============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. PHE 26 1.000 10.929 -24.404 -30.639 -99.200 -91.000 HIS 36 0.900 -1.157 -37.570 -33.464 -99.200 -91.000 PHE 38 1.000 -1.735 -26.825 -32.153 -99.200 -91.000 TYR 47 0.840 -11.365 -31.790 -29.565 -99.200 -91.000 TYR 55 0.840 8.656 -30.894 -18.276 -99.200 -91.000 TYR 58 0.840 12.870 -25.964 -17.959 -99.200 -91.000 PHE 59 1.000 4.508 -22.378 -23.664 -99.200 -91.000 TYR 67 0.840 19.028 -25.591 -34.739 -99.200 -91.000 HIS 98 0.900 12.158 -21.200 -15.787 -99.200 -91.000 PHE 100 1.000 14.800 -19.865 -20.860 -99.200 -91.000 TYR 109 0.840 5.033 -17.741 -33.755 -99.200 -91.000 PHE 112 1.000 -7.812 -14.660 -25.959 -99.200 -91.000 PHE 115 1.000 4.016 -13.589 -20.581 -99.200 -91.000 TYR 121 0.840 7.867 -16.164 -18.884 -99.200 -91.000 PHE 125 1.000 15.855 -15.385 -31.135 -99.200 -91.000 TYR 127 0.840 22.441 -18.365 -27.397 -99.200 -91.000 PHE 129 1.000 22.328 -16.306 -32.833 -99.200 -91.000 TYR 152 0.840 18.299 -2.578 -29.889 -99.200 -91.000 TYR 157 0.840 13.657 -8.437 -19.591 -99.200 -91.000 PHE 169 1.000 -0.210 -11.034 -23.984 -99.200 -91.000 TYR 180 0.840 -6.207 -15.465 -16.007 -99.200 -91.000 HIS 202 0.900 -12.528 -8.647 -38.795 -99.200 -91.000 PHE 211 1.000 4.458 -14.952 -38.670 -99.200 -91.000 HIS 222 0.900 19.848 -16.365 -37.222 -99.200 -91.000 PHE 226 1.000 24.498 -19.040 -36.190 -99.200 -91.000 PHE 239 1.000 26.808 -26.210 -24.913 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 2q34A1 ASN 15 HA -0.02 -0.09 0.18 -0.75 4.76 4.07 2q34A1 ASN 15 HB2 -0.02 -0.01 -0.02 -0.04 2.88 2.79 2q34A1 ASN 15 HB3 -0.02 0.06 -0.00 -0.04 2.79 2.80 2q34A1 ASN 15 HD21 -0.01 -0.02 0.01 -0.04 7.03 6.97 2q34A1 ASN 15 HD22 -0.01 0.03 -0.01 -0.04 7.74 7.71 2q34A1 ALA 16 H -0.02 0.06 0.08 -0.55 8.40 7.97 2q34A1 ALA 16 HA -0.03 -0.01 0.47 -0.75 4.34 4.02 2q34A1 ALA 16 HB3 -0.03 0.00 0.12 -0.04 1.41 1.47 2q34A1 VAL 17 H -0.02 0.02 0.15 -0.55 8.24 7.84 2q34A1 VAL 17 HA -0.04 0.24 0.45 -0.75 4.13 4.02 2q34A1 VAL 17 HB -0.05 0.01 -0.24 -0.04 2.12 1.80 2q34A1 VAL 17 HG13 -0.04 -0.01 0.07 -0.04 0.97 0.94 2q34A1 VAL 17 HG23 -0.01 -0.04 -0.24 -0.04 0.95 0.62 2q34A1 VAL 18 H -0.00 0.01 -0.27 -0.55 8.24 7.43 2q34A1 VAL 18 HA 0.00 0.53 0.86 -0.75 4.13 4.77 2q34A1 VAL 18 HB 0.03 -0.13 -0.03 -0.04 2.12 1.96 2q34A1 VAL 18 HG13 0.00 -0.00 -0.25 -0.04 0.97 0.68 2q34A1 VAL 18 HG23 0.02 0.00 -0.26 -0.04 0.95 0.67 2q34A1 GLN 19 H -0.01 0.61 0.19 -0.55 8.47 8.72 2q34A1 GLN 19 HA 0.01 0.11 0.93 -0.75 4.36 4.65 2q34A1 GLN 19 HB2 -0.01 0.01 0.02 -0.04 2.15 2.14 2q34A1 GLN 19 HB3 -0.00 0.01 -0.09 -0.04 2.02 1.90 2q34A1 GLN 19 HG2 -0.01 0.07 -0.49 -0.04 2.40 1.93 2q34A1 GLN 19 HG3 -0.01 -0.01 -0.11 -0.04 2.39 2.22 2q34A1 GLN 19 HE21 -0.01 -0.15 0.05 -0.04 6.97 6.82 2q34A1 GLN 19 HE22 -0.01 0.38 -0.04 -0.04 7.69 7.98 2q34A1 LEU 20 H -0.00 0.16 0.19 -0.55 8.37 8.18 2q34A1 LEU 20 HA -0.08 0.38 1.09 -0.75 4.35 4.99 2q34A1 LEU 20 HB2 -0.08 -0.02 0.01 -0.04 1.64 1.50 2q34A1 LEU 20 HB3 -0.02 -0.05 0.15 -0.04 1.64 1.67 2q34A1 LEU 20 HG -0.11 -0.01 -0.25 -0.04 1.64 1.23 2q34A1 LEU 20 HD13 -0.21 0.03 -0.13 -0.04 0.93 0.57 2q34A1 LEU 20 HD23 0.03 0.01 -0.08 -0.04 0.89 0.80 2q34A1 THR 21 H -0.08 0.70 0.41 -0.55 8.28 8.76 2q34A1 THR 21 HA -0.03 0.17 0.89 -0.75 4.39 4.67 2q34A1 THR 21 HB -0.03 0.04 0.04 -0.04 4.32 4.33 2q34A1 THR 21 HG23 -0.01 -0.01 -0.15 -0.04 1.22 1.00 2q34A1 GLU 22 H -0.03 0.16 0.17 -0.55 8.60 8.35 2q34A1 GLU 22 HA -0.16 0.18 0.90 -0.75 4.29 4.46 2q34A1 GLU 22 HB2 -0.00 0.00 0.14 -0.04 2.09 2.19 2q34A1 GLU 22 HB3 -0.01 -0.08 0.04 -0.04 1.99 1.90 2q34A1 GLU 22 HG2 -0.09 0.06 -0.07 -0.04 2.34 2.20 2q34A1 GLU 22 HG3 -0.00 -0.03 -0.11 -0.04 2.34 2.16 2q34A1 LEU 23 H -0.09 0.79 0.37 -0.55 8.37 8.90 2q34A1 LEU 23 HA -0.03 0.16 0.88 -0.75 4.35 4.61 2q34A1 LEU 23 HB2 -0.05 0.11 -0.06 -0.04 1.64 1.60 2q34A1 LEU 23 HB3 -0.03 -0.03 0.07 -0.04 1.64 1.61 2q34A1 LEU 23 HG -0.07 -0.02 -0.30 -0.04 1.64 1.21 2q34A1 LEU 23 HD13 -0.03 -0.00 -0.17 -0.04 0.93 0.68 2q34A1 LEU 23 HD23 -0.03 0.01 -0.23 -0.04 0.89 0.60 2q34A1 GLY 24 H -0.02 -0.01 -0.01 -0.55 8.43 7.85 2q34A1 GLY 24 HA2 0.01 -0.06 0.37 -0.51 4.01 3.82 2q34A1 GLY 24 HA3 -0.01 0.24 0.77 -0.51 4.01 4.51 2q34A1 ASN 25 H 0.01 0.13 0.15 -0.55 8.53 8.27 2q34A1 ASN 25 HA 0.02 0.03 0.33 -0.75 4.76 4.39 2q34A1 ASN 25 HB2 -0.01 0.17 -0.05 -0.04 2.88 2.95 2q34A1 ASN 25 HB3 0.00 0.12 0.16 -0.04 2.79 3.03 2q34A1 ASN 25 HD21 -0.01 -0.03 -0.08 -0.04 7.03 6.88 2q34A1 ASN 25 HD22 -0.01 0.09 -0.18 -0.04 7.74 7.60 2q34A1 GLY 26 H 0.04 -0.08 -0.33 -0.55 8.43 7.52 2q34A1 GLY 26 HA2 0.16 0.00 0.26 -0.51 4.01 3.92 2q34A1 GLY 26 HA3 0.07 0.29 0.73 -0.51 4.01 4.60 2q34A1 VAL 27 H -0.02 0.41 -0.30 -0.55 8.24 7.79 2q34A1 VAL 27 HA -0.05 0.23 0.79 -0.75 4.13 4.34 2q34A1 VAL 27 HB -0.04 0.01 0.02 -0.04 2.12 2.07 2q34A1 VAL 27 HG13 -0.04 -0.01 -0.15 -0.04 0.97 0.73 2q34A1 VAL 27 HG23 -0.03 0.02 -0.26 -0.04 0.95 0.64 2q34A1 VAL 28 H -0.14 0.81 0.46 -0.55 8.24 8.81 2q34A1 VAL 28 HA -0.21 0.09 1.08 -0.75 4.13 4.33 2q34A1 VAL 28 HB -0.39 0.05 0.08 -0.04 2.12 1.82 2q34A1 VAL 28 HG13 -1.21 -0.03 -0.23 -0.04 0.97 -0.53 2q34A1 VAL 28 HG23 -0.32 0.02 -0.06 -0.04 0.95 0.55 2q34A1 GLN 29 H -0.13 0.69 0.37 -0.55 8.47 8.86 2q34A1 GLN 29 HA -0.06 0.27 1.12 -0.75 4.36 4.92 2q34A1 GLN 29 HB2 -0.04 -0.03 -0.09 -0.04 2.15 1.95 2q34A1 GLN 29 HB3 -0.05 -0.08 0.10 -0.04 2.02 1.95 2q34A1 GLN 29 HG2 -0.01 0.01 -0.34 -0.04 2.40 2.01 2q34A1 GLN 29 HG3 -0.00 0.09 -0.05 -0.04 2.39 2.39 2q34A1 GLN 29 HE21 0.01 -0.05 -0.09 -0.04 6.97 6.80 2q34A1 GLN 29 HE22 0.01 0.03 -0.15 -0.04 7.69 7.54 2q34A1 ILE 30 H -0.07 0.72 0.33 -0.55 8.25 8.69 2q34A1 ILE 30 HA -0.09 0.25 0.97 -0.75 4.18 4.55 2q34A1 ILE 30 HB -0.15 -0.01 0.15 -0.04 1.89 1.84 2q34A1 ILE 30 HG12 -0.26 -0.01 -0.11 -0.04 1.49 1.07 2q34A1 ILE 30 HG13 -0.26 -0.06 -0.25 -0.04 1.21 0.59 2q34A1 ILE 30 HG23 -0.11 -0.01 -0.14 -0.04 0.93 0.62 2q34A1 ILE 30 HD13 -0.91 0.01 -0.17 -0.04 0.88 -0.23 2q34A1 THR 31 H -0.02 0.65 0.24 -0.55 8.28 8.61 2q34A1 THR 31 HA 0.02 0.34 0.81 -0.75 4.39 4.81 2q34A1 THR 31 HB 0.01 -0.05 0.08 -0.04 4.32 4.31 2q34A1 THR 31 HG23 0.06 0.04 -0.07 -0.04 1.22 1.20 2q34A1 LYS 33 HA -0.09 -0.13 0.20 -0.75 4.32 3.55 2q34A1 LYS 33 HB2 -0.00 0.03 -0.19 -0.04 1.87 1.66 2q34A1 LYS 33 HB3 -0.09 0.09 0.09 -0.04 1.79 1.84 2q34A1 LYS 33 HG2 -0.39 -0.12 0.00 -0.04 1.46 0.91 2q34A1 LYS 33 HG3 -0.49 -0.07 -0.04 -0.04 1.46 0.82 2q34A1 LYS 33 HD2 -0.01 0.04 -0.04 -0.04 1.69 1.64 2q34A1 LYS 33 HD3 -0.08 0.06 -0.01 -0.04 1.68 1.60 2q34A1 LYS 33 HE2 -0.14 -0.04 -0.01 -0.04 2.99 2.76 2q34A1 LYS 33 HE3 -0.02 -0.06 -0.02 -0.04 2.99 2.84 2q34A1 ASP 34 H -0.02 0.19 0.09 -0.55 8.40 8.11 2q34A1 ASP 34 HA -0.11 0.22 0.93 -0.75 4.63 4.92 2q34A1 ASP 34 HB2 -0.02 0.13 0.04 -0.04 2.71 2.82 2q34A1 ASP 34 HB3 -0.00 -0.07 0.23 -0.04 2.70 2.82 2q34A1 GLU 35 H -0.28 0.42 -0.09 -0.55 8.60 8.10 2q34A1 GLU 35 HA -0.10 0.07 0.38 -0.75 4.29 3.88 2q34A1 GLU 35 HB2 -0.13 0.02 0.09 -0.04 2.09 2.03 2q34A1 GLU 35 HB3 -0.07 0.04 0.05 -0.04 1.99 1.97 2q34A1 GLU 35 HG2 -1.00 -0.01 -0.04 -0.04 2.34 1.25 2q34A1 GLU 35 HG3 -0.49 0.11 -0.03 -0.04 2.34 1.88 2q34A1 SER 36 H -0.07 0.11 -0.15 -0.55 8.46 7.81 2q34A1 SER 36 HA -0.02 0.13 0.28 -0.75 4.49 4.13 2q34A1 SER 36 HB2 -0.01 0.05 0.04 -0.04 3.95 3.99 2q34A1 SER 36 HB3 -0.02 0.05 0.09 -0.04 3.93 4.01 2q34A1 SER 37 H -0.03 0.14 -0.37 -0.55 8.46 7.66 2q34A1 SER 37 HA -0.04 0.24 0.81 -0.75 4.49 4.76 2q34A1 SER 37 HB2 -0.02 -0.01 0.07 -0.04 3.95 3.95 2q34A1 SER 37 HB3 -0.01 -0.01 -0.04 -0.04 3.93 3.83 2q34A1 ARG 38 H -0.03 0.31 -0.18 -0.55 8.46 8.00 2q34A1 ARG 38 HA -0.03 0.04 0.31 -0.75 4.34 3.91 2q34A1 ARG 38 HB2 -0.36 0.15 0.01 -0.04 1.90 1.66 2q34A1 ARG 38 HB3 -1.35 -0.04 0.14 -0.04 1.80 0.52 2q34A1 ARG 38 HG2 -0.52 -0.03 0.00 -0.04 1.67 1.08 2q34A1 ARG 38 HG3 -0.16 0.15 -0.09 -0.04 1.67 1.52 2q34A1 ARG 38 HD2 -0.28 -0.02 -0.05 -0.04 3.22 2.84 2q34A1 ARG 38 HD3 -0.10 0.01 -0.06 -0.04 3.22 3.04 2q34A1 ASN 39 H 0.07 0.46 0.03 -0.55 8.53 8.53 2q34A1 ASN 39 HA 0.06 -0.03 0.34 -0.75 4.76 4.38 2q34A1 ASN 39 HB2 0.09 0.05 -0.50 -0.04 2.88 2.47 2q34A1 ASN 39 HB3 0.00 0.13 0.24 -0.04 2.79 3.13 2q34A1 ASN 39 HD21 0.25 -0.06 0.18 -0.04 7.03 7.37 2q34A1 ASN 39 HD22 0.03 0.40 0.08 -0.04 7.74 8.20 2q34A1 GLY 40 H -0.01 -0.03 -0.50 -0.55 8.43 7.34 2q34A1 GLY 40 HA2 -0.12 0.03 0.52 -0.51 4.01 3.93 2q34A1 GLY 40 HA3 -0.05 0.09 0.21 -0.51 4.01 3.75 2q34A1 PHE 41 H -0.09 0.68 0.03 -0.55 8.34 8.40 2q34A1 PHE 41 HA -0.03 0.15 0.55 -0.75 4.62 4.54 2q34A1 PHE 41 HB2 -0.10 -0.05 0.01 -0.04 3.15 2.97 2q34A1 PHE 41 HB3 -0.08 0.01 0.06 -0.04 3.06 3.01 2q34A1 PHE 41 HD2 -0.04 0.06 -0.19 -0.04 7.28 7.07 2q34A1 PHE 41 HE2 0.03 0.06 -0.09 -0.04 7.38 7.33 2q34A1 PHE 41 HZ 0.05 0.27 -0.41 -0.04 7.32 7.19 2q34A1 SER 42 H 0.09 0.49 -0.23 -0.55 8.46 8.27 2q34A1 SER 42 HA 0.03 0.19 0.52 -0.75 4.49 4.48 2q34A1 SER 42 HB2 0.02 0.04 0.09 -0.04 3.95 4.05 2q34A1 SER 42 HB3 0.02 0.05 0.00 -0.04 3.93 3.96 2q34A1 PRO 43 HA 0.00 0.10 0.47 -0.51 4.44 4.50 2q34A1 PRO 43 HB2 0.01 0.02 0.06 -0.04 2.28 2.32 2q34A1 PRO 43 HB3 0.01 0.09 0.08 -0.04 2.02 2.16 2q34A1 PRO 43 HG2 0.02 0.09 0.09 -0.04 2.03 2.18 2q34A1 PRO 43 HG3 0.02 0.10 0.09 -0.04 2.03 2.19 2q34A1 PRO 43 HD2 0.02 0.08 0.21 -0.04 3.68 3.94 2q34A1 PRO 43 HD3 0.02 0.19 0.20 -0.04 3.65 4.02 2q34A1 SER 44 H 0.01 0.11 -0.22 -0.55 8.46 7.82 2q34A1 SER 44 HA -0.00 0.11 0.36 -0.75 4.49 4.21 2q34A1 SER 44 HB2 -0.00 -0.06 0.05 -0.04 3.95 3.90 2q34A1 SER 44 HB3 -0.01 0.04 -0.00 -0.04 3.93 3.92 2q34A1 ILE 45 H 0.02 0.05 -0.27 -0.55 8.25 7.51 2q34A1 ILE 45 HA 0.02 0.12 0.37 -0.75 4.18 3.93 2q34A1 ILE 45 HB 0.07 -0.06 0.17 -0.04 1.89 2.03 2q34A1 ILE 45 HG12 0.02 -0.18 -0.00 -0.04 1.49 1.29 2q34A1 ILE 45 HG13 0.05 0.11 0.03 -0.04 1.21 1.37 2q34A1 ILE 45 HG23 0.08 0.03 -0.20 -0.04 0.93 0.80 2q34A1 ILE 45 HD13 0.02 0.01 -0.07 -0.04 0.88 0.79 2q34A1 VAL 46 H 0.01 0.57 -0.14 -0.55 8.24 8.13 2q34A1 VAL 46 HA -0.04 0.04 0.35 -0.75 4.13 3.73 2q34A1 VAL 46 HB -0.02 0.05 0.07 -0.04 2.12 2.18 2q34A1 VAL 46 HG13 -0.05 -0.00 -0.14 -0.04 0.97 0.73 2q34A1 VAL 46 HG23 -0.10 0.01 -0.13 -0.04 0.95 0.69 2q34A1 GLU 47 H 0.01 0.61 -0.08 -0.55 8.60 8.59 2q34A1 GLU 47 HA 0.02 0.03 0.43 -0.75 4.29 4.03 2q34A1 GLU 47 HB2 0.01 -0.02 0.09 -0.04 2.09 2.13 2q34A1 GLU 47 HB3 0.00 0.07 0.12 -0.04 1.99 2.15 2q34A1 GLU 47 HG2 -0.01 -0.01 -0.02 -0.04 2.34 2.26 2q34A1 GLU 47 HG3 0.00 0.01 -0.18 -0.04 2.34 2.13 2q34A1 GLY 48 H 0.02 0.47 -0.30 -0.55 8.43 8.07 2q34A1 GLY 48 HA2 0.06 0.01 0.42 -0.51 4.01 3.99 2q34A1 GLY 48 HA3 0.04 0.06 0.31 -0.51 4.01 3.90 2q34A1 LEU 49 H 0.05 0.65 -0.13 -0.55 8.37 8.40 2q34A1 LEU 49 HA 0.12 0.03 0.42 -0.75 4.35 4.16 2q34A1 LEU 49 HB2 0.06 0.07 0.14 -0.04 1.64 1.87 2q34A1 LEU 49 HB3 0.18 -0.03 -0.06 -0.04 1.64 1.70 2q34A1 LEU 49 HG 0.06 0.06 -0.00 -0.04 1.64 1.72 2q34A1 LEU 49 HD13 0.02 -0.02 -0.11 -0.04 0.93 0.78 2q34A1 LEU 49 HD23 0.16 0.00 -0.06 -0.04 0.89 0.95 2q34A1 ARG 50 H 0.07 0.55 -0.14 -0.55 8.46 8.39 2q34A1 ARG 50 HA 0.10 0.02 0.34 -0.75 4.34 4.05 2q34A1 ARG 50 HB2 0.03 0.01 0.10 -0.04 1.90 2.00 2q34A1 ARG 50 HB3 0.06 0.07 0.14 -0.04 1.80 2.03 2q34A1 ARG 50 HG2 0.05 -0.01 -0.07 -0.04 1.67 1.60 2q34A1 ARG 50 HG3 0.02 -0.03 -0.01 -0.04 1.67 1.61 2q34A1 ARG 50 HD2 0.03 -0.01 -0.06 -0.04 3.22 3.14 2q34A1 ARG 50 HD3 0.02 -0.04 -0.03 -0.04 3.22 3.13 2q34A1 HIS 51 H 0.16 0.60 -0.17 -0.55 8.41 8.45 2q34A1 HIS 51 HA 0.03 -0.00 0.37 -0.75 4.63 4.27 2q34A1 HIS 51 HB2 0.01 -0.02 0.10 -0.04 3.26 3.32 2q34A1 HIS 51 HB3 0.01 0.09 0.18 -0.04 3.20 3.44 2q34A1 HIS 51 HD2 -0.00 0.06 -0.09 -0.04 6.97 6.89 2q34A1 HIS 51 HE1 0.01 -0.01 -0.01 -0.04 7.75 7.70 2q34A1 CYS 52 H 0.07 0.67 -0.10 -0.55 8.50 8.60 2q34A1 CYS 52 HA -0.17 -0.03 0.34 -0.75 4.58 3.97 2q34A1 CYS 52 HB2 -0.09 0.09 0.08 -0.04 2.97 3.01 2q34A1 CYS 52 HB3 -0.20 -0.05 -0.06 -0.04 2.97 2.61 2q34A1 PHE 53 H 0.13 0.70 -0.14 -0.55 8.34 8.48 2q34A1 PHE 53 HA -0.01 0.01 0.54 -0.75 4.62 4.41 2q34A1 PHE 53 HB2 -0.01 0.12 0.09 -0.04 3.15 3.31 2q34A1 PHE 53 HB3 -0.01 0.00 -0.01 -0.04 3.06 3.00 2q34A1 PHE 53 HD2 0.00 0.05 -0.01 -0.04 7.28 7.28 2q34A1 PHE 53 HE2 0.02 -0.01 -0.06 -0.04 7.38 7.29 2q34A1 PHE 53 HZ 0.04 -0.01 -0.07 -0.04 7.32 7.24 2q34A1 SER 54 H 0.04 0.59 -0.15 -0.55 8.46 8.40 2q34A1 SER 54 HA 0.03 0.02 0.58 -0.75 4.49 4.37 2q34A1 SER 54 HB2 0.02 -0.02 0.09 -0.04 3.95 3.99 2q34A1 SER 54 HB3 -0.05 0.13 0.19 -0.04 3.93 4.16 2q34A1 VAL 55 H -0.20 0.60 -0.04 -0.55 8.24 8.05 2q34A1 VAL 55 HA -0.07 -0.01 0.49 -0.75 4.13 3.79 2q34A1 VAL 55 HB -0.14 0.14 0.14 -0.04 2.12 2.21 2q34A1 VAL 55 HG13 0.03 -0.02 -0.10 -0.04 0.97 0.84 2q34A1 VAL 55 HG23 -0.38 0.03 0.03 -0.04 0.95 0.60 2q34A1 VAL 56 H -0.02 0.50 -0.21 -0.55 8.24 7.96 2q34A1 VAL 56 HA 0.30 -0.01 0.46 -0.75 4.13 4.13 2q34A1 VAL 56 HB 0.05 0.13 0.16 -0.04 2.12 2.42 2q34A1 VAL 56 HG13 0.15 -0.01 -0.22 -0.04 0.97 0.85 2q34A1 VAL 56 HG23 -0.12 0.01 -0.04 -0.04 0.95 0.76 2q34A1 ALA 57 H 0.06 0.54 -0.11 -0.55 8.40 8.35 2q34A1 ALA 57 HA 0.05 -0.00 0.31 -0.75 4.34 3.94 2q34A1 ALA 57 HB3 0.04 0.01 0.10 -0.04 1.41 1.52 2q34A1 GLN 58 H -0.01 0.36 -0.47 -0.55 8.47 7.80 2q34A1 GLN 58 HA -0.03 0.04 0.50 -0.75 4.36 4.11 2q34A1 GLN 58 HB2 -0.04 0.13 0.09 -0.04 2.15 2.29 2q34A1 GLN 58 HB3 -0.04 -0.12 0.04 -0.04 2.02 1.86 2q34A1 GLN 58 HG2 -0.02 -0.07 -0.00 -0.04 2.40 2.27 2q34A1 GLN 58 HG3 -0.01 0.10 0.00 -0.04 2.39 2.44 2q34A1 GLN 58 HE21 -0.00 -0.06 -0.05 -0.04 6.97 6.81 2q34A1 GLN 58 HE22 -0.00 -0.01 -0.04 -0.04 7.69 7.60 2q34A1 ASN 59 H -0.10 0.50 -0.30 -0.55 8.53 8.09 2q34A1 ASN 59 HA -0.22 0.04 0.80 -0.75 4.76 4.61 2q34A1 ASN 59 HB2 -0.61 0.18 0.24 -0.04 2.88 2.66 2q34A1 ASN 59 HB3 -1.19 -0.18 0.10 -0.04 2.79 1.48 2q34A1 ASN 59 HD21 -0.08 -0.10 -0.03 -0.04 7.03 6.78 2q34A1 ASN 59 HD22 -0.10 0.42 0.04 -0.04 7.74 8.05 2q34A1 GLN 60 H -0.12 0.20 0.12 -0.55 8.47 8.12 2q34A1 GLN 60 HA -0.05 0.21 0.23 -0.75 4.36 3.99 2q34A1 GLN 60 HB2 -0.05 -0.06 0.06 -0.04 2.15 2.05 2q34A1 GLN 60 HB3 -0.03 -0.02 0.12 -0.04 2.02 2.05 2q34A1 GLN 60 HG2 -0.05 0.09 0.01 -0.04 2.40 2.42 2q34A1 GLN 60 HG3 -0.03 -0.06 0.04 -0.04 2.39 2.30 2q34A1 GLN 60 HE21 -0.01 -0.02 -0.00 -0.04 6.97 6.90 2q34A1 GLN 60 HE22 -0.03 0.14 -0.13 -0.04 7.69 7.64 2q34A1 GLN 61 H -0.21 -0.02 -0.49 -0.55 8.47 7.22 2q34A1 GLN 61 HA -0.01 0.12 0.66 -0.75 4.36 4.37 2q34A1 GLN 61 HB2 0.00 -0.02 0.08 -0.04 2.15 2.17 2q34A1 GLN 61 HB3 -0.07 -0.04 0.04 -0.04 2.02 1.91 2q34A1 GLN 61 HG2 -0.07 0.08 -0.27 -0.04 2.40 2.09 2q34A1 GLN 61 HG3 -0.02 -0.06 -0.06 -0.04 2.39 2.22 2q34A1 GLN 61 HE21 -0.27 0.02 -0.01 -0.04 6.97 6.66 2q34A1 GLN 61 HE22 -0.12 -0.03 -0.04 -0.04 7.69 7.45 2q34A1 TYR 62 H -0.10 0.48 -0.12 -0.55 8.29 8.00 2q34A1 TYR 62 HA -0.00 0.01 0.65 -0.75 4.56 4.46 2q34A1 TYR 62 HB2 -0.00 0.20 0.11 -0.04 3.06 3.33 2q34A1 TYR 62 HB3 -0.01 -0.02 -0.02 -0.04 2.98 2.88 2q34A1 TYR 62 HD2 -0.02 0.02 -0.11 -0.04 7.15 6.99 2q34A1 TYR 62 HE2 -0.03 -0.04 -0.12 -0.04 6.85 6.62 2q34A1 LYS 63 H 0.10 0.67 0.42 -0.55 8.42 9.05 2q34A1 LYS 63 HA 0.07 0.15 0.89 -0.75 4.32 4.67 2q34A1 LYS 63 HB2 0.04 0.03 0.02 -0.04 1.87 1.92 2q34A1 LYS 63 HB3 0.04 -0.02 -0.03 -0.04 1.79 1.74 2q34A1 LYS 63 HG2 0.04 -0.11 -0.08 -0.04 1.46 1.27 2q34A1 LYS 63 HG3 0.06 0.09 -0.15 -0.04 1.46 1.42 2q34A1 LYS 63 HD2 0.03 0.17 0.13 -0.04 1.69 1.97 2q34A1 LYS 63 HD3 0.03 0.08 0.02 -0.04 1.68 1.76 2q34A1 LYS 63 HE2 0.02 -0.34 0.08 -0.04 2.99 2.71 2q34A1 LYS 63 HE3 0.03 -0.07 0.02 -0.04 2.99 2.93 2q34A1 VAL 64 H 0.02 0.33 0.30 -0.55 8.24 8.34 2q34A1 VAL 64 HA 0.06 0.34 0.67 -0.75 4.13 4.44 2q34A1 VAL 64 HB -0.01 -0.14 0.04 -0.04 2.12 1.97 2q34A1 VAL 64 HG13 0.01 -0.01 -0.16 -0.04 0.97 0.77 2q34A1 VAL 64 HG23 0.01 0.04 -0.21 -0.04 0.95 0.74 2q34A1 VAL 65 H 0.07 0.73 0.29 -0.55 8.24 8.78 2q34A1 VAL 65 HA -0.06 0.16 0.95 -0.75 4.13 4.43 2q34A1 VAL 65 HB 0.12 0.03 0.12 -0.04 2.12 2.35 2q34A1 VAL 65 HG13 -0.09 -0.03 -0.26 -0.04 0.97 0.55 2q34A1 VAL 65 HG23 0.02 -0.00 -0.16 -0.04 0.95 0.76 2q34A1 ILE 66 H -0.04 0.71 0.43 -0.55 8.25 8.79 2q34A1 ILE 66 HA 0.05 0.26 1.07 -0.75 4.18 4.80 2q34A1 ILE 66 HB -0.01 -0.05 0.18 -0.04 1.89 1.97 2q34A1 ILE 66 HG12 0.01 0.03 -0.11 -0.04 1.49 1.38 2q34A1 ILE 66 HG13 -0.01 -0.01 -0.26 -0.04 1.21 0.88 2q34A1 ILE 66 HG23 0.03 -0.01 -0.16 -0.04 0.93 0.75 2q34A1 ILE 66 HD13 -0.02 -0.01 -0.21 -0.04 0.88 0.60 2q34A1 LEU 67 H 0.11 0.70 0.35 -0.55 8.37 8.98 2q34A1 LEU 67 HA 0.07 0.25 0.97 -0.75 4.35 4.88 2q34A1 LEU 67 HB2 0.21 -0.03 0.00 -0.04 1.64 1.78 2q34A1 LEU 67 HB3 0.23 -0.01 0.16 -0.04 1.64 1.99 2q34A1 LEU 67 HG 0.26 0.00 -0.20 -0.04 1.64 1.67 2q34A1 LEU 67 HD13 0.08 0.03 0.03 -0.04 0.93 1.03 2q34A1 LEU 67 HD23 0.28 -0.01 -0.09 -0.04 0.89 1.03 2q34A1 THR 68 H 0.08 0.68 0.49 -0.55 8.28 8.98 2q34A1 THR 68 HA 0.38 0.23 0.91 -0.75 4.39 5.16 2q34A1 THR 68 HB 0.10 -0.08 -0.30 -0.04 4.32 3.99 2q34A1 THR 68 HG23 0.06 0.04 -0.11 -0.04 1.22 1.17 2q34A1 GLY 69 H 0.20 0.16 0.20 -0.55 8.43 8.44 2q34A1 GLY 69 HA2 0.04 0.15 0.98 -0.51 4.01 4.67 2q34A1 GLY 69 HA3 0.05 0.23 0.62 -0.51 4.01 4.40 2q34A1 TYR 70 H -0.00 0.46 0.28 -0.55 8.29 8.47 2q34A1 TYR 70 HA 0.03 0.16 0.79 -0.75 4.56 4.79 2q34A1 TYR 70 HB2 0.03 -0.01 0.05 -0.04 3.06 3.09 2q34A1 TYR 70 HB3 0.02 0.10 -0.09 -0.04 2.98 2.97 2q34A1 TYR 70 HD2 0.04 0.06 -0.08 -0.04 7.15 7.12 2q34A1 TYR 70 HE2 0.04 -0.03 -0.14 -0.04 6.85 6.68 2q34A1 GLY 71 H 0.06 0.15 0.09 -0.55 8.43 8.18 2q34A1 GLY 71 HA2 -0.02 0.05 0.33 -0.51 4.01 3.85 2q34A1 GLY 71 HA3 -0.12 -0.03 0.35 -0.51 4.01 3.71 2q34A1 ASN 72 H -0.21 0.11 0.22 -0.55 8.53 8.10 2q34A1 ASN 72 HA -0.35 0.18 0.57 -0.75 4.76 4.41 2q34A1 ASN 72 HB2 -0.30 0.02 0.11 -0.04 2.88 2.67 2q34A1 ASN 72 HB3 -0.53 -0.02 0.19 -0.04 2.79 2.39 2q34A1 ASN 72 HD21 -0.01 0.01 0.02 -0.04 7.03 7.00 2q34A1 ASN 72 HD22 0.00 0.02 0.04 -0.04 7.74 7.76 2q34A1 TYR 73 H -0.35 0.54 -0.16 -0.55 8.29 7.77 2q34A1 TYR 73 HA -0.15 0.03 1.02 -0.75 4.56 4.71 2q34A1 TYR 73 HB2 -0.34 -0.03 -0.02 -0.04 3.06 2.62 2q34A1 TYR 73 HB3 -0.06 0.12 -0.25 -0.04 2.98 2.75 2q34A1 TYR 73 HD2 -0.06 -0.01 -0.06 -0.04 7.15 6.97 2q34A1 TYR 73 HE2 0.17 -0.00 -0.02 -0.04 6.85 6.95 2q34A1 PHE 74 H 0.08 0.44 -0.15 -0.55 8.34 8.16 2q34A1 PHE 74 HA -0.01 0.04 0.76 -0.75 4.62 4.66 2q34A1 PHE 74 HB2 -0.06 -0.02 -0.13 -0.04 3.15 2.90 2q34A1 PHE 74 HB3 -0.05 0.09 -0.05 -0.04 3.06 3.00 2q34A1 PHE 74 HD2 -0.02 -0.02 -0.09 -0.04 7.28 7.11 2q34A1 PHE 74 HE2 -0.00 0.06 -0.16 -0.04 7.38 7.24 2q34A1 PHE 74 HZ 0.02 0.01 -0.15 -0.04 7.32 7.15 2q34A1 SER 75 H 0.16 0.41 0.22 -0.55 8.46 8.70 2q34A1 SER 75 HA -0.04 0.30 0.62 -0.75 4.49 4.62 2q34A1 SER 75 HB2 -0.28 0.17 -0.03 -0.04 3.95 3.77 2q34A1 SER 75 HB3 0.04 0.00 0.08 -0.04 3.93 4.01 2q34A1 SER 76 H -0.01 0.47 -0.07 -0.55 8.46 8.30 2q34A1 SER 76 HA 0.29 0.04 0.91 -0.75 4.49 4.97 2q34A1 SER 76 HB2 0.19 -0.05 0.12 -0.04 3.95 4.17 2q34A1 SER 76 HB3 0.20 0.05 0.02 -0.04 3.93 4.16 2q34A1 GLY 77 H -0.38 0.13 -0.13 -0.55 8.43 7.50 2q34A1 GLY 77 HA2 -1.89 0.00 0.23 -0.51 4.01 1.84 2q34A1 GLY 77 HA3 -0.47 0.03 0.38 -0.51 4.01 3.44 2q34A1 ALA 78 H -0.21 0.03 0.21 -0.55 8.40 7.88 2q34A1 ALA 78 HA -0.11 -0.00 0.51 -0.75 4.34 3.98 2q34A1 ALA 78 HB3 0.06 0.02 0.10 -0.04 1.41 1.54 2q34A1 SER 79 H 0.00 0.06 0.18 -0.55 8.46 8.16 2q34A1 SER 79 HA -0.03 0.23 0.45 -0.75 4.49 4.39 2q34A1 SER 79 HB2 0.00 0.06 0.13 -0.04 3.95 4.10 2q34A1 SER 79 HB3 0.01 0.06 0.12 -0.04 3.93 4.08 2q34A1 LYS 80 H -0.11 0.24 0.18 -0.55 8.42 8.17 2q34A1 LYS 80 HA -0.06 0.13 0.47 -0.75 4.32 4.10 2q34A1 LYS 80 HB2 -0.52 -0.03 0.14 -0.04 1.87 1.41 2q34A1 LYS 80 HB3 -0.57 0.07 -0.01 -0.04 1.79 1.23 2q34A1 LYS 80 HG2 -0.06 0.06 0.00 -0.04 1.46 1.43 2q34A1 LYS 80 HG3 -0.09 -0.01 0.02 -0.04 1.46 1.35 2q34A1 LYS 80 HD2 -0.65 -0.04 -0.12 -0.04 1.69 0.83 2q34A1 LYS 80 HD3 -0.05 0.15 -0.20 -0.04 1.68 1.54 2q34A1 LYS 80 HE2 -0.16 -0.00 0.01 -0.04 2.99 2.80 2q34A1 LYS 80 HE3 -0.32 -0.12 0.04 -0.04 2.99 2.55 2q34A1 GLU 81 H 0.03 0.07 -0.15 -0.55 8.60 8.00 2q34A1 GLU 81 HA 0.24 0.14 0.42 -0.75 4.29 4.34 2q34A1 GLU 81 HB2 0.11 -0.04 0.01 -0.04 2.09 2.13 2q34A1 GLU 81 HB3 0.13 0.07 0.04 -0.04 1.99 2.19 2q34A1 GLU 81 HG2 0.09 -0.09 0.07 -0.04 2.34 2.37 2q34A1 GLU 81 HG3 0.09 0.03 0.03 -0.04 2.34 2.45 2q34A1 TYR 82 H 0.19 0.03 -0.31 -0.55 8.29 7.66 2q34A1 TYR 82 HA 0.04 0.07 0.45 -0.75 4.56 4.36 2q34A1 TYR 82 HB2 0.03 -0.03 0.09 -0.04 3.06 3.12 2q34A1 TYR 82 HB3 0.02 0.09 0.14 -0.04 2.98 3.20 2q34A1 TYR 82 HD2 0.02 0.04 -0.07 -0.04 7.15 7.10 2q34A1 TYR 82 HE2 -0.00 0.05 -0.02 -0.04 6.85 6.83 2q34A1 LEU 83 H 0.12 0.42 -0.16 -0.55 8.37 8.20 2q34A1 LEU 83 HA -0.22 0.02 0.40 -0.75 4.35 3.79 2q34A1 LEU 83 HB2 0.01 0.10 0.10 -0.04 1.64 1.82 2q34A1 LEU 83 HB3 0.13 0.05 -0.02 -0.04 1.64 1.75 2q34A1 LEU 83 HG 0.14 0.06 -0.10 -0.04 1.64 1.70 2q34A1 LEU 83 HD13 -0.30 0.01 -0.06 -0.04 0.93 0.53 2q34A1 LEU 83 HD23 0.19 -0.02 -0.06 -0.04 0.89 0.96 2q34A1 ILE 84 H 0.09 0.52 -0.15 -0.55 8.25 8.16 2q34A1 ILE 84 HA 0.08 0.05 0.46 -0.75 4.18 4.02 2q34A1 ILE 84 HB 0.12 0.08 0.15 -0.04 1.89 2.19 2q34A1 ILE 84 HG12 0.25 0.12 0.04 -0.04 1.49 1.86 2q34A1 ILE 84 HG13 0.27 -0.05 -0.03 -0.04 1.21 1.36 2q34A1 ILE 84 HG23 0.03 -0.01 -0.09 -0.04 0.93 0.82 2q34A1 ILE 84 HD13 0.10 -0.00 -0.03 -0.04 0.88 0.91 2q34A1 ARG 85 H -0.01 0.41 -0.23 -0.55 8.46 8.07 2q34A1 ARG 85 HA -0.01 0.03 0.37 -0.75 4.34 3.99 2q34A1 ARG 85 HB2 -0.08 0.13 0.17 -0.04 1.90 2.09 2q34A1 ARG 85 HB3 -0.03 -0.05 -0.06 -0.04 1.80 1.62 2q34A1 ARG 85 HG2 0.02 -0.02 0.01 -0.04 1.67 1.64 2q34A1 ARG 85 HG3 0.03 0.03 0.04 -0.04 1.67 1.72 2q34A1 ARG 85 HD2 0.06 -0.05 -0.07 -0.04 3.22 3.12 2q34A1 ARG 85 HD3 0.08 -0.02 -0.18 -0.04 3.22 3.07 2q34A1 LYS 86 H -0.25 0.55 -0.16 -0.55 8.42 8.01 2q34A1 LYS 86 HA -0.16 -0.16 0.44 -0.75 4.32 3.68 2q34A1 LYS 86 HB2 -0.54 0.08 0.15 -0.04 1.87 1.52 2q34A1 LYS 86 HB3 -0.26 0.13 -0.02 -0.04 1.79 1.59 2q34A1 LYS 86 HG2 -0.42 0.02 -0.04 -0.04 1.46 0.98 2q34A1 LYS 86 HG3 -0.40 -0.07 -0.11 -0.04 1.46 0.84 2q34A1 LYS 86 HD2 -0.27 -0.08 -0.15 -0.04 1.69 1.15 2q34A1 LYS 86 HD3 -0.56 -0.02 -0.07 -0.04 1.68 0.99 2q34A1 LYS 86 HE2 -0.65 -0.03 -0.08 -0.04 2.99 2.19 2q34A1 LYS 86 HE3 -2.30 0.09 -0.10 -0.04 2.99 0.63 2q34A1 THR 87 H 0.11 0.41 -0.31 -0.55 8.28 7.95 2q34A1 THR 87 HA 0.30 0.06 0.35 -0.75 4.39 4.35 2q34A1 THR 87 HB -0.04 -0.05 0.11 -0.04 4.32 4.29 2q34A1 THR 87 HG23 -0.09 0.05 0.02 -0.04 1.22 1.16 2q34A1 ARG 88 H 0.02 0.32 -0.34 -0.55 8.46 7.92 2q34A1 ARG 88 HA 0.01 0.12 0.73 -0.75 4.34 4.45 2q34A1 ARG 88 HB2 0.00 0.06 0.10 -0.04 1.90 2.02 2q34A1 ARG 88 HB3 0.00 -0.05 0.16 -0.04 1.80 1.88 2q34A1 ARG 88 HG2 0.00 -0.00 -0.06 -0.04 1.67 1.57 2q34A1 ARG 88 HG3 0.01 0.14 0.03 -0.04 1.67 1.81 2q34A1 ARG 88 HD2 0.00 -0.02 0.02 -0.04 3.22 3.18 2q34A1 ARG 88 HD3 -0.00 -0.04 -0.01 -0.04 3.22 3.13 2q34A1 GLY 89 H 0.03 0.54 -0.54 -0.55 8.43 7.92 2q34A1 GLY 89 HA2 -0.01 0.07 0.33 -0.51 4.01 3.90 2q34A1 GLY 89 HA3 0.00 -0.01 0.30 -0.51 4.01 3.80 2q34A1 GLU 90 H -0.03 0.24 -0.09 -0.55 8.60 8.17 2q34A1 GLU 90 HA -0.01 0.16 0.34 -0.75 4.29 4.03 2q34A1 GLU 90 HB2 -0.02 -0.06 -0.13 -0.04 2.09 1.84 2q34A1 GLU 90 HB3 -0.00 -0.09 0.05 -0.04 1.99 1.91 2q34A1 GLU 90 HG2 -0.00 0.03 -0.10 -0.04 2.34 2.23 2q34A1 GLU 90 HG3 -0.01 0.01 -0.31 -0.04 2.34 1.99 2q34A1 VAL 91 H -0.05 0.14 -0.14 -0.55 8.24 7.64 2q34A1 VAL 91 HA 0.02 0.18 0.79 -0.75 4.13 4.37 2q34A1 VAL 91 HB 0.14 0.02 0.14 -0.04 2.12 2.38 2q34A1 VAL 91 HG13 0.08 -0.01 -0.18 -0.04 0.97 0.82 2q34A1 VAL 91 HG23 -0.24 -0.02 -0.17 -0.04 0.95 0.48 2q34A1 GLU 92 H 0.06 0.10 0.11 -0.55 8.60 8.32 2q34A1 GLU 92 HA -0.00 0.25 0.72 -0.75 4.29 4.50 2q34A1 GLU 92 HB2 0.03 -0.03 -0.00 -0.04 2.09 2.05 2q34A1 GLU 92 HB3 0.01 -0.04 0.09 -0.04 1.99 2.01 2q34A1 GLU 92 HG2 -0.00 0.15 -0.02 -0.04 2.34 2.42 2q34A1 GLU 92 HG3 0.01 -0.00 -0.15 -0.04 2.34 2.15 2q34A1 VAL 93 H 0.01 0.18 0.08 -0.55 8.24 7.96 2q34A1 VAL 93 HA 0.13 0.09 0.65 -0.75 4.13 4.25 2q34A1 VAL 93 HB -0.02 -0.01 0.13 -0.04 2.12 2.17 2q34A1 VAL 93 HG13 -0.05 0.01 -0.11 -0.04 0.97 0.78 2q34A1 VAL 93 HG23 -0.08 0.02 -0.05 -0.04 0.95 0.80 2q34A1 LEU 94 H 0.02 0.14 0.16 -0.55 8.37 8.14 2q34A1 LEU 94 HA -0.03 0.08 0.48 -0.75 4.35 4.12 2q34A1 LEU 94 HB2 -0.11 0.06 0.10 -0.04 1.64 1.66 2q34A1 LEU 94 HB3 -0.05 -0.06 0.07 -0.04 1.64 1.56 2q34A1 LEU 94 HG -0.17 -0.07 -0.22 -0.04 1.64 1.14 2q34A1 LEU 94 HD13 -0.08 0.00 -0.03 -0.04 0.93 0.78 2q34A1 LEU 94 HD23 -0.14 -0.00 -0.06 -0.04 0.89 0.65 2q34A1 ASP 95 H -0.04 0.23 0.06 -0.55 8.40 8.10 2q34A1 ASP 95 HA 0.03 0.09 0.74 -0.75 4.63 4.73 2q34A1 ASP 95 HB2 0.02 0.12 -0.11 -0.04 2.71 2.70 2q34A1 ASP 95 HB3 -0.00 0.06 0.11 -0.04 2.70 2.83 2q34A1 LEU 96 H -0.02 0.22 0.02 -0.55 8.37 8.04 2q34A1 LEU 96 HA -0.11 0.15 0.61 -0.75 4.35 4.25 2q34A1 LEU 96 HB2 -0.11 0.03 -0.00 -0.04 1.64 1.52 2q34A1 LEU 96 HB3 -0.10 0.07 0.08 -0.04 1.64 1.65 2q34A1 LEU 96 HG -0.25 0.04 -0.04 -0.04 1.64 1.35 2q34A1 LEU 96 HD13 -0.53 -0.03 -0.18 -0.04 0.93 0.15 2q34A1 LEU 96 HD23 -0.61 0.02 -0.09 -0.04 0.89 0.18 2q34A1 SER 97 H -0.01 0.06 -0.34 -0.55 8.46 7.63 2q34A1 SER 97 HA -0.58 0.17 0.30 -0.75 4.49 3.63 2q34A1 SER 97 HB2 -0.75 0.14 -0.00 -0.04 3.95 3.29 2q34A1 SER 97 HB3 -0.09 -0.01 0.04 -0.04 3.93 3.84 2q34A1 GLY 98 H -0.13 0.10 -0.21 -0.55 8.43 7.65 2q34A1 GLY 98 HA2 -0.19 0.11 0.19 -0.51 4.01 3.61 2q34A1 GLY 98 HA3 -0.12 0.05 0.22 -0.51 4.01 3.66 2q34A1 LEU 99 H -0.14 -0.01 -0.39 -0.55 8.37 7.28 2q34A1 LEU 99 HA -0.16 0.06 0.30 -0.75 4.35 3.80 2q34A1 LEU 99 HB2 -0.11 -0.09 0.05 -0.04 1.64 1.45 2q34A1 LEU 99 HB3 -0.16 0.17 0.08 -0.04 1.64 1.69 2q34A1 LEU 99 HG -0.22 0.07 -0.24 -0.04 1.64 1.21 2q34A1 LEU 99 HD13 -0.04 0.00 -0.04 -0.04 0.93 0.81 2q34A1 LEU 99 HD23 -0.04 -0.03 -0.08 -0.04 0.89 0.69 2q34A1 ILE 100 H -0.24 0.36 -0.12 -0.55 8.25 7.70 2q34A1 ILE 100 HA -0.60 0.04 0.44 -0.75 4.18 3.31 2q34A1 ILE 100 HB -0.13 0.02 0.09 -0.04 1.89 1.83 2q34A1 ILE 100 HG12 -0.10 -0.02 0.02 -0.04 1.49 1.35 2q34A1 ILE 100 HG13 0.13 0.02 -0.02 -0.04 1.21 1.30 2q34A1 ILE 100 HG23 -0.02 0.03 -0.20 -0.04 0.93 0.69 2q34A1 ILE 100 HD13 -0.19 -0.01 -0.08 -0.04 0.88 0.57 2q34A1 LEU 101 H -0.31 0.72 -0.00 -0.55 8.37 8.23 2q34A1 LEU 101 HA -0.21 0.14 0.33 -0.75 4.35 3.86 2q34A1 LEU 101 HB2 -0.37 -0.06 -0.04 -0.04 1.64 1.13 2q34A1 LEU 101 HB3 -0.32 -0.02 0.02 -0.04 1.64 1.28 2q34A1 LEU 101 HG -0.62 0.01 0.04 -0.04 1.64 1.03 2q34A1 LEU 101 HD13 -1.22 -0.06 -0.11 -0.04 0.93 -0.50 2q34A1 LEU 101 HD23 -0.31 0.02 -0.02 -0.04 0.89 0.54 2q34A1 ASP 102 H -0.20 0.34 -0.43 -0.55 8.40 7.56 2q34A1 ASP 102 HA -0.10 0.04 0.48 -0.75 4.63 4.30 2q34A1 ASP 102 HB2 -0.12 0.12 0.04 -0.04 2.71 2.71 2q34A1 ASP 102 HB3 -0.07 -0.09 -0.05 -0.04 2.70 2.45 2q34A1 CYS 103 H -0.16 0.30 -0.38 -0.55 8.50 7.71 2q34A1 CYS 103 HA 0.03 -0.08 0.42 -0.75 4.58 4.19 2q34A1 CYS 103 HB2 -0.14 -0.04 0.12 -0.04 2.97 2.87 2q34A1 CYS 103 HB3 -0.03 0.17 0.13 -0.04 2.97 3.20 2q34A1 GLU 104 H 0.04 0.04 0.16 -0.55 8.60 8.30 2q34A1 GLU 104 HA 0.01 0.21 0.46 -0.75 4.29 4.22 2q34A1 GLU 104 HB2 0.02 -0.04 0.12 -0.04 2.09 2.14 2q34A1 GLU 104 HB3 0.01 0.04 0.08 -0.04 1.99 2.08 2q34A1 GLU 104 HG2 0.04 -0.03 0.07 -0.04 2.34 2.38 2q34A1 GLU 104 HG3 0.04 0.03 -0.18 -0.04 2.34 2.19 2q34A1 ILE 105 H 0.08 -0.01 -0.20 -0.55 8.25 7.56 2q34A1 ILE 105 HA 0.07 0.20 0.81 -0.75 4.18 4.49 2q34A1 ILE 105 HB 0.08 0.28 -0.15 -0.04 1.89 2.06 2q34A1 ILE 105 HG12 0.11 -0.11 -0.12 -0.04 1.49 1.33 2q34A1 ILE 105 HG13 0.12 -0.00 -0.30 -0.04 1.21 0.98 2q34A1 ILE 105 HG23 0.07 0.01 -0.09 -0.04 0.93 0.88 2q34A1 ILE 105 HD13 0.11 0.00 -0.42 -0.04 0.88 0.53 2q34A1 PRO 106 HA 0.12 0.04 0.43 -0.51 4.44 4.52 2q34A1 PRO 106 HB2 0.17 -0.04 -0.00 -0.04 2.28 2.36 2q34A1 PRO 106 HB3 0.27 0.01 0.09 -0.04 2.02 2.35 2q34A1 PRO 106 HG2 0.10 0.08 0.14 -0.04 2.03 2.31 2q34A1 PRO 106 HG3 0.13 0.02 0.11 -0.04 2.03 2.25 2q34A1 PRO 106 HD2 0.08 0.39 0.27 -0.04 3.68 4.38 2q34A1 PRO 106 HD3 0.08 0.16 0.16 -0.04 3.65 4.00 2q34A1 ILE 107 H 0.15 0.13 0.29 -0.55 8.25 8.26 2q34A1 ILE 107 HA 0.14 0.29 1.00 -0.75 4.18 4.85 2q34A1 ILE 107 HB 0.13 -0.11 0.19 -0.04 1.89 2.06 2q34A1 ILE 107 HG12 0.29 -0.06 -0.06 -0.04 1.49 1.62 2q34A1 ILE 107 HG13 0.15 0.19 -0.19 -0.04 1.21 1.33 2q34A1 ILE 107 HG23 0.20 -0.02 -0.17 -0.04 0.93 0.90 2q34A1 ILE 107 HD13 0.08 -0.00 0.00 -0.04 0.88 0.92 2q34A1 ILE 108 H 0.12 0.75 0.41 -0.55 8.25 8.97 2q34A1 ILE 108 HA 0.20 0.23 0.95 -0.75 4.18 4.80 2q34A1 ILE 108 HB 0.06 -0.05 0.16 -0.04 1.89 2.01 2q34A1 ILE 108 HG12 0.07 0.02 -0.12 -0.04 1.49 1.41 2q34A1 ILE 108 HG13 0.11 -0.03 -0.28 -0.04 1.21 0.97 2q34A1 ILE 108 HG23 0.09 -0.02 -0.28 -0.04 0.93 0.68 2q34A1 ILE 108 HD13 -0.08 0.00 -0.13 -0.04 0.88 0.64 2q34A1 ALA 109 H 0.01 0.79 0.30 -0.55 8.40 8.95 2q34A1 ALA 109 HA 0.07 0.17 1.02 -0.75 4.34 4.84 2q34A1 ALA 109 HB3 -0.20 0.01 0.22 -0.04 1.41 1.39 2q34A1 ALA 110 H 0.04 0.65 0.22 -0.55 8.40 8.77 2q34A1 ALA 110 HA -0.10 0.12 0.54 -0.75 4.34 4.14 2q34A1 ALA 110 HB3 0.03 -0.02 -0.07 -0.04 1.41 1.31 2q34A1 GLN 112 HA -0.03 -0.12 0.18 -0.75 4.36 3.64 2q34A1 GLN 112 HB2 -0.02 -0.01 0.02 -0.04 2.15 2.10 2q34A1 GLN 112 HB3 0.01 0.02 -0.34 -0.04 2.02 1.67 2q34A1 GLN 112 HG2 -0.06 0.07 -0.37 -0.04 2.40 1.99 2q34A1 GLN 112 HG3 -0.01 -0.04 -0.17 -0.04 2.39 2.14 2q34A1 GLN 112 HE21 -0.05 0.28 -0.52 -0.04 6.97 6.63 2q34A1 GLN 112 HE22 -0.12 0.32 -0.73 -0.04 7.69 7.12 2q34A1 GLY 113 H -0.01 0.27 -0.02 -0.55 8.43 8.13 2q34A1 GLY 113 HA2 -0.37 0.10 0.72 -0.51 4.01 3.96 2q34A1 GLY 113 HA3 -0.29 -0.06 -0.33 -0.51 4.01 2.82 2q34A1 HIS 114 H -0.76 0.68 0.45 -0.55 8.41 8.24 2q34A1 HIS 114 HA -0.73 0.16 0.45 -0.75 4.63 3.75 2q34A1 HIS 114 HB2 -0.38 -0.06 0.10 -0.04 3.26 2.89 2q34A1 HIS 114 HB3 -0.87 0.09 0.13 -0.04 3.20 2.52 2q34A1 HIS 114 HD2 -1.13 -0.05 0.05 -0.04 6.97 5.79 2q34A1 HIS 114 HE1 -0.16 0.07 0.10 -0.04 7.75 7.72 2q34A1 SER 115 H -0.67 0.53 0.41 -0.55 8.46 8.18 2q34A1 SER 115 HA -0.10 0.30 0.82 -0.75 4.49 4.76 2q34A1 SER 115 HB2 0.20 -0.05 0.09 -0.04 3.95 4.15 2q34A1 SER 115 HB3 0.15 0.01 -0.37 -0.04 3.93 3.68 2q34A1 PHE 116 H -0.02 0.57 0.26 -0.55 8.34 8.60 2q34A1 PHE 116 HA -0.01 0.28 1.12 -0.75 4.62 5.26 2q34A1 PHE 116 HB2 -0.05 0.08 0.07 -0.04 3.15 3.21 2q34A1 PHE 116 HB3 -0.06 0.02 -0.00 -0.04 3.06 2.97 2q34A1 PHE 116 HD2 0.00 0.00 -0.04 -0.04 7.28 7.21 2q34A1 PHE 116 HE2 0.01 -0.01 -0.13 -0.04 7.38 7.21 2q34A1 PHE 116 HZ -0.32 -0.02 -0.05 -0.04 7.32 6.89 2q34A1 GLY 117 H 0.02 0.72 0.35 -0.55 8.43 8.97 2q34A1 GLY 117 HA2 -0.45 0.01 0.45 -0.51 4.01 3.52 2q34A1 GLY 117 HA3 -0.22 0.05 0.38 -0.51 4.01 3.71 2q34A1 GLY 118 H 0.08 0.15 0.27 -0.55 8.43 8.37 2q34A1 GLY 118 HA2 0.29 0.10 0.45 -0.51 4.01 4.34 2q34A1 GLY 118 HA3 0.38 0.03 0.36 -0.51 4.01 4.26 2q34A1 GLY 119 H -0.08 0.58 -0.35 -0.55 8.43 8.03 2q34A1 GLY 119 HA2 0.14 0.03 0.38 -0.51 4.01 4.05 2q34A1 GLY 119 HA3 -0.01 0.18 0.11 -0.51 4.01 3.78 2q34A1 LEU 120 H 0.07 0.24 -0.62 -0.55 8.37 7.52 2q34A1 LEU 120 HA 0.05 0.11 0.47 -0.75 4.35 4.23 2q34A1 LEU 120 HB2 0.09 0.06 -0.13 -0.04 1.64 1.62 2q34A1 LEU 120 HB3 0.07 0.08 -0.02 -0.04 1.64 1.73 2q34A1 LEU 120 HG 0.03 0.00 -0.31 -0.04 1.64 1.32 2q34A1 LEU 120 HD13 0.02 0.00 -0.05 -0.04 0.93 0.87 2q34A1 LEU 120 HD23 0.11 -0.01 -0.22 -0.04 0.89 0.73 2q34A1 LEU 121 H 0.06 0.34 -0.20 -0.55 8.37 8.02 2q34A1 LEU 121 HA -0.17 0.08 0.29 -0.75 4.35 3.79 2q34A1 LEU 121 HB2 0.05 -0.06 0.13 -0.04 1.64 1.72 2q34A1 LEU 121 HB3 -0.45 0.02 -0.11 -0.04 1.64 1.06 2q34A1 LEU 121 HG 0.11 -0.03 -0.05 -0.04 1.64 1.63 2q34A1 LEU 121 HD13 -0.04 0.02 -0.11 -0.04 0.93 0.75 2q34A1 LEU 121 HD23 0.12 -0.00 -0.07 -0.04 0.89 0.90 2q34A1 LEU 122 H 0.07 0.51 -0.28 -0.55 8.37 8.12 2q34A1 LEU 122 HA 0.03 -0.03 0.28 -0.75 4.35 3.88 2q34A1 LEU 122 HB2 0.30 -0.08 0.05 -0.04 1.64 1.87 2q34A1 LEU 122 HB3 0.28 0.15 0.07 -0.04 1.64 2.11 2q34A1 LEU 122 HG 0.25 0.07 -0.35 -0.04 1.64 1.57 2q34A1 LEU 122 HD13 0.12 -0.02 -0.05 -0.04 0.93 0.93 2q34A1 LEU 122 HD23 0.10 -0.01 -0.09 -0.04 0.89 0.84 2q34A1 GLY 123 H 0.15 0.29 -0.39 -0.55 8.43 7.93 2q34A1 GLY 123 HA2 0.08 0.02 0.42 -0.51 4.01 4.01 2q34A1 GLY 123 HA3 -0.24 0.04 0.24 -0.51 4.01 3.54 2q34A1 LEU 124 H -0.14 0.41 -0.18 -0.55 8.37 7.92 2q34A1 LEU 124 HA -0.15 0.11 0.33 -0.75 4.35 3.87 2q34A1 LEU 124 HB2 -0.10 -0.06 -0.01 -0.04 1.64 1.44 2q34A1 LEU 124 HB3 0.00 -0.01 -0.04 -0.04 1.64 1.55 2q34A1 LEU 124 HG -0.14 0.07 -0.08 -0.04 1.64 1.45 2q34A1 LEU 124 HD13 0.04 -0.04 -0.17 -0.04 0.93 0.71 2q34A1 LEU 124 HD23 -0.14 0.01 -0.15 -0.04 0.89 0.57 2q34A1 TYR 125 H -0.08 0.35 -0.46 -0.55 8.29 7.55 2q34A1 TYR 125 HA 0.03 0.00 0.49 -0.75 4.56 4.32 2q34A1 TYR 125 HB2 0.01 0.17 0.00 -0.04 3.06 3.20 2q34A1 TYR 125 HB3 -0.05 -0.06 -0.04 -0.04 2.98 2.79 2q34A1 TYR 125 HD2 0.07 0.05 -0.09 -0.04 7.15 7.14 2q34A1 TYR 125 HE2 0.22 -0.08 -0.13 -0.04 6.85 6.82 2q34A1 ALA 126 H 0.06 0.29 -0.43 -0.55 8.40 7.78 2q34A1 ALA 126 HA 0.07 0.01 0.40 -0.75 4.34 4.07 2q34A1 ALA 126 HB3 0.06 0.03 0.02 -0.04 1.41 1.48 2q34A1 ASP 127 H 0.07 0.14 0.32 -0.55 8.40 8.38 2q34A1 ASP 127 HA -0.12 0.12 0.54 -0.75 4.63 4.41 2q34A1 ASP 127 HB2 0.12 0.01 0.20 -0.04 2.71 3.01 2q34A1 ASP 127 HB3 -0.25 -0.02 0.11 -0.04 2.70 2.49 2q34A1 PHE 128 H 0.19 0.42 0.26 -0.55 8.34 8.66 2q34A1 PHE 128 HA 0.20 0.22 0.83 -0.75 4.62 5.12 2q34A1 PHE 128 HB2 0.07 -0.10 0.04 -0.04 3.15 3.12 2q34A1 PHE 128 HB3 0.13 -0.00 0.02 -0.04 3.06 3.16 2q34A1 PHE 128 HD2 0.10 0.01 -0.08 -0.04 7.28 7.27 2q34A1 PHE 128 HE2 0.06 -0.02 -0.04 -0.04 7.38 7.34 2q34A1 PHE 128 HZ 0.05 -0.02 -0.03 -0.04 7.32 7.27 2q34A1 VAL 129 H 0.26 0.29 0.16 -0.55 8.24 8.40 2q34A1 VAL 129 HA -0.21 0.18 0.95 -0.75 4.13 4.29 2q34A1 VAL 129 HB -1.29 -0.03 -0.05 -0.04 2.12 0.71 2q34A1 VAL 129 HG13 -0.86 -0.02 -0.15 -0.04 0.97 -0.10 2q34A1 VAL 129 HG23 -0.39 0.03 -0.35 -0.04 0.95 0.20 2q34A1 VAL 130 H -0.27 0.74 0.32 -0.55 8.24 8.48 2q34A1 VAL 130 HA -0.03 0.25 0.89 -0.75 4.13 4.48 2q34A1 VAL 130 HB -0.08 -0.09 0.13 -0.04 2.12 2.04 2q34A1 VAL 130 HG13 -0.17 0.01 -0.08 -0.04 0.97 0.68 2q34A1 VAL 130 HG23 0.10 -0.01 -0.21 -0.04 0.95 0.79 2q34A1 PHE 131 H 0.14 0.72 0.25 -0.55 8.34 8.90 2q34A1 PHE 131 HA -0.26 0.18 0.87 -0.75 4.62 4.65 2q34A1 PHE 131 HB2 -0.19 0.05 0.02 -0.04 3.15 2.98 2q34A1 PHE 131 HB3 -0.31 -0.02 -0.04 -0.04 3.06 2.64 2q34A1 PHE 131 HD2 -0.95 0.04 -0.18 -0.04 7.28 6.15 2q34A1 PHE 131 HE2 -0.65 0.01 -0.16 -0.04 7.38 6.54 2q34A1 PHE 131 HZ -0.35 0.01 -0.15 -0.04 7.32 6.79 2q34A1 SER 132 H 0.22 0.21 0.09 -0.55 8.46 8.43 2q34A1 SER 132 HA 0.04 0.40 0.82 -0.75 4.49 4.99 2q34A1 SER 132 HB2 0.01 0.14 0.02 -0.04 3.95 4.07 2q34A1 SER 132 HB3 0.10 0.06 -0.03 -0.04 3.93 4.02 2q34A1 GLN 133 H 0.03 0.54 0.05 -0.55 8.47 8.55 2q34A1 GLN 133 HA 0.06 0.04 0.16 -0.75 4.36 3.87 2q34A1 GLN 133 HB2 0.02 -0.12 -0.01 -0.04 2.15 1.99 2q34A1 GLN 133 HB3 0.02 0.02 -0.09 -0.04 2.02 1.94 2q34A1 GLN 133 HG2 0.01 0.08 -0.20 -0.04 2.40 2.25 2q34A1 GLN 133 HG3 0.01 0.03 -0.51 -0.04 2.39 1.88 2q34A1 GLN 133 HE21 0.00 -0.00 0.01 -0.04 6.97 6.93 2q34A1 GLN 133 HE22 -0.01 0.25 -0.02 -0.04 7.69 7.87 2q34A1 GLU 134 H 0.02 0.01 -0.17 -0.55 8.60 7.92 2q34A1 GLU 134 HA 0.02 0.13 0.42 -0.75 4.29 4.12 2q34A1 GLU 134 HB2 -0.03 -0.00 0.05 -0.04 2.09 2.07 2q34A1 GLU 134 HB3 -0.01 0.07 0.10 -0.04 1.99 2.11 2q34A1 GLU 134 HG2 -0.01 0.06 0.04 -0.04 2.34 2.40 2q34A1 GLU 134 HG3 0.01 0.05 -0.05 -0.04 2.34 2.31 2q34A1 SER 135 H 0.03 0.07 -0.29 -0.55 8.46 7.73 2q34A1 SER 135 HA -0.05 0.14 0.59 -0.75 4.49 4.41 2q34A1 SER 135 HB2 -0.14 0.06 -0.15 -0.04 3.95 3.68 2q34A1 SER 135 HB3 -0.47 -0.01 -0.23 -0.04 3.93 3.18 2q34A1 VAL 136 H 0.23 0.12 0.19 -0.55 8.24 8.22 2q34A1 VAL 136 HA -0.06 0.29 0.68 -0.75 4.13 4.29 2q34A1 VAL 136 HB -0.14 -0.05 0.08 -0.04 2.12 1.97 2q34A1 VAL 136 HG13 0.10 -0.01 -0.18 -0.04 0.97 0.84 2q34A1 VAL 136 HG23 -0.01 0.01 -0.24 -0.04 0.95 0.67 2q34A1 TYR 137 H 0.13 0.66 0.33 -0.55 8.29 8.86 2q34A1 TYR 137 HA -0.10 0.28 0.98 -0.75 4.56 4.96 2q34A1 TYR 137 HB2 0.13 0.03 0.05 -0.04 3.06 3.23 2q34A1 TYR 137 HB3 0.10 0.00 0.02 -0.04 2.98 3.06 2q34A1 TYR 137 HD2 0.02 0.07 -0.07 -0.04 7.15 7.13 2q34A1 TYR 137 HE2 -0.07 0.11 -0.05 -0.04 6.85 6.80 2q34A1 ALA 138 H 0.14 0.49 0.37 -0.55 8.40 8.85 2q34A1 ALA 138 HA 0.22 0.25 0.69 -0.75 4.34 4.75 2q34A1 ALA 138 HB3 0.22 0.02 -0.23 -0.04 1.41 1.38 2q34A1 THR 139 H 0.12 0.40 0.01 -0.55 8.28 8.26 2q34A1 THR 139 HA -0.07 -0.07 0.83 -0.75 4.39 4.31 2q34A1 THR 139 HB 0.30 -0.07 0.15 -0.04 4.32 4.65 2q34A1 THR 139 HG23 0.13 0.01 -0.03 -0.04 1.22 1.29 2q34A1 ASN 140 H -0.31 -0.01 -0.05 -0.55 8.53 7.61 2q34A1 ASN 140 HA -0.08 0.34 0.66 -0.75 4.76 4.93 2q34A1 ASN 140 HB2 -0.28 0.09 0.14 -0.04 2.88 2.79 2q34A1 ASN 140 HB3 -0.09 0.09 -0.03 -0.04 2.79 2.71 2q34A1 ASN 140 HD21 -0.10 -0.03 -0.06 -0.04 7.03 6.79 2q34A1 ASN 140 HD22 -0.24 0.09 -0.04 -0.04 7.74 7.51 2q34A1 PHE 141 H -0.53 -0.05 -0.26 -0.55 8.34 6.95 2q34A1 PHE 141 HA 0.06 -0.03 0.23 -0.75 4.62 4.13 2q34A1 PHE 141 HB2 0.09 0.15 -0.02 -0.04 3.15 3.33 2q34A1 PHE 141 HB3 0.24 0.14 -0.20 -0.04 3.06 3.20 2q34A1 PHE 141 HD2 0.27 0.16 -0.03 -0.04 7.28 7.64 2q34A1 PHE 141 HE2 0.13 0.02 0.04 -0.04 7.38 7.52 2q34A1 PHE 141 HZ 0.11 0.01 -0.06 -0.04 7.32 7.34 2q34A1 LYS 143 HA -0.13 -0.01 0.33 -0.75 4.32 3.76 2q34A1 LYS 143 HB2 -0.19 0.04 0.13 -0.04 1.87 1.80 2q34A1 LYS 143 HB3 -0.46 0.13 0.08 -0.04 1.79 1.50 2q34A1 LYS 143 HG2 -0.48 -0.02 -0.17 -0.04 1.46 0.74 2q34A1 LYS 143 HG3 -0.21 -0.02 0.02 -0.04 1.46 1.20 2q34A1 LYS 143 HD2 -0.25 0.02 0.01 -0.04 1.69 1.43 2q34A1 LYS 143 HD3 -0.26 -0.03 -0.01 -0.04 1.68 1.33 2q34A1 LYS 143 HE2 -0.13 -0.01 -0.00 -0.04 2.99 2.81 2q34A1 LYS 143 HE3 -0.12 0.08 -0.04 -0.04 2.99 2.87 2q34A1 TYR 144 H -0.34 0.35 -0.43 -0.55 8.29 7.32 2q34A1 TYR 144 HA -0.08 0.08 0.58 -0.75 4.56 4.39 2q34A1 TYR 144 HB2 -0.84 0.07 0.07 -0.04 3.06 2.32 2q34A1 TYR 144 HB3 0.01 -0.08 0.06 -0.04 2.98 2.93 2q34A1 TYR 144 HD2 -0.10 0.04 -0.04 -0.04 7.15 7.01 2q34A1 TYR 144 HE2 -0.05 -0.08 -0.09 -0.04 6.85 6.58 2q34A1 GLY 145 H -0.17 0.36 0.05 -0.55 8.43 8.12 2q34A1 GLY 145 HA2 -0.01 0.02 0.09 -0.51 4.01 3.60 2q34A1 GLY 145 HA3 0.02 0.09 0.50 -0.51 4.01 4.11 2q34A1 PHE 146 H -0.45 0.36 0.04 -0.55 8.34 7.74 2q34A1 PHE 146 HA 0.08 0.20 0.82 -0.75 4.62 4.96 2q34A1 PHE 146 HB2 0.10 -0.09 -0.03 -0.04 3.15 3.09 2q34A1 PHE 146 HB3 0.06 0.17 -0.30 -0.04 3.06 2.94 2q34A1 PHE 146 HD2 0.25 0.18 -0.25 -0.04 7.28 7.42 2q34A1 PHE 146 HE2 0.40 -0.08 -0.06 -0.04 7.38 7.59 2q34A1 PHE 146 HZ 0.17 -0.10 -0.05 -0.04 7.32 7.30 2q34A1 THR 147 H 0.31 0.09 0.08 -0.55 8.28 8.21 2q34A1 THR 147 HA 0.13 0.17 0.41 -0.75 4.39 4.34 2q34A1 THR 147 HB 0.04 0.00 0.07 -0.04 4.32 4.40 2q34A1 THR 147 HG23 0.05 0.01 -0.05 -0.04 1.22 1.20 2q34A1 PRO 148 HA -1.31 0.04 0.43 -0.51 4.44 3.09 2q34A1 PRO 148 HB2 -0.24 -0.15 -0.05 -0.04 2.28 1.81 2q34A1 PRO 148 HB3 -0.58 -0.00 0.11 -0.04 2.02 1.51 2q34A1 PRO 148 HG2 -0.00 0.03 0.03 -0.04 2.03 2.05 2q34A1 PRO 148 HG3 0.15 0.13 0.08 -0.04 2.03 2.34 2q34A1 PRO 148 HD2 -0.04 0.05 0.15 -0.04 3.68 3.79 2q34A1 PRO 148 HD3 0.03 0.24 0.20 -0.04 3.65 4.08 2q34A1 VAL 149 H -0.94 0.15 0.21 -0.55 8.24 7.11 2q34A1 VAL 149 HA -0.20 0.19 0.69 -0.75 4.13 4.06 2q34A1 VAL 149 HB -0.16 -0.03 0.11 -0.04 2.12 1.99 2q34A1 VAL 149 HG13 -0.60 0.05 -0.13 -0.04 0.97 0.25 2q34A1 VAL 149 HG23 -0.13 -0.01 -0.03 -0.04 0.95 0.74 2q34A1 GLY 150 H -0.08 0.22 0.15 -0.55 8.43 8.18 2q34A1 GLY 150 HA2 0.08 0.05 0.29 -0.51 4.01 3.91 2q34A1 GLY 150 HA3 0.13 0.16 0.44 -0.51 4.01 4.23 2q34A1 ALA 151 H -0.11 0.07 -0.12 -0.55 8.40 7.69 2q34A1 ALA 151 HA -0.16 0.03 0.15 -0.75 4.34 3.60 2q34A1 ALA 151 HB3 -0.59 0.08 0.06 -0.04 1.41 0.93 2q34A1 THR 152 H -0.04 0.10 -0.39 -0.55 8.28 7.40 2q34A1 THR 152 HA 0.08 0.13 0.28 -0.75 4.39 4.12 2q34A1 THR 152 HB -0.02 -0.04 -0.00 -0.04 4.32 4.22 2q34A1 THR 152 HG23 0.19 0.02 -0.09 -0.04 1.22 1.30 2q34A1 SER 153 H -0.02 0.05 -0.24 -0.55 8.46 7.70 2q34A1 SER 153 HA 0.03 0.16 0.29 -0.75 4.49 4.21 2q34A1 SER 153 HB2 0.00 0.08 -0.02 -0.04 3.95 3.98 2q34A1 SER 153 HB3 -0.01 0.04 -0.00 -0.04 3.93 3.92 2q34A1 LEU 154 H -0.03 -0.02 -0.30 -0.55 8.37 7.48 2q34A1 LEU 154 HA 0.01 0.07 0.42 -0.75 4.35 4.10 2q34A1 LEU 154 HB2 -0.05 -0.06 0.05 -0.04 1.64 1.54 2q34A1 LEU 154 HB3 -0.06 0.08 0.10 -0.04 1.64 1.72 2q34A1 LEU 154 HG 0.08 0.07 -0.28 -0.04 1.64 1.48 2q34A1 LEU 154 HD13 0.02 -0.00 -0.01 -0.04 0.93 0.90 2q34A1 LEU 154 HD23 -0.02 0.02 -0.11 -0.04 0.89 0.74 2q34A1 ILE 155 H 0.07 0.52 -0.14 -0.55 8.25 8.16 2q34A1 ILE 155 HA 0.14 0.09 0.29 -0.75 4.18 3.94 2q34A1 ILE 155 HB 0.15 -0.02 0.06 -0.04 1.89 2.04 2q34A1 ILE 155 HG12 0.30 -0.01 0.04 -0.04 1.49 1.78 2q34A1 ILE 155 HG13 0.67 -0.00 -0.06 -0.04 1.21 1.77 2q34A1 ILE 155 HG23 0.13 0.02 -0.25 -0.04 0.93 0.79 2q34A1 ILE 155 HD13 0.39 0.02 -0.07 -0.04 0.88 1.17 2q34A1 LEU 156 H 0.07 0.68 -0.05 -0.55 8.37 8.53 2q34A1 LEU 156 HA 0.08 0.03 0.30 -0.75 4.35 4.00 2q34A1 LEU 156 HB2 0.06 0.31 0.13 -0.04 1.64 2.11 2q34A1 LEU 156 HB3 0.05 -0.01 -0.11 -0.04 1.64 1.54 2q34A1 LEU 156 HG 0.06 -0.01 -0.03 -0.04 1.64 1.61 2q34A1 LEU 156 HD13 0.08 -0.04 -0.06 -0.04 0.93 0.87 2q34A1 LEU 156 HD23 0.07 -0.01 -0.03 -0.04 0.89 0.88 2q34A1 ARG 157 H 0.05 0.45 -0.27 -0.55 8.46 8.14 2q34A1 ARG 157 HA 0.03 0.04 0.21 -0.75 4.34 3.87 2q34A1 ARG 157 HB2 0.03 0.18 0.10 -0.04 1.90 2.17 2q34A1 ARG 157 HB3 0.02 -0.11 -0.05 -0.04 1.80 1.62 2q34A1 ARG 157 HG2 0.03 -0.04 -0.05 -0.04 1.67 1.58 2q34A1 ARG 157 HG3 0.03 0.15 0.08 -0.04 1.67 1.88 2q34A1 ARG 157 HD2 0.03 -0.07 -0.00 -0.04 3.22 3.13 2q34A1 ARG 157 HD3 0.04 0.01 -0.02 -0.04 3.22 3.21 2q34A1 GLU 158 H 0.05 0.52 -0.17 -0.55 8.60 8.46 2q34A1 GLU 158 HA 0.03 -0.02 0.49 -0.75 4.29 4.04 2q34A1 GLU 158 HB2 0.05 -0.07 0.11 -0.04 2.09 2.14 2q34A1 GLU 158 HB3 0.07 0.12 0.16 -0.04 1.99 2.30 2q34A1 GLU 158 HG2 0.05 -0.04 -0.02 -0.04 2.34 2.29 2q34A1 GLU 158 HG3 0.04 0.08 -0.24 -0.04 2.34 2.18 2q34A1 LYS 159 H 0.09 0.44 -0.16 -0.55 8.42 8.24 2q34A1 LYS 159 HA 0.09 0.14 0.45 -0.75 4.32 4.25 2q34A1 LYS 159 HB2 0.21 -0.07 0.03 -0.04 1.87 2.00 2q34A1 LYS 159 HB3 0.50 -0.02 -0.02 -0.04 1.79 2.21 2q34A1 LYS 159 HG2 0.13 -0.09 0.01 -0.04 1.46 1.46 2q34A1 LYS 159 HG3 0.14 -0.02 -0.02 -0.04 1.46 1.52 2q34A1 LYS 159 HD2 0.22 0.05 -0.03 -0.04 1.69 1.90 2q34A1 LYS 159 HD3 0.19 -0.05 -0.04 -0.04 1.68 1.73 2q34A1 LYS 159 HE2 0.08 -0.12 -0.04 -0.04 2.99 2.86 2q34A1 LYS 159 HE3 0.12 -0.11 -0.00 -0.04 2.99 2.95 2q34A1 LEU 160 H 0.09 0.57 0.07 -0.55 8.37 8.56 2q34A1 LEU 160 HA 0.07 0.11 0.68 -0.75 4.35 4.46 2q34A1 LEU 160 HB2 0.03 0.14 0.01 -0.04 1.64 1.78 2q34A1 LEU 160 HB3 -0.01 -0.11 0.06 -0.04 1.64 1.54 2q34A1 LEU 160 HG 0.11 -0.00 0.02 -0.04 1.64 1.72 2q34A1 LEU 160 HD13 0.01 -0.03 -0.11 -0.04 0.93 0.76 2q34A1 LEU 160 HD23 0.18 -0.00 -0.15 -0.04 0.89 0.87 2q34A1 GLY 161 H 0.02 0.26 -0.35 -0.55 8.43 7.81 2q34A1 GLY 161 HA2 -0.01 0.08 0.40 -0.51 4.01 3.98 2q34A1 GLY 161 HA3 -0.02 0.12 0.76 -0.51 4.01 4.37 2q34A1 SER 162 H 0.00 0.17 0.16 -0.55 8.46 8.25 2q34A1 SER 162 HA 0.02 0.06 0.28 -0.75 4.49 4.10 2q34A1 SER 162 HB2 0.02 0.01 0.03 -0.04 3.95 3.97 2q34A1 SER 162 HB3 0.02 0.05 0.11 -0.04 3.93 4.06 2q34A1 GLU 163 H 0.00 0.11 -0.16 -0.55 8.60 8.01 2q34A1 GLU 163 HA 0.02 0.08 0.37 -0.75 4.29 4.00 2q34A1 GLU 163 HB2 -0.00 0.02 0.10 -0.04 2.09 2.16 2q34A1 GLU 163 HB3 -0.00 0.08 -0.07 -0.04 1.99 1.95 2q34A1 GLU 163 HG2 -0.00 0.04 0.01 -0.04 2.34 2.35 2q34A1 GLU 163 HG3 0.00 0.01 0.01 -0.04 2.34 2.33 2q34A1 LEU 164 H -0.02 0.19 -0.12 -0.55 8.37 7.87 2q34A1 LEU 164 HA -0.05 0.03 0.46 -0.75 4.35 4.03 2q34A1 LEU 164 HB2 -0.05 0.08 0.06 -0.04 1.64 1.69 2q34A1 LEU 164 HB3 -0.06 0.08 -0.13 -0.04 1.64 1.48 2q34A1 LEU 164 HG -0.09 0.03 -0.02 -0.04 1.64 1.52 2q34A1 LEU 164 HD13 -0.14 0.01 -0.05 -0.04 0.93 0.71 2q34A1 LEU 164 HD23 -0.25 -0.03 -0.02 -0.04 0.89 0.55 2q34A1 ALA 165 H 0.00 0.49 -0.35 -0.55 8.40 7.99 2q34A1 ALA 165 HA 0.01 -0.01 0.24 -0.75 4.34 3.83 2q34A1 ALA 165 HB3 0.03 0.03 -0.22 -0.04 1.41 1.21 2q34A1 GLN 166 H 0.05 0.42 -0.29 -0.55 8.47 8.11 2q34A1 GLN 166 HA 0.14 -0.04 0.26 -0.75 4.36 3.97 2q34A1 GLN 166 HB2 0.09 0.19 0.16 -0.04 2.15 2.55 2q34A1 GLN 166 HB3 0.10 0.02 0.07 -0.04 2.02 2.17 2q34A1 GLN 166 HG2 0.31 -0.02 -0.07 -0.04 2.40 2.58 2q34A1 GLN 166 HG3 0.32 -0.04 0.03 -0.04 2.39 2.65 2q34A1 GLN 166 HE21 0.09 -0.04 -0.03 -0.04 6.97 6.94 2q34A1 GLN 166 HE22 0.08 0.00 -0.04 -0.04 7.69 7.69 2q34A1 GLU 167 H 0.06 0.46 -0.16 -0.55 8.60 8.42 2q34A1 GLU 167 HA 0.13 -0.03 0.31 -0.75 4.29 3.94 2q34A1 GLU 167 HB2 0.05 0.02 0.11 -0.04 2.09 2.23 2q34A1 GLU 167 HB3 0.03 0.13 0.13 -0.04 1.99 2.23 2q34A1 GLU 167 HG2 0.23 -0.05 0.10 -0.04 2.34 2.57 2q34A1 GLU 167 HG3 0.10 -0.04 0.06 -0.04 2.34 2.42 2q34A1 ILE 169 HA 0.13 -0.10 0.38 -0.75 4.18 3.83 2q34A1 ILE 169 HB 0.03 0.07 0.04 -0.04 1.89 1.99 2q34A1 ILE 169 HG12 0.12 -0.17 0.02 -0.04 1.49 1.42 2q34A1 ILE 169 HG13 0.08 0.20 0.12 -0.04 1.21 1.57 2q34A1 ILE 169 HG23 -0.00 -0.04 -0.11 -0.04 0.93 0.73 2q34A1 ILE 169 HD13 0.04 -0.04 -0.17 -0.04 0.88 0.67 2q34A1 TYR 170 H 0.26 0.73 -0.44 -0.55 8.29 8.29 2q34A1 TYR 170 HA 0.06 -0.01 0.37 -0.75 4.56 4.23 2q34A1 TYR 170 HB2 0.05 0.16 0.13 -0.04 3.06 3.36 2q34A1 TYR 170 HB3 0.04 -0.06 -0.09 -0.04 2.98 2.83 2q34A1 TYR 170 HD2 0.03 0.15 -0.01 -0.04 7.15 7.29 2q34A1 TYR 170 HE2 0.03 -0.04 -0.03 -0.04 6.85 6.76 2q34A1 THR 171 H 0.20 0.59 0.24 -0.55 8.28 8.76 2q34A1 THR 171 HA 0.09 0.11 0.64 -0.75 4.39 4.47 2q34A1 THR 171 HB 0.05 -0.05 0.10 -0.04 4.32 4.38 2q34A1 THR 171 HG23 0.11 0.03 0.08 -0.04 1.22 1.39 2q34A1 GLY 172 H 0.12 0.18 -0.16 -0.55 8.43 8.03 2q34A1 GLY 172 HA2 0.07 0.31 0.39 -0.51 4.01 4.26 2q34A1 GLY 172 HA3 -0.00 0.18 0.54 -0.51 4.01 4.21 2q34A1 GLU 173 H 0.12 -0.01 -0.41 -0.55 8.60 7.76 2q34A1 GLU 173 HA -0.05 0.11 0.24 -0.75 4.29 3.83 2q34A1 GLU 173 HB2 -0.11 -0.03 -0.05 -0.04 2.09 1.86 2q34A1 GLU 173 HB3 -0.28 0.03 -0.04 -0.04 1.99 1.66 2q34A1 GLU 173 HG2 -0.07 0.07 -0.04 -0.04 2.34 2.26 2q34A1 GLU 173 HG3 -0.03 0.02 -0.03 -0.04 2.34 2.25 2q34A1 ASN 174 H -0.09 0.12 0.12 -0.55 8.53 8.13 2q34A1 ASN 174 HA 0.14 0.17 0.60 -0.75 4.76 4.91 2q34A1 ASN 174 HB2 -0.05 -0.01 0.13 -0.04 2.88 2.90 2q34A1 ASN 174 HB3 0.03 -0.06 -0.09 -0.04 2.79 2.64 2q34A1 ASN 174 HD21 -0.13 0.04 -0.02 -0.04 7.03 6.87 2q34A1 ASN 174 HD22 -0.07 -0.02 0.00 -0.04 7.74 7.62 2q34A1 TYR 175 H 0.33 0.78 0.35 -0.55 8.29 9.21 2q34A1 TYR 175 HA 0.04 0.11 0.92 -0.75 4.56 4.88 2q34A1 TYR 175 HB2 0.11 0.05 0.13 -0.04 3.06 3.30 2q34A1 TYR 175 HB3 0.06 -0.00 -0.04 -0.04 2.98 2.95 2q34A1 TYR 175 HD2 0.04 0.09 -0.07 -0.04 7.15 7.17 2q34A1 TYR 175 HE2 0.03 0.00 -0.10 -0.04 6.85 6.74 2q34A1 ARG 176 H 0.08 0.11 0.13 -0.55 8.46 8.23 2q34A1 ARG 176 HA 0.11 0.37 0.72 -0.75 4.34 4.79 2q34A1 ARG 176 HB2 0.06 -0.13 0.15 -0.04 1.90 1.94 2q34A1 ARG 176 HB3 0.07 0.10 0.15 -0.04 1.80 2.08 2q34A1 ARG 176 HG2 0.03 0.12 -0.12 -0.04 1.67 1.66 2q34A1 ARG 176 HG3 0.02 -0.03 -0.01 -0.04 1.67 1.61 2q34A1 ARG 176 HD2 0.02 0.05 0.03 -0.04 3.22 3.29 2q34A1 ARG 176 HD3 0.01 0.00 0.01 -0.04 3.22 3.20 2q34A1 GLY 177 H 0.26 0.58 0.15 -0.55 8.43 8.88 2q34A1 GLY 177 HA2 0.11 0.03 0.41 -0.51 4.01 4.04 2q34A1 GLY 177 HA3 0.20 0.25 0.25 -0.51 4.01 4.19 2q34A1 LYS 178 H 0.07 0.49 -0.06 -0.55 8.42 8.37 2q34A1 LYS 178 HA 0.01 0.05 0.32 -0.75 4.32 3.94 2q34A1 LYS 178 HB2 0.02 0.01 0.09 -0.04 1.87 1.96 2q34A1 LYS 178 HB3 0.03 -0.01 0.05 -0.04 1.79 1.82 2q34A1 LYS 178 HG2 0.01 0.01 -0.05 -0.04 1.46 1.38 2q34A1 LYS 178 HG3 0.01 -0.01 0.01 -0.04 1.46 1.42 2q34A1 LYS 178 HD2 0.01 -0.02 -0.03 -0.04 1.69 1.61 2q34A1 LYS 178 HD3 0.01 0.01 -0.06 -0.04 1.68 1.60 2q34A1 LYS 178 HE2 0.00 0.02 -0.04 -0.04 2.99 2.94 2q34A1 LYS 178 HE3 0.00 -0.01 -0.02 -0.04 2.99 2.92 2q34A1 GLU 179 H 0.06 0.13 -0.29 -0.55 8.60 7.96 2q34A1 GLU 179 HA 0.04 0.06 0.45 -0.75 4.29 4.08 2q34A1 GLU 179 HB2 0.15 0.13 0.09 -0.04 2.09 2.42 2q34A1 GLU 179 HB3 0.11 0.04 0.04 -0.04 1.99 2.14 2q34A1 GLU 179 HG2 0.03 0.02 0.03 -0.04 2.34 2.38 2q34A1 GLU 179 HG3 0.05 -0.09 0.09 -0.04 2.34 2.35 2q34A1 LEU 180 H 0.03 0.43 -0.22 -0.55 8.37 8.06 2q34A1 LEU 180 HA -0.07 0.05 0.41 -0.75 4.35 3.99 2q34A1 LEU 180 HB2 -0.21 0.13 0.11 -0.04 1.64 1.62 2q34A1 LEU 180 HB3 -0.30 -0.02 -0.03 -0.04 1.64 1.25 2q34A1 LEU 180 HG 0.06 0.08 -0.10 -0.04 1.64 1.64 2q34A1 LEU 180 HD13 -0.17 -0.01 -0.12 -0.04 0.93 0.59 2q34A1 LEU 180 HD23 -0.24 0.00 -0.07 -0.04 0.89 0.53 2q34A1 ALA 181 H -0.07 0.53 -0.13 -0.55 8.40 8.19 2q34A1 ALA 181 HA -0.09 0.10 0.45 -0.75 4.34 4.04 2q34A1 ALA 181 HB3 -0.05 0.02 0.09 -0.04 1.41 1.42 2q34A1 GLU 182 H -0.02 0.41 -0.22 -0.55 8.60 8.22 2q34A1 GLU 182 HA -0.01 0.02 0.40 -0.75 4.29 3.94 2q34A1 GLU 182 HB2 0.01 0.09 0.17 -0.04 2.09 2.31 2q34A1 GLU 182 HB3 0.00 -0.05 0.07 -0.04 1.99 1.97 2q34A1 GLU 182 HG2 -0.00 -0.04 0.04 -0.04 2.34 2.30 2q34A1 GLU 182 HG3 -0.00 0.15 0.08 -0.04 2.34 2.53 2q34A1 ARG 183 H -0.03 0.26 -0.49 -0.55 8.46 7.66 2q34A1 ARG 183 HA -0.01 0.01 0.46 -0.75 4.34 4.04 2q34A1 ARG 183 HB2 -0.02 0.17 0.19 -0.04 1.90 2.21 2q34A1 ARG 183 HB3 -0.06 0.04 -0.00 -0.04 1.80 1.73 2q34A1 ARG 183 HG2 -0.04 -0.05 0.00 -0.04 1.67 1.54 2q34A1 ARG 183 HG3 -0.02 -0.03 0.08 -0.04 1.67 1.67 2q34A1 ARG 183 HD2 0.02 0.01 -0.03 -0.04 3.22 3.18 2q34A1 ARG 183 HD3 0.07 -0.03 -0.04 -0.04 3.22 3.18 2q34A1 GLY 184 H -0.05 0.38 -0.41 -0.55 8.43 7.81 2q34A1 GLY 184 HA2 -0.05 0.05 0.27 -0.51 4.01 3.77 2q34A1 GLY 184 HA3 -0.04 0.02 0.54 -0.51 4.01 4.01 2q34A1 ILE 185 H -0.10 0.32 0.00 -0.55 8.25 7.92 2q34A1 ILE 185 HA -0.09 0.16 0.55 -0.75 4.18 4.04 2q34A1 ILE 185 HB -0.19 0.01 0.01 -0.04 1.89 1.68 2q34A1 ILE 185 HG12 0.01 -0.05 -0.07 -0.04 1.49 1.34 2q34A1 ILE 185 HG13 -0.07 0.09 0.07 -0.04 1.21 1.26 2q34A1 ILE 185 HG23 -0.25 -0.02 -0.20 -0.04 0.93 0.41 2q34A1 ILE 185 HD13 -0.64 -0.03 -0.10 -0.04 0.88 0.07 2q34A1 PRO 186 HA -0.15 0.09 0.48 -0.51 4.44 4.35 2q34A1 PRO 186 HB2 -0.57 0.04 0.09 -0.04 2.28 1.80 2q34A1 PRO 186 HB3 -0.22 -0.05 0.16 -0.04 2.02 1.86 2q34A1 PRO 186 HG2 -0.20 0.23 0.09 -0.04 2.03 2.11 2q34A1 PRO 186 HG3 -0.13 0.00 0.07 -0.04 2.03 1.93 2q34A1 PRO 186 HD2 -0.11 0.09 0.21 -0.04 3.68 3.82 2q34A1 PRO 186 HD3 -0.09 0.16 0.31 -0.04 3.65 3.99 2q34A1 PHE 187 H -0.01 0.04 -0.65 -0.55 8.34 7.16 2q34A1 PHE 187 HA 0.03 0.23 0.88 -0.75 4.62 5.01 2q34A1 PHE 187 HB2 -0.02 -0.12 -0.13 -0.04 3.15 2.84 2q34A1 PHE 187 HB3 0.16 0.19 -0.01 -0.04 3.06 3.36 2q34A1 PHE 187 HD2 0.05 -0.02 -0.01 -0.04 7.28 7.26 2q34A1 PHE 187 HE2 0.03 -0.00 -0.13 -0.04 7.38 7.23 2q34A1 PHE 187 HZ 0.01 0.05 -0.06 -0.04 7.32 7.28 2q34A1 PRO 188 HA -0.05 0.06 0.58 -0.51 4.44 4.52 2q34A1 PRO 188 HB2 -0.60 -0.07 -0.05 -0.04 2.28 1.52 2q34A1 PRO 188 HB3 -0.27 0.02 0.08 -0.04 2.02 1.80 2q34A1 PRO 188 HG2 -0.08 0.00 0.24 -0.04 2.03 2.16 2q34A1 PRO 188 HG3 0.03 0.02 0.08 -0.04 2.03 2.11 2q34A1 PRO 188 HD2 0.36 0.27 0.34 -0.04 3.68 4.62 2q34A1 PRO 188 HD3 0.17 0.14 0.18 -0.04 3.65 4.10 2q34A1 VAL 189 H -0.07 0.24 0.14 -0.55 8.24 8.00 2q34A1 VAL 189 HA -0.00 0.21 0.76 -0.75 4.13 4.35 2q34A1 VAL 189 HB -0.05 -0.01 0.06 -0.04 2.12 2.07 2q34A1 VAL 189 HG13 0.00 -0.02 -0.49 -0.04 0.97 0.42 2q34A1 VAL 189 HG23 -0.18 0.07 -0.23 -0.04 0.95 0.57 2q34A1 VAL 190 H -0.04 0.72 0.18 -0.55 8.24 8.55 2q34A1 VAL 190 HA -0.03 0.20 0.90 -0.75 4.13 4.46 2q34A1 VAL 190 HB -0.01 -0.11 0.07 -0.04 2.12 2.03 2q34A1 VAL 190 HG13 -0.15 0.02 -0.25 -0.04 0.97 0.54 2q34A1 VAL 190 HG23 -0.05 0.08 -0.28 -0.04 0.95 0.65 2q34A1 SER 191 H 0.00 0.18 0.13 -0.55 8.46 8.23 2q34A1 SER 191 HA 0.00 0.00 0.47 -0.75 4.49 4.21 2q34A1 SER 191 HB2 0.01 0.01 0.08 -0.04 3.95 4.01 2q34A1 SER 191 HB3 0.00 -0.04 0.07 -0.04 3.93 3.92 2q34A1 ARG 192 H -0.01 0.13 0.24 -0.55 8.46 8.26 2q34A1 ARG 192 HA -0.02 0.15 0.39 -0.75 4.34 4.11 2q34A1 ARG 192 HB2 -0.05 -0.05 0.19 -0.04 1.90 1.96 2q34A1 ARG 192 HB3 -0.03 -0.06 0.18 -0.04 1.80 1.85 2q34A1 ARG 192 HG2 -0.04 -0.06 -0.22 -0.04 1.67 1.31 2q34A1 ARG 192 HG3 -0.06 0.33 0.16 -0.04 1.67 2.05 2q34A1 ARG 192 HD2 -0.07 -0.10 0.00 -0.04 3.22 3.01 2q34A1 ARG 192 HD3 -0.09 0.03 -0.06 -0.04 3.22 3.06 2q34A1 GLN 193 H -0.00 0.04 -0.16 -0.55 8.47 7.80 2q34A1 GLN 193 HA 0.00 0.14 0.32 -0.75 4.36 4.07 2q34A1 GLN 193 HB2 0.01 0.06 0.09 -0.04 2.15 2.26 2q34A1 GLN 193 HB3 -0.00 -0.01 0.08 -0.04 2.02 2.04 2q34A1 GLN 193 HG2 0.01 -0.13 -0.14 -0.04 2.40 2.10 2q34A1 GLN 193 HG3 0.01 0.06 -0.25 -0.04 2.39 2.17 2q34A1 GLN 193 HE21 0.01 0.04 -0.01 -0.04 6.97 6.97 2q34A1 GLN 193 HE22 0.01 -0.05 -0.03 -0.04 7.69 7.58 2q34A1 ASP 194 H 0.01 0.36 -0.56 -0.55 8.40 7.67 2q34A1 ASP 194 HA 0.04 0.18 0.86 -0.75 4.63 4.95 2q34A1 ASP 194 HB2 0.03 0.04 -0.01 -0.04 2.71 2.72 2q34A1 ASP 194 HB3 0.07 0.01 0.03 -0.04 2.70 2.77 2q34A1 VAL 195 H 0.01 0.41 -0.14 -0.55 8.24 7.98 2q34A1 VAL 195 HA 0.01 0.04 0.21 -0.75 4.13 3.64 2q34A1 VAL 195 HB -0.01 0.07 0.07 -0.04 2.12 2.21 2q34A1 VAL 195 HG13 -0.04 0.04 -0.27 -0.04 0.97 0.66 2q34A1 VAL 195 HG23 -0.02 0.04 -0.18 -0.04 0.95 0.75 2q34A1 LEU 196 H 0.02 0.19 -0.17 -0.55 8.37 7.87 2q34A1 LEU 196 HA 0.04 0.10 0.25 -0.75 4.35 3.98 2q34A1 LEU 196 HB2 0.03 0.07 -0.01 -0.04 1.64 1.69 2q34A1 LEU 196 HB3 0.02 -0.01 0.00 -0.04 1.64 1.62 2q34A1 LEU 196 HG 0.02 -0.02 -0.23 -0.04 1.64 1.37 2q34A1 LEU 196 HD13 0.03 0.01 -0.06 -0.04 0.93 0.86 2q34A1 LEU 196 HD23 0.02 0.01 -0.08 -0.04 0.89 0.81 2q34A1 ASN 197 H 0.04 0.11 -0.32 -0.55 8.53 7.82 2q34A1 ASN 197 HA 0.02 0.05 0.36 -0.75 4.76 4.43 2q34A1 ASN 197 HB2 0.05 0.08 0.06 -0.04 2.88 3.03 2q34A1 ASN 197 HB3 0.02 0.00 -0.04 -0.04 2.79 2.73 2q34A1 ASN 197 HD21 0.01 -0.00 0.03 -0.04 7.03 7.03 2q34A1 ASN 197 HD22 0.02 -0.00 0.06 -0.04 7.74 7.78 2q34A1 TYR 198 H 0.16 0.60 -0.21 -0.55 8.29 8.28 2q34A1 TYR 198 HA -0.01 0.00 0.45 -0.75 4.56 4.24 2q34A1 TYR 198 HB2 0.00 -0.01 0.05 -0.04 3.06 3.07 2q34A1 TYR 198 HB3 0.00 0.13 0.10 -0.04 2.98 3.17 2q34A1 TYR 198 HD2 0.00 0.01 -0.24 -0.04 7.15 6.87 2q34A1 TYR 198 HE2 0.02 0.02 -0.06 -0.04 6.85 6.79 2q34A1 ALA 199 H 0.16 0.54 -0.12 -0.55 8.40 8.44 2q34A1 ALA 199 HA 0.12 0.01 0.29 -0.75 4.34 4.01 2q34A1 ALA 199 HB3 0.05 0.03 0.00 -0.04 1.41 1.45 2q34A1 GLN 200 H 0.01 0.54 -0.24 -0.55 8.47 8.24 2q34A1 GLN 200 HA -0.03 0.01 0.33 -0.75 4.36 3.92 2q34A1 GLN 200 HB2 -0.01 0.07 0.13 -0.04 2.15 2.29 2q34A1 GLN 200 HB3 -0.02 -0.03 -0.02 -0.04 2.02 1.91 2q34A1 GLN 200 HG2 -0.01 -0.03 -0.07 -0.04 2.40 2.25 2q34A1 GLN 200 HG3 0.00 0.15 -0.02 -0.04 2.39 2.49 2q34A1 GLN 200 HE21 -0.00 -0.03 -0.11 -0.04 6.97 6.79 2q34A1 GLN 200 HE22 -0.00 0.01 -0.11 -0.04 7.69 7.54 2q34A1 GLN 201 H -0.07 0.57 -0.12 -0.55 8.47 8.30 2q34A1 GLN 201 HA -0.08 0.01 0.42 -0.75 4.36 3.95 2q34A1 GLN 201 HB2 -0.21 0.12 0.16 -0.04 2.15 2.18 2q34A1 GLN 201 HB3 -0.16 -0.05 -0.02 -0.04 2.02 1.76 2q34A1 GLN 201 HG2 -0.07 -0.04 0.02 -0.04 2.40 2.27 2q34A1 GLN 201 HG3 -0.06 0.09 0.06 -0.04 2.39 2.43 2q34A1 GLN 201 HE21 -0.02 -0.06 -0.07 -0.04 6.97 6.78 2q34A1 GLN 201 HE22 -0.03 0.01 -0.08 -0.04 7.69 7.56 2q34A1 LEU 202 H -0.19 0.56 -0.15 -0.55 8.37 8.05 2q34A1 LEU 202 HA -0.19 0.01 0.51 -0.75 4.35 3.93 2q34A1 LEU 202 HB2 -0.23 -0.01 0.06 -0.04 1.64 1.42 2q34A1 LEU 202 HB3 -0.11 0.11 0.09 -0.04 1.64 1.69 2q34A1 LEU 202 HG -0.38 0.00 -0.25 -0.04 1.64 0.98 2q34A1 LEU 202 HD13 -0.27 -0.02 0.02 -0.04 0.93 0.62 2q34A1 LEU 202 HD23 -0.19 -0.00 -0.07 -0.04 0.89 0.58 2q34A1 GLY 203 H -0.09 0.57 -0.20 -0.55 8.43 8.17 2q34A1 GLY 203 HA2 -0.09 0.00 0.30 -0.51 4.01 3.71 2q34A1 GLY 203 HA3 -0.05 0.05 0.24 -0.51 4.01 3.73 2q34A1 GLN 204 H -0.07 0.54 -0.18 -0.55 8.47 8.21 2q34A1 GLN 204 HA -0.04 0.03 0.38 -0.75 4.36 3.98 2q34A1 GLN 204 HB2 -0.06 0.09 0.11 -0.04 2.15 2.25 2q34A1 GLN 204 HB3 -0.04 -0.06 -0.01 -0.04 2.02 1.87 2q34A1 GLN 204 HG2 -0.04 0.18 0.03 -0.04 2.40 2.53 2q34A1 GLN 204 HG3 -0.03 -0.08 -0.03 -0.04 2.39 2.20 2q34A1 GLN 204 HE21 -0.02 0.23 -0.16 -0.04 6.97 6.97 2q34A1 GLN 204 HE22 -0.03 -0.05 -0.08 -0.04 7.69 7.48 2q34A1 LYS 205 H -0.08 0.42 -0.24 -0.55 8.42 7.97 2q34A1 LYS 205 HA -0.05 -0.01 0.45 -0.75 4.32 3.96 2q34A1 LYS 205 HB2 -0.11 0.16 0.18 -0.04 1.87 2.06 2q34A1 LYS 205 HB3 -0.07 -0.06 -0.02 -0.04 1.79 1.61 2q34A1 LYS 205 HG2 -0.06 -0.07 0.03 -0.04 1.46 1.32 2q34A1 LYS 205 HG3 -0.09 0.15 0.08 -0.04 1.46 1.56 2q34A1 LYS 205 HD2 -0.12 0.00 -0.00 -0.04 1.69 1.53 2q34A1 LYS 205 HD3 -0.07 -0.03 -0.00 -0.04 1.68 1.54 2q34A1 LYS 205 HE2 -0.06 -0.04 -0.02 -0.04 2.99 2.83 2q34A1 LYS 205 HE3 -0.10 0.01 -0.06 -0.04 2.99 2.80 2q34A1 ILE 206 H -0.09 0.54 -0.11 -0.55 8.25 8.03 2q34A1 ILE 206 HA -0.03 -0.02 0.45 -0.75 4.18 3.83 2q34A1 ILE 206 HB -0.07 0.10 0.14 -0.04 1.89 2.01 2q34A1 ILE 206 HG12 -0.11 -0.05 0.01 -0.04 1.49 1.29 2q34A1 ILE 206 HG13 -0.19 0.05 0.05 -0.04 1.21 1.08 2q34A1 ILE 206 HG23 0.03 -0.01 -0.06 -0.04 0.93 0.84 2q34A1 ILE 206 HD13 -0.54 -0.02 -0.11 -0.04 0.88 0.17 2q34A1 ALA 207 H -0.03 0.56 -0.19 -0.55 8.40 8.20 2q34A1 ALA 207 HA 0.01 0.03 0.24 -0.75 4.34 3.86 2q34A1 ALA 207 HB3 -0.01 0.04 0.05 -0.04 1.41 1.45 2q34A1 LYS 208 H -0.01 0.33 -0.70 -0.55 8.42 7.47 2q34A1 LYS 208 HA -0.00 0.00 0.58 -0.75 4.32 4.14 2q34A1 LYS 208 HB2 -0.01 0.17 0.10 -0.04 1.87 2.08 2q34A1 LYS 208 HB3 -0.01 -0.14 0.06 -0.04 1.79 1.66 2q34A1 LYS 208 HG2 -0.01 -0.09 0.04 -0.04 1.46 1.36 2q34A1 LYS 208 HG3 -0.02 0.27 0.10 -0.04 1.46 1.77 2q34A1 LYS 208 HD2 -0.02 0.02 0.06 -0.04 1.69 1.71 2q34A1 LYS 208 HD3 -0.01 -0.09 0.03 -0.04 1.68 1.57 2q34A1 LYS 208 HE2 -0.02 -0.04 -0.01 -0.04 2.99 2.88 2q34A1 LYS 208 HE3 -0.03 0.03 -0.06 -0.04 2.99 2.89 2q34A1 SER 209 H 0.01 0.45 -0.11 -0.55 8.46 8.26 2q34A1 SER 209 HA 0.01 0.04 0.66 -0.75 4.49 4.45 2q34A1 SER 209 HB2 0.02 0.13 0.08 -0.04 3.95 4.14 2q34A1 SER 209 HB3 0.02 -0.08 0.07 -0.04 3.93 3.89 2q34A1 PRO 210 HA 0.01 0.13 0.53 -0.51 4.44 4.61 2q34A1 PRO 210 HB2 0.01 -0.24 0.06 -0.04 2.28 2.07 2q34A1 PRO 210 HB3 0.01 0.05 0.15 -0.04 2.02 2.18 2q34A1 PRO 210 HG2 0.01 0.01 0.12 -0.04 2.03 2.12 2q34A1 PRO 210 HG3 0.01 0.10 0.13 -0.04 2.03 2.23 2q34A1 PRO 210 HD2 0.01 0.03 0.23 -0.04 3.68 3.91 2q34A1 PRO 210 HD3 0.01 0.21 0.27 -0.04 3.65 4.09 2q34A1 ARG 211 H 0.02 0.19 0.20 -0.55 8.46 8.31 2q34A1 ARG 211 HA 0.03 0.18 0.41 -0.75 4.34 4.21 2q34A1 ARG 211 HB2 0.02 0.10 0.15 -0.04 1.90 2.13 2q34A1 ARG 211 HB3 0.02 -0.10 0.11 -0.04 1.80 1.79 2q34A1 ARG 211 HG2 0.03 -0.12 -0.07 -0.04 1.67 1.47 2q34A1 ARG 211 HG3 0.04 0.07 0.09 -0.04 1.67 1.83 2q34A1 ARG 211 HD2 0.03 0.16 -0.01 -0.04 3.22 3.36 2q34A1 ARG 211 HD3 0.01 -0.16 0.05 -0.04 3.22 3.09 2q34A1 LEU 212 H 0.01 0.07 -0.13 -0.55 8.37 7.78 2q34A1 LEU 212 HA 0.01 0.11 0.39 -0.75 4.35 4.11 2q34A1 LEU 212 HB2 0.01 0.01 0.11 -0.04 1.64 1.73 2q34A1 LEU 212 HB3 0.01 -0.02 0.04 -0.04 1.64 1.63 2q34A1 LEU 212 HG 0.01 -0.00 -0.01 -0.04 1.64 1.59 2q34A1 LEU 212 HD13 0.00 0.01 0.04 -0.04 0.93 0.94 2q34A1 LEU 212 HD23 0.00 0.00 -0.02 -0.04 0.89 0.84 2q34A1 SER 213 H 0.01 0.14 -0.32 -0.55 8.46 7.75 2q34A1 SER 213 HA 0.01 0.02 0.42 -0.75 4.49 4.19 2q34A1 SER 213 HB2 0.02 0.19 0.12 -0.04 3.95 4.24 2q34A1 SER 213 HB3 0.02 0.01 0.03 -0.04 3.93 3.95 2q34A1 LEU 214 H 0.03 0.49 -0.09 -0.55 8.37 8.25 2q34A1 LEU 214 HA 0.05 -0.01 0.48 -0.75 4.35 4.12 2q34A1 LEU 214 HB2 0.04 0.08 0.19 -0.04 1.64 1.91 2q34A1 LEU 214 HB3 0.06 0.03 0.09 -0.04 1.64 1.77 2q34A1 LEU 214 HG 0.03 0.02 -0.10 -0.04 1.64 1.54 2q34A1 LEU 214 HD13 0.04 0.05 -0.07 -0.04 0.93 0.91 2q34A1 LEU 214 HD23 0.05 0.01 0.04 -0.04 0.89 0.95 2q34A1 VAL 215 H 0.03 0.54 -0.14 -0.55 8.24 8.12 2q34A1 VAL 215 HA 0.04 0.29 0.49 -0.75 4.13 4.19 2q34A1 VAL 215 HB 0.02 0.00 0.17 -0.04 2.12 2.28 2q34A1 VAL 215 HG13 0.02 -0.01 -0.05 -0.04 0.97 0.89 2q34A1 VAL 215 HG23 0.03 0.05 -0.03 -0.04 0.95 0.95 2q34A1 ALA 216 H 0.02 0.51 -0.04 -0.55 8.40 8.35 2q34A1 ALA 216 HA 0.03 0.00 0.42 -0.75 4.34 4.04 2q34A1 ALA 216 HB3 0.01 -0.00 0.13 -0.04 1.41 1.51 2q34A1 LEU 217 H 0.04 0.65 -0.12 -0.55 8.37 8.40 2q34A1 LEU 217 HA 0.08 -0.03 0.49 -0.75 4.35 4.14 2q34A1 LEU 217 HB2 0.04 -0.01 0.14 -0.04 1.64 1.77 2q34A1 LEU 217 HB3 0.06 0.14 0.19 -0.04 1.64 1.99 2q34A1 LEU 217 HG 0.08 0.01 -0.18 -0.04 1.64 1.51 2q34A1 LEU 217 HD13 0.09 -0.03 0.06 -0.04 0.93 1.01 2q34A1 LEU 217 HD23 0.07 -0.00 -0.00 -0.04 0.89 0.92 2q34A1 LYS 218 H 0.05 0.67 -0.07 -0.55 8.42 8.52 2q34A1 LYS 218 HA 0.04 -0.04 0.42 -0.75 4.32 3.98 2q34A1 LYS 218 HB2 0.06 -0.04 0.12 -0.04 1.87 1.96 2q34A1 LYS 218 HB3 0.04 0.21 0.21 -0.04 1.79 2.21 2q34A1 LYS 218 HG2 0.01 0.02 -0.26 -0.04 1.46 1.19 2q34A1 LYS 218 HG3 0.01 -0.12 0.00 -0.04 1.46 1.31 2q34A1 LYS 218 HD2 0.06 -0.18 -0.27 -0.04 1.69 1.25 2q34A1 LYS 218 HD3 0.04 0.15 -0.56 -0.04 1.68 1.27 2q34A1 LYS 218 HE2 -0.00 0.26 -0.12 -0.04 2.99 3.09 2q34A1 LYS 218 HE3 -0.01 -0.12 -0.09 -0.04 2.99 2.73 2q34A1 GLN 219 H 0.04 0.56 -0.16 -0.55 8.47 8.36 2q34A1 GLN 219 HA 0.01 0.04 0.35 -0.75 4.36 4.00 2q34A1 GLN 219 HB2 0.02 0.10 0.13 -0.04 2.15 2.36 2q34A1 GLN 219 HB3 0.04 0.06 0.16 -0.04 2.02 2.24 2q34A1 GLN 219 HG2 0.03 -0.04 -0.17 -0.04 2.40 2.18 2q34A1 GLN 219 HG3 0.01 -0.01 0.03 -0.04 2.39 2.37 2q34A1 GLN 219 HE21 0.02 -0.06 -0.01 -0.04 6.97 6.88 2q34A1 GLN 219 HE22 0.03 0.03 -0.01 -0.04 7.69 7.70 2q34A1 HIS 220 H 0.13 0.49 -0.17 -0.55 8.41 8.31 2q34A1 HIS 220 HA 0.00 -0.04 0.44 -0.75 4.63 4.27 2q34A1 HIS 220 HB2 0.01 0.00 0.17 -0.04 3.26 3.39 2q34A1 HIS 220 HB3 0.01 0.16 0.26 -0.04 3.20 3.58 2q34A1 HIS 220 HD2 0.01 0.03 -0.03 -0.04 6.97 6.93 2q34A1 HIS 220 HE1 0.00 -0.04 0.01 -0.04 7.75 7.67 2q34A1 LEU 221 H 0.05 0.71 0.02 -0.55 8.37 8.61 2q34A1 LEU 221 HA -0.17 -0.03 0.40 -0.75 4.35 3.79 2q34A1 LEU 221 HB2 -0.00 0.12 0.14 -0.04 1.64 1.86 2q34A1 LEU 221 HB3 -0.03 -0.03 0.06 -0.04 1.64 1.60 2q34A1 LEU 221 HG 0.10 0.09 0.10 -0.04 1.64 1.89 2q34A1 LEU 221 HD13 0.04 -0.01 -0.02 -0.04 0.93 0.90 2q34A1 LEU 221 HD23 0.02 -0.03 0.04 -0.04 0.89 0.89 2q34A1 SER 222 H -0.04 0.56 -0.28 -0.55 8.46 8.16 2q34A1 SER 222 HA -0.04 0.05 0.57 -0.75 4.49 4.30 2q34A1 SER 222 HB2 -0.04 0.14 0.07 -0.04 3.95 4.08 2q34A1 SER 222 HB3 -0.06 -0.12 0.12 -0.04 3.93 3.83 2q34A1 ALA 223 H -0.08 0.45 -0.36 -0.55 8.40 7.85 2q34A1 ALA 223 HA -0.03 0.03 0.25 -0.75 4.34 3.83 2q34A1 ALA 223 HB3 -0.05 0.04 0.13 -0.04 1.41 1.49 2q34A1 ASP 224 H -0.06 0.25 -0.09 -0.55 8.40 7.95 2q34A1 ASP 224 HA -0.01 0.04 0.42 -0.75 4.63 4.31 2q34A1 ASP 224 HB2 -0.03 0.08 0.11 -0.04 2.71 2.82 2q34A1 ASP 224 HB3 -0.01 -0.01 -0.00 -0.04 2.70 2.63 2q34A1 ILE 225 H -0.01 0.22 -0.16 -0.55 8.25 7.76 2q34A1 ILE 225 HA 0.06 0.01 0.45 -0.75 4.18 3.95 2q34A1 ILE 225 HB 0.02 0.13 0.10 -0.04 1.89 2.10 2q34A1 ILE 225 HG12 0.02 -0.03 0.04 -0.04 1.49 1.48 2q34A1 ILE 225 HG13 0.04 0.11 0.01 -0.04 1.21 1.34 2q34A1 ILE 225 HG23 0.17 -0.01 -0.12 -0.04 0.93 0.93 2q34A1 ILE 225 HD13 0.05 -0.01 -0.04 -0.04 0.88 0.84 2q34A1 LYS 226 H -0.01 0.66 -0.04 -0.55 8.42 8.47 2q34A1 LYS 226 HA -0.02 -0.05 0.39 -0.75 4.32 3.88 2q34A1 LYS 226 HB2 -0.08 0.11 0.10 -0.04 1.87 1.97 2q34A1 LYS 226 HB3 -0.03 0.09 0.08 -0.04 1.79 1.88 2q34A1 LYS 226 HG2 -0.04 -0.07 -0.11 -0.04 1.46 1.21 2q34A1 LYS 226 HG3 -0.12 -0.06 0.02 -0.04 1.46 1.27 2q34A1 LYS 226 HD2 -0.07 0.10 -0.04 -0.04 1.69 1.63 2q34A1 LYS 226 HD3 -0.04 0.01 -0.06 -0.04 1.68 1.55 2q34A1 LYS 226 HE2 -0.04 -0.06 -0.06 -0.04 2.99 2.80 2q34A1 LYS 226 HE3 -0.07 -0.04 -0.05 -0.04 2.99 2.78 2q34A1 ALA 227 H 0.01 0.56 -0.26 -0.55 8.40 8.16 2q34A1 ALA 227 HA 0.02 -0.01 0.50 -0.75 4.34 4.10 2q34A1 ALA 227 HB3 0.01 0.04 0.12 -0.04 1.41 1.54 2q34A1 LYS 228 H 0.06 0.43 -0.21 -0.55 8.42 8.15 2q34A1 LYS 228 HA 0.02 0.02 0.52 -0.75 4.32 4.13 2q34A1 LYS 228 HB2 0.06 0.17 0.16 -0.04 1.87 2.21 2q34A1 LYS 228 HB3 0.02 -0.14 0.08 -0.04 1.79 1.70 2q34A1 LYS 228 HG2 0.01 -0.07 0.01 -0.04 1.46 1.38 2q34A1 LYS 228 HG3 0.02 0.17 0.06 -0.04 1.46 1.67 2q34A1 LYS 228 HD2 0.01 -0.07 0.00 -0.04 1.69 1.59 2q34A1 LYS 228 HD3 0.01 -0.03 -0.01 -0.04 1.68 1.61 2q34A1 LYS 228 HE2 0.02 0.05 -0.11 -0.04 2.99 2.90 2q34A1 LYS 228 HE3 0.03 0.02 -0.04 -0.04 2.99 2.96 2q34A1 PHE 229 H 0.19 0.42 -0.28 -0.55 8.34 8.11 2q34A1 PHE 229 HA -0.01 -0.07 0.28 -0.75 4.62 4.06 2q34A1 PHE 229 HB2 -0.04 0.19 0.10 -0.04 3.15 3.36 2q34A1 PHE 229 HB3 -0.05 0.06 0.06 -0.04 3.06 3.09 2q34A1 PHE 229 HD2 -0.05 0.03 -0.15 -0.04 7.28 7.07 2q34A1 PHE 229 HE2 -0.04 -0.04 -0.07 -0.04 7.38 7.19 2q34A1 PHE 229 HZ -0.23 0.04 -0.03 -0.04 7.32 7.06 2q34A1 PRO 230 HA 0.06 -0.00 0.40 -0.51 4.44 4.39 2q34A1 PRO 230 HB2 0.02 0.03 0.06 -0.04 2.28 2.35 2q34A1 PRO 230 HB3 0.03 0.00 0.08 -0.04 2.02 2.09 2q34A1 PRO 230 HG2 0.04 0.10 0.07 -0.04 2.03 2.19 2q34A1 PRO 230 HG3 0.07 0.01 0.06 -0.04 2.03 2.12 2q34A1 PRO 230 HD2 0.06 0.25 -0.11 -0.04 3.68 3.84 2q34A1 PRO 230 HD3 0.15 0.33 0.13 -0.04 3.65 4.22 2q34A1 GLU 231 H 0.00 0.28 -0.19 -0.55 8.60 8.15 2q34A1 GLU 231 HA -0.02 0.03 0.48 -0.75 4.29 4.03 2q34A1 GLU 231 HB2 -0.01 0.03 0.09 -0.04 2.09 2.17 2q34A1 GLU 231 HB3 -0.02 0.12 0.08 -0.04 1.99 2.14 2q34A1 GLU 231 HG2 -0.01 0.04 0.01 -0.04 2.34 2.33 2q34A1 GLU 231 HG3 -0.02 -0.03 -0.09 -0.04 2.34 2.16 2q34A1 ALA 232 H -0.09 0.54 -0.12 -0.55 8.40 8.19 2q34A1 ALA 232 HA -0.09 0.01 0.46 -0.75 4.34 3.97 2q34A1 ALA 232 HB3 -0.21 0.01 0.11 -0.04 1.41 1.28 2q34A1 ILE 233 H -0.24 0.78 -0.00 -0.55 8.25 8.24 2q34A1 ILE 233 HA -0.16 -0.23 0.43 -0.75 4.18 3.46 2q34A1 ILE 233 HB -0.07 0.21 0.15 -0.04 1.89 2.15 2q34A1 ILE 233 HG12 -0.58 0.04 -0.04 -0.04 1.49 0.87 2q34A1 ILE 233 HG13 0.01 0.05 -0.08 -0.04 1.21 1.15 2q34A1 ILE 233 HG23 -0.02 -0.02 -0.13 -0.04 0.93 0.72 2q34A1 ILE 233 HD13 0.01 -0.06 -0.09 -0.04 0.88 0.70 2q34A1 LYS 234 H -0.06 0.56 -0.15 -0.55 8.42 8.22 2q34A1 LYS 234 HA -0.03 -0.00 0.45 -0.75 4.32 3.99 2q34A1 LYS 234 HB2 -0.02 0.05 0.14 -0.04 1.87 2.00 2q34A1 LYS 234 HB3 -0.02 0.11 0.19 -0.04 1.79 2.03 2q34A1 LYS 234 HG2 -0.01 -0.02 -0.22 -0.04 1.46 1.16 2q34A1 LYS 234 HG3 -0.01 -0.03 0.03 -0.04 1.46 1.41 2q34A1 LYS 234 HD2 -0.01 0.00 -0.01 -0.04 1.69 1.64 2q34A1 LYS 234 HD3 -0.01 0.01 -0.01 -0.04 1.68 1.63 2q34A1 LYS 234 HE2 -0.01 -0.01 -0.03 -0.04 2.99 2.91 2q34A1 LYS 234 HE3 -0.01 -0.01 -0.01 -0.04 2.99 2.92 2q34A1 LYS 235 H -0.04 0.71 0.02 -0.55 8.42 8.56 2q34A1 LYS 235 HA -0.02 0.02 0.47 -0.75 4.32 4.04 2q34A1 LYS 235 HB2 -0.04 0.08 0.22 -0.04 1.87 2.08 2q34A1 LYS 235 HB3 -0.02 -0.04 -0.01 -0.04 1.79 1.67 2q34A1 LYS 235 HG2 -0.01 -0.03 0.05 -0.04 1.46 1.42 2q34A1 LYS 235 HG3 -0.02 0.03 0.09 -0.04 1.46 1.52 2q34A1 LYS 235 HD2 -0.03 0.02 -0.12 -0.04 1.69 1.52 2q34A1 LYS 235 HD3 -0.02 -0.03 -0.02 -0.04 1.68 1.57 2q34A1 LYS 235 HE2 -0.01 -0.01 -0.01 -0.04 2.99 2.92 2q34A1 LYS 235 HE3 -0.01 -0.00 -0.01 -0.04 2.99 2.92 2q34A1 GLU 236 H -0.06 0.59 -0.07 -0.55 8.60 8.52 2q34A1 GLU 236 HA -0.03 0.05 0.48 -0.75 4.29 4.04 2q34A1 GLU 236 HB2 -0.09 -0.02 0.19 -0.04 2.09 2.13 2q34A1 GLU 236 HB3 -0.09 0.16 0.04 -0.04 1.99 2.06 2q34A1 GLU 236 HG2 -0.06 0.08 0.02 -0.04 2.34 2.34 2q34A1 GLU 236 HG3 -0.08 0.13 0.06 -0.04 2.34 2.41 2q34A1 LEU 237 H -0.04 0.54 -0.08 -0.55 8.37 8.25 2q34A1 LEU 237 HA -0.01 -0.01 0.52 -0.75 4.35 4.09 2q34A1 LEU 237 HB2 -0.04 0.07 0.21 -0.04 1.64 1.84 2q34A1 LEU 237 HB3 -0.01 0.13 0.18 -0.04 1.64 1.89 2q34A1 LEU 237 HG 0.00 0.02 -0.06 -0.04 1.64 1.55 2q34A1 LEU 237 HD13 -0.04 -0.03 0.07 -0.04 0.93 0.89 2q34A1 LEU 237 HD23 -0.01 -0.01 0.01 -0.04 0.89 0.84 2q34A1 GLU 238 H -0.00 0.52 -0.10 -0.55 8.60 8.48 2q34A1 GLU 238 HA 0.01 0.01 0.41 -0.75 4.29 3.97 2q34A1 GLU 238 HB2 -0.00 0.14 0.22 -0.04 2.09 2.41 2q34A1 GLU 238 HB3 0.00 -0.03 0.00 -0.04 1.99 1.93 2q34A1 GLU 238 HG2 0.00 -0.03 0.06 -0.04 2.34 2.33 2q34A1 GLU 238 HG3 -0.00 0.00 0.08 -0.04 2.34 2.38 2q34A1 ILE 239 H 0.02 0.44 -0.12 -0.55 8.25 8.03 2q34A1 ILE 239 HA 0.02 0.04 0.52 -0.75 4.18 4.00 2q34A1 ILE 239 HB 0.02 0.08 0.16 -0.04 1.89 2.11 2q34A1 ILE 239 HG12 0.01 -0.03 0.03 -0.04 1.49 1.46 2q34A1 ILE 239 HG13 0.01 0.08 0.11 -0.04 1.21 1.36 2q34A1 ILE 239 HG23 0.03 -0.02 -0.04 -0.04 0.93 0.86 2q34A1 ILE 239 HD13 -0.00 -0.02 -0.03 -0.04 0.88 0.78 2q34A1 HIS 240 H 0.11 0.65 -0.06 -0.55 8.41 8.57 2q34A1 HIS 240 HA 0.06 -0.07 0.44 -0.75 4.63 4.31 2q34A1 HIS 240 HB2 -0.04 0.18 0.00 -0.04 3.26 3.36 2q34A1 HIS 240 HB3 -0.06 0.04 0.20 -0.04 3.20 3.34 2q34A1 HIS 240 HD2 -0.20 0.01 -0.16 -0.04 6.97 6.57 2q34A1 HIS 240 HE1 -0.76 -0.03 -0.06 -0.04 7.75 6.85 2q34A1 GLN 241 H 0.05 0.55 -0.21 -0.55 8.47 8.32 2q34A1 GLN 241 HA -0.07 -0.01 0.36 -0.75 4.36 3.89 2q34A1 GLN 241 HB2 0.01 0.13 0.17 -0.04 2.15 2.42 2q34A1 GLN 241 HB3 0.00 -0.02 0.03 -0.04 2.02 1.99 2q34A1 GLN 241 HG2 0.04 0.16 0.07 -0.04 2.40 2.63 2q34A1 GLN 241 HG3 0.01 -0.06 0.02 -0.04 2.39 2.32 2q34A1 GLN 241 HE21 -0.04 0.02 0.02 -0.04 6.97 6.93 2q34A1 GLN 241 HE22 -0.01 0.02 0.03 -0.04 7.69 7.69 2q34A1 VAL 242 H 0.00 0.32 -0.18 -0.55 8.24 7.84 2q34A1 VAL 242 HA 0.00 0.06 0.49 -0.75 4.13 3.92 2q34A1 VAL 242 HB 0.01 0.08 0.20 -0.04 2.12 2.38 2q34A1 VAL 242 HG13 0.01 -0.01 -0.10 -0.04 0.97 0.82 2q34A1 VAL 242 HG23 0.01 0.01 0.08 -0.04 0.95 1.00 2q34A1 THR 243 H 0.01 0.54 -0.01 -0.55 8.28 8.27 2q34A1 THR 243 HA 0.03 0.07 0.29 -0.75 4.39 4.03 2q34A1 THR 243 HB 0.11 0.08 0.14 -0.04 4.32 4.60 2q34A1 THR 243 HG23 0.05 0.02 0.04 -0.04 1.22 1.29 2q34A1 PHE 244 H -0.06 0.62 -0.13 -0.55 8.34 8.21 2q34A1 PHE 244 HA -0.12 0.02 0.48 -0.75 4.62 4.24 2q34A1 PHE 244 HB2 -1.15 -0.03 0.08 -0.04 3.15 2.01 2q34A1 PHE 244 HB3 -0.48 0.08 0.07 -0.04 3.06 2.69 2q34A1 PHE 244 HD2 -1.19 0.03 -0.15 -0.04 7.28 5.93 2q34A1 PHE 244 HE2 -0.26 -0.01 -0.23 -0.04 7.38 6.83 2q34A1 PHE 244 HZ -0.16 0.13 -0.06 -0.04 7.32 7.19 2q34A1 ASN 245 H 0.02 0.38 -0.28 -0.55 8.53 8.10 2q34A1 ASN 245 HA -0.07 0.10 0.67 -0.75 4.76 4.71 2q34A1 ASN 245 HB2 0.02 0.14 0.26 -0.04 2.88 3.26 2q34A1 ASN 245 HB3 0.01 -0.08 0.18 -0.04 2.79 2.86 2q34A1 ASN 245 HD21 0.06 -0.12 0.04 -0.04 7.03 6.97 2q34A1 ASN 245 HD22 0.03 0.46 0.20 -0.04 7.74 8.40 2q34A1 GLN 246 H -0.11 0.45 -0.24 -0.55 8.47 8.02 2q34A1 GLN 246 HA -0.02 0.16 0.77 -0.75 4.36 4.51 2q34A1 GLN 246 HB2 -0.02 0.07 0.04 -0.04 2.15 2.20 2q34A1 GLN 246 HB3 -0.01 -0.11 0.11 -0.04 2.02 1.96 2q34A1 GLN 246 HG2 -0.00 0.17 -0.26 -0.04 2.40 2.27 2q34A1 GLN 246 HG3 0.01 -0.07 0.01 -0.04 2.39 2.30 2q34A1 GLN 246 HE21 0.00 -0.15 0.05 -0.04 6.97 6.83 2q34A1 GLN 246 HE22 0.00 0.46 -0.01 -0.04 7.69 8.11 2q34A1 PRO 247 HA -0.03 0.08 0.34 -0.51 4.44 4.32 2q34A1 PRO 247 HB2 -0.01 -0.00 0.11 -0.04 2.28 2.34 2q34A1 PRO 247 HB3 -0.01 0.02 0.11 -0.04 2.02 2.09 2q34A1 PRO 247 HG2 -0.01 0.04 0.12 -0.04 2.03 2.13 2q34A1 PRO 247 HG3 -0.01 0.06 0.12 -0.04 2.03 2.15 2q34A1 PRO 247 HD2 -0.01 0.11 0.21 -0.04 3.68 3.95 2q34A1 PRO 247 HD3 -0.01 0.21 0.25 -0.04 3.65 4.06 2q34A1 GLU 248 H -0.02 0.15 -0.15 -0.55 8.60 8.04 2q34A1 GLU 248 HA -0.01 0.06 0.39 -0.75 4.29 3.98 2q34A1 GLU 248 HB2 -0.00 0.01 0.12 -0.04 2.09 2.18 2q34A1 GLU 248 HB3 -0.00 -0.02 0.08 -0.04 1.99 2.00 2q34A1 GLU 248 HG2 -0.00 0.11 -0.15 -0.04 2.34 2.26 2q34A1 GLU 248 HG3 0.01 0.04 -0.03 -0.04 2.34 2.32 2q34A1 ILE 249 H -0.06 0.43 -0.21 -0.55 8.25 7.86 2q34A1 ILE 249 HA 0.00 0.15 0.43 -0.75 4.18 4.01 2q34A1 ILE 249 HB -0.28 0.11 0.23 -0.04 1.89 1.91 2q34A1 ILE 249 HG12 -0.06 -0.15 0.09 -0.04 1.49 1.33 2q34A1 ILE 249 HG13 -0.13 0.18 0.17 -0.04 1.21 1.40 2q34A1 ILE 249 HG23 -0.28 -0.00 -0.04 -0.04 0.93 0.57 2q34A1 ILE 249 HD13 0.09 0.00 -0.04 -0.04 0.88 0.89 2q34A1 ALA 250 H -0.08 0.27 -0.04 -0.55 8.40 8.00 2q34A1 ALA 250 HA -0.04 0.05 0.42 -0.75 4.34 4.02 2q34A1 ALA 250 HB3 -0.04 0.02 0.12 -0.04 1.41 1.47 2q34A1 SER 251 H -0.01 0.18 -0.19 -0.55 8.46 7.90 2q34A1 SER 251 HA 0.01 0.01 0.45 -0.75 4.49 4.21 2q34A1 SER 251 HB2 -0.00 -0.03 0.10 -0.04 3.95 3.97 2q34A1 SER 251 HB3 0.00 0.15 0.12 -0.04 3.93 4.16 2q34A1 ARG 252 H 0.03 0.42 -0.10 -0.55 8.46 8.26 2q34A1 ARG 252 HA 0.05 0.00 0.53 -0.75 4.34 4.17 2q34A1 ARG 252 HB2 0.06 0.11 0.28 -0.04 1.90 2.31 2q34A1 ARG 252 HB3 0.08 0.08 0.08 -0.04 1.80 2.00 2q34A1 ARG 252 HG2 0.02 -0.05 0.05 -0.04 1.67 1.65 2q34A1 ARG 252 HG3 0.02 -0.06 0.06 -0.04 1.67 1.65 2q34A1 ARG 252 HD2 0.03 -0.05 -0.07 -0.04 3.22 3.08 2q34A1 ARG 252 HD3 0.02 0.16 -0.19 -0.04 3.22 3.17 2q34A1 ILE 253 H 0.10 0.55 -0.09 -0.55 8.25 8.27 2q34A1 ILE 253 HA 0.35 0.03 0.47 -0.75 4.18 4.28 2q34A1 ILE 253 HB 0.11 0.12 0.16 -0.04 1.89 2.24 2q34A1 ILE 253 HG12 0.12 -0.09 0.02 -0.04 1.49 1.51 2q34A1 ILE 253 HG13 0.18 0.26 0.11 -0.04 1.21 1.71 2q34A1 ILE 253 HG23 0.15 -0.05 -0.09 -0.04 0.93 0.89 2q34A1 ILE 253 HD13 0.10 -0.04 -0.12 -0.04 0.88 0.77 2q34A1 GLN 254 H 0.10 0.54 -0.06 -0.55 8.47 8.50 2q34A1 GLN 254 HA 0.11 -0.07 0.39 -0.75 4.36 4.04 2q34A1 GLN 254 HB2 0.00 -0.01 0.14 -0.04 2.15 2.24 2q34A1 GLN 254 HB3 0.03 0.19 0.19 -0.04 2.02 2.38 2q34A1 GLN 254 HG2 -0.01 0.04 -0.20 -0.04 2.40 2.19 2q34A1 GLN 254 HG3 -0.10 -0.07 0.06 -0.04 2.39 2.23 2q34A1 GLN 254 HE21 -0.03 -0.04 -0.01 -0.04 6.97 6.85 2q34A1 GLN 254 HE22 -0.03 0.01 -0.03 -0.04 7.69 7.60 2q34A1 GLN 255 H 0.09 0.41 -0.34 -0.55 8.47 8.09 2q34A1 GLN 255 HA 0.07 0.05 0.49 -0.75 4.36 4.21 2q34A1 GLN 255 HB2 0.04 0.12 0.12 -0.04 2.15 2.39 2q34A1 GLN 255 HB3 0.03 -0.06 0.13 -0.04 2.02 2.08 2q34A1 GLN 255 HG2 0.03 0.23 0.09 -0.04 2.40 2.70 2q34A1 GLN 255 HG3 0.02 -0.07 0.03 -0.04 2.39 2.32 2q34A1 GLN 255 HE21 0.01 -0.06 -0.00 -0.04 6.97 6.89 2q34A1 GLN 255 HE22 0.02 0.03 0.07 -0.04 7.69 7.77 2q34A1 GLU 256 H 0.18 0.34 -0.37 -0.55 8.60 8.19 2q34A1 GLU 256 HA 0.01 0.12 0.74 -0.75 4.29 4.41 2q34A1 GLU 256 HB2 0.29 0.05 0.11 -0.04 2.09 2.49 2q34A1 GLU 256 HB3 -0.00 -0.13 0.08 -0.04 1.99 1.90 2q34A1 GLU 256 HG2 0.03 0.28 0.01 -0.04 2.34 2.62 2q34A1 GLU 256 HG3 -0.31 -0.08 -0.10 -0.04 2.34 1.82 2q34A1 PHE 257 H 0.38 0.29 -0.22 -0.55 8.34 8.23 2q34A1 PHE 257 HA 0.02 -0.01 0.38 -0.75 4.62 4.26 2q34A1 PHE 257 HB2 0.02 0.37 0.13 -0.04 3.15 3.63 2q34A1 PHE 257 HB3 0.01 -0.06 0.05 -0.04 3.06 3.02 2q34A1 PHE 257 HD2 0.03 0.12 0.03 -0.04 7.28 7.42 2q34A1 PHE 257 HE2 0.03 -0.01 -0.07 -0.04 7.38 7.28 2q34A1 PHE 257 HZ 0.03 -0.09 -0.14 -0.04 7.32 7.07