============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. PHE 13 1.000 12.939 17.214 15.107 -99.200 -91.000 PHE 19 1.000 5.515 27.620 22.477 -99.200 -91.000 TYR 20 0.840 10.563 26.102 22.921 -99.200 -91.000 PHE 25 1.000 14.654 29.668 22.954 -99.200 -91.000 PHE 29 1.000 22.526 18.646 12.934 -99.200 -91.000 TRP 34 1.040 20.513 16.682 18.123 -99.200 -91.000 TRP6 34 1.020 19.920 15.325 19.950 -99.200 -91.000 PHE 46 1.000 12.475 20.797 21.877 -99.200 -91.000 PHE 47 1.000 13.931 12.429 22.906 -99.200 -91.000 HIS 49 0.900 8.377 10.049 22.543 -99.200 -91.000 TRP 58 1.040 6.322 12.383 35.620 -99.200 -91.000 TRP6 58 1.020 6.759 13.089 37.825 -99.200 -91.000 PHE 59 1.000 9.801 13.235 28.589 -99.200 -91.000 PHE 71 1.000 12.164 32.843 27.571 -99.200 -91.000 TYR 72 0.840 5.497 36.524 32.263 -99.200 -91.000 TYR 87 0.840 -1.903 20.562 25.609 -99.200 -91.000 HIS 91 0.900 0.584 29.163 35.514 -99.200 -91.000 TRP 98 1.040 14.995 28.720 43.681 -99.200 -91.000 TRP6 98 1.020 16.646 30.200 42.883 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 1mh6A1 THR 202 HA -0.00 -0.08 0.17 -0.75 4.39 3.72 1mh6A1 THR 202 HB -0.00 -0.02 -0.08 -0.04 4.32 4.18 1mh6A1 THR 202 HG23 -0.00 0.03 -0.19 -0.04 1.22 1.02 1mh6A1 ASP 203 H -0.00 0.08 0.03 -0.55 8.40 7.96 1mh6A1 ASP 203 HA -0.00 0.07 0.63 -0.75 4.63 4.58 1mh6A1 ASP 203 HB2 -0.00 -0.02 0.17 -0.04 2.71 2.81 1mh6A1 ASP 203 HB3 -0.00 0.00 0.14 -0.04 2.70 2.79 1mh6A1 GLN 204 H -0.00 0.33 0.19 -0.55 8.47 8.44 1mh6A1 GLN 204 HA -0.00 0.09 0.76 -0.75 4.36 4.45 1mh6A1 GLN 204 HB2 -0.00 -0.01 -0.05 -0.04 2.15 2.05 1mh6A1 GLN 204 HB3 -0.00 0.01 -0.26 -0.04 2.02 1.72 1mh6A1 GLN 204 HG2 0.00 0.13 0.15 -0.04 2.40 2.64 1mh6A1 GLN 204 HG3 0.01 -0.08 -0.01 -0.04 2.39 2.27 1mh6A1 GLN 204 HE21 0.00 -0.01 -0.03 -0.04 6.97 6.89 1mh6A1 GLN 204 HE22 0.00 -0.04 -0.01 -0.04 7.69 7.61 1mh6A1 ALA 205 H -0.00 0.15 0.11 -0.55 8.40 8.11 1mh6A1 ALA 205 HA 0.01 0.09 0.71 -0.75 4.34 4.39 1mh6A1 ALA 205 HB3 -0.00 0.00 0.08 -0.04 1.41 1.44 1mh6A1 THR 206 H 0.02 0.18 0.17 -0.55 8.28 8.11 1mh6A1 THR 206 HA -0.00 0.20 0.85 -0.75 4.39 4.68 1mh6A1 THR 206 HB 0.01 0.22 0.09 -0.04 4.32 4.60 1mh6A1 THR 206 HG23 0.01 -0.00 -0.14 -0.04 1.22 1.05 1mh6A1 PRO 207 HA 0.00 0.04 0.38 -0.51 4.44 4.35 1mh6A1 PRO 207 HB2 -0.09 0.00 -0.11 -0.04 2.28 2.04 1mh6A1 PRO 207 HB3 -0.03 0.02 0.05 -0.04 2.02 2.03 1mh6A1 PRO 207 HG2 -0.13 -0.01 0.08 -0.04 2.03 1.93 1mh6A1 PRO 207 HG3 -0.06 -0.01 -0.04 -0.04 2.03 1.88 1mh6A1 PRO 207 HD2 -0.03 0.26 0.23 -0.04 3.68 4.11 1mh6A1 PRO 207 HD3 -0.02 0.14 0.18 -0.04 3.65 3.91 1mh6A1 ASN 208 H 0.04 0.16 0.12 -0.55 8.53 8.30 1mh6A1 ASN 208 HA -0.17 0.27 0.86 -0.75 4.76 4.97 1mh6A1 ASN 208 HB2 0.21 -0.06 0.21 -0.04 2.88 3.20 1mh6A1 ASN 208 HB3 0.29 0.06 0.09 -0.04 2.79 3.19 1mh6A1 ASN 208 HD21 0.25 -0.01 0.00 -0.04 7.03 7.23 1mh6A1 ASN 208 HD22 0.26 -0.04 0.03 -0.04 7.74 7.95 1mh6A1 LEU 209 H -0.44 0.17 -0.16 -0.55 8.37 7.39 1mh6A1 LEU 209 HA -0.10 0.16 0.46 -0.75 4.35 4.12 1mh6A1 LEU 209 HB2 -1.15 -0.03 -0.14 -0.04 1.64 0.28 1mh6A1 LEU 209 HB3 -0.24 0.07 -0.11 -0.04 1.64 1.32 1mh6A1 LEU 209 HG -0.25 -0.07 -0.44 -0.04 1.64 0.84 1mh6A1 LEU 209 HD13 -0.30 -0.00 -0.21 -0.04 0.93 0.37 1mh6A1 LEU 209 HD23 0.05 0.04 -0.28 -0.04 0.89 0.66 1mh6A1 PRO 210 HA -1.09 0.21 0.64 -0.51 4.44 3.69 1mh6A1 PRO 210 HB2 -0.53 0.03 -0.03 -0.04 2.28 1.72 1mh6A1 PRO 210 HB3 -0.76 0.03 0.04 -0.04 2.02 1.29 1mh6A1 PRO 210 HG2 -0.53 0.04 0.09 -0.04 2.03 1.58 1mh6A1 PRO 210 HG3 -1.73 0.03 0.05 -0.04 2.03 0.35 1mh6A1 PRO 210 HD2 -0.30 0.05 0.13 -0.04 3.68 3.52 1mh6A1 PRO 210 HD3 -0.60 0.16 0.16 -0.04 3.65 3.33 1mh6A1 SER 211 H -0.12 0.66 0.27 -0.55 8.46 8.72 1mh6A1 SER 211 HA -0.11 0.06 0.65 -0.75 4.49 4.34 1mh6A1 SER 211 HB2 -0.44 0.04 -0.17 -0.04 3.95 3.34 1mh6A1 SER 211 HB3 0.19 0.05 -0.17 -0.04 3.93 3.96 1mh6A1 ARG 212 H -0.09 0.14 0.04 -0.55 8.46 7.99 1mh6A1 ARG 212 HA -0.06 0.15 0.34 -0.75 4.34 4.02 1mh6A1 ARG 212 HB2 -0.06 -0.10 0.15 -0.04 1.90 1.85 1mh6A1 ARG 212 HB3 -0.05 0.02 0.05 -0.04 1.80 1.78 1mh6A1 ARG 212 HG2 -0.06 0.11 0.15 -0.04 1.67 1.83 1mh6A1 ARG 212 HG3 -0.11 -0.03 0.01 -0.04 1.67 1.50 1mh6A1 ARG 212 HD2 -0.05 -0.03 0.09 -0.04 3.22 3.19 1mh6A1 ARG 212 HD3 -0.09 0.23 0.11 -0.04 3.22 3.43 1mh6A1 ASP 213 H -0.04 0.12 0.04 -0.55 8.40 7.97 1mh6A1 ASP 213 HA -0.05 0.24 0.78 -0.75 4.63 4.85 1mh6A1 ASP 213 HB2 -0.02 0.16 0.07 -0.04 2.71 2.87 1mh6A1 ASP 213 HB3 -0.02 -0.01 0.15 -0.04 2.70 2.78 1mh6A1 PHE 214 H 0.08 0.18 0.07 -0.55 8.34 8.12 1mh6A1 PHE 214 HA -0.10 0.11 0.52 -0.75 4.62 4.40 1mh6A1 PHE 214 HB2 -0.01 0.03 0.02 -0.04 3.15 3.15 1mh6A1 PHE 214 HB3 -0.02 0.05 -0.02 -0.04 3.06 3.04 1mh6A1 PHE 214 HD2 -0.03 0.00 -0.33 -0.04 7.28 6.88 1mh6A1 PHE 214 HE2 0.06 -0.10 -0.73 -0.04 7.38 6.57 1mh6A1 PHE 214 HZ 0.12 0.16 -0.47 -0.04 7.32 7.10 1mh6A1 ASP 215 H 0.07 -0.04 -0.16 -0.55 8.40 7.73 1mh6A1 ASP 215 HA 0.02 0.21 0.76 -0.75 4.63 4.86 1mh6A1 ASP 215 HB2 0.02 -0.04 0.10 -0.04 2.71 2.75 1mh6A1 ASP 215 HB3 0.01 0.07 0.02 -0.04 2.70 2.77 1mh6A1 SER 216 H 0.01 0.03 -0.08 -0.55 8.46 7.87 1mh6A1 SER 216 HA -0.01 0.13 0.34 -0.75 4.49 4.20 1mh6A1 SER 216 HB2 -0.03 -0.04 0.11 -0.04 3.95 3.96 1mh6A1 SER 216 HB3 -0.03 0.10 0.01 -0.04 3.93 3.97 1mh6A1 THR 217 H -0.05 0.33 -0.10 -0.55 8.28 7.91 1mh6A1 THR 217 HA -0.08 0.08 0.53 -0.75 4.39 4.16 1mh6A1 THR 217 HB -0.28 0.08 0.04 -0.04 4.32 4.11 1mh6A1 THR 217 HG23 -0.68 0.01 -0.05 -0.04 1.22 0.46 1mh6A1 ALA 218 H -0.05 0.08 -0.51 -0.55 8.40 7.37 1mh6A1 ALA 218 HA -0.00 0.03 0.52 -0.75 4.34 4.13 1mh6A1 ALA 218 HB3 -0.03 0.04 0.11 -0.04 1.41 1.49 1mh6A1 ALA 219 H 0.00 0.56 -0.05 -0.55 8.40 8.35 1mh6A1 ALA 219 HA -0.01 -0.03 0.39 -0.75 4.34 3.93 1mh6A1 ALA 219 HB3 -0.00 0.01 0.08 -0.04 1.41 1.46 1mh6A1 PHE 220 H 0.06 0.15 -0.59 -0.55 8.34 7.41 1mh6A1 PHE 220 HA -0.17 0.12 0.72 -0.75 4.62 4.54 1mh6A1 PHE 220 HB2 -0.19 0.02 0.15 -0.04 3.15 3.10 1mh6A1 PHE 220 HB3 -0.34 0.07 0.20 -0.04 3.06 2.95 1mh6A1 PHE 220 HD2 -0.78 0.02 0.01 -0.04 7.28 6.49 1mh6A1 PHE 220 HE2 -0.26 0.00 -0.01 -0.04 7.38 7.07 1mh6A1 PHE 220 HZ -0.12 0.03 -0.05 -0.04 7.32 7.14 1mh6A1 TYR 221 H 0.01 0.39 0.04 -0.55 8.29 8.18 1mh6A1 TYR 221 HA -0.39 0.07 0.46 -0.75 4.56 3.95 1mh6A1 TYR 221 HB2 -0.25 0.06 0.10 -0.04 3.06 2.93 1mh6A1 TYR 221 HB3 -1.01 -0.04 -0.04 -0.04 2.98 1.85 1mh6A1 TYR 221 HD2 -0.41 0.10 0.01 -0.04 7.15 6.81 1mh6A1 TYR 221 HE2 0.08 -0.03 -0.03 -0.04 6.85 6.83 1mh6A1 GLU 222 H 0.02 0.62 0.03 -0.55 8.60 8.73 1mh6A1 GLU 222 HA 0.11 0.16 0.44 -0.75 4.29 4.25 1mh6A1 GLU 222 HB2 0.04 0.01 0.05 -0.04 2.09 2.15 1mh6A1 GLU 222 HB3 0.00 0.13 0.03 -0.04 1.99 2.11 1mh6A1 GLU 222 HG2 0.02 -0.02 -0.12 -0.04 2.34 2.18 1mh6A1 GLU 222 HG3 0.01 -0.02 -0.05 -0.04 2.34 2.23 1mh6A1 ARG 223 H -0.04 0.19 -0.13 -0.55 8.46 7.93 1mh6A1 ARG 223 HA -0.04 0.01 0.31 -0.75 4.34 3.87 1mh6A1 ARG 223 HB2 -0.16 0.14 -0.02 -0.04 1.90 1.81 1mh6A1 ARG 223 HB3 -0.10 -0.01 0.04 -0.04 1.80 1.69 1mh6A1 ARG 223 HG2 -0.06 -0.07 0.05 -0.04 1.67 1.54 1mh6A1 ARG 223 HG3 -0.07 -0.04 0.06 -0.04 1.67 1.58 1mh6A1 ARG 223 HD2 -0.09 0.09 0.05 -0.04 3.22 3.23 1mh6A1 ARG 223 HD3 -0.06 -0.08 0.06 -0.04 3.22 3.09 1mh6A1 LEU 224 H -0.04 0.37 -0.52 -0.55 8.37 7.64 1mh6A1 LEU 224 HA -0.15 0.04 0.57 -0.75 4.35 4.06 1mh6A1 LEU 224 HB2 0.21 0.16 0.08 -0.04 1.64 2.05 1mh6A1 LEU 224 HB3 -0.23 -0.10 0.14 -0.04 1.64 1.41 1mh6A1 LEU 224 HG -0.32 0.11 -0.02 -0.04 1.64 1.38 1mh6A1 LEU 224 HD13 -0.25 -0.03 -0.01 -0.04 0.93 0.60 1mh6A1 LEU 224 HD23 -0.40 -0.00 -0.13 -0.04 0.89 0.32 1mh6A1 GLY 225 H 0.05 0.39 -0.41 -0.55 8.43 7.91 1mh6A1 GLY 225 HA2 0.02 0.00 0.25 -0.51 4.01 3.77 1mh6A1 GLY 225 HA3 -0.02 0.01 0.61 -0.51 4.01 4.09 1mh6A1 PHE 226 H 0.29 0.35 -0.09 -0.55 8.34 8.34 1mh6A1 PHE 226 HA 0.04 0.09 0.14 -0.75 4.62 4.14 1mh6A1 PHE 226 HB2 0.10 0.00 -0.41 -0.04 3.15 2.80 1mh6A1 PHE 226 HB3 0.06 -0.10 -0.35 -0.04 3.06 2.63 1mh6A1 PHE 226 HD2 0.04 0.12 -0.36 -0.04 7.28 7.04 1mh6A1 PHE 226 HE2 0.12 0.04 -0.03 -0.04 7.38 7.47 1mh6A1 PHE 226 HZ 0.41 -0.05 -0.04 -0.04 7.32 7.60 1mh6A1 GLY 227 H 0.07 0.59 0.11 -0.55 8.43 8.65 1mh6A1 GLY 227 HA2 0.06 0.02 0.41 -0.51 4.01 3.99 1mh6A1 GLY 227 HA3 0.05 0.06 0.29 -0.51 4.01 3.91 1mh6A1 ILE 228 H 0.05 0.15 0.14 -0.55 8.25 8.04 1mh6A1 ILE 228 HA 0.05 0.24 0.61 -0.75 4.18 4.33 1mh6A1 ILE 228 HB 0.02 -0.02 0.18 -0.04 1.89 2.02 1mh6A1 ILE 228 HG12 0.01 0.02 -0.03 -0.04 1.49 1.45 1mh6A1 ILE 228 HG13 0.04 0.04 0.05 -0.04 1.21 1.30 1mh6A1 ILE 228 HG23 -0.01 -0.00 -0.13 -0.04 0.93 0.75 1mh6A1 ILE 228 HD13 0.01 -0.01 -0.00 -0.04 0.88 0.84 1mh6A1 VAL 229 H 0.07 0.51 0.26 -0.55 8.24 8.54 1mh6A1 VAL 229 HA 0.07 0.10 0.55 -0.75 4.13 4.10 1mh6A1 VAL 229 HB 0.10 -0.02 0.03 -0.04 2.12 2.19 1mh6A1 VAL 229 HG13 0.06 0.02 -0.09 -0.04 0.97 0.91 1mh6A1 VAL 229 HG23 0.10 0.02 -0.05 -0.04 0.95 0.98 1mh6A1 PHE 230 H 0.16 0.27 0.09 -0.55 8.34 8.31 1mh6A1 PHE 230 HA 0.07 0.17 0.57 -0.75 4.62 4.67 1mh6A1 PHE 230 HB2 0.12 0.07 -0.10 -0.04 3.15 3.20 1mh6A1 PHE 230 HB3 0.17 -0.10 0.02 -0.04 3.06 3.10 1mh6A1 PHE 230 HD2 0.21 0.03 -0.18 -0.04 7.28 7.30 1mh6A1 PHE 230 HE2 0.15 -0.04 -0.05 -0.04 7.38 7.39 1mh6A1 PHE 230 HZ 0.07 -0.01 -0.05 -0.04 7.32 7.29 1mh6A1 ARG 231 H -0.56 0.20 0.04 -0.55 8.46 7.58 1mh6A1 ARG 231 HA -0.01 0.27 0.45 -0.75 4.34 4.29 1mh6A1 ARG 231 HB2 -0.07 0.05 0.05 -0.04 1.90 1.90 1mh6A1 ARG 231 HB3 -0.06 -0.04 0.03 -0.04 1.80 1.69 1mh6A1 ARG 231 HG2 0.07 0.14 -0.19 -0.04 1.67 1.65 1mh6A1 ARG 231 HG3 0.03 0.02 0.00 -0.04 1.67 1.68 1mh6A1 ARG 231 HD2 -0.02 0.02 -0.05 -0.04 3.22 3.13 1mh6A1 ARG 231 HD3 0.01 -0.04 -0.06 -0.04 3.22 3.09 1mh6A1 ASP 232 H 0.15 0.42 0.11 -0.55 8.40 8.53 1mh6A1 ASP 232 HA -0.00 0.25 0.70 -0.75 4.63 4.82 1mh6A1 ASP 232 HB2 0.08 0.07 0.20 -0.04 2.71 3.02 1mh6A1 ASP 232 HB3 0.00 0.08 0.02 -0.04 2.70 2.76 1mh6A1 ALA 233 H 0.15 -0.02 0.19 -0.55 8.40 8.18 1mh6A1 ALA 233 HA 0.08 0.20 0.73 -0.75 4.34 4.60 1mh6A1 ALA 233 HB3 0.04 0.02 0.10 -0.04 1.41 1.53 1mh6A1 GLY 234 H 0.25 -0.10 0.11 -0.55 8.43 8.14 1mh6A1 GLY 234 HA2 0.21 0.15 0.65 -0.51 4.01 4.51 1mh6A1 GLY 234 HA3 0.28 0.03 0.32 -0.51 4.01 4.13 1mh6A1 TRP 235 H 0.60 -0.10 0.02 -0.55 7.97 7.95 1mh6A1 TRP 235 HA 0.32 0.42 0.81 -0.75 4.62 5.42 1mh6A1 TRP 235 HB2 0.22 -0.03 -0.12 -0.04 3.23 3.25 1mh6A1 TRP 235 HB3 0.41 -0.09 -0.04 -0.04 3.23 3.47 1mh6A1 TRP 235 HD1 -0.04 -0.06 -0.20 -0.04 7.22 6.87 1mh6A1 TRP 235 HE1 -0.05 0.01 -0.13 -0.04 10.20 9.99 1mh6A1 TRP 235 HE3 0.20 0.01 -0.12 -0.04 7.59 7.64 1mh6A1 TRP 235 HZ2 0.00 -0.00 -0.07 -0.04 7.44 7.33 1mh6A1 TRP 235 HZ3 0.11 -0.02 -0.08 -0.04 7.13 7.10 1mh6A1 TRP 235 HH2 0.04 -0.01 -0.03 -0.04 7.19 7.15 1mh6A1 MET 236 H -0.50 0.55 0.07 -0.55 8.47 8.05 1mh6A1 MET 236 HA -0.10 0.24 0.75 -0.75 4.52 4.66 1mh6A1 MET 236 HB2 -1.37 0.01 -0.24 -0.04 2.15 0.51 1mh6A1 MET 236 HB3 -1.04 -0.02 0.03 -0.04 2.03 0.95 1mh6A1 MET 236 HG2 -0.26 -0.02 -0.23 -0.04 2.63 2.08 1mh6A1 MET 236 HG3 -0.26 0.06 0.02 -0.04 2.56 2.33 1mh6A1 MET 236 HE3 -0.45 -0.04 -0.12 -0.04 2.10 1.45 1mh6A1 ILE 237 H 0.08 0.50 0.18 -0.55 8.25 8.46 1mh6A1 ILE 237 HA -0.09 0.20 0.58 -0.75 4.18 4.11 1mh6A1 ILE 237 HB 0.17 -0.12 0.14 -0.04 1.89 2.04 1mh6A1 ILE 237 HG12 0.09 0.04 -0.18 -0.04 1.49 1.39 1mh6A1 ILE 237 HG13 0.25 -0.07 -0.15 -0.04 1.21 1.21 1mh6A1 ILE 237 HG23 0.07 0.01 -0.26 -0.04 0.93 0.71 1mh6A1 ILE 237 HD13 0.22 0.01 -0.10 -0.04 0.88 0.96 1mh6A1 LEU 238 H 0.00 0.64 0.27 -0.55 8.37 8.73 1mh6A1 LEU 238 HA 0.10 0.19 0.63 -0.75 4.35 4.52 1mh6A1 LEU 238 HB2 0.03 -0.00 0.17 -0.04 1.64 1.80 1mh6A1 LEU 238 HB3 0.10 0.00 -0.08 -0.04 1.64 1.62 1mh6A1 LEU 238 HG 0.02 0.09 -0.15 -0.04 1.64 1.56 1mh6A1 LEU 238 HD13 -0.05 -0.03 -0.10 -0.04 0.93 0.71 1mh6A1 LEU 238 HD23 -0.01 0.02 -0.17 -0.04 0.89 0.68 1mh6A1 GLN 239 H 0.14 0.59 0.02 -0.55 8.47 8.68 1mh6A1 GLN 239 HA 0.07 0.28 0.51 -0.75 4.36 4.47 1mh6A1 GLN 239 HB2 0.06 -0.03 -0.43 -0.04 2.15 1.71 1mh6A1 GLN 239 HB3 0.05 0.04 0.01 -0.04 2.02 2.07 1mh6A1 GLN 239 HG2 -0.00 0.04 -0.42 -0.04 2.40 1.98 1mh6A1 GLN 239 HG3 0.01 -0.11 -0.51 -0.04 2.39 1.74 1mh6A1 GLN 239 HE21 0.01 0.39 0.11 -0.04 6.97 7.43 1mh6A1 GLN 239 HE22 0.02 -0.04 -0.03 -0.04 7.69 7.60 1mh6A1 ARG 240 H -0.30 0.27 -0.00 -0.55 8.46 7.88 1mh6A1 ARG 240 HA -0.18 0.34 0.90 -0.75 4.34 4.65 1mh6A1 ARG 240 HB2 -1.12 0.04 -0.22 -0.04 1.90 0.56 1mh6A1 ARG 240 HB3 -0.70 -0.11 0.18 -0.04 1.80 1.12 1mh6A1 ARG 240 HG2 -0.15 -0.12 -0.01 -0.04 1.67 1.35 1mh6A1 ARG 240 HG3 -0.18 0.16 0.08 -0.04 1.67 1.69 1mh6A1 ARG 240 HD2 -0.25 0.08 -0.01 -0.04 3.22 3.00 1mh6A1 ARG 240 HD3 -0.02 -0.15 0.03 -0.04 3.22 3.05 1mh6A1 GLY 241 H -0.06 0.33 -0.12 -0.55 8.43 8.03 1mh6A1 GLY 241 HA2 -0.03 0.07 0.35 -0.51 4.01 3.89 1mh6A1 GLY 241 HA3 -0.04 0.05 0.62 -0.51 4.01 4.13 1mh6A1 ASP 242 H -0.04 0.22 0.14 -0.55 8.40 8.18 1mh6A1 ASP 242 HA -0.01 0.16 0.31 -0.75 4.63 4.34 1mh6A1 ASP 242 HB2 -0.01 -0.01 0.08 -0.04 2.71 2.73 1mh6A1 ASP 242 HB3 -0.01 0.02 0.18 -0.04 2.70 2.85 1mh6A1 LEU 243 H -0.08 0.37 -0.21 -0.55 8.37 7.90 1mh6A1 LEU 243 HA -0.01 0.18 0.69 -0.75 4.35 4.47 1mh6A1 LEU 243 HB2 -0.39 -0.17 0.23 -0.04 1.64 1.28 1mh6A1 LEU 243 HB3 0.09 0.04 0.12 -0.04 1.64 1.84 1mh6A1 LEU 243 HG -0.11 0.13 0.11 -0.04 1.64 1.73 1mh6A1 LEU 243 HD13 -0.02 -0.00 0.01 -0.04 0.93 0.87 1mh6A1 LEU 243 HD23 -0.03 -0.00 -0.06 -0.04 0.89 0.77 1mh6A1 MET 244 H 0.01 0.54 -0.44 -0.55 8.47 8.03 1mh6A1 MET 244 HA 0.04 0.09 0.09 -0.75 4.52 3.98 1mh6A1 MET 244 HB2 0.02 -0.01 -0.13 -0.04 2.15 1.99 1mh6A1 MET 244 HB3 0.01 0.02 0.10 -0.04 2.03 2.13 1mh6A1 MET 244 HG2 0.03 -0.02 -0.23 -0.04 2.63 2.37 1mh6A1 MET 244 HG3 0.04 -0.02 -0.18 -0.04 2.56 2.36 1mh6A1 MET 244 HE3 0.03 0.01 -0.05 -0.04 2.10 2.04 1mh6A1 LEU 245 H 0.05 0.76 0.37 -0.55 8.37 9.01 1mh6A1 LEU 245 HA -0.25 0.16 0.72 -0.75 4.35 4.23 1mh6A1 LEU 245 HB2 -0.12 -0.00 0.26 -0.04 1.64 1.73 1mh6A1 LEU 245 HB3 -0.57 -0.05 0.03 -0.04 1.64 1.01 1mh6A1 LEU 245 HG 0.10 0.14 -0.09 -0.04 1.64 1.75 1mh6A1 LEU 245 HD13 -0.69 -0.02 -0.04 -0.04 0.93 0.13 1mh6A1 LEU 245 HD23 -0.15 -0.00 -0.16 -0.04 0.89 0.54 1mh6A1 GLU 246 H -0.28 0.62 0.15 -0.55 8.60 8.55 1mh6A1 GLU 246 HA -0.43 0.08 0.44 -0.75 4.29 3.62 1mh6A1 GLU 246 HB2 -0.14 0.07 0.07 -0.04 2.09 2.05 1mh6A1 GLU 246 HB3 -0.38 -0.06 -0.03 -0.04 1.99 1.48 1mh6A1 GLU 246 HG2 0.01 -0.09 -0.28 -0.04 2.34 1.95 1mh6A1 GLU 246 HG3 -0.01 0.19 -0.24 -0.04 2.34 2.23 1mh6A1 PHE 247 H -0.32 0.67 0.24 -0.55 8.34 8.37 1mh6A1 PHE 247 HA -0.32 0.13 0.31 -0.75 4.62 3.98 1mh6A1 PHE 247 HB2 -0.44 0.06 0.11 -0.04 3.15 2.84 1mh6A1 PHE 247 HB3 -0.18 -0.02 -0.15 -0.04 3.06 2.66 1mh6A1 PHE 247 HD2 -0.25 0.13 -0.34 -0.04 7.28 6.78 1mh6A1 PHE 247 HE2 -0.34 0.04 -0.14 -0.04 7.38 6.90 1mh6A1 PHE 247 HZ -0.10 -0.02 -0.10 -0.04 7.32 7.06 1mh6A1 PHE 248 H -0.11 0.66 0.29 -0.55 8.34 8.62 1mh6A1 PHE 248 HA 0.32 0.30 0.96 -0.75 4.62 5.44 1mh6A1 PHE 248 HB2 0.29 0.00 0.06 -0.04 3.15 3.46 1mh6A1 PHE 248 HB3 0.29 0.00 0.01 -0.04 3.06 3.31 1mh6A1 PHE 248 HD2 0.06 0.05 -0.34 -0.04 7.28 7.00 1mh6A1 PHE 248 HE2 0.03 0.09 -0.11 -0.04 7.38 7.34 1mh6A1 PHE 248 HZ 0.05 -0.02 -0.07 -0.04 7.32 7.24 1mh6A1 ALA 249 H 0.41 0.44 0.21 -0.55 8.40 8.91 1mh6A1 ALA 249 HA -0.15 0.19 0.41 -0.75 4.34 4.03 1mh6A1 ALA 249 HB3 -0.27 0.01 0.19 -0.04 1.41 1.30 1mh6A1 HIS 250 H 0.02 0.58 0.23 -0.55 8.41 8.68 1mh6A1 HIS 250 HA 0.06 0.15 0.75 -0.75 4.63 4.84 1mh6A1 HIS 250 HB2 -0.13 0.04 -0.13 -0.04 3.26 3.00 1mh6A1 HIS 250 HB3 -0.20 -0.08 0.00 -0.04 3.20 2.88 1mh6A1 HIS 250 HD2 0.03 0.00 -0.06 -0.04 6.97 6.90 1mh6A1 HIS 250 HE1 0.07 0.14 -0.10 -0.04 7.75 7.81 1mh6A1 PRO 251 HA 0.00 0.06 0.49 -0.51 4.44 4.48 1mh6A1 PRO 251 HB2 0.01 0.02 0.02 -0.04 2.28 2.29 1mh6A1 PRO 251 HB3 -0.01 0.06 0.10 -0.04 2.02 2.13 1mh6A1 PRO 251 HG2 0.05 -0.00 0.09 -0.04 2.03 2.12 1mh6A1 PRO 251 HG3 0.01 0.05 0.05 -0.04 2.03 2.10 1mh6A1 PRO 251 HD2 0.06 0.14 0.17 -0.04 3.68 4.01 1mh6A1 PRO 251 HD3 0.01 0.19 -0.15 -0.04 3.65 3.66 1mh6A1 GLY 252 H 0.23 0.13 -0.22 -0.55 8.43 8.02 1mh6A1 GLY 252 HA2 0.05 0.14 0.59 -0.51 4.01 4.27 1mh6A1 GLY 252 HA3 0.11 -0.01 0.34 -0.51 4.01 3.94 1mh6A1 LEU 253 H -0.06 0.38 -0.35 -0.55 8.37 7.79 1mh6A1 LEU 253 HA -0.20 0.11 0.75 -0.75 4.35 4.26 1mh6A1 LEU 253 HB2 -0.69 0.01 -0.19 -0.04 1.64 0.72 1mh6A1 LEU 253 HB3 -0.24 -0.01 -0.04 -0.04 1.64 1.30 1mh6A1 LEU 253 HG -0.17 0.09 -0.27 -0.04 1.64 1.25 1mh6A1 LEU 253 HD13 -0.44 -0.01 -0.03 -0.04 0.93 0.41 1mh6A1 LEU 253 HD23 -0.26 -0.01 -0.12 -0.04 0.89 0.45 1mh6A1 ASP 254 H -0.04 0.17 0.06 -0.55 8.40 8.05 1mh6A1 ASP 254 HA -0.06 0.20 0.78 -0.75 4.63 4.80 1mh6A1 ASP 254 HB2 -0.00 0.06 0.04 -0.04 2.71 2.77 1mh6A1 ASP 254 HB3 0.00 0.01 0.10 -0.04 2.70 2.76 1mh6A1 PRO 255 HA -0.24 0.25 0.11 -0.51 4.44 4.05 1mh6A1 PRO 255 HB2 -1.21 -0.01 -0.08 -0.04 2.28 0.95 1mh6A1 PRO 255 HB3 -0.90 0.02 -0.15 -0.04 2.02 0.95 1mh6A1 PRO 255 HG2 -0.29 0.05 0.10 -0.04 2.03 1.85 1mh6A1 PRO 255 HG3 -0.27 0.06 0.11 -0.04 2.03 1.89 1mh6A1 PRO 255 HD2 -0.12 0.02 0.21 -0.04 3.68 3.75 1mh6A1 PRO 255 HD3 -0.11 0.31 0.21 -0.04 3.65 4.01 1mh6A1 LEU 256 H -0.12 0.02 -0.25 -0.55 8.37 7.46 1mh6A1 LEU 256 HA -0.07 0.18 0.55 -0.75 4.35 4.25 1mh6A1 LEU 256 HB2 -0.01 -0.06 0.08 -0.04 1.64 1.61 1mh6A1 LEU 256 HB3 -0.00 0.04 0.01 -0.04 1.64 1.64 1mh6A1 LEU 256 HG 0.07 -0.03 -0.01 -0.04 1.64 1.63 1mh6A1 LEU 256 HD13 0.06 0.00 0.00 -0.04 0.93 0.96 1mh6A1 LEU 256 HD23 0.13 0.02 -0.03 -0.04 0.89 0.97 1mh6A1 ALA 257 H -0.03 0.01 -0.12 -0.55 8.40 7.71 1mh6A1 ALA 257 HA -0.06 0.16 0.56 -0.75 4.34 4.24 1mh6A1 ALA 257 HB3 0.04 -0.01 0.11 -0.04 1.41 1.51 1mh6A1 SER 258 H -0.06 0.32 -0.77 -0.55 8.46 7.40 1mh6A1 SER 258 HA 0.17 0.02 0.46 -0.75 4.49 4.39 1mh6A1 SER 258 HB2 0.01 0.11 0.01 -0.04 3.95 4.04 1mh6A1 SER 258 HB3 -0.02 0.21 0.20 -0.04 3.93 4.28 1mh6A1 TRP 259 H 0.18 0.24 0.18 -0.55 7.97 8.03 1mh6A1 TRP 259 HA -0.08 0.13 0.62 -0.75 4.62 4.54 1mh6A1 TRP 259 HB2 -0.35 -0.02 0.08 -0.04 3.23 2.90 1mh6A1 TRP 259 HB3 -0.19 -0.01 0.09 -0.04 3.23 3.07 1mh6A1 TRP 259 HD1 -0.10 0.07 0.03 -0.04 7.22 7.18 1mh6A1 TRP 259 HE1 -0.04 -0.02 -0.02 -0.04 10.20 10.09 1mh6A1 TRP 259 HE3 -0.06 0.01 0.05 -0.04 7.59 7.55 1mh6A1 TRP 259 HZ2 -0.03 -0.02 -0.01 -0.04 7.44 7.34 1mh6A1 TRP 259 HZ3 -0.03 -0.01 0.00 -0.04 7.13 7.05 1mh6A1 TRP 259 HH2 -0.02 -0.02 -0.01 -0.04 7.19 7.10 1mh6A1 PHE 260 H 0.17 0.04 -0.37 -0.55 8.34 7.63 1mh6A1 PHE 260 HA 0.11 0.04 0.29 -0.75 4.62 4.30 1mh6A1 PHE 260 HB2 0.04 0.03 0.03 -0.04 3.15 3.21 1mh6A1 PHE 260 HB3 0.04 -0.01 -0.00 -0.04 3.06 3.05 1mh6A1 PHE 260 HD2 0.08 0.03 0.03 -0.04 7.28 7.38 1mh6A1 PHE 260 HE2 0.14 0.02 0.01 -0.04 7.38 7.52 1mh6A1 PHE 260 HZ 0.21 -0.00 0.00 -0.04 7.32 7.49 1mh6A1 SER 261 H 0.18 0.18 0.17 -0.55 8.46 8.44 1mh6A1 SER 261 HA 0.10 0.02 0.50 -0.75 4.49 4.36 1mh6A1 SER 261 HB2 0.06 0.08 0.04 -0.04 3.95 4.10 1mh6A1 SER 261 HB3 0.09 0.09 -0.18 -0.04 3.93 3.89 1mh6A1 CYS 262 H 0.05 0.32 0.07 -0.55 8.50 8.39 1mh6A1 CYS 262 HA 0.01 0.11 0.45 -0.75 4.58 4.39 1mh6A1 CYS 262 HB2 -0.02 0.04 0.03 -0.04 2.97 2.98 1mh6A1 CYS 262 HB3 -0.02 0.06 -0.13 -0.04 2.97 2.84 1mh6A1 CYS 263 H -0.02 0.18 0.11 -0.55 8.50 8.22 1mh6A1 CYS 263 HA -0.03 0.23 0.83 -0.75 4.58 4.86 1mh6A1 CYS 263 HB2 -0.07 -0.01 0.17 -0.04 2.97 3.02 1mh6A1 CYS 263 HB3 -0.09 -0.01 0.01 -0.04 2.97 2.84 1mh6A1 LEU 264 H -0.04 0.40 0.06 -0.55 8.37 8.24 1mh6A1 LEU 264 HA -0.04 0.09 0.68 -0.75 4.35 4.33 1mh6A1 LEU 264 HB2 -0.19 -0.04 0.09 -0.04 1.64 1.45 1mh6A1 LEU 264 HB3 -0.16 -0.00 0.01 -0.04 1.64 1.45 1mh6A1 LEU 264 HG 0.03 0.02 -0.09 -0.04 1.64 1.56 1mh6A1 LEU 264 HD13 0.12 0.01 -0.04 -0.04 0.93 0.98 1mh6A1 LEU 264 HD23 0.11 0.01 -0.11 -0.04 0.89 0.86 1mh6A1 ARG 265 H -0.04 0.27 0.09 -0.55 8.46 8.22 1mh6A1 ARG 265 HA -0.03 0.15 0.73 -0.75 4.34 4.43 1mh6A1 ARG 265 HB2 -0.04 0.05 0.15 -0.04 1.90 2.03 1mh6A1 ARG 265 HB3 -0.03 -0.03 0.02 -0.04 1.80 1.72 1mh6A1 ARG 265 HG2 -0.07 -0.01 -0.08 -0.04 1.67 1.46 1mh6A1 ARG 265 HG3 -0.09 0.01 -0.11 -0.04 1.67 1.44 1mh6A1 ARG 265 HD2 -0.07 0.05 0.01 -0.04 3.22 3.17 1mh6A1 ARG 265 HD3 -0.06 -0.04 -0.02 -0.04 3.22 3.06 1mh6A1 LEU 266 H -0.01 0.70 0.28 -0.55 8.37 8.79 1mh6A1 LEU 266 HA -0.00 0.09 0.38 -0.75 4.35 4.07 1mh6A1 LEU 266 HB2 0.01 -0.02 -0.10 -0.04 1.64 1.49 1mh6A1 LEU 266 HB3 0.04 -0.02 -0.22 -0.04 1.64 1.39 1mh6A1 LEU 266 HG -0.13 0.19 -0.20 -0.04 1.64 1.46 1mh6A1 LEU 266 HD13 -0.19 -0.01 0.00 -0.04 0.93 0.69 1mh6A1 LEU 266 HD23 -0.10 0.01 -0.11 -0.04 0.89 0.65 1mh6A1 ASP 267 H 0.02 0.17 0.14 -0.55 8.40 8.18 1mh6A1 ASP 267 HA 0.03 0.12 0.71 -0.75 4.63 4.73 1mh6A1 ASP 267 HB2 0.02 0.02 0.14 -0.04 2.71 2.85 1mh6A1 ASP 267 HB3 0.02 0.03 0.09 -0.04 2.70 2.80 1mh6A1 ASP 268 H 0.05 0.14 -0.02 -0.55 8.40 8.02 1mh6A1 ASP 268 HA 0.05 0.17 0.42 -0.75 4.63 4.51 1mh6A1 ASP 268 HB2 0.04 0.14 0.13 -0.04 2.71 2.98 1mh6A1 ASP 268 HB3 0.06 0.01 0.15 -0.04 2.70 2.87 1mh6A1 LEU 269 H 0.05 0.25 -0.03 -0.55 8.37 8.09 1mh6A1 LEU 269 HA 0.08 0.13 0.48 -0.75 4.35 4.28 1mh6A1 LEU 269 HB2 0.06 0.07 -0.03 -0.04 1.64 1.70 1mh6A1 LEU 269 HB3 0.05 -0.01 0.08 -0.04 1.64 1.71 1mh6A1 LEU 269 HG 0.04 -0.01 -0.26 -0.04 1.64 1.37 1mh6A1 LEU 269 HD13 0.05 -0.01 -0.09 -0.04 0.93 0.84 1mh6A1 LEU 269 HD23 0.05 0.01 -0.13 -0.04 0.89 0.77 1mh6A1 ALA 270 H 0.07 0.05 -0.15 -0.55 8.40 7.81 1mh6A1 ALA 270 HA 0.14 0.13 0.55 -0.75 4.34 4.40 1mh6A1 ALA 270 HB3 0.06 0.04 0.06 -0.04 1.41 1.54 1mh6A1 GLU 271 H 0.10 0.04 -0.35 -0.55 8.60 7.85 1mh6A1 GLU 271 HA 0.08 0.09 0.52 -0.75 4.29 4.22 1mh6A1 GLU 271 HB2 0.06 -0.03 0.09 -0.04 2.09 2.17 1mh6A1 GLU 271 HB3 0.09 0.09 0.12 -0.04 1.99 2.25 1mh6A1 GLU 271 HG2 0.04 0.01 0.01 -0.04 2.34 2.36 1mh6A1 GLU 271 HG3 0.05 0.07 -0.09 -0.04 2.34 2.33 1mh6A1 PHE 272 H 0.25 0.21 -0.14 -0.55 8.34 8.10 1mh6A1 PHE 272 HA 0.06 0.10 0.57 -0.75 4.62 4.60 1mh6A1 PHE 272 HB2 0.08 -0.02 0.14 -0.04 3.15 3.30 1mh6A1 PHE 272 HB3 0.12 0.10 0.08 -0.04 3.06 3.32 1mh6A1 PHE 272 HD2 0.10 -0.01 -0.08 -0.04 7.28 7.25 1mh6A1 PHE 272 HE2 0.22 0.01 -0.02 -0.04 7.38 7.56 1mh6A1 PHE 272 HZ 0.41 0.01 -0.02 -0.04 7.32 7.69 1mh6A1 TYR 273 H 0.35 0.23 -0.27 -0.55 8.29 8.05 1mh6A1 TYR 273 HA 0.12 0.08 0.59 -0.75 4.56 4.59 1mh6A1 TYR 273 HB2 0.12 0.04 0.09 -0.04 3.06 3.28 1mh6A1 TYR 273 HB3 0.08 0.03 0.10 -0.04 2.98 3.15 1mh6A1 TYR 273 HD2 0.09 0.01 -0.08 -0.04 7.15 7.12 1mh6A1 TYR 273 HE2 0.05 0.08 -0.15 -0.04 6.85 6.79 1mh6A1 ARG 274 H 0.15 0.55 0.01 -0.55 8.46 8.62 1mh6A1 ARG 274 HA 0.03 0.02 0.58 -0.75 4.34 4.22 1mh6A1 ARG 274 HB2 0.05 0.05 0.23 -0.04 1.90 2.19 1mh6A1 ARG 274 HB3 0.02 0.01 -0.01 -0.04 1.80 1.78 1mh6A1 ARG 274 HG2 0.03 -0.01 0.01 -0.04 1.67 1.66 1mh6A1 ARG 274 HG3 0.05 -0.01 0.05 -0.04 1.67 1.73 1mh6A1 ARG 274 HD2 0.05 -0.03 -0.05 -0.04 3.22 3.16 1mh6A1 ARG 274 HD3 0.08 0.12 -0.12 -0.04 3.22 3.26 1mh6A1 GLN 275 H -0.02 0.52 -0.12 -0.55 8.47 8.31 1mh6A1 GLN 275 HA -0.08 0.02 0.38 -0.75 4.36 3.92 1mh6A1 GLN 275 HB2 -0.07 0.04 0.13 -0.04 2.15 2.20 1mh6A1 GLN 275 HB3 -0.21 0.06 0.19 -0.04 2.02 2.01 1mh6A1 GLN 275 HG2 -0.16 0.04 -0.01 -0.04 2.40 2.23 1mh6A1 GLN 275 HG3 -0.09 -0.04 0.05 -0.04 2.39 2.27 1mh6A1 GLN 275 HE21 -0.06 0.04 -0.02 -0.04 6.97 6.90 1mh6A1 GLN 275 HE22 -0.05 -0.03 -0.21 -0.04 7.69 7.36 1mh6A1 CYS 276 H -0.18 0.52 -0.05 -0.55 8.50 8.25 1mh6A1 CYS 276 HA -0.22 0.04 0.35 -0.75 4.58 4.00 1mh6A1 CYS 276 HB2 -0.27 0.02 0.13 -0.04 2.97 2.81 1mh6A1 CYS 276 HB3 -0.18 -0.01 -0.02 -0.04 2.97 2.72 1mh6A1 LYS 277 H -0.21 0.37 -0.19 -0.55 8.42 7.84 1mh6A1 LYS 277 HA -0.13 0.06 0.59 -0.75 4.32 4.09 1mh6A1 LYS 277 HB2 -0.11 0.09 0.12 -0.04 1.87 1.94 1mh6A1 LYS 277 HB3 -0.07 -0.04 0.07 -0.04 1.79 1.70 1mh6A1 LYS 277 HG2 -0.18 0.02 0.04 -0.04 1.46 1.30 1mh6A1 LYS 277 HG3 -0.43 0.03 0.04 -0.04 1.46 1.05 1mh6A1 LYS 277 HD2 -0.09 -0.04 -0.01 -0.04 1.69 1.51 1mh6A1 LYS 277 HD3 -0.00 0.00 -0.00 -0.04 1.68 1.63 1mh6A1 LYS 277 HE2 -0.00 0.00 0.02 -0.04 2.99 2.97 1mh6A1 LYS 277 HE3 -0.03 -0.01 0.04 -0.04 2.99 2.96 1mh6A1 SER 278 H -0.09 0.31 -0.24 -0.55 8.46 7.90 1mh6A1 SER 278 HA -0.05 0.05 0.70 -0.75 4.49 4.44 1mh6A1 SER 278 HB2 -0.04 -0.06 0.05 -0.04 3.95 3.85 1mh6A1 SER 278 HB3 -0.04 -0.02 0.10 -0.04 3.93 3.92 1mh6A1 VAL 279 H -0.10 0.55 0.02 -0.55 8.24 8.16 1mh6A1 VAL 279 HA -0.07 0.05 0.49 -0.75 4.13 3.85 1mh6A1 VAL 279 HB -0.10 -0.06 0.06 -0.04 2.12 1.98 1mh6A1 VAL 279 HG13 -0.08 0.05 -0.01 -0.04 0.97 0.88 1mh6A1 VAL 279 HG23 -0.18 0.03 -0.26 -0.04 0.95 0.50 1mh6A1 GLY 280 H -0.10 0.22 -0.31 -0.55 8.43 7.69 1mh6A1 GLY 280 HA2 -0.07 -0.01 0.19 -0.51 4.01 3.61 1mh6A1 GLY 280 HA3 -0.06 0.10 0.64 -0.51 4.01 4.18 1mh6A1 ILE 281 H -0.09 0.32 0.09 -0.55 8.25 8.02 1mh6A1 ILE 281 HA 0.01 0.07 0.38 -0.75 4.18 3.88 1mh6A1 ILE 281 HB -0.10 -0.06 -0.03 -0.04 1.89 1.66 1mh6A1 ILE 281 HG12 -0.31 0.09 0.00 -0.04 1.49 1.23 1mh6A1 ILE 281 HG13 -0.25 0.01 -0.48 -0.04 1.21 0.44 1mh6A1 ILE 281 HG23 0.16 -0.01 -0.23 -0.04 0.93 0.80 1mh6A1 ILE 281 HD13 -0.44 -0.02 -0.07 -0.04 0.88 0.31 1mh6A1 GLN 282 H 0.01 0.19 -0.02 -0.55 8.47 8.11 1mh6A1 GLN 282 HA -0.04 0.03 0.28 -0.75 4.36 3.88 1mh6A1 GLN 282 HB2 -0.03 0.01 -0.04 -0.04 2.15 2.05 1mh6A1 GLN 282 HB3 -0.02 -0.01 0.01 -0.04 2.02 1.95 1mh6A1 GLN 282 HG2 -0.01 0.10 0.10 -0.04 2.40 2.55 1mh6A1 GLN 282 HG3 -0.02 0.02 0.02 -0.04 2.39 2.38 1mh6A1 GLN 282 HE21 -0.03 0.01 -0.12 -0.04 6.97 6.79 1mh6A1 GLN 282 HE22 -0.04 -0.05 -0.06 -0.04 7.69 7.50 1mh6A1 GLU 283 H -0.04 0.12 0.17 -0.55 8.60 8.30 1mh6A1 GLU 283 HA -0.07 0.24 0.74 -0.75 4.29 4.46 1mh6A1 GLU 283 HB2 -0.03 0.03 0.13 -0.04 2.09 2.17 1mh6A1 GLU 283 HB3 -0.01 -0.04 0.23 -0.04 1.99 2.13 1mh6A1 GLU 283 HG2 0.01 -0.04 -0.01 -0.04 2.34 2.26 1mh6A1 GLU 283 HG3 0.07 0.11 0.03 -0.04 2.34 2.51 1mh6A1 THR 284 H -0.16 0.36 0.26 -0.55 8.28 8.19 1mh6A1 THR 284 HA -0.04 0.01 0.77 -0.75 4.39 4.38 1mh6A1 THR 284 HB -0.03 -0.02 -0.32 -0.04 4.32 3.91 1mh6A1 THR 284 HG23 -0.02 0.05 -0.19 -0.04 1.22 1.01 1mh6A1 SER 285 H 0.02 0.06 0.13 -0.55 8.46 8.12 1mh6A1 SER 285 HA 0.29 0.10 0.60 -0.75 4.49 4.73 1mh6A1 SER 285 HB2 0.10 0.02 0.07 -0.04 3.95 4.10 1mh6A1 SER 285 HB3 0.11 -0.00 0.12 -0.04 3.93 4.12 1mh6A1 SER 286 H 0.04 -0.02 0.06 -0.55 8.46 7.99 1mh6A1 SER 286 HA 0.05 0.18 0.67 -0.75 4.49 4.63 1mh6A1 SER 286 HB2 0.02 -0.01 0.07 -0.04 3.95 3.99 1mh6A1 SER 286 HB3 0.01 -0.01 0.04 -0.04 3.93 3.93 1mh6A1 GLY 287 H 0.03 0.01 0.06 -0.55 8.43 7.99 1mh6A1 GLY 287 HA2 -0.08 -0.05 0.28 -0.51 4.01 3.65 1mh6A1 GLY 287 HA3 -0.05 0.14 0.45 -0.51 4.01 4.04 1mh6A1 TYR 288 H -0.32 0.17 0.10 -0.55 8.29 7.68 1mh6A1 TYR 288 HA -0.03 0.11 0.37 -0.75 4.56 4.26 1mh6A1 TYR 288 HB2 -0.07 0.16 0.00 -0.04 3.06 3.11 1mh6A1 TYR 288 HB3 -0.03 0.08 -0.13 -0.04 2.98 2.87 1mh6A1 TYR 288 HD2 -0.06 0.01 -0.15 -0.04 7.15 6.90 1mh6A1 TYR 288 HE2 -0.04 -0.02 0.00 -0.04 6.85 6.75 1mh6A1 PRO 289 HA 0.01 0.25 0.26 -0.51 4.44 4.45 1mh6A1 PRO 289 HB2 0.06 0.06 0.05 -0.04 2.28 2.40 1mh6A1 PRO 289 HB3 -0.44 -0.13 -0.00 -0.04 2.02 1.41 1mh6A1 PRO 289 HG2 0.06 0.00 0.10 -0.04 2.03 2.15 1mh6A1 PRO 289 HG3 -0.03 0.02 0.11 -0.04 2.03 2.08 1mh6A1 PRO 289 HD2 -0.06 0.09 0.41 -0.04 3.68 4.09 1mh6A1 PRO 289 HD3 -0.05 0.03 0.16 -0.04 3.65 3.74 1mh6A1 ARG 290 H 0.08 0.69 0.34 -0.55 8.46 9.02 1mh6A1 ARG 290 HA 0.03 0.21 0.70 -0.75 4.34 4.53 1mh6A1 ARG 290 HB2 -0.02 0.01 0.11 -0.04 1.90 1.96 1mh6A1 ARG 290 HB3 0.03 0.04 -0.39 -0.04 1.80 1.43 1mh6A1 ARG 290 HG2 0.10 0.02 -0.05 -0.04 1.67 1.70 1mh6A1 ARG 290 HG3 0.12 -0.14 -0.16 -0.04 1.67 1.44 1mh6A1 ARG 290 HD2 0.05 0.13 -0.07 -0.04 3.22 3.29 1mh6A1 ARG 290 HD3 0.10 0.06 -0.31 -0.04 3.22 3.03 1mh6A1 ILE 291 H -0.02 0.53 0.21 -0.55 8.25 8.42 1mh6A1 ILE 291 HA 0.14 0.22 0.91 -0.75 4.18 4.69 1mh6A1 ILE 291 HB 0.15 -0.00 -0.08 -0.04 1.89 1.92 1mh6A1 ILE 291 HG12 -0.06 0.08 -0.43 -0.04 1.49 1.03 1mh6A1 ILE 291 HG13 -0.04 -0.10 -0.09 -0.04 1.21 0.94 1mh6A1 ILE 291 HG23 0.06 -0.02 -0.15 -0.04 0.93 0.78 1mh6A1 ILE 291 HD13 -0.45 -0.02 -0.12 -0.04 0.88 0.24 1mh6A1 HIS 292 H 0.23 0.61 0.30 -0.55 8.41 9.00 1mh6A1 HIS 292 HA 0.13 0.13 0.75 -0.75 4.63 4.89 1mh6A1 HIS 292 HB2 0.09 0.06 0.16 -0.04 3.26 3.52 1mh6A1 HIS 292 HB3 0.06 -0.06 0.10 -0.04 3.20 3.26 1mh6A1 HIS 292 HD2 0.05 -0.11 0.06 -0.04 6.97 6.92 1mh6A1 HIS 292 HE1 0.04 0.26 0.15 -0.04 7.75 8.16 1mh6A1 ALA 293 H 0.17 0.11 0.12 -0.55 8.40 8.25 1mh6A1 ALA 293 HA -0.42 0.11 0.03 -0.75 4.34 3.30 1mh6A1 ALA 293 HB3 -0.04 0.02 0.03 -0.04 1.41 1.38 1mh6A1 PRO 294 HA -0.06 0.09 0.30 -0.51 4.44 4.25 1mh6A1 PRO 294 HB2 -0.10 0.01 0.14 -0.04 2.28 2.29 1mh6A1 PRO 294 HB3 -0.06 -0.02 -0.01 -0.04 2.02 1.88 1mh6A1 PRO 294 HG2 -0.24 0.00 0.02 -0.04 2.03 1.77 1mh6A1 PRO 294 HG3 -0.26 0.06 -0.03 -0.04 2.03 1.76 1mh6A1 PRO 294 HD2 -0.43 0.11 0.13 -0.04 3.68 3.44 1mh6A1 PRO 294 HD3 -1.38 0.14 0.11 -0.04 3.65 2.49 1mh6A1 GLU 295 H -0.01 0.61 0.20 -0.55 8.60 8.85 1mh6A1 GLU 295 HA -0.03 0.10 0.48 -0.75 4.29 4.09 1mh6A1 GLU 295 HB2 0.01 0.16 0.13 -0.04 2.09 2.35 1mh6A1 GLU 295 HB3 -0.00 -0.00 0.06 -0.04 1.99 2.01 1mh6A1 GLU 295 HG2 -0.00 -0.02 -0.09 -0.04 2.34 2.18 1mh6A1 GLU 295 HG3 -0.01 -0.07 -0.37 -0.04 2.34 1.85 1mh6A1 LEU 296 H -0.03 0.11 0.17 -0.55 8.37 8.06 1mh6A1 LEU 296 HA -0.11 0.17 0.73 -0.75 4.35 4.39 1mh6A1 LEU 296 HB2 -0.06 -0.03 0.16 -0.04 1.64 1.67 1mh6A1 LEU 296 HB3 -0.09 0.06 0.06 -0.04 1.64 1.62 1mh6A1 LEU 296 HG -0.06 -0.03 0.01 -0.04 1.64 1.52 1mh6A1 LEU 296 HD13 -0.05 -0.00 0.02 -0.04 0.93 0.86 1mh6A1 LEU 296 HD23 -0.10 0.02 -0.02 -0.04 0.89 0.75 1mh6A1 GLN 297 H -0.24 0.45 0.27 -0.55 8.47 8.41 1mh6A1 GLN 297 HA -0.03 0.18 0.57 -0.75 4.36 4.32 1mh6A1 GLN 297 HB2 -0.50 -0.08 -0.17 -0.04 2.15 1.36 1mh6A1 GLN 297 HB3 0.11 -0.01 -0.16 -0.04 2.02 1.93 1mh6A1 GLN 297 HG2 0.02 0.12 -0.13 -0.04 2.40 2.36 1mh6A1 GLN 297 HG3 0.32 -0.03 -0.17 -0.04 2.39 2.48 1mh6A1 GLN 297 HE21 0.05 0.10 -0.12 -0.04 6.97 6.95 1mh6A1 GLN 297 HE22 0.05 -0.02 -0.10 -0.04 7.69 7.58 1mh6A1 GLU 298 H 0.04 0.18 0.06 -0.55 8.60 8.34 1mh6A1 GLU 298 HB2 -0.02 0.12 0.47 -0.04 2.09 2.62 1mh6A1 GLU 298 HB3 0.05 0.05 0.38 -0.04 1.99 2.43 1mh6A1 TRP 299 H -0.21 0.43 -0.16 -0.55 7.97 7.48 1mh6A1 TRP 299 HA 0.00 0.13 0.42 -0.75 4.62 4.42 1mh6A1 TRP 299 HB2 0.00 0.01 0.02 -0.04 3.23 3.23 1mh6A1 TRP 299 HB3 0.00 0.15 -0.04 -0.04 3.23 3.31 1mh6A1 TRP 299 HD1 0.00 0.02 -0.32 -0.04 7.22 6.89 1mh6A1 TRP 299 HE1 -0.00 0.06 -0.22 -0.04 10.20 10.00 1mh6A1 TRP 299 HE3 0.00 0.09 -0.27 -0.04 7.59 7.37 1mh6A1 TRP 299 HZ2 -0.00 0.14 -0.06 -0.04 7.44 7.48 1mh6A1 TRP 299 HZ3 -0.00 0.03 -0.03 -0.04 7.13 7.09 1mh6A1 TRP 299 HH2 -0.00 0.22 0.07 -0.04 7.19 7.43 1mh6A1 GLY 300 H -0.99 0.07 0.01 -0.55 8.43 6.98 1mh6A1 GLY 300 HA2 -0.19 0.11 0.56 -0.51 4.01 3.97 1mh6A1 GLY 300 HA3 -0.26 0.03 0.29 -0.51 4.01 3.56 1mh6A1 GLY 301 H -2.13 0.07 0.06 -0.55 8.43 5.88 1mh6A1 GLY 301 HA2 -0.35 0.22 0.82 -0.51 4.01 4.19 1mh6A1 GLY 301 HA3 -0.39 -0.01 0.39 -0.51 4.01 3.50 1mh6A1 THR 302 H -0.15 0.16 0.22 -0.55 8.28 7.96 1mh6A1 THR 302 HA -0.09 0.26 0.95 -0.75 4.39 4.76 1mh6A1 THR 302 HB -0.08 0.04 -0.29 -0.04 4.32 3.95 1mh6A1 THR 302 HG23 -0.01 -0.03 -0.04 -0.04 1.22 1.10 1mh6A1 MET 303 H 0.06 0.68 0.25 -0.55 8.47 8.91 1mh6A1 MET 303 HA 0.15 0.26 0.91 -0.75 4.52 5.08 1mh6A1 MET 303 HB2 0.43 -0.09 -0.26 -0.04 2.15 2.19 1mh6A1 MET 303 HB3 0.22 -0.01 -0.01 -0.04 2.03 2.18 1mh6A1 MET 303 HG2 0.10 0.18 -0.23 -0.04 2.63 2.64 1mh6A1 MET 303 HG3 0.10 -0.00 -0.48 -0.04 2.56 2.14 1mh6A1 MET 303 HE3 0.11 0.00 -0.12 -0.04 2.10 2.05 1mh6A1 ALA 304 H 0.07 0.56 0.29 -0.55 8.40 8.77 1mh6A1 ALA 304 HA 0.07 0.35 0.69 -0.75 4.34 4.69 1mh6A1 ALA 304 HB3 0.07 0.02 -0.02 -0.04 1.41 1.43 1mh6A1 ALA 305 H 0.18 0.46 0.11 -0.55 8.40 8.60 1mh6A1 ALA 305 HA 0.12 0.18 0.89 -0.75 4.34 4.78 1mh6A1 ALA 305 HB3 0.12 0.01 -0.11 -0.04 1.41 1.39 1mh6A1 LEU 306 H 0.15 0.58 0.28 -0.55 8.37 8.84 1mh6A1 LEU 306 HA 0.20 0.21 0.93 -0.75 4.35 4.93 1mh6A1 LEU 306 HB2 0.29 -0.05 0.12 -0.04 1.64 1.96 1mh6A1 LEU 306 HB3 0.23 0.01 0.25 -0.04 1.64 2.09 1mh6A1 LEU 306 HG 0.29 -0.04 -0.18 -0.04 1.64 1.67 1mh6A1 LEU 306 HD13 0.25 0.06 -0.02 -0.04 0.93 1.17 1mh6A1 LEU 306 HD23 0.44 -0.02 -0.02 -0.04 0.89 1.25 1mh6A1 VAL 307 H 0.15 0.68 0.27 -0.55 8.24 8.80 1mh6A1 VAL 307 HA 0.09 0.29 0.61 -0.75 4.13 4.36 1mh6A1 VAL 307 HB 0.11 0.01 0.11 -0.04 2.12 2.30 1mh6A1 VAL 307 HG13 0.04 0.02 -0.20 -0.04 0.97 0.79 1mh6A1 VAL 307 HG23 0.10 -0.00 -0.23 -0.04 0.95 0.78 1mh6A1 ASP 308 H 0.04 0.31 0.08 -0.55 8.40 8.27 1mh6A1 ASP 308 HA -0.50 0.18 0.50 -0.75 4.63 4.05 1mh6A1 ASP 308 HB2 -0.57 0.07 0.15 -0.04 2.71 2.31 1mh6A1 ASP 308 HB3 0.10 0.08 0.07 -0.04 2.70 2.91 1mh6A1 PRO 309 HA -0.01 0.16 0.48 -0.51 4.44 4.57 1mh6A1 PRO 309 HB2 -0.20 -0.04 -0.00 -0.04 2.28 2.00 1mh6A1 PRO 309 HB3 -0.11 0.07 0.08 -0.04 2.02 2.02 1mh6A1 PRO 309 HG2 -0.42 0.06 0.06 -0.04 2.03 1.69 1mh6A1 PRO 309 HG3 -0.47 0.12 0.11 -0.04 2.03 1.74 1mh6A1 PRO 309 HD2 -0.72 0.06 0.22 -0.04 3.68 3.20 1mh6A1 PRO 309 HD3 -2.09 0.18 0.23 -0.04 3.65 1.92 1mh6A1 ASP 310 H -0.18 0.05 -0.29 -0.55 8.40 7.44 1mh6A1 ASP 310 HA -0.18 0.18 0.56 -0.75 4.63 4.44 1mh6A1 ASP 310 HB2 -0.07 -0.02 0.08 -0.04 2.71 2.66 1mh6A1 ASP 310 HB3 -0.12 0.10 0.10 -0.04 2.70 2.74 1mh6A1 GLY 311 H -0.20 0.24 -0.50 -0.55 8.43 7.42 1mh6A1 GLY 311 HA2 -0.17 0.08 0.26 -0.51 4.01 3.68 1mh6A1 GLY 311 HA3 -0.15 0.25 0.63 -0.51 4.01 4.23 1mh6A1 THR 312 H -0.01 -0.12 -0.32 -0.55 8.28 7.27 1mh6A1 THR 312 HA 0.10 0.31 0.05 -0.75 4.39 4.10 1mh6A1 THR 312 HB 0.16 -0.11 0.04 -0.04 4.32 4.38 1mh6A1 THR 312 HG23 0.13 -0.02 -0.31 -0.04 1.22 0.98 1mh6A1 LEU 313 H 0.08 0.55 0.30 -0.55 8.37 8.76 1mh6A1 LEU 313 HA 0.08 0.22 0.56 -0.75 4.35 4.46 1mh6A1 LEU 313 HB2 0.03 0.10 0.10 -0.04 1.64 1.83 1mh6A1 LEU 313 HB3 0.05 0.02 0.17 -0.04 1.64 1.84 1mh6A1 LEU 313 HG 0.05 -0.10 -0.09 -0.04 1.64 1.46 1mh6A1 LEU 313 HD13 0.05 0.02 -0.14 -0.04 0.93 0.82 1mh6A1 LEU 313 HD23 -0.00 -0.01 -0.02 -0.04 0.89 0.82 1mh6A1 LEU 314 H 0.13 0.69 0.39 -0.55 8.37 9.03 1mh6A1 LEU 314 HA 0.07 0.08 0.77 -0.75 4.35 4.53 1mh6A1 LEU 314 HB2 0.21 0.01 0.21 -0.04 1.64 2.03 1mh6A1 LEU 314 HB3 0.12 -0.05 0.07 -0.04 1.64 1.74 1mh6A1 LEU 314 HG 0.08 -0.02 -0.04 -0.04 1.64 1.62 1mh6A1 LEU 314 HD13 0.22 -0.02 -0.17 -0.04 0.93 0.92 1mh6A1 LEU 314 HD23 0.18 -0.01 -0.06 -0.04 0.89 0.96 1mh6A1 ARG 315 H 0.03 0.42 0.25 -0.55 8.46 8.61 1mh6A1 ARG 315 HA 0.05 0.17 0.61 -0.75 4.34 4.42 1mh6A1 ARG 315 HB2 -0.00 -0.05 0.08 -0.04 1.90 1.89 1mh6A1 ARG 315 HB3 0.01 -0.04 -0.02 -0.04 1.80 1.71 1mh6A1 ARG 315 HG2 0.04 0.03 -0.08 -0.04 1.67 1.62 1mh6A1 ARG 315 HG3 0.04 0.10 -0.13 -0.04 1.67 1.64 1mh6A1 ARG 315 HD2 -0.01 -0.06 -0.06 -0.04 3.22 3.05 1mh6A1 ARG 315 HD3 0.03 -0.00 -0.07 -0.04 3.22 3.14 1mh6A1 LEU 316 H 0.05 0.64 0.26 -0.55 8.37 8.77 1mh6A1 LEU 316 HA -0.09 0.17 0.56 -0.75 4.35 4.24 1mh6A1 LEU 316 HB2 0.04 -0.15 0.19 -0.04 1.64 1.69 1mh6A1 LEU 316 HB3 -0.09 -0.02 0.09 -0.04 1.64 1.58 1mh6A1 LEU 316 HG 0.06 0.09 -0.04 -0.04 1.64 1.71 1mh6A1 LEU 316 HD13 0.24 -0.01 -0.09 -0.04 0.93 1.04 1mh6A1 LEU 316 HD23 -0.37 -0.01 -0.07 -0.04 0.89 0.40 1mh6A1 ILE 317 H -0.03 0.52 0.30 -0.55 8.25 8.49 1mh6A1 ILE 317 HA 0.15 0.16 0.83 -0.75 4.18 4.57 1mh6A1 ILE 317 HB -0.06 -0.01 0.02 -0.04 1.89 1.79 1mh6A1 ILE 317 HG12 0.01 0.00 -0.09 -0.04 1.49 1.38 1mh6A1 ILE 317 HG13 -0.04 0.04 -0.22 -0.04 1.21 0.95 1mh6A1 ILE 317 HG23 -0.00 -0.02 -0.19 -0.04 0.93 0.68 1mh6A1 ILE 317 HD13 -0.40 -0.01 -0.06 -0.04 0.88 0.37 1mh6A1 GLN 318 H 0.21 0.49 0.34 -0.55 8.47 8.97 1mh6A1 GLN 318 HA 0.08 0.07 0.80 -0.75 4.36 4.56 1mh6A1 GLN 318 HB2 0.07 -0.05 0.15 -0.04 2.15 2.29 1mh6A1 GLN 318 HB3 0.12 -0.04 0.25 -0.04 2.02 2.31 1mh6A1 GLN 318 HG2 0.04 -0.04 0.05 -0.04 2.40 2.41 1mh6A1 GLN 318 HG3 0.07 0.14 -0.10 -0.04 2.39 2.46 1mh6A1 GLN 318 HE21 0.05 0.30 0.16 -0.04 6.97 7.44 1mh6A1 GLN 318 HE22 0.04 0.20 0.06 -0.04 7.69 7.95 1mh6A1 ASN 319 H 0.06 0.53 0.22 -0.55 8.53 8.80 1mh6A1 ASN 319 HA 0.09 0.05 0.55 -0.75 4.76 4.70 1mh6A1 ASN 319 HB2 0.04 0.06 0.03 -0.04 2.88 2.97 1mh6A1 ASN 319 HB3 0.04 -0.03 -0.03 -0.04 2.79 2.72 1mh6A1 ASN 319 HD21 0.01 -0.07 -0.34 -0.04 7.03 6.59 1mh6A1 ASN 319 HD22 0.00 0.19 -0.36 -0.04 7.74 7.54 1mh6A1 GLU 320 H 0.09 0.20 0.12 -0.55 8.60 8.46 1mh6A1 GLU 320 HA 0.08 0.17 0.20 -0.75 4.29 3.98 1mh6A1 GLU 320 HB2 0.08 -0.01 0.23 -0.04 2.09 2.35 1mh6A1 GLU 320 HB3 0.08 -0.01 0.14 -0.04 1.99 2.16 1mh6A1 GLU 320 HG2 0.23 0.05 0.03 -0.04 2.34 2.60 1mh6A1 GLU 320 HG3 0.26 0.07 -0.02 -0.04 2.34 2.61 1mh6A1 LEU 321 H 0.04 0.54 0.14 -0.55 8.37 8.54 1mh6A1 LEU 321 HA 0.02 0.02 0.14 -0.75 4.35 3.78 1mh6A1 LEU 321 HB2 0.02 0.03 0.11 -0.04 1.64 1.76 1mh6A1 LEU 321 HB3 0.02 0.02 0.08 -0.04 1.64 1.71 1mh6A1 LEU 321 HG 0.02 0.03 0.04 -0.04 1.64 1.68 1mh6A1 LEU 321 HD13 0.02 -0.02 -0.12 -0.04 0.93 0.78 1mh6A1 LEU 321 HD23 0.03 0.10 0.13 -0.04 0.89 1.11 1mh6A1 LEU 322 H 0.02 0.10 -0.22 -0.55 8.37 7.73 1mh6A1 LEU 322 HA 0.01 0.09 0.60 -0.75 4.35 4.30 1mh6A1 LEU 322 HB2 0.01 -0.02 0.04 -0.04 1.64 1.63 1mh6A1 LEU 322 HB3 0.01 0.08 0.01 -0.04 1.64 1.69 1mh6A1 LEU 322 HG 0.01 -0.06 0.05 -0.04 1.64 1.59 1mh6A1 LEU 322 HD13 -0.01 0.01 0.01 -0.04 0.93 0.91 1mh6A1 LEU 322 HD23 0.00 0.02 0.03 -0.04 0.89 0.90 1mh6A1 ALA 323 H 0.03 0.23 -0.12 -0.55 8.40 7.99 1mh6A1 ALA 323 HA 0.02 0.18 0.72 -0.75 4.34 4.51 1mh6A1 ALA 323 HB3 0.03 0.01 0.08 -0.04 1.41 1.49 1mh6A1 GLY 324 H 0.03 0.49 0.10 -0.55 8.43 8.50 1mh6A1 GLY 324 HA2 0.02 0.10 0.34 -0.51 4.01 3.96 1mh6A1 GLY 324 HA3 0.02 -0.04 0.20 -0.51 4.01 3.68 1mh6A1 ILE 325 H 0.02 0.13 -0.31 -0.55 8.25 7.54 1mh6A1 ILE 325 HA 0.01 0.17 0.77 -0.75 4.18 4.38 1mh6A1 ILE 325 HB 0.01 0.08 0.16 -0.04 1.89 2.10 1mh6A1 ILE 325 HG12 0.01 0.05 -0.01 -0.04 1.49 1.50 1mh6A1 ILE 325 HG13 0.01 -0.11 -0.18 -0.04 1.21 0.90 1mh6A1 ILE 325 HG23 0.01 -0.00 -0.07 -0.04 0.93 0.82 1mh6A1 ILE 325 HD13 0.01 -0.02 -0.01 -0.04 0.88 0.83 1mh6A1 SER 326 H 0.01 0.30 -0.01 -0.55 8.46 8.22 1mh6A1 SER 326 HA 0.01 0.12 0.49 -0.75 4.49 4.35 1mh6A1 SER 326 HB2 0.01 -0.02 0.10 -0.04 3.95 3.99 1mh6A1 SER 326 HB3 0.01 -0.06 0.04 -0.04 3.93 3.88