0.04 7.38 7.55 2erbB1 PHE 59 HZ -0.02 0.01 -0.02 -0.04 7.32 7.25 2erbB1 HIS 60 H 0.33 0.49 -0.14 -0.55 8.41 8.55 2erbB1 HIS 60 HA 0.09 -0.02 0.46 -0.75 4.63 4.40 2erbB1 HIS 60 HB2 0.04 0.10 0.17 -0.04 3.26 3.53 2erbB1 HIS 60 HB3 0.04 -0.03 -0.02 -0.04 3.20 3.15 2erbB1 HIS 60 HD2 0.12 0.32 0.02 -0.04 6.97 7.38 2erbB1 HIS 60 HE1 0.03 -0.03 -0.00 -0.04 7.75 7.71 2erbB1 GLU 61 H 0.11 0.69 -0.01 -0.55 8.60 8.85 2erbB1 GLU 61 HA 0.06 0.02 0.43 -0.75 4.29 4.05 2erbB1 GLU 61 HB2 0.01 0.07 0.13 -0.04 2.09 2.26 2erbB1 GLU 61 HB3 0.03 -0.04 0.05 -0.04 1.99 1.99 2erbB1 GLU 61 HG2 0.03 0.07 0.06 -0.04 2.34 2.47 2erbB1 GLU 61 HG3 0.00 -0.06 0.01 -0.04 2.34 2.25 2erbB1 ALA 62 H 0.08 0.42 -0.38 -0.55 8.40 7.98 2erbB1 ALA 62 HA 0.05 0.09 0.55 -0.75 4.34 4.28 2erbB1 ALA 62 HB3 0.10 -0.02 0.05 -0.04 1.41 1.50 2erbB1 LYS 63 H 0.06 0.36 -0.58 -0.55 8.42 7.70 2erbB1 LYS 63 HA 0.01 -0.00 0.35 -0.75 4.32 3.92 2erbB1 LYS 63 HB2 0.02 0.18 -0.10 -0.04 1.87 1.93 2erbB1 LYS 63 HB3 0.01 -0.09 0.19 -0.04 1.79 1.85 2erbB1 LYS 63 HG2 0.03 0.16 -0.24 -0.04 1.46 1.38 2erbB1 LYS 63 HG3 0.02 -0.07 -0.05 -0.04 1.46 1.32 2erbB1 LYS 63 HD2 0.02 -0.09 0.04 -0.04 1.69 1.61 2erbB1 LYS 63 HD3 0.03 0.14 0.10 -0.04 1.68 1.90 2erbB1 LYS 63 HE2 0.04 0.07 0.03 -0.04 2.99 3.09 2erbB1 LYS 63 HE3 0.03 -0.06 0.01 -0.04 2.99 2.92 2erbB1 VAL 64 H 0.05 0.45 -0.11 -0.55 8.24 8.08 2erbB1 VAL 64 HA 0.01 0.21 0.85 -0.75 4.13 4.45 2erbB1 VAL 64 HB 0.06 -0.12 0.06 -0.04 2.12 2.08 2erbB1 VAL 64 HG13 0.07 0.08 -0.30 -0.04 0.97 0.78 2erbB1 VAL 64 HG23 0.20 0.01 -0.06 -0.04 0.95 1.06 2erbB1 VAL 65 H -0.05 0.19 -0.17 -0.55 8.24 7.67 2erbB1 VAL 65 HA -0.06 0.14 0.94 -0.75 4.13 4.40 2erbB1 VAL 65 HB -0.21 -0.12 -0.31 -0.04 2.12 1.44 2erbB1 VAL 65 HG13 -0.29 0.01 -0.46 -0.04 0.97 0.18 2erbB1 VAL 65 HG23 -0.29 0.01 -0.10 -0.04 0.95 0.53 2erbB1 ASP 66 H -0.02 0.61 0.13 -0.55 8.40 8.58 2erbB1 ASP 66 HA 0.02 0.22 0.64 -0.75 4.63 4.75 2erbB1 ASP 66 HB2 0.05 -0.06 0.18 -0.04 2.71 2.85 2erbB1 ASP 66 HB3 0.11 0.08 0.04 -0.04 2.70 2.89 2erbB1 ASP 67 H 0.02 0.17 0.14 -0.55 8.40 8.18 2erbB1 ASP 67 HA 0.01 0.20 0.43 -0.75 4.63 4.52 2erbB1 ASP 67 HB2 0.01 -0.03 0.12 -0.04 2.71 2.78 2erbB1 ASP 67 HB3 0.01 0.04 0.11 -0.04 2.70 2.83 2erbB1 ASN 68 H 0.01 -0.02 -0.37 -0.55 8.53 7.60 2erbB1 ASN 68 HA 0.03 0.22 0.69 -0.75 4.76 4.94 2erbB1 ASN 68 HB2 0.00 -0.09 0.00 -0.04 2.88 2.76 2erbB1 ASN 68 HB3 0.01 0.05 0.08 -0.04 2.79 2.89 2erbB1 ASN 68 HD21 -0.00 0.03 -0.02 -0.04 7.03 7.00 2erbB1 ASN 68 HD22 -0.01 0.01 -0.01 -0.04 7.74 7.69 2erbB1 GLY 69 H 0.01 0.42 -0.35 -0.55 8.43 7.96 2erbB1 GLY 69 HA2 -0.07 0.10 0.21 -0.51 4.01 3.74 2erbB1 GLY 69 HA3 0.19 0.12 0.59 -0.51 4.01 4.40 2erbB1 ASP 70 H -0.01 -0.08 -0.23 -0.55 8.40 7.53 2erbB1 ASP 70 HA -0.03 0.14 0.58 -0.75 4.63 4.57 2erbB1 ASP 70 HB2 -0.03 -0.11 -0.00 -0.04 2.71 2.52 2erbB1 ASP 70 HB3 -0.06 0.15 -0.01 -0.04 2.70 2.73 2erbB1 VAL 71 H -0.14 0.12 0.12 -0.55 8.24 7.78 2erbB1 VAL 71 HA -0.19 0.18 0.45 -0.75 4.13 3.82 2erbB1 VAL 71 HB -0.26 -0.01 0.10 -0.04 2.12 1.91 2erbB1 VAL 71 HG13 -0.27 0.01 -0.19 -0.04 0.97 0.48 2erbB1 VAL 71 HG23 -0.89 0.00 0.01 -0.04 0.95 0.04 2erbB1 HIS 72 H 0.02 0.83 0.34 -0.55 8.41 9.05 2erbB1 HIS 72 HA -0.04 0.11 0.79 -0.75 4.63 4.74 2erbB1 HIS 72 HB2 -0.04 0.01 -0.10 -0.04 3.26 3.09 2erbB1 HIS 72 HB3 -0.03 0.04 0.05 -0.04 3.20 3.22 2erbB1 HIS 72 HD2 -0.01 -0.01 -0.01 -0.04 6.97 6.89 2erbB1 HIS 72 HE1 0.01 0.05 0.00 -0.04 7.75 7.76 2erbB1 LEU 73 H -0.13 0.27 0.06 -0.55 8.37 8.02 2erbB1 LEU 73 HA 0.04 0.11 0.31 -0.75 4.35 4.06 2erbB1 LEU 73 HB2 -0.07 -0.01 0.09 -0.04 1.64 1.62 2erbB1 LEU 73 HB3 -0.03 0.05 0.04 -0.04 1.64 1.66 2erbB1 LEU 73 HG -0.04 -0.02 -0.01 -0.04 1.64 1.53 2erbB1 LEU 73 HD13 -0.04 0.05 0.06 -0.04 0.93 0.95 2erbB1 LEU 73 HD23 0.16 0.01 -0.04 -0.04 0.89 0.98 2erbB1 GLU 74 H 0.24 0.06 -0.23 -0.55 8.60 8.13 2erbB1 GLU 74 HA 0.14 0.14 0.53 -0.75 4.29 4.35 2erbB1 GLU 74 HB2 0.41 -0.03 0.05 -0.04 2.09 2.49 2erbB1 GLU 74 HB3 0.14 0.06 0.01 -0.04 1.99 2.15 2erbB1 GLU 74 HG2 0.09 0.06 -0.01 -0.04 2.34 2.44 2erbB1 GLU 74 HG3 0.06 -0.06 0.01 -0.04 2.34 2.31 2erbB1 LYS 75 H 0.32 0.07 -0.14 -0.55 8.42 8.11 2erbB1 LYS 75 HA -0.01 0.05 0.35 -0.75 4.32 3.96 2erbB1 LYS 75 HB2 0.02 0.12 0.12 -0.04 1.87 2.08 2erbB1 LYS 75 HB3 -0.03 0.15 0.07 -0.04 1.79 1.95 2erbB1 LYS 75 HG2 -0.21 0.02 0.02 -0.04 1.46 1.25 2erbB1 LYS 75 HG3 -0.66 -0.15 0.01 -0.04 1.46 0.61 2erbB1 LYS 75 HD2 -0.09 -0.06 -0.24 -0.04 1.69 1.25 2erbB1 LYS 75 HD3 -0.10 0.21 -0.01 -0.04 1.68 1.75 2erbB1 LYS 75 HE2 -0.44 -0.12 -0.08 -0.04 2.99 2.30 2erbB1 LYS 75 HE3 -0.12 0.12 -0.08 -0.04 2.99 2.87 2erbB1 LEU 76 H 0.10 0.38 -0.23 -0.55 8.37 8.07 2erbB1 LEU 76 HA 0.08 0.08 0.38 -0.75 4.35 4.13 2erbB1 LEU 76 HB2 0.06 -0.00 0.04 -0.04 1.64 1.70 2erbB1 LEU 76 HB3 0.05 0.02 0.09 -0.04 1.64 1.75 2erbB1 LEU 76 HG -0.03 0.03 -0.36 -0.04 1.64 1.24 2erbB1 LEU 76 HD13 0.15 -0.01 -0.04 -0.04 0.93 1.00 2erbB1 LEU 76 HD23 -0.01 -0.01 -0.07 -0.04 0.89 0.76 2erbB1 HIS 77 H 0.13 0.52 -0.12 -0.55 8.41 8.40 2erbB1 HIS 77 HA -0.05 0.00 0.37 -0.75 4.63 4.20 2erbB1 HIS 77 HB2 -0.04 0.14 0.19 -0.04 3.26 3.51 2erbB1 HIS 77 HB3 0.00 0.01 0.10 -0.04 3.20 3.27 2erbB1 HIS 77 HD2 -0.12 -0.00 0.05 -0.04 6.97 6.86 2erbB1 HIS 77 HE1 -0.62 -0.05 -0.01 -0.04 7.75 7.02 2erbB1 ASP 78 H 0.09 0.57 -0.21 -0.55 8.40 8.30 2erbB1 ASP 78 HA -0.01 -0.03 0.37 -0.75 4.63 4.21 2erbB1 ASP 78 HB2 0.02 0.11 0.13 -0.04 2.71 2.93 2erbB1 ASP 78 HB3 0.00 -0.05 -0.01 -0.04 2.70 2.61 2erbB1 SER 79 H 0.05 0.38 -0.38 -0.55 8.46 7.97 2erbB1 SER 79 HA 0.03 0.01 0.54 -0.75 4.49 4.32 2erbB1 SER 79 HB2 0.05 -0.08 0.10 -0.04 3.95 3.98 2erbB1 SER 79 HB3 0.04 0.08 0.10 -0.04 3.93 4.12 2erbB1 LEU 80 H 0.06 0.39 -0.33 -0.55 8.37 7.94 2erbB1 LEU 80 HA 0.05 0.08 0.65 -0.75 4.35 4.39 2erbB1 LEU 80 HB2 0.09 0.07 0.01 -0.04 1.64 1.77 2erbB1 LEU 80 HB3 0.08 -0.08 0.03 -0.04 1.64 1.62 2erbB1 LEU 80 HG 0.05 0.29 0.00 -0.04 1.64 1.94 2erbB1 LEU 80 HD13 -0.02 -0.03 -0.06 -0.04 0.93 0.77 2erbB1 LEU 80 HD23 0.04 -0.02 -0.09 -0.04 0.89 0.78 2erbB1 PRO 81 HA 0.02 0.08 0.45 -0.51 4.44 4.48 2erbB1 PRO 81 HB2 0.04 -0.08 0.07 -0.04 2.28 2.27 2erbB1 PRO 81 HB3 0.02 -0.00 0.14 -0.04 2.02 2.13 2erbB1 PRO 81 HG2 0.01 -0.02 0.12 -0.04 2.03 2.09 2erbB1 PRO 81 HG3 0.02 0.08 0.07 -0.04 2.03 2.16 2erbB1 PRO 81 HD2 0.06 0.08 0.20 -0.04 3.68 3.98 2erbB1 PRO 81 HD3 0.05 0.25 0.24 -0.04 3.65 4.15 2erbB1 SER 82 H 0.01 0.17 0.21 -0.55 8.46 8.30 2erbB1 SER 82 HA 0.02 0.16 0.42 -0.75 4.49 4.33 2erbB1 SER 82 HB2 -0.05 0.00 0.11 -0.04 3.95 3.97 2erbB1 SER 82 HB3 -0.04 0.09 0.17 -0.04 3.93 4.11 2erbB1 SER 83 H 0.04 0.05 -0.29 -0.55 8.46 7.71 2erbB1 SER 83 HA 0.04 0.07 0.37 -0.75 4.49 4.22 2erbB1 SER 83 HB2 0.06 0.05 0.10 -0.04 3.95 4.12 2erbB1 SER 83 HB3 0.04 -0.02 0.10 -0.04 3.93 4.00 2erbB1 MET 84 H 0.10 0.55 -0.46 -0.55 8.47 8.10 2erbB1 MET 84 HA 0.11 0.16 0.95 -0.75 4.52 4.98 2erbB1 MET 84 HB2 0.22 -0.03 0.15 -0.04 2.15 2.46 2erbB1 MET 84 HB3 0.26 0.00 -0.05 -0.04 2.03 2.21 2erbB1 MET 84 HG2 0.11 0.06 0.02 -0.04 2.63 2.77 2erbB1 MET 84 HG3 0.11 0.03 -0.12 -0.04 2.56 2.55 2erbB1 MET 84 HE3 0.23 0.01 -0.00 -0.04 2.10 2.29 2erbB1 HIS 85 H 0.17 0.50 -0.15 -0.55 8.41 8.39 2erbB1 HIS 85 HA 0.13 0.12 0.33 -0.75 4.63 4.45 2erbB1 HIS 85 HB2 -0.04 0.07 0.19 -0.04 3.26 3.43 2erbB1 HIS 85 HB3 0.01 -0.04 0.17 -0.04 3.20 3.29 2erbB1 HIS 85 HD2 -0.48 0.12 -0.02 -0.04 6.97 6.55 2erbB1 HIS 85 HE1 -0.00 -0.02 -0.04 -0.04 7.75 7.64 2erbB1 ASP 86 H 0.16 0.15 -0.13 -0.55 8.40 8.03 2erbB1 ASP 86 HA 0.06 0.09 0.44 -0.75 4.63 4.47 2erbB1 ASP 86 HB2 0.08 0.01 0.07 -0.04 2.71 2.82 2erbB1 ASP 86 HB3 0.15 0.04 -0.01 -0.04 2.70 2.83 2erbB1 ILE 87 H 0.02 0.10 -0.17 -0.55 8.25 7.64 2erbB1 ILE 87 HA -0.04 0.05 0.40 -0.75 4.18 3.84 2erbB1 ILE 87 HB -0.05 0.02 0.12 -0.04 1.89 1.94 2erbB1 ILE 87 HG12 -0.33 0.02 0.02 -0.04 1.49 1.16 2erbB1 ILE 87 HG13 -0.14 -0.09 0.04 -0.04 1.21 0.98 2erbB1 ILE 87 HG23 -0.18 0.03 -0.11 -0.04 0.93 0.62 2erbB1 ILE 87 HD13 -0.66 0.02 0.02 -0.04 0.88 0.22 2erbB1 ALA 88 H -0.00 0.63 -0.21 -0.55 8.40 8.27 2erbB1 ALA 88 HA -0.17 0.05 0.36 -0.75 4.34 3.82 2erbB1 ALA 88 HB3 -0.12 0.02 0.05 -0.04 1.41 1.32 2erbB1 MET 89 H -0.17 0.47 -0.16 -0.55 8.47 8.07 2erbB1 MET 89 HA -0.43 0.00 0.36 -0.75 4.52 3.70 2erbB1 MET 89 HB2 -0.30 0.11 0.16 -0.04 2.15 2.08 2erbB1 MET 89 HB3 -0.28 0.07 0.16 -0.04 2.03 1.94 2erbB1 MET 89 HG2 -0.32 -0.02 -0.14 -0.04 2.63 2.11 2erbB1 MET 89 HG3 -0.27 -0.03 0.02 -0.04 2.56 2.24 2erbB1 MET 89 HE3 -0.08 0.00 -0.05 -0.04 2.10 1.94 2erbB1 HIS 90 H -0.07 0.55 -0.11 -0.55 8.41 8.23 2erbB1 HIS 90 HA -0.05 -0.00 0.53 -0.75 4.63 4.35 2erbB1 HIS 90 HB2 -0.06 0.10 0.11 -0.04 3.26 3.37 2erbB1 HIS 90 HB3 -0.04 -0.00 0.02 -0.04 3.20 3.14 2erbB1 HIS 90 HD2 -0.04 0.10 -0.04 -0.04 6.97 6.94 2erbB1 HIS 90 HE1 -0.01 -0.03 -0.01 -0.04 7.75 7.65 2erbB1 MET 91 H -0.04 0.44 -0.27 -0.55 8.47 8.05 2erbB1 MET 91 HA 0.06 0.05 0.38 -0.75 4.52 4.25 2erbB1 MET 91 HB2 -0.02 0.08 0.10 -0.04 2.15 2.27 2erbB1 MET 91 HB3 -0.20 0.06 0.12 -0.04 2.03 1.98 2erbB1 MET 91 HG2 0.11 -0.09 -0.01 -0.04 2.63 2.60 2erbB1 MET 91 HG3 0.12 0.04 0.09 -0.04 2.56 2.77 2erbB1 MET 91 HE3 0.19 0.05 -0.18 -0.04 2.10 2.12 2erbB1 GLY 92 H -0.12 0.43 -0.27 -0.55 8.43 7.92 2erbB1 GLY 92 HA2 0.33 0.15 0.69 -0.51 4.01 4.68 2erbB1 GLY 92 HA3 0.05 0.01 0.26 -0.51 4.01 3.81 2erbB1 LYS 93 H -0.02 0.36 -0.26 -0.55 8.42 7.94 2erbB1 LYS 93 HA -0.05 0.02 0.32 -0.75 4.32 3.85 2erbB1 LYS 93 HB2 -0.05 -0.09 0.11 -0.04 1.87 1.80 2erbB1 LYS 93 HB3 -0.11 0.17 0.14 -0.04 1.79 1.95 2erbB1 LYS 93 HG2 0.02 0.25 0.07 -0.04 1.46 1.76 2erbB1 LYS 93 HG3 0.02 -0.05 -0.18 -0.04 1.46 1.20 2erbB1 LYS 93 HD2 0.01 -0.08 -0.00 -0.04 1.69 1.58 2erbB1 LYS 93 HD3 -0.04 -0.02 0.04 -0.04 1.68 1.62 2erbB1 LYS 93 HE2 0.14 0.17 0.06 -0.04 2.99 3.31 2erbB1 LYS 93 HE3 0.08 -0.04 -0.01 -0.04 2.99 2.98 2erbB1 ARG 94 H 0.04 0.26 -0.43 -0.55 8.46 7.79 2erbB1 ARG 94 HA 0.03 0.15 0.88 -0.75 4.34 4.65 2erbB1 ARG 94 HB2 0.02 0.09 0.05 -0.04 1.90 2.01 2erbB1 ARG 94 HB3 0.03 -0.03 0.19 -0.04 1.80 1.94 2erbB1 ARG 94 HG2 0.03 -0.03 -0.30 -0.04 1.67 1.32 2erbB1 ARG 94 HG3 0.02 0.00 -0.02 -0.04 1.67 1.63 2erbB1 ARG 94 HD2 0.04 -0.05 0.04 -0.04 3.22 3.22 2erbB1 ARG 94 HD3 0.04 0.10 0.11 -0.04 3.22 3.43 2erbB1 CYS 95 H 0.07 0.52 -0.38 -0.55 8.50 8.17 2erbB1 CYS 95 HA 0.20 0.12 0.69 -0.75 4.58 4.83 2erbB1 CYS 95 HB2 0.29 0.08 0.10 -0.04 2.97 3.40 2erbB1 CYS 95 HB3 -0.01 -0.06 0.16 -0.04 2.97 3.01 2erbB1 LEU 96 H -0.00 0.12 -0.15 -0.55 8.37 7.79 2erbB1 LEU 96 HA -0.13 0.16 0.48 -0.75 4.35 4.11 2erbB1 LEU 96 HB2 -0.90 -0.02 0.02 -0.04 1.64 0.69 2erbB1 LEU 96 HB3 -0.87 -0.04 0.03 -0.04 1.64 0.71 2erbB1 LEU 96 HG -0.14 0.10 -0.03 -0.04 1.64 1.53 2erbB1 LEU 96 HD13 -0.19 -0.02 0.02 -0.04 0.93 0.70 2erbB1 LEU 96 HD23 -0.13 0.01 -0.06 -0.04 0.89 0.67 2erbB1 TYR 97 H 0.05 0.08 -0.23 -0.55 8.29 7.63 2erbB1 TYR 97 HA -0.20 0.23 0.93 -0.75 4.56 4.77 2erbB1 TYR 97 HB2 -0.09 -0.03 0.11 -0.04 3.06 3.01 2erbB1 TYR 97 HB3 -0.16 0.03 0.03 -0.04 2.98 2.84 2erbB1 TYR 97 HD2 -0.04 0.04 -0.05 -0.04 7.15 7.07 2erbB1 TYR 97 HE2 -0.02 -0.00 -0.03 -0.04 6.85 6.75 2erbB1 PRO 98 HA -3.13 0.01 0.33 -0.51 4.44 1.13 2erbB1 PRO 98 HB2 -0.36 -0.06 -0.02 -0.04 2.28 1.80 2erbB1 PRO 98 HB3 -0.38 0.08 0.09 -0.04 2.02 1.78 2erbB1 PRO 98 HG2 -0.17 -0.02 0.02 -0.04 2.03 1.82 2erbB1 PRO 98 HG3 -0.10 0.11 -0.03 -0.04 2.03 1.97 2erbB1 PRO 98 HD2 -0.21 0.05 0.13 -0.04 3.68 3.62 2erbB1 PRO 98 HD3 -0.18 0.32 -0.35 -0.04 3.65 3.41 2erbB1 GLU 99 H -2.18 0.16 0.21 -0.55 8.60 6.25 2erbB1 GLU 99 HA -0.35 0.20 0.89 -0.75 4.29 4.28 2erbB1 GLU 99 HB2 -0.21 -0.02 0.06 -0.04 2.09 1.88 2erbB1 GLU 99 HB3 -0.12 -0.06 0.05 -0.04 1.99 1.82 2erbB1 GLU 99 HG2 -0.26 0.10 -0.13 -0.04 2.34 2.01 2erbB1 GLU 99 HG3 -0.41 0.07 -0.06 -0.04 2.34 1.89 2erbB1 GLY 100 H -0.12 0.21 0.07 -0.55 8.43 8.04 2erbB1 GLY 100 HA2 0.00 -0.02 0.30 -0.51 4.01 3.78 2erbB1 GLY 100 HA3 -0.01 0.12 0.59 -0.51 4.01 4.20 2erbB1 GLU 101 H 0.00 0.10 0.14 -0.55 8.60 8.30 2erbB1 GLU 101 HA -0.02 0.16 0.53 -0.75 4.29 4.21 2erbB1 GLU 101 HB2 0.00 -0.05 0.18 -0.04 2.09 2.17 2erbB1 GLU 101 HB3 -0.00 0.02 -0.03 -0.04 1.99 1.93 2erbB1 GLU 101 HG2 -0.00 0.01 0.04 -0.04 2.34 2.34 2erbB1 GLU 101 HG3 -0.01 0.03 0.03 -0.04 2.34 2.35 2erbB1 THR 102 H 0.01 -0.04 0.02 -0.55 8.28 7.72 2erbB1 THR 102 HA 0.01 0.38 0.97 -0.75 4.39 4.99 2erbB1 THR 102 HB 0.01 -0.00 0.15 -0.04 4.32 4.44 2erbB1 THR 102 HG23 0.00 0.04 -0.06 -0.04 1.22 1.17 2erbB1 LEU 103 H 0.03 0.24 0.15 -0.55 8.37 8.24 2erbB1 LEU 103 HA 0.05 0.14 0.40 -0.75 4.35 4.19 2erbB1 LEU 103 HB2 0.06 -0.04 0.11 -0.04 1.64 1.72 2erbB1 LEU 103 HB3 0.15 0.09 0.03 -0.04 1.64 1.87 2erbB1 LEU 103 HG 0.05 -0.04 0.05 -0.04 1.64 1.67 2erbB1 LEU 103 HD13 0.17 0.07 0.04 -0.04 0.93 1.18 2erbB1 LEU 103 HD23 0.06 0.07 -0.20 -0.04 0.89 0.78 2erbB1 CYS 104 H 0.04 0.08 -0.13 -0.55 8.50 7.94 2erbB1 CYS 104 HA 0.09 0.19 0.44 -0.75 4.58 4.54 2erbB1 CYS 104 HB2 0.02 -0.05 -0.02 -0.04 2.97 2.88 2erbB1 CYS 104 HB3 0.02 -0.03 -0.30 -0.04 2.97 2.63 2erbB1 ASP 105 H 0.05 0.00 -0.30 -0.55 8.40 7.61 2erbB1 ASP 105 HA 0.12 0.07 0.46 -0.75 4.63 4.52 2erbB1 ASP 105 HB2 0.04 0.01 0.10 -0.04 2.71 2.82 2erbB1 ASP 105 HB3 0.09 0.10 0.08 -0.04 2.70 2.93 2erbB1 LYS 106 H 0.06 0.46 -0.23 -0.55 8.42 8.15 2erbB1 LYS 106 HA 0.05 0.18 0.40 -0.75 4.32 4.19 2erbB1 LYS 106 HB2 0.01 0.02 0.04 -0.04 1.87 1.90 2erbB1 LYS 106 HB3 -0.07 -0.02 -0.07 -0.04 1.79 1.59 2erbB1 LYS 106 HG2 -0.21 -0.03 -0.57 -0.04 1.46 0.62 2erbB1 LYS 106 HG3 -0.06 -0.03 -0.35 -0.04 1.46 0.98 2erbB1 LYS 106 HD2 -0.11 -0.05 -0.14 -0.04 1.69 1.35 2erbB1 LYS 106 HD3 -0.13 0.08 -0.20 -0.04 1.68 1.39 2erbB1 LYS 106 HE2 -0.03 0.07 -0.47 -0.04 2.99 2.52 2erbB1 LYS 106 HE3 -0.01 -0.09 -0.26 -0.04 2.99 2.59 2erbB1 ALA 107 H 0.16 0.44 -0.25 -0.55 8.40 8.20 2erbB1 ALA 107 HA 0.33 0.05 0.38 -0.75 4.34 4.34 2erbB1 ALA 107 HB3 0.32 0.03 0.02 -0.04 1.41 1.74 2erbB1 PHE 108 H 0.28 0.51 -0.12 -0.55 8.34 8.46 2erbB1 PHE 108 HA -0.02 0.02 0.51 -0.75 4.62 4.39 2erbB1 PHE 108 HB2 -0.03 -0.06 0.17 -0.04 3.15 3.19 2erbB1 PHE 108 HB3 0.04 0.10 0.18 -0.04 3.06 3.34 2erbB1 PHE 108 HD2 -0.13 0.02 -0.06 -0.04 7.28 7.07 2erbB1 PHE 108 HE2 -0.05 0.07 -0.01 -0.04 7.38 7.34 2erbB1 PHE 108 HZ 0.11 0.03 -0.11 -0.04 7.32 7.31 2erbB1 TRP 109 H 0.34 0.51 -0.17 -0.55 7.97 8.11 2erbB1 TRP 109 HA -0.13 -0.02 0.41 -0.75 4.62 4.13 2erbB1 TRP 109 HB2 0.01 0.15 0.23 -0.04 3.23 3.58 2erbB1 TRP 109 HB3 -0.08 0.14 0.22 -0.04 3.23 3.47 2erbB1 TRP 109 HD1 0.00 0.00 0.06 -0.04 7.22 7.24 2erbB1 TRP 109 HE1 -0.01 0.01 0.02 -0.04 10.20 10.17 2erbB1 TRP 109 HE3 -0.24 0.10 -0.38 -0.04 7.59 7.03 2erbB1 TRP 109 HZ2 -0.01 0.02 -0.07 -0.04 7.44 7.34 2erbB1 TRP 109 HZ3 -0.16 0.25 -0.20 -0.04 7.13 6.98 2erbB1 TRP 109 HH2 -0.05 -0.12 -0.25 -0.04 7.19 6.74 2erbB1 LEU 110 H 0.11 0.45 -0.23 -0.55 8.37 8.16 2erbB1 LEU 110 HA -0.43 0.06 0.48 -0.75 4.35 3.71 2erbB1 LEU 110 HB2 -0.31 0.12 0.21 -0.04 1.64 1.61 2erbB1 LEU 110 HB3 -1.69 -0.01 -0.02 -0.04 1.64 -0.13 2erbB1 LEU 110 HG 0.05 -0.01 0.06 -0.04 1.64 1.70 2erbB1 LEU 110 HD13 -0.23 -0.03 0.00 -0.04 0.93 0.63 2erbB1 LEU 110 HD23 -0.04 0.00 0.04 -0.04 0.89 0.85 2erbB1 HIS 111 H -0.23 0.49 0.00 -0.55 8.41 8.13 2erbB1 HIS 111 HA 0.00 0.04 0.42 -0.75 4.63 4.34 2erbB1 HIS 111 HB2 -0.25 0.02 0.17 -0.04 3.26 3.17 2erbB1 HIS 111 HB3 0.05 0.01 -0.03 -0.04 3.20 3.19 2erbB1 HIS 111 HD2 0.03 0.16 0.01 -0.04 6.97 7.12 2erbB1 HIS 111 HE1 0.12 0.01 0.02 -0.04 7.75 7.85 2erbB1 LYS 112 H -0.46 0.68 -0.14 -0.55 8.42 7.95 2erbB1 LYS 112 HA -0.21 0.03 0.46 -0.75 4.32 3.84 2erbB1 LYS 112 HB2 -0.84 -0.04 0.08 -0.04 1.87 1.03 2erbB1 LYS 112 HB3 -0.57 0.10 0.14 -0.04 1.79 1.42 2erbB1 LYS 112 HG2 -0.32 0.03 -0.19 -0.04 1.46 0.93 2erbB1 LYS 112 HG3 -0.23 -0.03 0.02 -0.04 1.46 1.18 2erbB1 LYS 112 HD2 -0.06 -0.05 -0.05 -0.04 1.69 1.49 2erbB1 LYS 112 HD3 -0.18 -0.01 -0.04 -0.04 1.68 1.41 2erbB1 LYS 112 HE2 -0.13 0.02 -0.05 -0.04 2.99 2.80 2erbB1 LYS 112 HE3 -0.06 0.01 -0.04 -0.04 2.99 2.85 2erbB1 CYS 113 H -0.63 0.54 -0.14 -0.55 8.50 7.72 2erbB1 CYS 113 HA -0.42 -0.02 0.43 -0.75 4.58 3.82 2erbB1 CYS 113 HB2 -1.27 0.04 0.18 -0.04 2.97 1.89 2erbB1 CYS 113 HB3 -0.73 0.09 0.21 -0.04 2.97 2.49 2erbB1 TRP 114 H -0.35 0.60 -0.10 -0.55 7.97 7.58 2erbB1 TRP 114 HA -0.06 0.17 0.45 -0.75 4.62 4.43 2erbB1 TRP 114 HB2 0.04 0.06 0.12 -0.04 3.23 3.42 2erbB1 TRP 114 HB3 0.16 -0.05 -0.03 -0.04 3.23 3.26 2erbB1 TRP 114 HD1 -0.05 0.17 -0.16 -0.04 7.22 7.14 2erbB1 TRP 114 HE1 -0.03 -0.01 -0.01 -0.04 10.20 10.10 2erbB1 TRP 114 HE3 -0.04 0.03 -0.04 -0.04 7.59 7.50 2erbB1 TRP 114 HZ2 -0.06 -0.03 -0.04 -0.04 7.44 7.26 2erbB1 TRP 114 HZ3 -0.37 -0.03 -0.06 -0.04 7.13 6.63 2erbB1 TRP 114 HH2 0.12 -0.05 -0.06 -0.04 7.19 7.16 2erbB1 LYS 115 H -0.25 0.55 -0.14 -0.55 8.42 8.03 2erbB1 LYS 115 HA -0.10 0.05 0.30 -0.75 4.32 3.82 2erbB1 LYS 115 HB2 -1.35 0.02 0.09 -0.04 1.87 0.58 2erbB1 LYS 115 HB3 -0.48 -0.01 0.13 -0.04 1.79 1.39 2erbB1 LYS 115 HG2 -0.26 -0.07 -0.13 -0.04 1.46 0.96 2erbB1 LYS 115 HG3 -0.19 0.07 0.03 -0.04 1.46 1.33 2erbB1 LYS 115 HD2 -0.67 0.11 -0.03 -0.04 1.69 1.05 2erbB1 LYS 115 HD3 -0.93 -0.20 -0.03 -0.04 1.68 0.48 2erbB1 LYS 115 HE2 -0.49 -0.17 -0.19 -0.04 2.99 2.10 2erbB1 LYS 115 HE3 -0.25 -0.18 -0.03 -0.04 2.99 2.49 2erbB1 GLN 116 H -0.18 0.54 -0.19 -0.55 8.47 8.10 2erbB1 GLN 116 HA -0.10 -0.01 0.44 -0.75 4.36 3.94 2erbB1 GLN 116 HB2 -0.16 0.11 0.15 -0.04 2.15 2.21 2erbB1 GLN 116 HB3 -0.10 -0.08 0.01 -0.04 2.02 1.81 2erbB1 GLN 116 HG2 -0.19 0.07 0.06 -0.04 2.40 2.30 2erbB1 GLN 116 HG3 -0.19 -0.09 -0.02 -0.04 2.39 2.05 2erbB1 GLN 116 HE21 -0.07 -0.05 0.00 -0.04 6.97 6.81 2erbB1 GLN 116 HE22 -0.11 -0.03 -0.01 -0.04 7.69 7.50 2erbB1 SER 117 H -0.02 0.42 -0.29 -0.55 8.46 8.03 2erbB1 SER 117 HA 0.00 -0.04 0.46 -0.75 4.49 4.16 2erbB1 SER 117 HB2 0.10 0.00 0.27 -0.04 3.95 4.28 2erbB1 SER 117 HB3 0.06 0.00 0.08 -0.04 3.93 4.03 2erbB1 ASP 118 H 0.09 0.57 -0.19 -0.55 8.40 8.32 2erbB1 ASP 118 HA 0.08 0.09 0.73 -0.75 4.63 4.78 2erbB1 ASP 118 HB2 0.08 0.05 -0.22 -0.04 2.71 2.58 2erbB1 ASP 118 HB3 0.15 0.03 0.13 -0.04 2.70 2.97 2erbB1 PRO 119 HA 0.12 0.10 0.52 -0.51 4.44 4.67 2erbB1 PRO 119 HB2 0.02 0.03 -0.02 -0.04 2.28 2.27 2erbB1 PRO 119 HB3 -0.01 0.08 0.12 -0.04 2.02 2.17 2erbB1 PRO 119 HG2 0.02 -0.06 0.06 -0.04 2.03 2.01 2erbB1 PRO 119 HG3 -0.00 0.00 0.05 -0.04 2.03 2.04 2erbB1 PRO 119 HD2 0.04 0.07 -0.03 -0.04 3.68 3.72 2erbB1 PRO 119 HD3 0.01 0.36 -0.17 -0.04 3.65 3.81 2erbB1 LYS 120 H 0.06 0.05 -0.24 -0.55 8.42 7.73 2erbB1 LYS 120 HA -0.02 0.17 0.33 -0.75 4.32 4.04 2erbB1 LYS 120 HB2 -0.04 0.08 0.06 -0.04 1.87 1.93 2erbB1 LYS 120 HB3 -0.05 -0.11 0.06 -0.04 1.79 1.66 2erbB1 LYS 120 HG2 -0.65 -0.08 -0.17 -0.04 1.46 0.51 2erbB1 LYS 120 HG3 -0.17 0.24 0.11 -0.04 1.46 1.61 2erbB1 LYS 120 HD2 -0.07 0.05 0.01 -0.04 1.69 1.64 2erbB1 LYS 120 HD3 -0.05 -0.06 -0.02 -0.04 1.68 1.50 2erbB1 LYS 120 HE2 -0.04 -0.06 -0.02 -0.04 2.99 2.82 2erbB1 LYS 120 HE3 -0.30 -0.05 -0.04 -0.04 2.99 2.55 2erbB1 HIS 121 H 0.18 0.12 -0.19 -0.55 8.41 7.97 2erbB1 HIS 121 HA 0.16 0.20 0.89 -0.75 4.63 5.13 2erbB1 HIS 121 HB2 0.04 0.04 0.03 -0.04 3.26 3.33 2erbB1 HIS 121 HB3 0.03 -0.07 0.06 -0.04 3.20 3.19 2erbB1 HIS 121 HD2 -1.19 -0.03 -0.02 -0.04 6.97 5.69 2erbB1 HIS 121 HE1 -0.09 -0.00 -0.04 -0.04 7.75 7.58 2erbB1 TYR 122 H 0.31 0.31 -0.12 -0.55 8.29 8.25 2erbB1 TYR 122 HA 0.17 -0.07 0.47 -0.75 4.56 4.37 2erbB1 TYR 122 HB2 0.15 0.03 -0.09 -0.04 3.06 3.11 2erbB1 TYR 122 HB3 0.12 0.13 0.10 -0.04 2.98 3.28 2erbB1 TYR 122 HD2 0.19 0.09 -0.14 -0.04 7.15 7.25 2erbB1 TYR 122 HE2 0.48 -0.06 -0.15 -0.04 6.85 7.08 2erbB1 PHE 123 H -1.13 0.20 0.24 -0.55 8.34 7.09 2erbB1 PHE 123 HA -0.15 0.24 0.40 -0.75 4.62 4.36 2erbB1 PHE 123 HB2 -0.07 -0.09 0.03 -0.04 3.15 2.98 2erbB1 PHE 123 HB3 -0.04 0.25 -0.13 -0.04 3.06 3.10 2erbB1 PHE 123 HD2 -0.04 0.15 -0.25 -0.04 7.28 7.10 2erbB1 PHE 123 HE2 -0.08 -0.04 -0.08 -0.04 7.38 7.14 2erbB1 PHE 123 HZ -0.10 -0.04 -0.06 -0.04 7.32 7.08 2erbB1 LEU 124 H 0.16 0.33 0.11 -0.55 8.37 8.42 2erbB1 LEU 124 HA -0.03 0.08 0.59 -0.75 4.35 4.23 2erbB1 LEU 124 HB2 0.27 0.12 -0.19 -0.04 1.64 1.79 2erbB1 LEU 124 HB3 0.26 0.07 -0.02 -0.04 1.64 1.91 2erbB1 LEU 124 HG 0.19 -0.11 -0.22 -0.04 1.64 1.46 2erbB1 LEU 124 HD13 -0.08 -0.00 0.00 -0.04 0.93 0.81 2erbB1 LEU 124 HD23 0.05 0.01 -0.07 -0.04 0.89 0.84 2erbB1 VAL 125 H 0.17 0.15 -0.04 -0.55 8.24 7.98 2erbB1 VAL 125 HA 0.10 0.24 0.63 -0.75 4.13 4.34 2erbB1 VAL 125 HB 0.01 0.00 -0.00 -0.04 2.12 2.09 2erbB1 VAL 125 HG13 0.11 0.01 -0.24 -0.04 0.97 0.81 2erbB1 VAL 125 HG23 0.16 0.01 -0.05 -0.04 0.95 1.03