============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 64 rings ring int. center anis. iso. TYR 16 0.840 29.447 59.253 63.544 -99.200 -91.000 TRP 18 1.040 24.908 61.162 61.069 -99.200 -91.000 TRP6 18 1.020 25.786 63.332 60.774 -99.200 -91.000 TRP 20 1.040 18.638 52.417 65.303 -99.200 -91.000 TRP6 20 1.020 17.099 53.370 63.781 -99.200 -91.000 TRP 44 1.040 -0.066 50.642 51.141 -99.200 -91.000 TRP6 44 1.020 1.625 49.131 50.471 -99.200 -91.000 TRP 74 1.040 19.062 39.323 47.353 -99.200 -91.000 TRP6 74 1.020 18.505 38.949 45.075 -99.200 -91.000 HIS 76 0.900 15.079 42.900 54.840 -99.200 -91.000 PHE 81 1.000 17.941 51.926 50.661 -99.200 -91.000 TYR 88 0.840 34.328 62.175 52.071 -99.200 -91.000 PHE 96 1.000 26.140 51.713 45.157 -99.200 -91.000 HIS 99 0.900 21.521 51.706 38.313 -99.200 -91.000 TRP 100 1.040 19.881 49.980 43.340 -99.200 -91.000 TRP6 100 1.020 20.633 49.914 45.576 -99.200 -91.000 TYR 120 0.840 24.539 62.613 45.066 -99.200 -91.000 HIS 130 0.900 27.324 71.890 55.554 -99.200 -91.000 PHE 136 1.000 23.320 83.967 58.913 -99.200 -91.000 HIS 141 0.900 29.587 89.616 53.279 -99.200 -91.000 TRP 146 1.040 31.019 94.329 55.078 -99.200 -91.000 TRP6 146 1.020 30.331 93.125 56.998 -99.200 -91.000 HIS 148 0.900 34.126 96.664 47.036 -99.200 -91.000 TYR 154 0.840 38.982 75.230 54.461 -99.200 -91.000 PHE 165 1.000 36.371 70.470 51.265 -99.200 -91.000 PHE 166 1.000 32.443 67.396 52.322 -99.200 -91.000 TYR 172 0.840 35.074 79.867 47.035 -99.200 -91.000 HIS 185 0.900 39.914 79.113 48.717 -99.200 -91.000 PHE 188 1.000 42.807 76.747 61.079 -99.200 -91.000 HIS 195 0.900 48.892 74.512 59.573 -99.200 -91.000 TYR 196 0.840 47.011 78.138 65.860 -99.200 -91.000 TYR 211 0.840 31.619 85.005 57.054 -99.200 -91.000 PHE 219 1.000 35.800 82.355 66.982 -99.200 -91.000 TYR 236 0.840 41.586 93.371 60.743 -99.200 -91.000 PHE 238 1.000 38.837 88.185 63.777 -99.200 -91.000 PHE 239 1.000 30.219 87.453 60.836 -99.200 -91.000 HIS 240 0.900 33.308 78.916 66.415 -99.200 -91.000 PHE 244 1.000 24.941 69.723 63.903 -99.200 -91.000 TRP 260 1.040 34.409 84.059 77.290 -99.200 -91.000 TRP6 260 1.020 35.144 83.401 79.436 -99.200 -91.000 PHE 274 1.000 35.531 84.552 72.306 -99.200 -91.000 TYR 282 0.840 22.884 73.879 61.393 -99.200 -91.000 TYR 290 0.840 13.394 71.133 68.902 -99.200 -91.000 PHE 293 1.000 11.495 64.876 68.453 -99.200 -91.000 PHE 305 1.000 15.934 53.286 70.048 -99.200 -91.000 PHE 307 1.000 22.943 58.708 73.311 -99.200 -91.000 PHE 321 1.000 17.661 60.983 59.610 -99.200 -91.000 HIS 322 0.900 8.598 62.799 64.679 -99.200 -91.000 TYR 328 0.840 8.421 57.739 51.746 -99.200 -91.000 TRP 353 1.040 12.186 67.134 45.970 -99.200 -91.000 TRP6 353 1.020 13.673 67.109 44.131 -99.200 -91.000 PHE 357 1.000 4.660 67.428 57.177 -99.200 -91.000 TYR 363 0.840 7.259 77.355 56.671 -99.200 -91.000 PHE 376 1.000 22.319 78.463 58.879 -99.200 -91.000 TRP 379 1.040 23.839 82.028 69.145 -99.200 -91.000 TRP6 379 1.020 22.948 81.439 71.246 -99.200 -91.000 PHE 388 1.000 29.498 86.133 71.734 -99.200 -91.000 TYR 394 0.840 18.627 83.527 55.908 -99.200 -91.000 HIS 407 0.900 19.003 91.508 72.666 -99.200 -91.000 TYR 410 0.840 30.336 96.321 70.190 -99.200 -91.000 TRP 411 1.040 28.290 96.864 63.498 -99.200 -91.000 TRP6 411 1.020 30.014 95.310 63.049 -99.200 -91.000 TYR 415 0.840 30.560 103.858 60.279 -99.200 -91.000 PHE 425 1.000 42.866 94.093 51.252 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 1t34A1 SER 1 HA -0.59 0.03 0.24 -0.75 4.49 3.41 1t34A1 SER 1 HB2 -0.22 -0.01 0.09 -0.04 3.95 3.77 1t34A1 SER 1 HB3 -0.14 -0.05 0.09 -0.04 3.93 3.79 1t34A1 ASP 2 H 0.02 0.19 0.13 -0.55 8.40 8.19 1t34A1 ASP 2 HA 0.33 0.05 1.05 -0.75 4.63 5.32 1t34A1 ASP 2 HB2 0.11 0.03 -0.01 -0.04 2.71 2.80 1t34A1 ASP 2 HB3 0.07 -0.04 -0.03 -0.04 2.70 2.66 1t34A1 LEU 3 H 0.35 0.25 -0.06 -0.55 8.37 8.37 1t34A1 LEU 3 HA 0.08 0.11 0.58 -0.75 4.35 4.36 1t34A1 LEU 3 HB2 -0.22 0.05 -0.06 -0.04 1.64 1.37 1t34A1 LEU 3 HB3 0.04 -0.07 0.05 -0.04 1.64 1.62 1t34A1 LEU 3 HG -0.11 0.04 -0.13 -0.04 1.64 1.40 1t34A1 LEU 3 HD13 -0.46 0.01 -0.08 -0.04 0.93 0.36 1t34A1 LEU 3 HD23 0.08 -0.01 -0.17 -0.04 0.89 0.75 1t34A1 THR 4 H 0.04 0.25 0.21 -0.55 8.28 8.24 1t34A1 THR 4 HA -0.00 0.03 0.46 -0.75 4.39 4.13 1t34A1 THR 4 HB -0.03 -0.03 0.02 -0.04 4.32 4.23 1t34A1 THR 4 HG23 -0.07 -0.01 -0.21 -0.04 1.22 0.88 1t34A1 VAL 5 H -0.04 0.43 0.20 -0.55 8.24 8.29 1t34A1 VAL 5 HA -0.11 0.13 0.93 -0.75 4.13 4.32 1t34A1 VAL 5 HB 0.01 0.10 0.21 -0.04 2.12 2.39 1t34A1 VAL 5 HG13 -0.02 -0.03 -0.29 -0.04 0.97 0.60 1t34A1 VAL 5 HG23 0.02 0.01 -0.14 -0.04 0.95 0.81 1t34A1 ALA 6 H -0.34 0.82 0.34 -0.55 8.40 8.68 1t34A1 ALA 6 HA -0.22 0.13 0.88 -0.75 4.34 4.37 1t34A1 ALA 6 HB3 -0.92 0.01 -0.00 -0.04 1.41 0.46 1t34A1 VAL 7 H -0.13 0.64 0.35 -0.55 8.24 8.55 1t34A1 VAL 7 HA 0.02 0.20 1.16 -0.75 4.13 4.75 1t34A1 VAL 7 HB -0.35 -0.02 0.21 -0.04 2.12 1.92 1t34A1 VAL 7 HG13 -0.32 -0.04 -0.20 -0.04 0.97 0.37 1t34A1 VAL 7 HG23 0.01 0.03 -0.18 -0.04 0.95 0.77 1t34A1 VAL 8 H 0.10 0.73 0.12 -0.55 8.24 8.64 1t34A1 VAL 8 HA 0.00 0.34 0.92 -0.75 4.13 4.63 1t34A1 VAL 8 HB 0.12 0.04 -0.07 -0.04 2.12 2.17 1t34A1 VAL 8 HG13 0.05 -0.03 -0.23 -0.04 0.97 0.72 1t34A1 VAL 8 HG23 0.27 0.01 -0.34 -0.04 0.95 0.84 1t34A1 LEU 9 H -0.08 0.58 0.20 -0.55 8.37 8.52 1t34A1 LEU 9 HA 0.04 -0.01 0.67 -0.75 4.35 4.30 1t34A1 LEU 9 HB2 0.03 0.04 -0.08 -0.04 1.64 1.58 1t34A1 LEU 9 HB3 0.14 0.07 0.19 -0.04 1.64 2.00 1t34A1 LEU 9 HG 0.06 0.19 -0.34 -0.04 1.64 1.51 1t34A1 LEU 9 HD13 -0.03 0.03 -0.16 -0.04 0.93 0.74 1t34A1 LEU 9 HD23 0.08 -0.01 0.12 -0.04 0.89 1.04 1t34A1 PRO 10 HA 0.06 -0.08 0.74 -0.51 4.44 4.65 1t34A1 PRO 10 HB2 0.14 0.07 0.37 -0.04 2.28 2.83 1t34A1 PRO 10 HB3 0.14 0.03 0.22 -0.04 2.02 2.37 1t34A1 PRO 10 HG2 -0.01 0.00 0.05 -0.04 2.03 2.04 1t34A1 PRO 10 HG3 -0.09 -0.04 0.10 -0.04 2.03 1.97 1t34A1 PRO 10 HD2 0.23 0.40 0.26 -0.04 3.68 4.53 1t34A1 PRO 10 HD3 0.17 0.05 0.26 -0.04 3.65 4.09 1t34A1 LEU 11 H 0.03 0.14 0.33 -0.55 8.37 8.33 1t34A1 LEU 11 HA 0.17 0.11 0.56 -0.75 4.35 4.43 1t34A1 LEU 11 HB2 -0.00 -0.03 0.05 -0.04 1.64 1.62 1t34A1 LEU 11 HB3 -0.03 0.11 0.10 -0.04 1.64 1.79 1t34A1 LEU 11 HG -0.11 0.02 -0.01 -0.04 1.64 1.50 1t34A1 LEU 11 HD13 -0.14 0.00 -0.26 -0.04 0.93 0.49 1t34A1 LEU 11 HD23 -0.58 0.00 -0.16 -0.04 0.89 0.11 1t34A1 THR 12 H 0.10 -0.22 -0.21 -0.55 8.28 7.40 1t34A1 THR 12 HA 0.10 0.31 0.90 -0.75 4.39 4.95 1t34A1 THR 12 HB 0.07 0.03 -0.07 -0.04 4.32 4.30 1t34A1 THR 12 HG23 0.06 0.06 -0.05 -0.04 1.22 1.25 1t34A1 ASN 13 H 0.11 -0.11 0.13 -0.55 8.53 8.11 1t34A1 ASN 13 HA 0.06 0.18 0.66 -0.75 4.76 4.91 1t34A1 ASN 13 HB2 0.14 0.25 0.27 -0.04 2.88 3.50 1t34A1 ASN 13 HB3 0.27 -0.19 0.24 -0.04 2.79 3.07 1t34A1 ASN 13 HD21 -0.02 -0.04 0.04 -0.04 7.03 6.96 1t34A1 ASN 13 HD22 0.09 0.32 0.10 -0.04 7.74 8.21 1t34A1 THR 14 H 0.02 0.25 0.14 -0.55 8.28 8.13 1t34A1 THR 14 HA -0.11 0.13 1.02 -0.75 4.39 4.68 1t34A1 THR 14 HB -0.49 -0.01 0.12 -0.04 4.32 3.90 1t34A1 THR 14 HG23 0.04 0.05 -0.12 -0.04 1.22 1.15 1t34A1 SER 15 H -0.15 0.03 -0.17 -0.55 8.46 7.62 1t34A1 SER 15 HA -0.13 0.34 0.96 -0.75 4.49 4.91 1t34A1 SER 15 HB2 -0.29 0.03 0.14 -0.04 3.95 3.79 1t34A1 SER 15 HB3 -0.19 0.05 0.04 -0.04 3.93 3.79 1t34A1 TYR 16 H -0.14 0.05 -0.04 -0.55 8.29 7.61 1t34A1 TYR 16 HA -0.60 0.25 0.76 -0.75 4.56 4.21 1t34A1 TYR 16 HB2 -0.52 -0.00 0.05 -0.04 3.06 2.55 1t34A1 TYR 16 HB3 -1.67 -0.02 -0.00 -0.04 2.98 1.25 1t34A1 TYR 16 HD2 -0.21 0.06 0.04 -0.04 7.15 6.99 1t34A1 TYR 16 HE2 0.06 0.06 0.09 -0.04 6.85 7.02 1t34A1 PRO 17 HA -0.22 0.15 0.31 -0.51 4.44 4.17 1t34A1 PRO 17 HB2 -0.07 0.01 -0.08 -0.04 2.28 2.09 1t34A1 PRO 17 HB3 -0.26 0.12 0.19 -0.04 2.02 2.03 1t34A1 PRO 17 HG2 -0.76 0.01 0.08 -0.04 2.03 1.32 1t34A1 PRO 17 HG3 -0.67 0.08 0.11 -0.04 2.03 1.51 1t34A1 PRO 17 HD2 -1.56 0.01 0.18 -0.04 3.68 2.27 1t34A1 PRO 17 HD3 -0.59 0.24 0.29 -0.04 3.65 3.55 1t34A1 TRP 18 H -0.90 -0.13 -0.86 -0.55 7.97 5.54 1t34A1 TRP 18 HA -0.09 0.29 0.70 -0.75 4.62 4.76 1t34A1 TRP 18 HB2 -0.11 0.01 0.12 -0.04 3.23 3.21 1t34A1 TRP 18 HB3 0.08 0.10 -0.10 -0.04 3.23 3.26 1t34A1 TRP 18 HD1 -0.10 0.05 -0.07 -0.04 7.22 7.06 1t34A1 TRP 18 HE1 -0.35 -0.07 0.00 -0.04 10.20 9.75 1t34A1 TRP 18 HE3 0.16 0.14 -0.18 -0.04 7.59 7.66 1t34A1 TRP 18 HZ2 0.09 -0.09 -0.06 -0.04 7.44 7.34 1t34A1 TRP 18 HZ3 0.26 0.09 -0.02 -0.04 7.13 7.43 1t34A1 TRP 18 HH2 0.19 -0.01 -0.00 -0.04 7.19 7.33 1t34A1 SER 19 H -0.15 0.66 -0.03 -0.55 8.46 8.39 1t34A1 SER 19 HA 0.10 0.04 0.68 -0.75 4.49 4.56 1t34A1 SER 19 HB2 -0.20 0.09 0.07 -0.04 3.95 3.87 1t34A1 SER 19 HB3 -0.07 0.06 0.12 -0.04 3.93 4.01 1t34A1 TRP 20 H 0.26 0.86 0.31 -0.55 7.97 8.84 1t34A1 TRP 20 HA -0.09 -0.00 0.21 -0.75 4.62 3.98 1t34A1 TRP 20 HB2 0.02 -0.02 -0.06 -0.04 3.23 3.12 1t34A1 TRP 20 HB3 0.03 0.09 0.07 -0.04 3.23 3.38 1t34A1 TRP 20 HD1 0.16 0.11 -0.05 -0.04 7.22 7.40 1t34A1 TRP 20 HE1 0.19 0.08 -0.05 -0.04 10.20 10.39 1t34A1 TRP 20 HE3 -0.06 -0.06 -0.13 -0.04 7.59 7.30 1t34A1 TRP 20 HZ2 0.13 0.09 -0.07 -0.04 7.44 7.55 1t34A1 TRP 20 HZ3 -0.01 0.03 -0.20 -0.04 7.13 6.91 1t34A1 TRP 20 HH2 0.07 0.08 -0.11 -0.04 7.19 7.19 1t34A1 ALA 21 H -0.06 0.10 -0.30 -0.55 8.40 7.59 1t34A1 ALA 21 HA -0.21 0.16 0.41 -0.75 4.34 3.94 1t34A1 ALA 21 HB3 -0.48 0.02 -0.06 -0.04 1.41 0.85 1t34A1 ARG 22 H -0.33 0.35 -0.41 -0.55 8.46 7.52 1t34A1 ARG 22 HA -0.29 0.20 0.76 -0.75 4.34 4.25 1t34A1 ARG 22 HB2 -0.26 -0.07 -0.05 -0.04 1.90 1.47 1t34A1 ARG 22 HB3 -0.13 0.04 -0.16 -0.04 1.80 1.51 1t34A1 ARG 22 HG2 -0.05 0.01 -0.02 -0.04 1.67 1.57 1t34A1 ARG 22 HG3 -0.11 0.00 -0.14 -0.04 1.67 1.37 1t34A1 ARG 22 HD2 -0.03 0.08 -0.08 -0.04 3.22 3.15 1t34A1 ARG 22 HD3 0.03 -0.01 -0.12 -0.04 3.22 3.08 1t34A1 VAL 23 H -0.29 0.39 -0.01 -0.55 8.24 7.78 1t34A1 VAL 23 HA -0.16 0.10 0.59 -0.75 4.13 3.91 1t34A1 VAL 23 HB -0.04 0.01 -0.14 -0.04 2.12 1.90 1t34A1 VAL 23 HG13 -0.16 0.00 -0.21 -0.04 0.97 0.55 1t34A1 VAL 23 HG23 -0.32 -0.01 -0.15 -0.04 0.95 0.42 1t34A1 GLY 24 H -1.04 0.58 0.06 -0.55 8.43 7.48 1t34A1 GLY 24 HA2 -2.25 -0.01 0.32 -0.51 4.01 1.56 1t34A1 GLY 24 HA3 -2.04 0.19 0.29 -0.51 4.01 1.93 1t34A1 PRO 25 HA -0.18 0.07 0.37 -0.51 4.44 4.18 1t34A1 PRO 25 HB2 -0.35 0.06 -0.09 -0.04 2.28 1.85 1t34A1 PRO 25 HB3 -0.26 -0.01 -0.10 -0.04 2.02 1.61 1t34A1 PRO 25 HG2 -0.62 0.18 0.00 -0.04 2.03 1.55 1t34A1 PRO 25 HG3 -1.52 0.02 -0.06 -0.04 2.03 0.44 1t34A1 PRO 25 HD2 -0.88 -0.03 -0.78 -0.04 3.68 1.95 1t34A1 PRO 25 HD3 -2.27 0.19 -0.05 -0.04 3.65 1.48 1t34A1 ALA 26 H -0.30 0.25 -0.49 -0.55 8.40 7.32 1t34A1 ALA 26 HA 0.06 0.01 0.38 -0.75 4.34 4.03 1t34A1 ALA 26 HB3 0.16 0.03 0.11 -0.04 1.41 1.67 1t34A1 VAL 27 H -0.12 0.59 -0.23 -0.55 8.24 7.94 1t34A1 VAL 27 HA 0.18 0.03 0.46 -0.75 4.13 4.05 1t34A1 VAL 27 HB -0.02 0.12 0.10 -0.04 2.12 2.28 1t34A1 VAL 27 HG13 0.25 -0.00 -0.17 -0.04 0.97 1.00 1t34A1 VAL 27 HG23 0.24 0.01 -0.12 -0.04 0.95 1.04 1t34A1 GLU 28 H -0.01 0.70 -0.01 -0.55 8.60 8.73 1t34A1 GLU 28 HA 0.11 0.02 0.41 -0.75 4.29 4.07 1t34A1 GLU 28 HB2 0.07 0.06 0.18 -0.04 2.09 2.35 1t34A1 GLU 28 HB3 0.09 -0.02 -0.05 -0.04 1.99 1.97 1t34A1 GLU 28 HG2 0.13 -0.02 0.00 -0.04 2.34 2.42 1t34A1 GLU 28 HG3 0.19 0.06 -0.03 -0.04 2.34 2.52 1t34A1 LEU 29 H 0.06 0.68 -0.19 -0.55 8.37 8.37 1t34A1 LEU 29 HA 0.09 -0.01 0.35 -0.75 4.35 4.03 1t34A1 LEU 29 HB2 0.10 0.17 0.14 -0.04 1.64 2.02 1t34A1 LEU 29 HB3 0.08 -0.07 0.00 -0.04 1.64 1.62 1t34A1 LEU 29 HG -0.06 0.16 -0.06 -0.04 1.64 1.63 1t34A1 LEU 29 HD13 -0.17 -0.04 -0.08 -0.04 0.93 0.59 1t34A1 LEU 29 HD23 0.00 -0.02 -0.04 -0.04 0.89 0.79 1t34A1 ALA 30 H 0.26 0.31 -0.51 -0.55 8.40 7.92 1t34A1 ALA 30 HA 0.21 -0.00 0.45 -0.75 4.34 4.25 1t34A1 ALA 30 HB3 0.16 0.03 0.11 -0.04 1.41 1.67 1t34A1 LEU 31 H 0.13 0.70 0.10 -0.55 8.37 8.76 1t34A1 LEU 31 HA 0.09 0.04 0.49 -0.75 4.35 4.21 1t34A1 LEU 31 HB2 0.10 0.05 0.08 -0.04 1.64 1.83 1t34A1 LEU 31 HB3 0.09 -0.00 0.04 -0.04 1.64 1.72 1t34A1 LEU 31 HG 0.13 0.12 -0.05 -0.04 1.64 1.80 1t34A1 LEU 31 HD13 0.12 0.00 -0.10 -0.04 0.93 0.91 1t34A1 LEU 31 HD23 0.10 -0.01 -0.05 -0.04 0.89 0.88 1t34A1 ALA 32 H 0.11 0.54 -0.33 -0.55 8.40 8.17 1t34A1 ALA 32 HA 0.07 0.03 0.52 -0.75 4.34 4.21 1t34A1 ALA 32 HB3 0.08 0.03 0.04 -0.04 1.41 1.52 1t34A1 ARG 33 H 0.12 0.51 -0.05 -0.55 8.46 8.49 1t34A1 ARG 33 HA 0.08 -0.01 0.37 -0.75 4.34 4.02 1t34A1 ARG 33 HB2 0.16 0.13 0.21 -0.04 1.90 2.36 1t34A1 ARG 33 HB3 0.09 -0.02 -0.02 -0.04 1.80 1.81 1t34A1 ARG 33 HG2 0.10 -0.03 0.05 -0.04 1.67 1.76 1t34A1 ARG 33 HG3 0.18 0.02 0.05 -0.04 1.67 1.88 1t34A1 ARG 33 HD2 0.17 -0.07 -0.01 -0.04 3.22 3.26 1t34A1 ARG 33 HD3 0.15 -0.01 -0.01 -0.04 3.22 3.31 1t34A1 VAL 34 H 0.08 0.21 -0.77 -0.55 8.24 7.21 1t34A1 VAL 34 HA 0.05 0.04 0.53 -0.75 4.13 3.99 1t34A1 VAL 34 HB 0.07 0.12 0.24 -0.04 2.12 2.50 1t34A1 VAL 34 HG13 0.06 -0.00 -0.07 -0.04 0.97 0.91 1t34A1 VAL 34 HG23 0.05 0.01 -0.01 -0.04 0.95 0.96 1t34A1 LYS 35 H 0.06 0.46 0.08 -0.55 8.42 8.47 1t34A1 LYS 35 HA 0.05 0.06 0.28 -0.75 4.32 3.96 1t34A1 LYS 35 HB2 0.05 0.09 0.19 -0.04 1.87 2.15 1t34A1 LYS 35 HB3 0.04 -0.07 0.04 -0.04 1.79 1.77 1t34A1 LYS 35 HG2 0.06 0.00 0.12 -0.04 1.46 1.60 1t34A1 LYS 35 HG3 0.05 -0.01 0.08 -0.04 1.46 1.54 1t34A1 LYS 35 HD2 0.04 -0.01 0.06 -0.04 1.69 1.74 1t34A1 LYS 35 HD3 0.04 0.00 0.05 -0.04 1.68 1.74 1t34A1 LYS 35 HE2 0.04 -0.02 0.01 -0.04 2.99 2.97 1t34A1 LYS 35 HE3 0.04 0.01 0.01 -0.04 2.99 3.02 1t34A1 ALA 36 H 0.05 0.18 -0.97 -0.55 8.40 7.11 1t34A1 ALA 36 HA 0.03 0.06 0.67 -0.75 4.34 4.35 1t34A1 ALA 36 HB3 0.04 -0.02 0.02 -0.04 1.41 1.41 1t34A1 ARG 37 H 0.04 0.82 -0.04 -0.55 8.46 8.73 1t34A1 ARG 37 HA 0.03 0.10 0.99 -0.75 4.34 4.70 1t34A1 ARG 37 HB2 0.04 0.13 0.29 -0.04 1.90 2.32 1t34A1 ARG 37 HB3 0.03 -0.17 0.08 -0.04 1.80 1.69 1t34A1 ARG 37 HG2 0.04 0.01 -0.12 -0.04 1.67 1.55 1t34A1 ARG 37 HG3 0.04 0.01 0.04 -0.04 1.67 1.73 1t34A1 ARG 37 HD2 0.02 -0.01 0.05 -0.04 3.22 3.25 1t34A1 ARG 37 HD3 0.02 -0.05 0.00 -0.04 3.22 3.15 1t34A1 PRO 38 HA 0.03 0.21 0.57 -0.51 4.44 4.74 1t34A1 PRO 38 HB2 0.02 -0.02 -0.04 -0.04 2.28 2.19 1t34A1 PRO 38 HB3 0.02 0.01 0.09 -0.04 2.02 2.10 1t34A1 PRO 38 HG2 0.02 -0.03 0.04 -0.04 2.03 2.03 1t34A1 PRO 38 HG3 0.02 0.09 -0.04 -0.04 2.03 2.07 1t34A1 PRO 38 HD2 0.02 -0.01 0.20 -0.04 3.68 3.85 1t34A1 PRO 38 HD3 0.03 0.52 0.05 -0.04 3.65 4.20 1t34A1 ASP 39 H 0.02 0.08 -0.26 -0.55 8.40 7.69 1t34A1 ASP 39 HA 0.02 0.12 0.52 -0.75 4.63 4.54 1t34A1 ASP 39 HB2 0.02 0.01 0.12 -0.04 2.71 2.82 1t34A1 ASP 39 HB3 0.02 -0.04 0.05 -0.04 2.70 2.69 1t34A1 LEU 40 H 0.03 0.36 -0.70 -0.55 8.37 7.51 1t34A1 LEU 40 HA 0.02 0.12 0.92 -0.75 4.35 4.65 1t34A1 LEU 40 HB2 0.03 0.20 0.10 -0.04 1.64 1.93 1t34A1 LEU 40 HB3 0.02 -0.02 -0.05 -0.04 1.64 1.54 1t34A1 LEU 40 HG 0.03 -0.13 -0.30 -0.04 1.64 1.20 1t34A1 LEU 40 HD13 0.05 0.00 -0.01 -0.04 0.93 0.93 1t34A1 LEU 40 HD23 0.03 0.01 -0.09 -0.04 0.89 0.81 1t34A1 LEU 41 H 0.00 0.10 0.08 -0.55 8.37 8.00 1t34A1 LEU 41 HA 0.05 0.03 0.27 -0.75 4.35 3.94 1t34A1 LEU 41 HB2 0.08 0.16 -0.05 -0.04 1.64 1.79 1t34A1 LEU 41 HB3 0.15 -0.01 0.06 -0.04 1.64 1.80 1t34A1 LEU 41 HG -0.04 -0.04 -0.09 -0.04 1.64 1.43 1t34A1 LEU 41 HD13 -0.01 -0.02 -0.07 -0.04 0.93 0.78 1t34A1 LEU 41 HD23 -0.21 -0.01 -0.05 -0.04 0.89 0.58 1t34A1 PRO 42 HA 0.07 0.04 0.42 -0.51 4.44 4.46 1t34A1 PRO 42 HB2 0.08 0.00 0.03 -0.04 2.28 2.35 1t34A1 PRO 42 HB3 0.05 -0.00 0.05 -0.04 2.02 2.07 1t34A1 PRO 42 HG2 0.05 0.02 0.00 -0.04 2.03 2.05 1t34A1 PRO 42 HG3 0.04 0.12 -0.09 -0.04 2.03 2.06 1t34A1 PRO 42 HD2 0.09 0.10 0.09 -0.04 3.68 3.92 1t34A1 PRO 42 HD3 0.05 -0.01 -0.07 -0.04 3.65 3.57 1t34A1 GLY 43 H 0.04 0.10 0.22 -0.55 8.43 8.25 1t34A1 GLY 43 HA2 -0.06 -0.06 0.34 -0.51 4.01 3.72 1t34A1 GLY 43 HA3 -0.09 0.02 0.41 -0.51 4.01 3.83 1t34A1 TRP 44 H 0.16 0.35 0.00 -0.55 7.97 7.94 1t34A1 TRP 44 HA -0.00 0.47 0.73 -0.75 4.62 5.06 1t34A1 TRP 44 HB2 -0.01 0.01 -0.23 -0.04 3.23 2.96 1t34A1 TRP 44 HB3 -0.01 -0.15 -0.14 -0.04 3.23 2.89 1t34A1 TRP 44 HD1 -0.02 0.13 -0.32 -0.04 7.22 6.97 1t34A1 TRP 44 HE1 -0.02 -0.06 -0.06 -0.04 10.20 10.02 1t34A1 TRP 44 HE3 -0.00 -0.16 -0.39 -0.04 7.59 7.00 1t34A1 TRP 44 HZ2 -0.02 -0.11 -0.02 -0.04 7.44 7.26 1t34A1 TRP 44 HZ3 -0.01 0.11 -0.52 -0.04 7.13 6.66 1t34A1 TRP 44 HH2 -0.01 -0.06 -0.06 -0.04 7.19 7.02 1t34A1 THR 45 H 0.20 0.47 0.32 -0.55 8.28 8.72 1t34A1 THR 45 HA 0.12 0.20 1.01 -0.75 4.39 4.97 1t34A1 THR 45 HB 0.07 0.02 0.05 -0.04 4.32 4.41 1t34A1 THR 45 HG23 0.03 0.04 -0.12 -0.04 1.22 1.12 1t34A1 VAL 46 H 0.10 0.18 0.13 -0.55 8.24 8.11 1t34A1 VAL 46 HA 0.11 0.10 0.57 -0.75 4.13 4.15 1t34A1 VAL 46 HB 0.08 -0.06 0.14 -0.04 2.12 2.24 1t34A1 VAL 46 HG13 0.07 0.04 -0.05 -0.04 0.97 1.00 1t34A1 VAL 46 HG23 0.07 0.01 0.03 -0.04 0.95 1.02 1t34A1 ARG 47 H 0.07 0.49 0.16 -0.55 8.46 8.62 1t34A1 ARG 47 HA 0.04 0.14 0.77 -0.75 4.34 4.54 1t34A1 ARG 47 HB2 0.04 0.02 -0.16 -0.04 1.90 1.76 1t34A1 ARG 47 HB3 -0.02 -0.05 -0.03 -0.04 1.80 1.67 1t34A1 ARG 47 HG2 0.02 -0.00 -0.03 -0.04 1.67 1.62 1t34A1 ARG 47 HG3 0.05 0.06 -0.16 -0.04 1.67 1.58 1t34A1 ARG 47 HD2 0.00 -0.03 -0.03 -0.04 3.22 3.12 1t34A1 ARG 47 HD3 0.02 0.00 -0.05 -0.04 3.22 3.15 1t34A1 MET 48 H -0.01 0.19 0.12 -0.55 8.47 8.22 1t34A1 MET 48 HA -0.03 0.22 1.01 -0.75 4.52 4.96 1t34A1 MET 48 HB2 0.08 -0.03 -0.09 -0.04 2.15 2.06 1t34A1 MET 48 HB3 0.07 -0.05 -0.13 -0.04 2.03 1.89 1t34A1 MET 48 HG2 0.05 0.11 0.10 -0.04 2.63 2.85 1t34A1 MET 48 HG3 0.09 0.04 -0.28 -0.04 2.56 2.37 1t34A1 MET 48 HE3 0.29 -0.01 -0.12 -0.04 2.10 2.22 1t34A1 VAL 49 H -0.13 0.64 0.30 -0.55 8.24 8.49 1t34A1 VAL 49 HA -0.17 0.18 1.07 -0.75 4.13 4.46 1t34A1 VAL 49 HB -0.18 0.01 -0.02 -0.04 2.12 1.89 1t34A1 VAL 49 HG13 -1.08 0.00 -0.10 -0.04 0.97 -0.25 1t34A1 VAL 49 HG23 -0.18 -0.02 -0.07 -0.04 0.95 0.65 1t34A1 LEU 50 H -0.11 0.19 0.20 -0.55 8.37 8.11 1t34A1 LEU 50 HA -0.24 0.22 1.13 -0.75 4.35 4.70 1t34A1 LEU 50 HB2 -0.15 0.00 0.09 -0.04 1.64 1.54 1t34A1 LEU 50 HB3 -0.39 -0.04 -0.02 -0.04 1.64 1.15 1t34A1 LEU 50 HG -0.12 0.04 -0.21 -0.04 1.64 1.30 1t34A1 LEU 50 HD13 -0.10 -0.00 -0.04 -0.04 0.93 0.74 1t34A1 LEU 50 HD23 -0.77 0.02 -0.14 -0.04 0.89 -0.03 1t34A1 GLY 51 H -0.17 0.60 0.40 -0.55 8.43 8.71 1t34A1 GLY 51 HA2 -0.02 0.07 0.77 -0.51 4.01 4.32 1t34A1 GLY 51 HA3 0.01 0.08 0.32 -0.51 4.01 3.91 1t34A1 SER 52 H -0.01 0.18 0.20 -0.55 8.46 8.29 1t34A1 SER 52 HA -0.04 0.37 0.96 -0.75 4.49 5.02 1t34A1 SER 52 HB2 -0.01 0.09 0.13 -0.04 3.95 4.12 1t34A1 SER 52 HB3 0.01 0.12 0.09 -0.04 3.93 4.12 1t34A1 SER 53 H 0.01 0.25 -0.06 -0.55 8.46 8.12 1t34A1 SER 53 HA 0.02 0.26 0.59 -0.75 4.49 4.60 1t34A1 SER 53 HB2 -0.00 -0.07 0.06 -0.04 3.95 3.89 1t34A1 SER 53 HB3 0.01 0.19 -0.27 -0.04 3.93 3.82 1t34A1 GLU 54 H 0.03 0.02 -0.09 -0.55 8.60 8.01 1t34A1 GLU 54 HA 0.05 0.11 0.56 -0.75 4.29 4.26 1t34A1 GLU 54 HB2 0.09 0.02 -0.52 -0.04 2.09 1.64 1t34A1 GLU 54 HB3 0.08 -0.13 -0.20 -0.04 1.99 1.70 1t34A1 GLU 54 HG2 0.05 -0.14 0.10 -0.04 2.34 2.31 1t34A1 GLU 54 HG3 0.06 0.21 -0.16 -0.04 2.34 2.40 1t34A1 ASN 55 H 0.05 0.57 0.19 -0.55 8.53 8.80 1t34A1 ASN 55 HA 0.03 0.28 0.79 -0.75 4.76 5.12 1t34A1 ASN 55 HB2 0.03 -0.05 0.21 -0.04 2.88 3.03 1t34A1 ASN 55 HB3 0.03 -0.03 0.11 -0.04 2.79 2.85 1t34A1 ASN 55 HD21 0.04 0.03 -0.04 -0.04 7.03 7.03 1t34A1 ASN 55 HD22 0.03 0.00 0.01 -0.04 7.74 7.74 1t34A1 ALA 56 H 0.03 0.18 0.15 -0.55 8.40 8.22 1t34A1 ALA 56 HA 0.03 0.15 0.37 -0.75 4.34 4.14 1t34A1 ALA 56 HB3 0.02 0.03 0.11 -0.04 1.41 1.53 1t34A1 ALA 57 H 0.03 0.01 -0.21 -0.55 8.40 7.68 1t34A1 ALA 57 HA 0.03 0.17 0.41 -0.75 4.34 4.19 1t34A1 ALA 57 HB3 0.03 -0.01 0.06 -0.04 1.41 1.46 1t34A1 GLY 58 H 0.05 0.62 -0.62 -0.55 8.43 7.93 1t34A1 GLY 58 HA2 0.07 0.06 0.23 -0.51 4.01 3.86 1t34A1 GLY 58 HA3 0.06 0.14 0.44 -0.51 4.01 4.15 1t34A1 VAL 59 H 0.08 0.04 -0.27 -0.55 8.24 7.54 1t34A1 VAL 59 HA 0.27 0.14 0.84 -0.75 4.13 4.62 1t34A1 VAL 59 HB 0.17 0.07 -0.01 -0.04 2.12 2.30 1t34A1 VAL 59 HG13 0.12 0.03 -0.03 -0.04 0.97 1.05 1t34A1 VAL 59 HG23 0.07 -0.01 -0.09 -0.04 0.95 0.88 1t34A1 CYS 60 H 0.17 0.10 0.13 -0.55 8.50 8.35 1t34A1 CYS 60 HA 0.02 0.14 0.30 -0.75 4.58 4.29 1t34A1 CYS 60 HB2 -0.02 0.05 0.02 -0.04 2.97 2.98 1t34A1 CYS 60 HB3 -0.19 -0.02 0.06 -0.04 2.97 2.79 1t34A1 SER 61 H 0.03 0.65 0.41 -0.55 8.46 9.00 1t34A1 SER 61 HA 0.05 0.22 0.89 -0.75 4.49 4.90 1t34A1 SER 61 HB2 0.02 0.09 0.09 -0.04 3.95 4.12 1t34A1 SER 61 HB3 0.04 0.06 -0.00 -0.04 3.93 3.98 1t34A1 ASP 62 H 0.01 0.21 0.08 -0.55 8.40 8.16 1t34A1 ASP 62 HA -0.00 0.20 0.47 -0.75 4.63 4.55 1t34A1 ASP 62 HB2 0.01 0.09 0.24 -0.04 2.71 3.01 1t34A1 ASP 62 HB3 0.07 0.04 0.07 -0.04 2.70 2.84 1t34A1 THR 63 H 0.01 -0.16 -0.61 -0.55 8.28 6.97 1t34A1 THR 63 HA 0.00 0.30 0.90 -0.75 4.39 4.84 1t34A1 THR 63 HB 0.01 -0.08 0.05 -0.04 4.32 4.26 1t34A1 THR 63 HG23 0.02 0.04 0.00 -0.04 1.22 1.24 1t34A1 ALA 64 H 0.02 -0.05 0.02 -0.55 8.40 7.83 1t34A1 ALA 64 HA 0.03 0.12 0.38 -0.75 4.34 4.12 1t34A1 ALA 64 HB3 0.03 0.03 -0.14 -0.04 1.41 1.28 1t34A1 ALA 65 H 0.01 0.20 -0.01 -0.55 8.40 8.05 1t34A1 ALA 65 HA 0.02 0.05 0.34 -0.75 4.34 3.99 1t34A1 ALA 65 HB3 -0.03 0.01 0.14 -0.04 1.41 1.49 1t34A1 PRO 66 HA -0.12 0.10 0.36 -0.51 4.44 4.27 1t34A1 PRO 66 HB2 -0.19 0.07 -0.09 -0.04 2.28 2.03 1t34A1 PRO 66 HB3 -0.57 0.01 -0.07 -0.04 2.02 1.35 1t34A1 PRO 66 HG2 -0.02 0.14 -0.04 -0.04 2.03 2.07 1t34A1 PRO 66 HG3 -0.13 0.22 -0.05 -0.04 2.03 2.04 1t34A1 PRO 66 HD2 -0.03 -0.21 -0.57 -0.04 3.68 2.83 1t34A1 PRO 66 HD3 -0.11 0.18 -0.01 -0.04 3.65 3.67 1t34A1 LEU 67 H 0.05 0.39 -0.33 -0.55 8.37 7.94 1t34A1 LEU 67 HA 0.17 0.04 0.41 -0.75 4.35 4.21 1t34A1 LEU 67 HB2 0.06 0.42 0.23 -0.04 1.64 2.31 1t34A1 LEU 67 HB3 0.07 -0.01 0.02 -0.04 1.64 1.68 1t34A1 LEU 67 HG 0.07 -0.01 0.03 -0.04 1.64 1.69 1t34A1 LEU 67 HD13 0.09 0.00 0.01 -0.04 0.93 0.99 1t34A1 LEU 67 HD23 0.04 -0.02 -0.04 -0.04 0.89 0.83 1t34A1 ALA 68 H 0.09 0.73 -0.07 -0.55 8.40 8.60 1t34A1 ALA 68 HA 0.11 -0.01 0.48 -0.75 4.34 4.17 1t34A1 ALA 68 HB3 0.08 0.00 0.09 -0.04 1.41 1.54 1t34A1 ALA 69 H 0.16 0.41 -0.30 -0.55 8.40 8.12 1t34A1 ALA 69 HA 0.44 0.01 0.35 -0.75 4.34 4.38 1t34A1 ALA 69 HB3 0.14 0.05 0.06 -0.04 1.41 1.61 1t34A1 VAL 70 H 0.36 0.52 -0.14 -0.55 8.24 8.42 1t34A1 VAL 70 HA 0.55 0.07 0.43 -0.75 4.13 4.43 1t34A1 VAL 70 HB 0.28 0.08 0.20 -0.04 2.12 2.64 1t34A1 VAL 70 HG13 0.14 -0.01 -0.13 -0.04 0.97 0.92 1t34A1 VAL 70 HG23 0.48 0.00 0.01 -0.04 0.95 1.40 1t34A1 ASP 71 H 0.19 0.44 -0.21 -0.55 8.40 8.27 1t34A1 ASP 71 HA 0.14 0.02 0.35 -0.75 4.63 4.39 1t34A1 ASP 71 HB2 0.09 0.01 0.12 -0.04 2.71 2.89 1t34A1 ASP 71 HB3 0.12 0.06 0.17 -0.04 2.70 3.00 1t34A1 LEU 72 H 0.20 0.61 -0.11 -0.55 8.37 8.52 1t34A1 LEU 72 HA 0.15 0.00 0.46 -0.75 4.35 4.21 1t34A1 LEU 72 HB2 0.28 0.11 0.03 -0.04 1.64 2.02 1t34A1 LEU 72 HB3 0.07 -0.05 -0.07 -0.04 1.64 1.55 1t34A1 LEU 72 HG 0.14 0.12 0.00 -0.04 1.64 1.86 1t34A1 LEU 72 HD13 0.11 -0.04 -0.22 -0.04 0.93 0.74 1t34A1 LEU 72 HD23 0.10 0.00 -0.25 -0.04 0.89 0.70 1t34A1 LYS 73 H 0.18 0.45 -0.37 -0.55 8.42 8.12 1t34A1 LYS 73 HA -0.04 0.03 0.40 -0.75 4.32 3.96 1t34A1 LYS 73 HB2 -0.29 0.17 0.14 -0.04 1.87 1.85 1t34A1 LYS 73 HB3 -0.42 0.07 0.09 -0.04 1.79 1.49 1t34A1 LYS 73 HG2 -0.40 -0.00 0.06 -0.04 1.46 1.08 1t34A1 LYS 73 HG3 -1.18 -0.00 -0.03 -0.04 1.46 0.20 1t34A1 LYS 73 HD2 -2.20 -0.05 -0.04 -0.04 1.69 -0.65 1t34A1 LYS 73 HD3 -0.60 -0.02 -0.14 -0.04 1.68 0.88 1t34A1 LYS 73 HE2 -0.47 0.03 -0.02 -0.04 2.99 2.49 1t34A1 LYS 73 HE3 -1.14 0.03 -0.03 -0.04 2.99 1.82 1t34A1 TRP 74 H 0.16 0.34 -0.18 -0.55 7.97 7.74 1t34A1 TRP 74 HA -0.14 0.10 0.47 -0.75 4.62 4.29 1t34A1 TRP 74 HB2 -0.09 -0.02 0.08 -0.04 3.23 3.16 1t34A1 TRP 74 HB3 -0.07 0.03 0.15 -0.04 3.23 3.30 1t34A1 TRP 74 HD1 -0.08 -0.01 -0.17 -0.04 7.22 6.93 1t34A1 TRP 74 HE1 -0.05 -0.04 -0.05 -0.04 10.20 10.02 1t34A1 TRP 74 HE3 -0.09 0.03 0.01 -0.04 7.59 7.49 1t34A1 TRP 74 HZ2 -0.03 -0.03 -0.01 -0.04 7.44 7.32 1t34A1 TRP 74 HZ3 -0.05 -0.00 0.00 -0.04 7.13 7.04 1t34A1 TRP 74 HH2 -0.03 -0.03 -0.00 -0.04 7.19 7.09 1t34A1 GLU 75 H 0.04 0.48 -0.01 -0.55 8.60 8.56 1t34A1 GLU 75 HA -0.34 0.07 0.46 -0.75 4.29 3.72 1t34A1 GLU 75 HB2 -0.03 0.03 0.14 -0.04 2.09 2.19 1t34A1 GLU 75 HB3 -0.59 -0.00 0.02 -0.04 1.99 1.38 1t34A1 GLU 75 HG2 -0.34 0.03 0.10 -0.04 2.34 2.08 1t34A1 GLU 75 HG3 -0.05 -0.04 0.05 -0.04 2.34 2.26 1t34A1 HIS 76 H -0.13 0.33 -0.27 -0.55 8.41 7.80 1t34A1 HIS 76 HA -0.10 0.22 1.02 -0.75 4.63 5.01 1t34A1 HIS 76 HB2 -0.08 0.09 -0.04 -0.04 3.26 3.20 1t34A1 HIS 76 HB3 -0.07 -0.07 -0.04 -0.04 3.20 2.98 1t34A1 HIS 76 HD2 -0.04 0.06 -0.04 -0.04 6.97 6.90 1t34A1 HIS 76 HE1 -0.00 -0.05 -0.03 -0.04 7.75 7.62 1t34A1 SER 77 H -0.12 0.22 -0.08 -0.55 8.46 7.94 1t34A1 SER 77 HA -0.12 0.13 0.40 -0.75 4.49 4.14 1t34A1 SER 77 HB2 -0.16 -0.05 -0.30 -0.04 3.95 3.39 1t34A1 SER 77 HB3 -0.08 -0.03 0.25 -0.04 3.93 4.03 1t34A1 PRO 78 HA -0.07 0.08 0.30 -0.51 4.44 4.24 1t34A1 PRO 78 HB2 -0.31 0.03 -0.05 -0.04 2.28 1.90 1t34A1 PRO 78 HB3 -0.23 -0.08 -0.20 -0.04 2.02 1.46 1t34A1 PRO 78 HG2 -0.12 0.07 -0.16 -0.04 2.03 1.77 1t34A1 PRO 78 HG3 -0.50 -0.06 -0.18 -0.04 2.03 1.25 1t34A1 PRO 78 HD2 -0.07 0.11 0.13 -0.04 3.68 3.81 1t34A1 PRO 78 HD3 -0.06 0.13 -0.10 -0.04 3.65 3.57 1t34A1 ALA 79 H -0.06 0.53 0.34 -0.55 8.40 8.66 1t34A1 ALA 79 HA 0.01 0.18 0.76 -0.75 4.34 4.53 1t34A1 ALA 79 HB3 -0.02 0.01 0.04 -0.04 1.41 1.41 1t34A1 VAL 80 H -0.10 0.10 0.19 -0.55 8.24 7.88 1t34A1 VAL 80 HA -0.00 0.36 0.74 -0.75 4.13 4.47 1t34A1 VAL 80 HB -0.31 0.03 -0.29 -0.04 2.12 1.51 1t34A1 VAL 80 HG13 -0.26 -0.02 -0.16 -0.04 0.97 0.49 1t34A1 VAL 80 HG23 -0.67 0.02 -0.09 -0.04 0.95 0.17 1t34A1 PHE 81 H 0.15 0.60 0.28 -0.55 8.34 8.81 1t34A1 PHE 81 HA 0.01 0.28 1.14 -0.75 4.62 5.30 1t34A1 PHE 81 HB2 0.05 0.11 0.11 -0.04 3.15 3.38 1t34A1 PHE 81 HB3 0.04 0.01 -0.07 -0.04 3.06 3.01 1t34A1 PHE 81 HD2 0.11 0.03 -0.24 -0.04 7.28 7.13 1t34A1 PHE 81 HE2 0.18 -0.00 -0.15 -0.04 7.38 7.37 1t34A1 PHE 81 HZ 0.19 0.06 -0.08 -0.04 7.32 7.44 1t34A1 LEU 82 H 0.12 0.69 0.42 -0.55 8.37 9.05 1t34A1 LEU 82 HA 0.12 0.28 1.08 -0.75 4.35 5.08 1t34A1 LEU 82 HB2 0.10 0.08 -0.07 -0.04 1.64 1.71 1t34A1 LEU 82 HB3 0.19 -0.17 0.07 -0.04 1.64 1.70 1t34A1 LEU 82 HG 0.50 -0.06 -0.05 -0.04 1.64 1.99 1t34A1 LEU 82 HD13 0.05 0.04 -0.10 -0.04 0.93 0.88 1t34A1 LEU 82 HD23 0.38 -0.02 -0.14 -0.04 0.89 1.07 1t34A1 GLY 83 H 0.18 0.75 0.39 -0.55 8.43 9.20 1t34A1 GLY 83 HA2 0.21 -0.08 0.29 -0.51 4.01 3.92 1t34A1 GLY 83 HA3 0.17 0.07 0.72 -0.51 4.01 4.45 1t34A1 PRO 84 HA -0.01 0.23 0.52 -0.51 4.44 4.67 1t34A1 PRO 84 HB2 -0.14 -0.18 -0.12 -0.04 2.28 1.81 1t34A1 PRO 84 HB3 -0.05 -0.05 0.09 -0.04 2.02 1.97 1t34A1 PRO 84 HG2 -0.07 0.04 -0.42 -0.04 2.03 1.53 1t34A1 PRO 84 HG3 -0.02 0.11 -0.08 -0.04 2.03 2.01 1t34A1 PRO 84 HD2 -0.09 -0.03 0.10 -0.04 3.68 3.61 1t34A1 PRO 84 HD3 -0.03 0.26 0.33 -0.04 3.65 4.17 1t34A1 GLY 85 H -0.41 0.05 0.20 -0.55 8.43 7.73 1t34A1 GLY 85 HA2 -0.68 0.15 0.82 -0.51 4.01 3.79 1t34A1 GLY 85 HA3 -2.05 0.05 0.31 -0.51 4.01 1.81 1t34A1 CYS 86 H -0.34 0.03 0.11 -0.55 8.50 7.75 1t34A1 CYS 86 HA -0.03 0.11 0.53 -0.75 4.58 4.44 1t34A1 CYS 86 HB2 0.00 -0.00 0.09 -0.04 2.97 3.02 1t34A1 CYS 86 HB3 0.12 -0.03 -0.00 -0.04 2.97 3.02 1t34A1 VAL 87 H -0.06 0.19 0.22 -0.55 8.24 8.04 1t34A1 VAL 87 HA -0.33 0.14 0.41 -0.75 4.13 3.59 1t34A1 VAL 87 HB -0.37 0.04 0.16 -0.04 2.12 1.91 1t34A1 VAL 87 HG13 -1.07 0.03 -0.12 -0.04 0.97 -0.23 1t34A1 VAL 87 HG23 -0.37 -0.01 0.09 -0.04 0.95 0.62 1t34A1 TYR 88 H 0.07 0.07 -0.12 -0.55 8.29 7.76 1t34A1 TYR 88 HA -0.03 0.19 0.42 -0.75 4.56 4.39 1t34A1 TYR 88 HB2 0.06 -0.08 -0.03 -0.04 3.06 2.97 1t34A1 TYR 88 HB3 0.02 0.04 0.01 -0.04 2.98 3.00 1t34A1 TYR 88 HD2 0.12 -0.04 0.04 -0.04 7.15 7.23 1t34A1 TYR 88 HE2 0.18 0.04 -0.06 -0.04 6.85 6.96 1t34A1 SER 89 H 0.00 0.02 -0.56 -0.55 8.46 7.37 1t34A1 SER 89 HA -0.01 0.17 0.50 -0.75 4.49 4.40 1t34A1 SER 89 HB2 -0.03 -0.18 0.01 -0.04 3.95 3.71 1t34A1 SER 89 HB3 -0.06 0.09 -0.11 -0.04 3.93 3.81 1t34A1 ALA 90 H -0.14 0.40 -0.16 -0.55 8.40 7.96 1t34A1 ALA 90 HA -0.12 0.11 0.28 -0.75 4.34 3.85 1t34A1 ALA 90 HB3 -0.21 0.02 -0.11 -0.04 1.41 1.07 1t34A1 ALA 91 H -0.13 0.30 -0.20 -0.55 8.40 7.82 1t34A1 ALA 91 HA -0.01 0.06 0.15 -0.75 4.34 3.78 1t34A1 ALA 91 HB3 -0.05 0.01 0.03 -0.04 1.41 1.36 1t34A1 PRO 92 HA -0.26 0.09 0.43 -0.51 4.44 4.19 1t34A1 PRO 92 HB2 -0.55 0.01 -0.02 -0.04 2.28 1.68 1t34A1 PRO 92 HB3 -0.26 0.02 0.09 -0.04 2.02 1.83 1t34A1 PRO 92 HG2 -0.17 0.06 0.04 -0.04 2.03 1.92 1t34A1 PRO 92 HG3 -0.09 0.05 0.12 -0.04 2.03 2.06 1t34A1 PRO 92 HD2 -0.09 -0.01 -0.72 -0.04 3.68 2.82 1t34A1 PRO 92 HD3 -0.03 0.05 0.02 -0.04 3.65 3.65 1t34A1 VAL 93 H -0.22 0.30 -0.35 -0.55 8.24 7.41 1t34A1 VAL 93 HA -0.43 0.02 0.35 -0.75 4.13 3.31 1t34A1 VAL 93 HB -0.14 0.07 0.14 -0.04 2.12 2.14 1t34A1 VAL 93 HG13 -0.20 0.02 -0.14 -0.04 0.97 0.61 1t34A1 VAL 93 HG23 -0.14 -0.00 -0.17 -0.04 0.95 0.60 1t34A1 GLY 94 H -0.07 0.75 -0.04 -0.55 8.43 8.52 1t34A1 GLY 94 HA2 -0.05 0.08 0.24 -0.51 4.01 3.77 1t34A1 GLY 94 HA3 0.12 0.05 0.22 -0.51 4.01 3.89 1t34A1 ARG 95 H -0.14 0.15 -0.69 -0.55 8.46 7.22 1t34A1 ARG 95 HA -0.30 0.15 0.38 -0.75 4.34 3.81 1t34A1 ARG 95 HB2 -0.19 0.11 0.07 -0.04 1.90 1.85 1t34A1 ARG 95 HB3 -0.20 0.13 0.16 -0.04 1.80 1.84 1t34A1 ARG 95 HG2 -0.08 -0.07 -0.05 -0.04 1.67 1.43 1t34A1 ARG 95 HG3 -0.15 0.02 -0.03 -0.04 1.67 1.47 1t34A1 ARG 95 HD2 -0.15 -0.05 -0.04 -0.04 3.22 2.95 1t34A1 ARG 95 HD3 -0.40 0.08 -0.05 -0.04 3.22 2.81 1t34A1 PHE 96 H -0.24 0.53 0.01 -0.55 8.34 8.09 1t34A1 PHE 96 HA -0.65 0.00 0.55 -0.75 4.62 3.77 1t34A1 PHE 96 HB2 -0.68 0.09 0.22 -0.04 3.15 2.74 1t34A1 PHE 96 HB3 -1.91 -0.02 -0.04 -0.04 3.06 1.05 1t34A1 PHE 96 HD2 -0.28 -0.00 -0.05 -0.04 7.28 6.91 1t34A1 PHE 96 HE2 -0.08 -0.04 -0.06 -0.04 7.38 7.16 1t34A1 PHE 96 HZ -0.06 -0.05 -0.03 -0.04 7.32 7.14 1t34A1 THR 97 H -0.32 0.73 -0.09 -0.55 8.28 8.06 1t34A1 THR 97 HA 0.06 -0.02 0.24 -0.75 4.39 3.92 1t34A1 THR 97 HB 0.08 0.22 -0.06 -0.04 4.32 4.52 1t34A1 THR 97 HG23 -0.38 0.00 -0.07 -0.04 1.22 0.73 1t34A1 ALA 98 H -0.11 0.39 -0.37 -0.55 8.40 7.76 1t34A1 ALA 98 HA 0.00 0.03 0.33 -0.75 4.34 3.94 1t34A1 ALA 98 HB3 -0.07 0.04 0.14 -0.04 1.41 1.49 1t34A1 HIS 99 H -0.08 0.38 -0.22 -0.55 8.41 7.95 1t34A1 HIS 99 HA -0.05 0.01 0.53 -0.75 4.63 4.37 1t34A1 HIS 99 HB2 -0.16 -0.04 0.16 -0.04 3.26 3.18 1t34A1 HIS 99 HB3 -0.39 0.21 0.24 -0.04 3.20 3.22 1t34A1 HIS 99 HD2 0.00 0.01 -0.10 -0.04 6.97 6.84 1t34A1 HIS 99 HE1 0.01 -0.05 0.00 -0.04 7.75 7.66 1t34A1 TRP 100 H -0.03 0.43 -0.19 -0.55 7.97 7.64 1t34A1 TRP 100 HA -0.13 -0.01 0.34 -0.75 4.62 4.06 1t34A1 TRP 100 HB2 0.03 0.08 0.06 -0.04 3.23 3.36 1t34A1 TRP 100 HB3 0.04 -0.01 0.01 -0.04 3.23 3.23 1t34A1 TRP 100 HD1 0.05 0.00 -0.12 -0.04 7.22 7.12 1t34A1 TRP 100 HE1 0.02 -0.07 -0.04 -0.04 10.20 10.06 1t34A1 TRP 100 HE3 -0.01 0.06 -0.15 -0.04 7.59 7.45 1t34A1 TRP 100 HZ2 -0.06 -0.07 -0.04 -0.04 7.44 7.23 1t34A1 TRP 100 HZ3 -0.23 -0.02 -0.17 -0.04 7.13 6.66 1t34A1 TRP 100 HH2 0.16 -0.10 -0.42 -0.04 7.19 6.78 1t34A1 ARG 101 H 0.07 0.16 -0.83 -0.55 8.46 7.32 1t34A1 ARG 101 HA 0.03 0.00 0.24 -0.75 4.34 3.86 1t34A1 ARG 101 HB2 0.03 0.26 0.03 -0.04 1.90 2.18 1t34A1 ARG 101 HB3 0.01 -0.16 0.29 -0.04 1.80 1.91 1t34A1 ARG 101 HG2 -0.02 0.20 -0.09 -0.04 1.67 1.71 1t34A1 ARG 101 HG3 -0.02 -0.08 -0.02 -0.04 1.67 1.52 1t34A1 ARG 101 HD2 -0.02 -0.10 0.04 -0.04 3.22 3.10 1t34A1 ARG 101 HD3 -0.01 -0.08 0.05 -0.04 3.22 3.13 1t34A1 VAL 102 H 0.15 0.61 -0.03 -0.55 8.24 8.42 1t34A1 VAL 102 HA 0.11 0.20 0.89 -0.75 4.13 4.58 1t34A1 VAL 102 HB 0.36 -0.11 -0.06 -0.04 2.12 2.27 1t34A1 VAL 102 HG13 0.35 0.08 -0.41 -0.04 0.97 0.95 1t34A1 VAL 102 HG23 0.20 0.03 -0.23 -0.04 0.95 0.91 1t34A1 PRO 103 HA 0.04 0.23 0.51 -0.51 4.44 4.71 1t34A1 PRO 103 HB2 -0.05 -0.06 0.05 -0.04 2.28 2.19 1t34A1 PRO 103 HB3 0.02 0.01 0.08 -0.04 2.02 2.09 1t34A1 PRO 103 HG2 0.11 0.04 0.07 -0.04 2.03 2.22 1t34A1 PRO 103 HG3 0.02 -0.10 0.06 -0.04 2.03 1.97 1t34A1 PRO 103 HD2 0.07 0.57 0.40 -0.04 3.68 4.67 1t34A1 PRO 103 HD3 0.06 0.13 0.29 -0.04 3.65 4.09 1t34A1 LEU 104 H 0.05 0.79 0.46 -0.55 8.37 9.12 1t34A1 LEU 104 HA 0.08 0.11 0.98 -0.75 4.35 4.77 1t34A1 LEU 104 HB2 0.04 0.06 -0.05 -0.04 1.64 1.64 1t34A1 LEU 104 HB3 0.03 -0.05 0.12 -0.04 1.64 1.70 1t34A1 LEU 104 HG 0.03 0.07 -0.15 -0.04 1.64 1.55 1t34A1 LEU 104 HD13 -0.01 0.01 -0.12 -0.04 0.93 0.77 1t34A1 LEU 104 HD23 -0.03 -0.05 -0.25 -0.04 0.89 0.52 1t34A1 LEU 105 H -0.01 0.78 0.35 -0.55 8.37 8.95 1t34A1 LEU 105 HA -0.09 0.38 1.11 -0.75 4.35 5.00 1t34A1 LEU 105 HB2 -0.12 0.05 0.15 -0.04 1.64 1.69 1t34A1 LEU 105 HB3 -0.18 -0.11 -0.04 -0.04 1.64 1.27 1t34A1 LEU 105 HG -0.16 0.01 -0.31 -0.04 1.64 1.13 1t34A1 LEU 105 HD13 -0.27 -0.02 -0.16 -0.04 0.93 0.44 1t34A1 LEU 105 HD23 -0.06 0.02 -0.03 -0.04 0.89 0.78 1t34A1 THR 106 H -0.21 0.58 0.30 -0.55 8.28 8.40 1t34A1 THR 106 HA -0.61 -0.02 0.40 -0.75 4.39 3.40 1t34A1 THR 106 HB -0.02 0.05 0.09 -0.04 4.32 4.40 1t34A1 THR 106 HG23 -0.14 0.06 -0.33 -0.04 1.22 0.76 1t34A1 ALA 107 H -0.69 0.11 0.06 -0.55 8.40 7.33 1t34A1 ALA 107 HA -0.20 0.08 0.76 -0.75 4.34 4.22 1t34A1 ALA 107 HB3 -0.01 0.01 -0.02 -0.04 1.41 1.35 1t34A1 GLY 108 H -0.12 -0.02 -0.16 -0.55 8.43 7.59 1t34A1 GLY 108 HA2 -0.22 0.15 0.80 -0.51 4.01 4.24 1t34A1 GLY 108 HA3 -0.59 -0.14 0.47 -0.51 4.01 3.24 1t34A1 ALA 109 H -0.49 0.51 0.11 -0.55 8.40 7.97 1t34A1 ALA 109 HA -0.34 -0.18 0.22 -0.75 4.34 3.28 1t34A1 ALA 109 HB3 -0.29 0.06 -0.08 -0.04 1.41 1.06 1t34A1 PRO 110 HA -0.33 0.33 0.44 -0.51 4.44 4.37 1t34A1 PRO 110 HB2 -1.67 -0.15 -0.05 -0.04 2.28 0.36 1t34A1 PRO 110 HB3 -0.39 0.28 -0.11 -0.04 2.02 1.76 1t34A1 PRO 110 HG2 0.02 -0.08 -0.07 -0.04 2.03 1.87 1t34A1 PRO 110 HG3 0.04 0.05 -0.05 -0.04 2.03 2.02 1t34A1 PRO 110 HD2 -0.21 -0.08 0.09 -0.04 3.68 3.44 1t34A1 PRO 110 HD3 -0.24 0.06 -0.17 -0.04 3.65 3.27 1t34A1 ALA 111 H -0.37 0.04 -0.56 -0.55 8.40 6.96 1t34A1 ALA 111 HA -0.10 0.05 0.37 -0.75 4.34 3.90 1t34A1 ALA 111 HB3 -0.66 -0.00 0.04 -0.04 1.41 0.74 1t34A1 LEU 112 H -0.03 0.15 0.14 -0.55 8.37 8.08 1t34A1 LEU 112 HA -0.09 0.10 0.42 -0.75 4.35 4.02 1t34A1 LEU 112 HB2 -0.03 0.01 0.04 -0.04 1.64 1.62 1t34A1 LEU 112 HB3 -0.01 -0.05 0.07 -0.04 1.64 1.60 1t34A1 LEU 112 HG -0.03 0.02 -0.23 -0.04 1.64 1.36 1t34A1 LEU 112 HD13 -0.04 0.02 0.00 -0.04 0.93 0.87 1t34A1 LEU 112 HD23 -0.01 0.03 -0.07 -0.04 0.89 0.80 1t34A1 GLY 113 H -0.11 0.01 -0.20 -0.55 8.43 7.58 1t34A1 GLY 113 HA2 -0.03 0.09 0.26 -0.51 4.01 3.82 1t34A1 GLY 113 HA3 -0.09 0.02 0.22 -0.51 4.01 3.65 1t34A1 ILE 114 H -0.34 0.11 -0.49 -0.55 8.25 6.99 1t34A1 ILE 114 HA -1.12 0.07 0.26 -0.75 4.18 2.63 1t34A1 ILE 114 HB -0.34 0.17 -0.04 -0.04 1.89 1.63 1t34A1 ILE 114 HG12 -0.47 -0.24 -0.06 -0.04 1.49 0.68 1t34A1 ILE 114 HG13 -0.41 0.04 -0.02 -0.04 1.21 0.79 1t34A1 ILE 114 HG23 -0.37 0.03 -0.11 -0.04 0.93 0.44 1t34A1 ILE 114 HD13 -0.71 0.00 -0.11 -0.04 0.88 0.01 1t34A1 GLY 115 H -0.17 0.29 -0.44 -0.55 8.43 7.56 1t34A1 GLY 115 HA2 -0.14 0.05 0.27 -0.51 4.01 3.68 1t34A1 GLY 115 HA3 -0.11 -0.06 0.24 -0.51 4.01 3.57 1t34A1 VAL 116 H -0.01 0.35 -0.34 -0.55 8.24 7.70 1t34A1 VAL 116 HA 0.02 0.01 0.62 -0.75 4.13 4.03 1t34A1 VAL 116 HB 0.12 0.07 0.18 -0.04 2.12 2.44 1t34A1 VAL 116 HG13 0.04 -0.06 -0.04 -0.04 0.97 0.87 1t34A1 VAL 116 HG23 0.02 0.01 0.01 -0.04 0.95 0.94 1t34A1 LYS 117 H 0.05 0.21 0.25 -0.55 8.42 8.37 1t34A1 LYS 117 HA 0.16 0.29 0.15 -0.75 4.32 4.17 1t34A1 LYS 117 HB2 0.35 -0.05 -0.00 -0.04 1.87 2.13 1t34A1 LYS 117 HB3 0.12 0.21 0.10 -0.04 1.79 2.18 1t34A1 LYS 117 HG2 0.28 0.01 -0.01 -0.04 1.46 1.70 1t34A1 LYS 117 HG3 0.07 0.05 0.12 -0.04 1.46 1.66 1t34A1 LYS 117 HD2 0.06 -0.16 0.16 -0.04 1.69 1.72 1t34A1 LYS 117 HD3 0.10 0.20 -0.17 -0.04 1.68 1.76 1t34A1 LYS 117 HE2 0.06 -0.04 -0.01 -0.04 2.99 2.96 1t34A1 LYS 117 HE3 0.12 0.06 -0.03 -0.04 2.99 3.09 1t34A1 ASP 118 H 0.06 0.02 -0.18 -0.55 8.40 7.76 1t34A1 ASP 118 HA 0.04 0.08 0.29 -0.75 4.63 4.28 1t34A1 ASP 118 HB2 0.03 -0.08 0.05 -0.04 2.71 2.68 1t34A1 ASP 118 HB3 0.01 0.03 -0.09 -0.04 2.70 2.61 1t34A1 GLU 119 H 0.02 0.05 -0.42 -0.55 8.60 7.71 1t34A1 GLU 119 HA -0.13 0.10 0.64 -0.75 4.29 4.15 1t34A1 GLU 119 HB2 -0.06 -0.10 0.02 -0.04 2.09 1.92 1t34A1 GLU 119 HB3 -0.06 0.11 0.07 -0.04 1.99 2.07 1t34A1 GLU 119 HG2 -0.25 -0.08 -0.06 -0.04 2.34 1.91 1t34A1 GLU 119 HG3 -0.66 0.06 -0.16 -0.04 2.34 1.54 1t34A1 TYR 120 H 0.12 0.54 -0.01 -0.55 8.29 8.39 1t34A1 TYR 120 HA -0.02 0.15 0.64 -0.75 4.56 4.58 1t34A1 TYR 120 HB2 -0.02 0.21 0.07 -0.04 3.06 3.27 1t34A1 TYR 120 HB3 -0.03 -0.05 0.10 -0.04 2.98 2.97 1t34A1 TYR 120 HD2 -0.06 0.14 -0.06 -0.04 7.15 7.12 1t34A1 TYR 120 HE2 -0.09 0.04 -0.09 -0.04 6.85 6.67 1t34A1 ALA 121 H -0.01 0.25 -0.40 -0.55 8.40 7.70 1t34A1 ALA 121 HA 0.15 -0.01 0.48 -0.75 4.34 4.21 1t34A1 ALA 121 HB3 0.01 0.00 0.05 -0.04 1.41 1.43 1t34A1 LEU 122 H 0.03 0.10 0.08 -0.55 8.37 8.04 1t34A1 LEU 122 HA -0.03 -0.02 0.23 -0.75 4.35 3.77 1t34A1 LEU 122 HB2 0.03 0.28 -0.45 -0.04 1.64 1.46 1t34A1 LEU 122 HB3 0.02 -0.10 -0.12 -0.04 1.64 1.40 1t34A1 LEU 122 HG -0.02 -0.00 -0.33 -0.04 1.64 1.24 1t34A1 LEU 122 HD13 0.01 0.00 -0.39 -0.04 0.93 0.50 1t34A1 LEU 122 HD23 -0.12 -0.02 -0.13 -0.04 0.89 0.58 1t34A1 THR 123 H 0.25 0.29 -0.64 -0.55 8.28 7.64 1t34A1 THR 123 HA 0.09 0.11 0.93 -0.75 4.39 4.76 1t34A1 THR 123 HB 0.15 0.20 0.11 -0.04 4.32 4.74 1t34A1 THR 123 HG23 -0.03 -0.06 -0.24 -0.04 1.22 0.85 1t34A1 THR 124 H 0.08 0.76 0.32 -0.55 8.28 8.90 1t34A1 THR 124 HA 0.12 0.29 1.07 -0.75 4.39 5.11 1t34A1 THR 124 HB 0.08 -0.05 0.11 -0.04 4.32 4.43 1t34A1 THR 124 HG23 0.10 -0.02 -0.18 -0.04 1.22 1.08 1t34A1 ARG 125 H -0.16 0.76 0.33 -0.55 8.46 8.84 1t34A1 ARG 125 HA -0.16 0.24 0.88 -0.75 4.34 4.55 1t34A1 ARG 125 HB2 -0.19 -0.04 0.17 -0.04 1.90 1.80 1t34A1 ARG 125 HB3 -0.18 -0.00 -0.01 -0.04 1.80 1.56 1t34A1 ARG 125 HG2 -0.18 0.02 -0.16 -0.04 1.67 1.31 1t34A1 ARG 125 HG3 -0.17 0.06 -0.23 -0.04 1.67 1.30 1t34A1 ARG 125 HD2 -0.22 -0.00 -0.15 -0.04 3.22 2.81 1t34A1 ARG 125 HD3 -0.24 0.11 -0.05 -0.04 3.22 2.99 1t34A1 THR 126 H -0.21 0.39 0.21 -0.55 8.28 8.12 1t34A1 THR 126 HA -0.15 0.14 0.76 -0.75 4.39 4.39 1t34A1 THR 126 HB -0.15 -0.04 0.13 -0.04 4.32 4.22 1t34A1 THR 126 HG23 -0.14 0.03 -0.13 -0.04 1.22 0.94 1t34A1 GLY 127 H -0.17 0.16 -0.12 -0.55 8.43 7.76 1t34A1 GLY 127 HA2 -0.13 0.13 0.81 -0.51 4.01 4.30 1t34A1 GLY 127 HA3 -0.11 0.04 0.41 -0.51 4.01 3.84 1t34A1 PRO 128 HA -0.22 0.11 0.29 -0.51 4.44 4.11 1t34A1 PRO 128 HB2 -0.24 -0.06 -0.08 -0.04 2.28 1.86 1t34A1 PRO 128 HB3 -0.71 0.00 0.05 -0.04 2.02 1.32 1t34A1 PRO 128 HG2 -0.67 -0.04 0.04 -0.04 2.03 1.32 1t34A1 PRO 128 HG3 -0.72 0.06 0.07 -0.04 2.03 1.40 1t34A1 PRO 128 HD2 -0.08 0.25 0.20 -0.04 3.68 4.00 1t34A1 PRO 128 HD3 -0.15 0.10 0.23 -0.04 3.65 3.79 1t34A1 SER 129 H -0.03 0.19 0.18 -0.55 8.46 8.26 1t34A1 SER 129 HA -0.26 0.20 0.82 -0.75 4.49 4.50 1t34A1 SER 129 HB2 -0.06 -0.10 0.03 -0.04 3.95 3.78 1t34A1 SER 129 HB3 -0.12 -0.08 -0.01 -0.04 3.93 3.68 1t34A1 HIS 130 H -0.28 0.71 0.23 -0.55 8.41 8.53 1t34A1 HIS 130 HA 0.07 0.06 0.25 -0.75 4.63 4.26 1t34A1 HIS 130 HB2 -0.02 0.03 0.10 -0.04 3.26 3.32 1t34A1 HIS 130 HB3 -0.02 0.07 0.20 -0.04 3.20 3.41 1t34A1 HIS 130 HD2 0.06 -0.08 -0.41 -0.04 6.97 6.49 1t34A1 HIS 130 HE1 0.19 -0.01 -0.11 -0.04 7.75 7.77 1t34A1 VAL 131 H -0.01 0.16 -0.19 -0.55 8.24 7.65 1t34A1 VAL 131 HA -0.02 0.17 0.48 -0.75 4.13 4.01 1t34A1 VAL 131 HB -0.03 0.07 -0.05 -0.04 2.12 2.07 1t34A1 VAL 131 HG13 -0.04 0.02 0.05 -0.04 0.97 0.96 1t34A1 VAL 131 HG23 -0.07 -0.01 0.01 -0.04 0.95 0.85 1t34A1 LYS 132 H 0.04 0.17 -0.32 -0.55 8.42 7.76 1t34A1 LYS 132 HA 0.09 0.09 0.29 -0.75 4.32 4.03 1t34A1 LYS 132 HB2 0.21 0.15 0.15 -0.04 1.87 2.34 1t34A1 LYS 132 HB3 0.24 0.00 0.11 -0.04 1.79 2.11 1t34A1 LYS 132 HG2 0.00 -0.09 0.02 -0.04 1.46 1.34 1t34A1 LYS 132 HG3 0.01 0.16 0.07 -0.04 1.46 1.67 1t34A1 LYS 132 HD2 0.07 -0.05 0.09 -0.04 1.69 1.76 1t34A1 LYS 132 HD3 0.04 -0.03 -0.01 -0.04 1.68 1.64 1t34A1 LYS 132 HE2 -0.06 -0.05 -0.08 -0.04 2.99 2.76 1t34A1 LYS 132 HE3 -0.06 0.19 -0.26 -0.04 2.99 2.83 1t34A1 LEU 133 H 0.12 0.21 -0.39 -0.55 8.37 7.76 1t34A1 LEU 133 HA -0.54 0.04 0.36 -0.75 4.35 3.46 1t34A1 LEU 133 HB2 -0.04 -0.06 0.03 -0.04 1.64 1.53 1t34A1 LEU 133 HB3 -0.04 0.26 0.05 -0.04 1.64 1.87 1t34A1 LEU 133 HG -0.23 0.02 -0.24 -0.04 1.64 1.15 1t34A1 LEU 133 HD13 -0.56 -0.01 -0.08 -0.04 0.93 0.24 1t34A1 LEU 133 HD23 -0.13 -0.01 -0.08 -0.04 0.89 0.63 1t34A1 GLY 134 H -0.05 0.46 -0.45 -0.55 8.43 7.84 1t34A1 GLY 134 HA2 -0.17 -0.00 0.43 -0.51 4.01 3.76 1t34A1 GLY 134 HA3 -0.10 0.10 0.29 -0.51 4.01 3.80 1t34A1 ASP 135 H -0.02 0.26 -0.24 -0.55 8.40 7.86 1t34A1 ASP 135 HA -0.01 0.07 0.42 -0.75 4.63 4.35 1t34A1 ASP 135 HB2 0.13 0.24 0.24 -0.04 2.71 3.28 1t34A1 ASP 135 HB3 0.25 0.03 0.04 -0.04 2.70 2.98 1t34A1 PHE 136 H -0.16 0.37 -0.17 -0.55 8.34 7.84 1t34A1 PHE 136 HA -1.16 0.03 0.24 -0.75 4.62 2.98 1t34A1 PHE 136 HB2 -0.68 -0.01 0.01 -0.04 3.15 2.44 1t34A1 PHE 136 HB3 -0.62 0.14 0.09 -0.04 3.06 2.62 1t34A1 PHE 136 HD2 -0.46 0.01 -0.14 -0.04 7.28 6.65 1t34A1 PHE 136 HE2 0.02 -0.02 -0.22 -0.04 7.38 7.13 1t34A1 PHE 136 HZ 0.10 -0.01 -0.23 -0.04 7.32 7.14 1t34A1 VAL 137 H -0.23 0.47 -0.25 -0.55 8.24 7.68 1t34A1 VAL 137 HA -0.39 0.00 0.38 -0.75 4.13 3.37 1t34A1 VAL 137 HB -0.28 0.10 0.14 -0.04 2.12 2.03 1t34A1 VAL 137 HG13 -0.43 -0.00 -0.16 -0.04 0.97 0.34 1t34A1 VAL 137 HG23 -0.31 0.02 -0.05 -0.04 0.95 0.56 1t34A1 THR 138 H -0.18 0.63 -0.14 -0.55 8.28 8.04 1t34A1 THR 138 HA -0.09 0.01 0.38 -0.75 4.39 3.93 1t34A1 THR 138 HB -0.05 0.20 0.22 -0.04 4.32 4.65 1t34A1 THR 138 HG23 -0.02 -0.02 -0.05 -0.04 1.22 1.09 1t34A1 ALA 139 H -0.13 0.55 -0.21 -0.55 8.40 8.07 1t34A1 ALA 139 HA 0.04 0.01 0.34 -0.75 4.34 3.97 1t34A1 ALA 139 HB3 0.07 0.04 0.04 -0.04 1.41 1.52 1t34A1 LEU 140 H -0.30 0.50 -0.18 -0.55 8.37 7.85 1t34A1 LEU 140 HA -0.06 -0.02 0.34 -0.75 4.35 3.86 1t34A1 LEU 140 HB2 -0.14 0.13 0.12 -0.04 1.64 1.71 1t34A1 LEU 140 HB3 0.09 -0.01 -0.12 -0.04 1.64 1.56 1t34A1 LEU 140 HG -1.38 0.11 -0.08 -0.04 1.64 0.24 1t34A1 LEU 140 HD13 -0.24 -0.02 -0.13 -0.04 0.93 0.49 1t34A1 LEU 140 HD23 -0.10 -0.02 -0.10 -0.04 0.89 0.62 1t34A1 HIS 141 H 0.20 0.55 -0.21 -0.55 8.41 8.40 1t34A1 HIS 141 HA 0.32 0.05 0.37 -0.75 4.63 4.62 1t34A1 HIS 141 HB2 0.07 0.11 0.15 -0.04 3.26 3.56 1t34A1 HIS 141 HB3 0.16 0.07 0.00 -0.04 3.20 3.40 1t34A1 HIS 141 HD2 0.30 -0.04 -0.10 -0.04 6.97 7.07 1t34A1 HIS 141 HE1 0.06 0.02 -0.11 -0.04 7.75 7.68 1t34A1 ARG 142 H 0.08 0.59 -0.10 -0.55 8.46 8.48 1t34A1 ARG 142 HA 0.00 -0.00 0.49 -0.75 4.34 4.08 1t34A1 ARG 142 HB2 0.02 0.10 0.20 -0.04 1.90 2.19 1t34A1 ARG 142 HB3 0.01 -0.04 0.05 -0.04 1.80 1.77 1t34A1 ARG 142 HG2 0.01 -0.04 0.04 -0.04 1.67 1.63 1t34A1 ARG 142 HG3 0.03 0.05 0.04 -0.04 1.67 1.75 1t34A1 ARG 142 HD2 0.02 -0.00 -0.10 -0.04 3.22 3.10 1t34A1 ARG 142 HD3 0.02 -0.04 -0.00 -0.04 3.22 3.16 1t34A1 ARG 143 H -0.01 0.62 0.02 -0.55 8.46 8.53 1t34A1 ARG 143 HA -0.04 -0.04 0.28 -0.75 4.34 3.79 1t34A1 ARG 143 HB2 0.02 0.05 0.17 -0.04 1.90 2.09 1t34A1 ARG 143 HB3 -0.01 0.06 0.05 -0.04 1.80 1.86 1t34A1 ARG 143 HG2 -0.00 0.02 0.10 -0.04 1.67 1.75 1t34A1 ARG 143 HG3 0.02 -0.05 0.09 -0.04 1.67 1.69 1t34A1 ARG 143 HD2 0.06 -0.03 0.02 -0.04 3.22 3.23 1t34A1 ARG 143 HD3 0.06 0.01 -0.02 -0.04 3.22 3.23 1t34A1 LEU 144 H -0.20 0.33 -0.57 -0.55 8.37 7.39 1t34A1 LEU 144 HA -0.36 0.15 0.79 -0.75 4.35 4.18 1t34A1 LEU 144 HB2 -0.74 0.12 0.05 -0.04 1.64 1.03 1t34A1 LEU 144 HB3 -1.38 -0.00 0.11 -0.04 1.64 0.32 1t34A1 LEU 144 HG -0.09 0.02 -0.05 -0.04 1.64 1.48 1t34A1 LEU 144 HD13 0.02 -0.02 -0.25 -0.04 0.93 0.63 1t34A1 LEU 144 HD23 0.33 -0.02 -0.05 -0.04 0.89 1.10 1t34A1 GLY 145 H -0.24 0.52 -0.25 -0.55 8.43 7.91 1t34A1 GLY 145 HA2 -0.14 -0.05 0.38 -0.51 4.01 3.70 1t34A1 GLY 145 HA3 -0.25 -0.05 0.36 -0.51 4.01 3.56 1t34A1 TRP 146 H 0.06 0.38 -0.03 -0.55 7.97 7.83 1t34A1 TRP 146 HA -0.03 0.04 0.86 -0.75 4.62 4.74 1t34A1 TRP 146 HB2 -0.49 -0.02 0.09 -0.04 3.23 2.76 1t34A1 TRP 146 HB3 -0.15 -0.07 0.08 -0.04 3.23 3.04 1t34A1 TRP 146 HD1 -0.08 -0.30 0.29 -0.04 7.22 7.09 1t34A1 TRP 146 HE1 -0.18 0.33 0.10 -0.04 10.20 10.40 1t34A1 TRP 146 HE3 -0.84 -0.11 -0.12 -0.04 7.59 6.49 1t34A1 TRP 146 HZ2 -0.24 0.15 -0.06 -0.04 7.44 7.26 1t34A1 TRP 146 HZ3 0.20 -0.09 -0.14 -0.04 7.13 7.06 1t34A1 TRP 146 HH2 0.38 -0.04 -0.07 -0.04 7.19 7.42 1t34A1 GLU 147 H 0.16 0.18 -0.02 -0.55 8.60 8.38 1t34A1 GLU 147 HA 0.04 0.25 0.88 -0.75 4.29 4.71 1t34A1 GLU 147 HB2 -0.19 0.03 0.21 -0.04 2.09 2.09 1t34A1 GLU 147 HB3 -0.04 0.04 -0.04 -0.04 1.99 1.91 1t34A1 GLU 147 HG2 -0.00 -0.01 -0.09 -0.04 2.34 2.18 1t34A1 GLU 147 HG3 -0.29 0.00 -0.04 -0.04 2.34 1.98 1t34A1 HIS 148 H 0.18 0.07 -0.21 -0.55 8.41 7.91 1t34A1 HIS 148 HA 0.07 0.20 0.94 -0.75 4.63 5.09 1t34A1 HIS 148 HB2 0.09 -0.04 0.05 -0.04 3.26 3.32 1t34A1 HIS 148 HB3 0.09 0.04 0.03 -0.04 3.20 3.31 1t34A1 HIS 148 HD2 0.08 -0.07 -0.14 -0.04 6.97 6.79 1t34A1 HIS 148 HE1 0.03 -0.04 -0.00 -0.04 7.75 7.69 1t34A1 GLN 149 H 0.18 0.16 0.23 -0.55 8.47 8.49 1t34A1 GLN 149 HA 0.10 0.49 1.15 -0.75 4.36 5.35 1t34A1 GLN 149 HB2 0.18 -0.09 -0.07 -0.04 2.15 2.13 1t34A1 GLN 149 HB3 0.15 0.01 0.00 -0.04 2.02 2.14 1t34A1 GLN 149 HG2 0.05 0.04 0.09 -0.04 2.40 2.54 1t34A1 GLN 149 HG3 0.05 0.02 0.12 -0.04 2.39 2.54 1t34A1 GLN 149 HE21 -0.10 -0.05 -0.01 -0.04 6.97 6.77 1t34A1 GLN 149 HE22 0.07 -0.02 -0.04 -0.04 7.69 7.65 1t34A1 ALA 150 H 0.09 0.56 0.45 -0.55 8.40 8.95 1t34A1 ALA 150 HA 0.07 0.07 0.81 -0.75 4.34 4.54 1t34A1 ALA 150 HB3 0.21 0.01 -0.04 -0.04 1.41 1.55 1t34A1 LEU 151 H 0.13 0.52 0.24 -0.55 8.37 8.71 1t34A1 LEU 151 HA 0.11 0.25 1.12 -0.75 4.35 5.08 1t34A1 LEU 151 HB2 0.07 0.15 -0.34 -0.04 1.64 1.48 1t34A1 LEU 151 HB3 0.09 -0.04 -0.09 -0.04 1.64 1.55 1t34A1 LEU 151 HG 0.12 -0.10 -0.56 -0.04 1.64 1.06 1t34A1 LEU 151 HD13 0.06 0.04 -0.29 -0.04 0.93 0.69 1t34A1 LEU 151 HD23 0.06 0.01 -0.28 -0.04 0.89 0.64 1t34A1 VAL 152 H 0.16 1.12 0.41 -0.55 8.24 9.38 1t34A1 VAL 152 HA 0.26 0.24 1.15 -0.75 4.13 5.03 1t34A1 VAL 152 HB 0.15 -0.05 0.13 -0.04 2.12 2.31 1t34A1 VAL 152 HG13 0.12 -0.03 -0.10 -0.04 0.97 0.92 1t34A1 VAL 152 HG23 0.07 0.01 -0.15 -0.04 0.95 0.83 1t34A1 LEU 153 H 0.27 0.64 0.38 -0.55 8.37 9.11 1t34A1 LEU 153 HA 0.26 0.33 1.11 -0.75 4.35 5.30 1t34A1 LEU 153 HB2 0.25 -0.12 -0.01 -0.04 1.64 1.72 1t34A1 LEU 153 HB3 0.16 0.00 0.03 -0.04 1.64 1.79 1t34A1 LEU 153 HG 0.16 0.03 -0.27 -0.04 1.64 1.52 1t34A1 LEU 153 HD13 0.01 -0.01 -0.17 -0.04 0.93 0.71 1t34A1 LEU 153 HD23 0.03 0.02 -0.22 -0.04 0.89 0.68 1t34A1 TYR 154 H 0.07 0.58 0.39 -0.55 8.29 8.78 1t34A1 TYR 154 HA 0.13 0.19 0.94 -0.75 4.56 5.07 1t34A1 TYR 154 HB2 0.02 -0.01 0.07 -0.04 3.06 3.09 1t34A1 TYR 154 HB3 0.06 0.05 -0.11 -0.04 2.98 2.94 1t34A1 TYR 154 HD2 0.06 -0.03 -0.29 -0.04 7.15 6.85 1t34A1 TYR 154 HE2 0.14 -0.01 -0.16 -0.04 6.85 6.78 1t34A1 ALA 155 H -0.04 0.56 0.41 -0.55 8.40 8.78 1t34A1 ALA 155 HA -0.79 0.39 1.15 -0.75 4.34 4.34 1t34A1 ALA 155 HB3 -0.81 -0.06 0.04 -0.04 1.41 0.53 1t34A1 ASP 156 H -0.22 0.47 0.29 -0.55 8.40 8.40 1t34A1 ASP 156 HA -0.02 -0.10 0.54 -0.75 4.63 4.30 1t34A1 ASP 156 HB2 0.07 0.03 -0.49 -0.04 2.71 2.28 1t34A1 ASP 156 HB3 0.02 0.20 -0.06 -0.04 2.70 2.82 1t34A1 ARG 157 H 0.00 0.02 0.12 -0.55 8.46 8.05 1t34A1 ARG 157 HA -0.02 0.14 0.56 -0.75 4.34 4.27 1t34A1 ARG 157 HB2 0.02 -0.03 0.01 -0.04 1.90 1.86 1t34A1 ARG 157 HB3 0.00 -0.18 0.20 -0.04 1.80 1.79 1t34A1 ARG 157 HG2 0.01 -0.08 0.09 -0.04 1.67 1.65 1t34A1 ARG 157 HG3 0.02 0.08 0.06 -0.04 1.67 1.78 1t34A1 ARG 157 HD2 0.01 0.05 0.08 -0.04 3.22 3.31 1t34A1 ARG 157 HD3 0.00 0.01 0.07 -0.04 3.22 3.26 1t34A1 LEU 158 H -0.01 0.03 0.18 -0.55 8.37 8.02 1t34A1 LEU 158 HA -0.05 0.26 0.89 -0.75 4.35 4.70 1t34A1 LEU 158 HB2 -0.03 -0.01 0.02 -0.04 1.64 1.58 1t34A1 LEU 158 HB3 -0.03 0.02 0.03 -0.04 1.64 1.63 1t34A1 LEU 158 HG -0.06 -0.00 0.08 -0.04 1.64 1.62 1t34A1 LEU 158 HD13 -0.08 0.02 0.02 -0.04 0.93 0.85 1t34A1 LEU 158 HD23 -0.04 0.01 -0.00 -0.04 0.89 0.82 1t34A1 GLY 159 H -0.01 -0.05 0.09 -0.55 8.43 7.92 1t34A1 GLY 159 HA2 -0.03 0.26 0.74 -0.51 4.01 4.47 1t34A1 GLY 159 HA3 -0.00 0.05 0.40 -0.51 4.01 3.94 1t34A1 ASP 160 H 0.02 0.47 -0.16 -0.55 8.40 8.18 1t34A1 ASP 160 HA 0.09 0.17 0.50 -0.75 4.63 4.64 1t34A1 ASP 160 HB2 0.12 -0.01 0.21 -0.04 2.71 2.98 1t34A1 ASP 160 HB3 0.06 0.14 -0.23 -0.04 2.70 2.62 1t34A1 ASP 161 H 0.22 0.17 0.15 -0.55 8.40 8.38 1t34A1 ASP 161 HA 0.47 0.20 0.63 -0.75 4.63 5.18 1t34A1 ASP 161 HB2 0.33 0.03 0.14 -0.04 2.71 3.17 1t34A1 ASP 161 HB3 0.35 0.04 0.09 -0.04 2.70 3.14 1t34A1 ARG 162 H 0.18 -0.03 -0.48 -0.55 8.46 7.58 1t34A1 ARG 162 HA 0.11 -0.00 0.25 -0.75 4.34 3.94 1t34A1 ARG 162 HB2 -0.04 0.11 0.07 -0.04 1.90 2.00 1t34A1 ARG 162 HB3 -0.06 -0.04 0.13 -0.04 1.80 1.78 1t34A1 ARG 162 HG2 -0.02 0.11 -0.10 -0.04 1.67 1.61 1t34A1 ARG 162 HG3 0.15 0.04 -0.32 -0.04 1.67 1.50 1t34A1 ARG 162 HD2 -0.05 0.10 -0.02 -0.04 3.22 3.21 1t34A1 ARG 162 HD3 0.01 -0.03 -0.07 -0.04 3.22 3.09 1t34A1 PRO 163 HA 0.36 0.12 0.28 -0.51 4.44 4.69 1t34A1 PRO 163 HB2 0.22 0.10 -0.03 -0.04 2.28 2.53 1t34A1 PRO 163 HB3 0.31 0.03 0.07 -0.04 2.02 2.39 1t34A1 PRO 163 HG2 0.15 0.04 0.11 -0.04 2.03 2.28 1t34A1 PRO 163 HG3 0.18 0.09 0.06 -0.04 2.03 2.32 1t34A1 PRO 163 HD2 0.15 0.07 0.14 -0.04 3.68 4.00 1t34A1 PRO 163 HD3 0.23 0.00 -0.04 -0.04 3.65 3.80 1t34A1 CYS 164 H 0.13 0.13 -0.11 -0.55 8.50 8.10 1t34A1 CYS 164 HA 0.03 0.09 0.48 -0.75 4.58 4.43 1t34A1 CYS 164 HB2 0.10 0.03 0.18 -0.04 2.97 3.24 1t34A1 CYS 164 HB3 0.15 0.07 0.08 -0.04 2.97 3.22 1t34A1 PHE 165 H 0.14 0.20 -0.40 -0.55 8.34 7.72 1t34A1 PHE 165 HA -0.31 0.16 0.54 -0.75 4.62 4.26 1t34A1 PHE 165 HB2 -0.07 0.02 0.01 -0.04 3.15 3.06 1t34A1 PHE 165 HB3 -0.38 0.14 0.15 -0.04 3.06 2.93 1t34A1 PHE 165 HD2 -0.87 -0.00 -0.06 -0.04 7.28 6.30 1t34A1 PHE 165 HE2 -0.21 0.02 -0.06 -0.04 7.38 7.09 1t34A1 PHE 165 HZ -0.10 0.05 -0.05 -0.04 7.32 7.18 1t34A1 PHE 166 H -0.05 0.40 0.03 -0.55 8.34 8.16 1t34A1 PHE 166 HA -0.31 0.05 0.48 -0.75 4.62 4.08 1t34A1 PHE 166 HB2 0.12 0.09 0.12 -0.04 3.15 3.44 1t34A1 PHE 166 HB3 0.18 -0.07 -0.00 -0.04 3.06 3.12 1t34A1 PHE 166 HD2 0.05 -0.01 0.03 -0.04 7.28 7.31 1t34A1 PHE 166 HE2 -0.01 0.05 -0.00 -0.04 7.38 7.38 1t34A1 PHE 166 HZ -0.35 0.04 -0.04 -0.04 7.32 6.93 1t34A1 ILE 167 H -0.16 0.37 -0.25 -0.55 8.25 7.66 1t34A1 ILE 167 HA -0.79 0.01 0.37 -0.75 4.18 3.01 1t34A1 ILE 167 HB -0.18 0.01 0.15 -0.04 1.89 1.83 1t34A1 ILE 167 HG12 -0.44 -0.01 -0.00 -0.04 1.49 1.00 1t34A1 ILE 167 HG13 -0.73 -0.01 0.03 -0.04 1.21 0.46 1t34A1 ILE 167 HG23 -0.15 0.02 -0.14 -0.04 0.93 0.62 1t34A1 ILE 167 HD13 -0.01 -0.01 -0.06 -0.04 0.88 0.75 1t34A1 VAL 168 H -0.26 0.36 -0.20 -0.55 8.24 7.59 1t34A1 VAL 168 HA -0.19 0.03 0.30 -0.75 4.13 3.52 1t34A1 VAL 168 HB -0.62 0.11 0.16 -0.04 2.12 1.72 1t34A1 VAL 168 HG13 -0.42 0.01 -0.16 -0.04 0.97 0.36 1t34A1 VAL 168 HG23 -0.05 -0.00 -0.02 -0.04 0.95 0.84 1t34A1 GLU 169 H -0.50 0.58 -0.28 -0.55 8.60 7.85 1t34A1 GLU 169 HA -0.34 0.04 0.33 -0.75 4.29 3.57 1t34A1 GLU 169 HB2 -0.83 -0.00 0.05 -0.04 2.09 1.27 1t34A1 GLU 169 HB3 -0.46 0.01 0.21 -0.04 1.99 1.70 1t34A1 GLU 169 HG2 0.00 -0.19 0.01 -0.04 2.34 2.13 1t34A1 GLU 169 HG3 -0.09 0.03 -0.30 -0.04 2.34 1.93 1t34A1 GLY 170 H -0.09 0.51 -0.24 -0.55 8.43 8.06 1t34A1 GLY 170 HA2 -0.03 -0.04 0.32 -0.51 4.01 3.75 1t34A1 GLY 170 HA3 0.03 -0.03 0.01 -0.51 4.01 3.51 1t34A1 LEU 171 H -0.11 0.43 -0.06 -0.55 8.37 8.09 1t34A1 LEU 171 HA -0.14 -0.03 0.38 -0.75 4.35 3.82 1t34A1 LEU 171 HB2 -0.17 -0.02 0.02 -0.04 1.64 1.43 1t34A1 LEU 171 HB3 -0.15 0.08 0.10 -0.04 1.64 1.63 1t34A1 LEU 171 HG -0.30 -0.02 -0.07 -0.04 1.64 1.20 1t34A1 LEU 171 HD13 -0.42 -0.01 -0.11 -0.04 0.93 0.35 1t34A1 LEU 171 HD23 -0.29 0.01 -0.30 -0.04 0.89 0.27 1t34A1 TYR 172 H -0.03 0.72 -0.14 -0.55 8.29 8.29 1t34A1 TYR 172 HA -0.13 0.04 0.27 -0.75 4.56 3.98 1t34A1 TYR 172 HB2 -0.18 0.00 0.03 -0.04 3.06 2.87 1t34A1 TYR 172 HB3 -0.19 0.04 0.11 -0.04 2.98 2.89 1t34A1 TYR 172 HD2 -0.08 -0.02 -0.08 -0.04 7.15 6.93 1t34A1 TYR 172 HE2 0.03 0.12 0.01 -0.04 6.85 6.98 1t34A1 MET 173 H -0.03 0.41 -0.18 -0.55 8.47 8.12 1t34A1 MET 173 HA -0.22 0.08 0.32 -0.75 4.52 3.94 1t34A1 MET 173 HB2 -0.05 0.03 0.13 -0.04 2.15 2.22 1t34A1 MET 173 HB3 -0.05 -0.02 0.01 -0.04 2.03 1.93 1t34A1 MET 173 HG2 0.11 -0.01 0.05 -0.04 2.63 2.74 1t34A1 MET 173 HG3 0.01 -0.08 0.03 -0.04 2.56 2.47 1t34A1 MET 173 HE3 0.00 -0.01 -0.03 -0.04 2.10 2.03 1t34A1 ARG 174 H -0.10 0.50 -0.01 -0.55 8.46 8.30 1t34A1 ARG 174 HA -0.08 0.08 0.59 -0.75 4.34 4.18 1t34A1 ARG 174 HB2 -0.06 -0.07 0.18 -0.04 1.90 1.91 1t34A1 ARG 174 HB3 -0.09 0.03 0.18 -0.04 1.80 1.89 1t34A1 ARG 174 HG2 -0.04 0.05 -0.03 -0.04 1.67 1.61 1t34A1 ARG 174 HG3 -0.06 0.02 -0.28 -0.04 1.67 1.30 1t34A1 ARG 174 HD2 -0.03 0.03 -0.04 -0.04 3.22 3.13 1t34A1 ARG 174 HD3 -0.05 0.01 0.11 -0.04 3.22 3.24 1t34A1 VAL 175 H -0.16 0.56 -0.10 -0.55 8.24 7.99 1t34A1 VAL 175 HA -0.14 0.07 0.42 -0.75 4.13 3.73 1t34A1 VAL 175 HB -0.21 0.17 0.13 -0.04 2.12 2.17 1t34A1 VAL 175 HG13 -0.21 0.00 -0.20 -0.04 0.97 0.52 1t34A1 VAL 175 HG23 -0.24 -0.03 0.05 -0.04 0.95 0.69 1t34A1 ARG 176 H -0.25 0.44 -0.14 -0.55 8.46 7.95 1t34A1 ARG 176 HA -0.15 0.04 0.33 -0.75 4.34 3.81 1t34A1 ARG 176 HB2 -0.37 0.07 0.11 -0.04 1.90 1.67 1t34A1 ARG 176 HB3 -0.22 -0.03 0.04 -0.04 1.80 1.55 1t34A1 ARG 176 HG2 -0.25 0.11 0.00 -0.04 1.67 1.49 1t34A1 ARG 176 HG3 -0.65 0.16 0.12 -0.04 1.67 1.26 1t34A1 ARG 176 HD2 -0.45 -0.04 0.07 -0.04 3.22 2.76 1t34A1 ARG 176 HD3 -0.66 -0.06 0.01 -0.04 3.22 2.47 1t34A1 GLU 177 H -0.13 0.16 -0.63 -0.55 8.60 7.45 1t34A1 GLU 177 HA -0.07 0.03 0.48 -0.75 4.29 3.97 1t34A1 GLU 177 HB2 -0.08 0.23 0.23 -0.04 2.09 2.42 1t34A1 GLU 177 HB3 -0.07 0.14 0.11 -0.04 1.99 2.13 1t34A1 GLU 177 HG2 -0.04 -0.01 -0.03 -0.04 2.34 2.22 1t34A1 GLU 177 HG3 -0.04 -0.03 0.09 -0.04 2.34 2.32 1t34A1 ARG 178 H -0.08 0.23 -0.36 -0.55 8.46 7.69 1t34A1 ARG 178 HA -0.04 0.19 0.92 -0.75 4.34 4.65 1t34A1 ARG 178 HB2 -0.05 0.01 0.08 -0.04 1.90 1.90 1t34A1 ARG 178 HB3 -0.03 -0.04 0.08 -0.04 1.80 1.77 1t34A1 ARG 178 HG2 -0.04 -0.10 -0.33 -0.04 1.67 1.16 1t34A1 ARG 178 HG3 -0.06 0.39 0.07 -0.04 1.67 2.03 1t34A1 ARG 178 HD2 -0.02 -0.02 -0.04 -0.04 3.22 3.10 1t34A1 ARG 178 HD3 -0.02 -0.09 -0.05 -0.04 3.22 3.02 1t34A1 LEU 179 H -0.07 0.60 0.20 -0.55 8.37 8.55 1t34A1 LEU 179 HA -0.03 0.29 1.10 -0.75 4.35 4.95 1t34A1 LEU 179 HB2 -0.06 0.01 0.00 -0.04 1.64 1.55 1t34A1 LEU 179 HB3 -0.01 0.00 0.12 -0.04 1.64 1.72 1t34A1 LEU 179 HG -0.06 -0.05 -0.07 -0.04 1.64 1.42 1t34A1 LEU 179 HD13 -0.03 0.00 0.01 -0.04 0.93 0.87 1t34A1 LEU 179 HD23 -0.01 0.06 -0.14 -0.04 0.89 0.76 1t34A1 ASN 180 H -0.06 0.21 -0.02 -0.55 8.53 8.11 1t34A1 ASN 180 HA -0.05 0.06 0.34 -0.75 4.76 4.36 1t34A1 ASN 180 HB2 -0.03 -0.05 0.01 -0.04 2.88 2.77 1t34A1 ASN 180 HB3 -0.03 -0.02 -0.55 -0.04 2.79 2.15 1t34A1 ASN 180 HD21 -0.05 -0.07 -0.06 -0.04 7.03 6.82 1t34A1 ASN 180 HD22 -0.04 0.39 0.06 -0.04 7.74 8.12 1t34A1 ILE 181 H -0.03 0.09 -1.04 -0.55 8.25 6.72 1t34A1 ILE 181 HA 0.01 0.09 0.29 -0.75 4.18 3.82 1t34A1 ILE 181 HB 0.07 0.06 -0.50 -0.04 1.89 1.48 1t34A1 ILE 181 HG12 -0.04 -0.00 -0.20 -0.04 1.49 1.21 1t34A1 ILE 181 HG13 -0.05 -0.10 -0.26 -0.04 1.21 0.76 1t34A1 ILE 181 HG23 0.06 0.06 -0.25 -0.04 0.93 0.76 1t34A1 ILE 181 HD13 -0.03 0.00 -0.35 -0.04 0.88 0.46 1t34A1 THR 182 H 0.05 0.47 0.34 -0.55 8.28 8.60 1t34A1 THR 182 HA 0.03 0.01 0.59 -0.75 4.39 4.27 1t34A1 THR 182 HB 0.04 0.01 0.24 -0.04 4.32 4.57 1t34A1 THR 182 HG23 0.02 -0.02 -0.02 -0.04 1.22 1.15 1t34A1 VAL 183 H 0.08 0.17 0.22 -0.55 8.24 8.16 1t34A1 VAL 183 HA 0.09 0.23 1.01 -0.75 4.13 4.71 1t34A1 VAL 183 HB 0.29 -0.06 0.15 -0.04 2.12 2.46 1t34A1 VAL 183 HG13 0.21 -0.03 -0.24 -0.04 0.97 0.87 1t34A1 VAL 183 HG23 -0.06 0.06 -0.14 -0.04 0.95 0.78 1t34A1 ASN 184 H 0.09 0.85 0.45 -0.55 8.53 9.37 1t34A1 ASN 184 HA -0.02 0.11 0.99 -0.75 4.76 5.09 1t34A1 ASN 184 HB2 0.02 0.01 0.13 -0.04 2.88 3.00 1t34A1 ASN 184 HB3 -0.06 -0.02 0.04 -0.04 2.79 2.70 1t34A1 ASN 184 HD21 -0.09 -0.05 0.03 -0.04 7.03 6.88 1t34A1 ASN 184 HD22 -0.02 0.36 0.11 -0.04 7.74 8.14 1t34A1 HIS 185 H -0.40 0.20 0.24 -0.55 8.41 7.91 1t34A1 HIS 185 HA 0.10 0.43 1.10 -0.75 4.63 5.50 1t34A1 HIS 185 HB2 0.11 -0.06 0.01 -0.04 3.26 3.28 1t34A1 HIS 185 HB3 -0.13 0.02 -0.11 -0.04 3.20 2.94 1t34A1 HIS 185 HD2 0.06 -0.06 -0.15 -0.04 6.97 6.77 1t34A1 HIS 185 HE1 -0.15 0.03 0.04 -0.04 7.75 7.62 1t34A1 GLN 186 H 0.27 0.56 0.35 -0.55 8.47 9.10 1t34A1 GLN 186 HA 0.03 0.08 0.71 -0.75 4.36 4.44 1t34A1 GLN 186 HB2 -0.01 0.10 -0.14 -0.04 2.15 2.06 1t34A1 GLN 186 HB3 0.04 -0.03 0.02 -0.04 2.02 2.01 1t34A1 GLN 186 HG2 -0.06 -0.01 -0.11 -0.04 2.40 2.19 1t34A1 GLN 186 HG3 -0.03 -0.06 -0.33 -0.04 2.39 1.93 1t34A1 GLN 186 HE21 -0.11 -0.11 0.09 -0.04 6.97 6.80 1t34A1 GLN 186 HE22 -0.13 0.36 0.04 -0.04 7.69 7.93 1t34A1 GLU 187 H -0.12 0.17 0.17 -0.55 8.60 8.27 1t34A1 GLU 187 HA -0.95 0.25 1.03 -0.75 4.29 3.87 1t34A1 GLU 187 HB2 -0.73 -0.02 0.04 -0.04 2.09 1.34 1t34A1 GLU 187 HB3 -0.22 -0.01 0.11 -0.04 1.99 1.83 1t34A1 GLU 187 HG2 -0.29 -0.00 -0.14 -0.04 2.34 1.86 1t34A1 GLU 187 HG3 -0.55 0.01 0.09 -0.04 2.34 1.85 1t34A1 PHE 188 H -0.50 0.56 0.43 -0.55 8.34 8.27 1t34A1 PHE 188 HA -0.48 0.15 0.55 -0.75 4.62 4.09 1t34A1 PHE 188 HB2 -0.17 -0.04 0.07 -0.04 3.15 2.98 1t34A1 PHE 188 HB3 -0.27 0.13 -0.18 -0.04 3.06 2.71 1t34A1 PHE 188 HD2 -0.15 0.09 -0.33 -0.04 7.28 6.85 1t34A1 PHE 188 HE2 -0.01 -0.03 -0.32 -0.04 7.38 6.98 1t34A1 PHE 188 HZ 0.05 -0.05 -0.27 -0.04 7.32 7.01 1t34A1 VAL 189 H 0.87 0.23 0.13 -0.55 8.24 8.92 1t34A1 VAL 189 HA -0.05 0.11 1.01 -0.75 4.13 4.45 1t34A1 VAL 189 HB 0.16 0.02 0.15 -0.04 2.12 2.41 1t34A1 VAL 189 HG13 0.03 -0.05 -0.11 -0.04 0.97 0.81 1t34A1 VAL 189 HG23 0.12 0.05 -0.05 -0.04 0.95 1.03 1t34A1 GLU 190 H -0.04 0.07 0.05 -0.55 8.60 8.14 1t34A1 GLU 190 HA 0.31 0.14 0.14 -0.75 4.29 4.13 1t34A1 GLU 190 HB2 0.05 -0.09 0.12 -0.04 2.09 2.13 1t34A1 GLU 190 HB3 0.13 0.09 -0.07 -0.04 1.99 2.09 1t34A1 GLU 190 HG2 0.23 0.04 -0.01 -0.04 2.34 2.56 1t34A1 GLU 190 HG3 0.08 0.05 -0.03 -0.04 2.34 2.40 1t34A1 GLY 191 H 0.07 -0.02 -0.08 -0.55 8.43 7.85 1t34A1 GLY 191 HA2 0.07 0.08 0.35 -0.51 4.01 4.01 1t34A1 GLY 191 HA3 0.04 -0.02 0.25 -0.51 4.01 3.78 1t34A1 ASP 192 H 0.03 0.06 -0.36 -0.55 8.40 7.59 1t34A1 ASP 192 HA -0.03 0.18 0.62 -0.75 4.63 4.65 1t34A1 ASP 192 HB2 -0.12 0.01 0.04 -0.04 2.71 2.61 1t34A1 ASP 192 HB3 -0.33 -0.02 0.13 -0.04 2.70 2.44 1t34A1 PRO 193 HA 0.35 0.13 0.39 -0.51 4.44 4.81 1t34A1 PRO 193 HB2 0.02 0.03 -0.02 -0.04 2.28 2.27 1t34A1 PRO 193 HB3 -0.02 0.05 0.10 -0.04 2.02 2.11 1t34A1 PRO 193 HG2 -0.01 0.04 0.11 -0.04 2.03 2.13 1t34A1 PRO 193 HG3 -0.01 0.12 0.14 -0.04 2.03 2.24 1t34A1 PRO 193 HD2 -0.02 0.00 0.24 -0.04 3.68 3.86 1t34A1 PRO 193 HD3 -0.00 0.27 0.41 -0.04 3.65 4.29 1t34A1 ASP 194 H -0.04 0.13 -0.09 -0.55 8.40 7.84 1t34A1 ASP 194 HA 0.03 0.09 0.37 -0.75 4.63 4.37 1t34A1 ASP 194 HB2 -0.14 -0.06 0.03 -0.04 2.71 2.50 1t34A1 ASP 194 HB3 0.03 0.06 -0.03 -0.04 2.70 2.71 1t34A1 HIS 195 H -0.13 0.24 -0.46 -0.55 8.41 7.51 1t34A1 HIS 195 HA -0.05 0.08 0.36 -0.75 4.63 4.27 1t34A1 HIS 195 HB2 -0.13 0.23 0.05 -0.04 3.26 3.37 1t34A1 HIS 195 HB3 -0.12 -0.03 0.08 -0.04 3.20 3.08 1t34A1 HIS 195 HD2 -0.00 0.05 -0.16 -0.04 6.97 6.81 1t34A1 HIS 195 HE1 0.00 0.01 0.05 -0.04 7.75 7.77 1t34A1 TYR 196 H 0.20 0.74 -0.24 -0.55 8.29 8.44 1t34A1 TYR 196 HA -0.09 0.01 0.38 -0.75 4.56 4.11 1t34A1 TYR 196 HB2 -0.03 0.19 0.17 -0.04 3.06 3.35 1t34A1 TYR 196 HB3 -0.06 -0.02 0.01 -0.04 2.98 2.86 1t34A1 TYR 196 HD2 -0.06 0.03 0.04 -0.04 7.15 7.12 1t34A1 TYR 196 HE2 0.00 0.11 -0.14 -0.04 6.85 6.79 1t34A1 PRO 197 HA 0.01 0.08 0.41 -0.51 4.44 4.43 1t34A1 PRO 197 HB2 0.02 0.06 -0.04 -0.04 2.28 2.27 1t34A1 PRO 197 HB3 0.01 0.03 0.08 -0.04 2.02 2.11 1t34A1 PRO 197 HG2 0.04 0.03 0.05 -0.04 2.03 2.11 1t34A1 PRO 197 HG3 0.04 0.01 0.04 -0.04 2.03 2.08 1t34A1 PRO 197 HD2 0.06 0.59 -0.01 -0.04 3.68 4.28 1t34A1 PRO 197 HD3 0.14 0.21 0.16 -0.04 3.65 4.12 1t34A1 LYS 198 H 0.00 0.16 -0.69 -0.55 8.42 7.34 1t34A1 LYS 198 HA -0.02 0.10 0.52 -0.75 4.32 4.17 1t34A1 LYS 198 HB2 0.03 0.07 0.05 -0.04 1.87 1.98 1t34A1 LYS 198 HB3 -0.03 0.13 0.11 -0.04 1.79 1.97 1t34A1 LYS 198 HG2 -0.04 0.00 -0.02 -0.04 1.46 1.37 1t34A1 LYS 198 HG3 -0.00 -0.01 -0.01 -0.04 1.46 1.40 1t34A1 LYS 198 HD2 -0.06 -0.00 -0.03 -0.04 1.69 1.56 1t34A1 LYS 198 HD3 -0.04 -0.07 -0.02 -0.04 1.68 1.51 1t34A1 LYS 198 HE2 -0.16 0.03 -0.03 -0.04 2.99 2.79 1t34A1 LYS 198 HE3 -0.12 0.07 -0.10 -0.04 2.99 2.80 1t34A1 LEU 199 H -0.13 0.54 0.01 -0.55 8.37 8.24 1t34A1 LEU 199 HA -0.14 0.03 0.27 -0.75 4.35 3.76 1t34A1 LEU 199 HB2 -0.29 0.08 0.17 -0.04 1.64 1.56 1t34A1 LEU 199 HB3 -0.28 -0.02 -0.12 -0.04 1.64 1.18 1t34A1 LEU 199 HG -0.35 0.03 -0.02 -0.04 1.64 1.27 1t34A1 LEU 199 HD13 -1.15 -0.03 -0.21 -0.04 0.93 -0.51 1t34A1 LEU 199 HD23 -0.49 -0.02 -0.15 -0.04 0.89 0.20 1t34A1 LEU 200 H -0.08 0.49 -0.06 -0.55 8.37 8.18 1t34A1 LEU 200 HA -0.07 0.04 0.37 -0.75 4.35 3.93 1t34A1 LEU 200 HB2 -0.03 0.05 0.09 -0.04 1.64 1.71 1t34A1 LEU 200 HB3 -0.04 0.06 -0.10 -0.04 1.64 1.53 1t34A1 LEU 200 HG -0.04 0.02 -0.07 -0.04 1.64 1.51 1t34A1 LEU 200 HD13 -0.09 0.00 -0.13 -0.04 0.93 0.67 1t34A1 LEU 200 HD23 -0.04 -0.02 -0.05 -0.04 0.89 0.74 1t34A1 ARG 201 H -0.03 0.29 -0.35 -0.55 8.46 7.82 1t34A1 ARG 201 HA -0.01 0.03 0.33 -0.75 4.34 3.93 1t34A1 ARG 201 HB2 -0.01 0.08 0.14 -0.04 1.90 2.07 1t34A1 ARG 201 HB3 -0.02 0.18 0.11 -0.04 1.80 2.03 1t34A1 ARG 201 HG2 -0.01 -0.00 -0.17 -0.04 1.67 1.45 1t34A1 ARG 201 HG3 0.00 -0.02 0.02 -0.04 1.67 1.64 1t34A1 ARG 201 HD2 -0.00 -0.03 0.00 -0.04 3.22 3.15 1t34A1 ARG 201 HD3 -0.01 0.01 0.02 -0.04 3.22 3.21 1t34A1 ALA 202 H -0.04 0.35 -0.43 -0.55 8.40 7.74 1t34A1 ALA 202 HA -0.01 0.02 0.36 -0.75 4.34 3.95 1t34A1 ALA 202 HB3 -0.04 0.01 0.02 -0.04 1.41 1.37 1t34A1 VAL 203 H -0.03 0.66 0.01 -0.55 8.24 8.33 1t34A1 VAL 203 HA 0.03 -0.03 0.37 -0.75 4.13 3.74 1t34A1 VAL 203 HB -0.04 0.05 0.18 -0.04 2.12 2.27 1t34A1 VAL 203 HG13 -0.11 0.01 -0.22 -0.04 0.97 0.61 1t34A1 VAL 203 HG23 0.10 -0.03 -0.12 -0.04 0.95 0.85 1t34A1 ARG 204 H -0.03 0.84 -0.06 -0.55 8.46 8.66 1t34A1 ARG 204 HA -0.01 0.03 0.29 -0.75 4.34 3.90 1t34A1 ARG 204 HB2 -0.04 -0.07 0.01 -0.04 1.90 1.76 1t34A1 ARG 204 HB3 0.01 0.06 0.08 -0.04 1.80 1.90 1t34A1 ARG 204 HG2 0.08 0.04 -0.04 -0.04 1.67 1.70 1t34A1 ARG 204 HG3 0.05 -0.02 0.02 -0.04 1.67 1.68 1t34A1 ARG 204 HD2 0.03 -0.03 -0.02 -0.04 3.22 3.16 1t34A1 ARG 204 HD3 0.01 -0.06 -0.04 -0.04 3.22 3.08 1t34A1 ARG 205 H 0.06 0.15 -0.59 -0.55 8.46 7.52 1t34A1 ARG 205 HA 0.20 0.21 0.93 -0.75 4.34 4.93 1t34A1 ARG 205 HB2 0.02 0.06 0.07 -0.04 1.90 2.02 1t34A1 ARG 205 HB3 0.02 -0.09 -0.01 -0.04 1.80 1.69 1t34A1 ARG 205 HG2 0.06 -0.02 -0.23 -0.04 1.67 1.44 1t34A1 ARG 205 HG3 0.03 -0.09 -0.04 -0.04 1.67 1.53 1t34A1 ARG 205 HD2 0.04 -0.09 -0.00 -0.04 3.22 3.13 1t34A1 ARG 205 HD3 0.06 -0.03 0.04 -0.04 3.22 3.25 1t34A1 LYS 206 H 0.07 0.66 0.13 -0.55 8.42 8.72 1t34A1 LYS 206 HA -0.15 0.20 1.02 -0.75 4.32 4.64 1t34A1 LYS 206 HB2 -0.00 0.05 0.00 -0.04 1.87 1.88 1t34A1 LYS 206 HB3 -0.05 -0.10 0.09 -0.04 1.79 1.69 1t34A1 LYS 206 HG2 -0.05 -0.03 -0.35 -0.04 1.46 1.00 1t34A1 LYS 206 HG3 -0.04 -0.07 -0.03 -0.04 1.46 1.28 1t34A1 LYS 206 HD2 -0.08 -0.07 -0.03 -0.04 1.69 1.48 1t34A1 LYS 206 HD3 -0.12 0.01 0.01 -0.04 1.68 1.54 1t34A1 LYS 206 HE2 -0.14 0.07 -0.05 -0.04 2.99 2.83 1t34A1 LYS 206 HE3 -0.07 -0.00 -0.09 -0.04 2.99 2.79 1t34A1 GLY 207 H 0.19 0.46 0.01 -0.55 8.43 8.54 1t34A1 GLY 207 HA2 0.20 0.09 0.32 -0.51 4.01 4.12 1t34A1 GLY 207 HA3 0.10 -0.08 0.20 -0.51 4.01 3.72 1t34A1 ARG 208 H -0.01 0.02 0.09 -0.55 8.46 8.02 1t34A1 ARG 208 HA 0.16 0.17 0.81 -0.75 4.34 4.74 1t34A1 ARG 208 HB2 -0.23 -0.05 0.03 -0.04 1.90 1.62 1t34A1 ARG 208 HB3 -0.25 0.29 0.06 -0.04 1.80 1.85 1t34A1 ARG 208 HG2 -0.08 -0.07 -0.37 -0.04 1.67 1.11 1t34A1 ARG 208 HG3 -0.23 0.14 -0.31 -0.04 1.67 1.22 1t34A1 ARG 208 HD2 -0.09 0.08 -0.10 -0.04 3.22 3.07 1t34A1 ARG 208 HD3 0.04 -0.03 -0.51 -0.04 3.22 2.68 1t34A1 VAL 209 H -0.24 0.05 0.18 -0.55 8.24 7.69 1t34A1 VAL 209 HA -0.36 0.20 0.79 -0.75 4.13 4.01 1t34A1 VAL 209 HB -0.20 -0.10 0.34 -0.04 2.12 2.12 1t34A1 VAL 209 HG13 -0.40 -0.00 -0.08 -0.04 0.97 0.45 1t34A1 VAL 209 HG23 -1.43 0.03 0.08 -0.04 0.95 -0.41 1t34A1 ILE 210 H -0.26 0.87 0.32 -0.55 8.25 8.62 1t34A1 ILE 210 HA 0.09 0.29 0.99 -0.75 4.18 4.80 1t34A1 ILE 210 HB -0.37 0.06 0.06 -0.04 1.89 1.60 1t34A1 ILE 210 HG12 0.03 -0.04 -0.24 -0.04 1.49 1.20 1t34A1 ILE 210 HG13 -0.07 -0.17 -0.75 -0.04 1.21 0.19 1t34A1 ILE 210 HG23 0.25 -0.03 -0.27 -0.04 0.93 0.83 1t34A1 ILE 210 HD13 -0.27 0.08 -0.19 -0.04 0.88 0.47 1t34A1 TYR 211 H 0.37 0.68 0.42 -0.55 8.29 9.21 1t34A1 TYR 211 HA 0.34 0.19 1.05 -0.75 4.56 5.39 1t34A1 TYR 211 HB2 0.12 -0.03 0.16 -0.04 3.06 3.27 1t34A1 TYR 211 HB3 0.12 -0.09 -0.03 -0.04 2.98 2.95 1t34A1 TYR 211 HD2 0.05 0.01 -0.11 -0.04 7.15 7.06 1t34A1 TYR 211 HE2 -0.21 0.02 -0.13 -0.04 6.85 6.50 1t34A1 ILE 212 H 0.39 1.01 0.44 -0.55 8.25 9.54 1t34A1 ILE 212 HA 0.34 0.27 1.06 -0.75 4.18 5.11 1t34A1 ILE 212 HB 0.60 0.04 0.04 -0.04 1.89 2.53 1t34A1 ILE 212 HG12 0.26 -0.01 -0.17 -0.04 1.49 1.52 1t34A1 ILE 212 HG13 0.37 0.02 -0.51 -0.04 1.21 1.05 1t34A1 ILE 212 HG23 0.44 -0.05 -0.31 -0.04 0.93 0.97 1t34A1 ILE 212 HD13 0.22 0.01 -0.20 -0.04 0.88 0.86 1t34A1 CYS 213 H 0.31 0.73 0.32 -0.55 8.50 9.32 1t34A1 CYS 213 HA 0.17 0.14 1.03 -0.75 4.58 5.17 1t34A1 CYS 213 HB2 0.12 0.05 0.10 -0.04 2.97 3.19 1t34A1 CYS 213 HB3 0.19 -0.03 0.39 -0.04 2.97 3.48 1t34A1 SER 214 H 0.32 0.39 0.08 -0.55 8.46 8.70 1t34A1 SER 214 HA 0.14 0.07 0.69 -0.75 4.49 4.63 1t34A1 SER 214 HB2 0.26 -0.14 0.01 -0.04 3.95 4.04 1t34A1 SER 214 HB3 0.35 0.08 -0.25 -0.04 3.93 4.07 1t34A1 SER 215 H 0.15 0.07 0.12 -0.55 8.46 8.26 1t34A1 SER 215 HA 0.15 0.16 0.44 -0.75 4.49 4.48 1t34A1 SER 215 HB2 0.09 0.11 0.12 -0.04 3.95 4.22 1t34A1 SER 215 HB3 0.09 0.02 0.13 -0.04 3.93 4.14 1t34A1 PRO 216 HA 0.15 0.10 0.31 -0.51 4.44 4.49 1t34A1 PRO 216 HB2 0.08 0.19 -0.04 -0.04 2.28 2.46 1t34A1 PRO 216 HB3 0.11 -0.00 0.01 -0.04 2.02 2.10 1t34A1 PRO 216 HG2 0.06 0.04 0.05 -0.04 2.03 2.14 1t34A1 PRO 216 HG3 0.06 0.16 -0.09 -0.04 2.03 2.12 1t34A1 PRO 216 HD2 0.09 0.05 0.22 -0.04 3.68 4.00 1t34A1 PRO 216 HD3 0.12 0.12 0.17 -0.04 3.65 4.02 1t34A1 ASP 217 H 0.10 0.08 -0.25 -0.55 8.40 7.78 1t34A1 ASP 217 HA 0.09 0.18 0.39 -0.75 4.63 4.54 1t34A1 ASP 217 HB2 0.08 -0.09 0.01 -0.04 2.71 2.67 1t34A1 ASP 217 HB3 0.06 0.05 -0.07 -0.04 2.70 2.70 1t34A1 ALA 218 H 0.14 0.13 -0.33 -0.55 8.40 7.80 1t34A1 ALA 218 HA 0.17 0.12 0.44 -0.75 4.34 4.32 1t34A1 ALA 218 HB3 0.26 0.02 -0.01 -0.04 1.41 1.63 1t34A1 PHE 219 H 0.18 0.42 -0.24 -0.55 8.34 8.15 1t34A1 PHE 219 HA -0.06 0.06 0.25 -0.75 4.62 4.12 1t34A1 PHE 219 HB2 -0.48 -0.04 -0.11 -0.04 3.15 2.48 1t34A1 PHE 219 HB3 -0.42 0.11 -0.04 -0.04 3.06 2.66 1t34A1 PHE 219 HD2 -0.08 -0.02 -0.20 -0.04 7.28 6.94 1t34A1 PHE 219 HE2 -0.22 0.05 -0.25 -0.04 7.38 6.92 1t34A1 PHE 219 HZ -0.10 0.17 -0.14 -0.04 7.32 7.21 1t34A1 ARG 220 H 0.13 0.26 -0.47 -0.55 8.46 7.83 1t34A1 ARG 220 HA 0.26 0.08 0.36 -0.75 4.34 4.29 1t34A1 ARG 220 HB2 0.16 0.11 0.14 -0.04 1.90 2.27 1t34A1 ARG 220 HB3 0.10 -0.01 0.04 -0.04 1.80 1.89 1t34A1 ARG 220 HG2 0.33 -0.05 -0.01 -0.04 1.67 1.89 1t34A1 ARG 220 HG3 0.27 0.05 -0.01 -0.04 1.67 1.95 1t34A1 ARG 220 HD2 0.17 0.15 -0.02 -0.04 3.22 3.48 1t34A1 ARG 220 HD3 0.11 -0.03 -0.04 -0.04 3.22 3.22 1t34A1 ASN 221 H 0.02 0.43 -0.07 -0.55 8.53 8.37 1t34A1 ASN 221 HA -0.06 -0.00 0.34 -0.75 4.76 4.28 1t34A1 ASN 221 HB2 0.01 0.09 0.13 -0.04 2.88 3.06 1t34A1 ASN 221 HB3 -0.13 -0.01 -0.01 -0.04 2.79 2.60 1t34A1 ASN 221 HD21 -0.01 -0.06 -0.02 -0.04 7.03 6.90 1t34A1 ASN 221 HD22 0.02 -0.04 -0.03 -0.04 7.74 7.65 1t34A1 LEU 222 H -0.10 0.44 -0.47 -0.55 8.37 7.69 1t34A1 LEU 222 HA -0.10 0.01 0.38 -0.75 4.35 3.89 1t34A1 LEU 222 HB2 -0.28 0.08 0.02 -0.04 1.64 1.42 1t34A1 LEU 222 HB3 -0.28 0.01 -0.08 -0.04 1.64 1.25 1t34A1 LEU 222 HG 0.13 -0.01 -0.07 -0.04 1.64 1.65 1t34A1 LEU 222 HD13 -0.10 -0.02 -0.23 -0.04 0.93 0.54 1t34A1 LEU 222 HD23 -0.17 -0.01 -0.09 -0.04 0.89 0.58 1t34A1 MET 223 H -0.44 0.45 -0.29 -0.55 8.47 7.64 1t34A1 MET 223 HA -0.64 0.06 0.21 -0.75 4.52 3.39 1t34A1 MET 223 HB2 -0.49 0.10 0.14 -0.04 2.15 1.86 1t34A1 MET 223 HB3 -0.52 -0.06 -0.07 -0.04 2.03 1.34 1t34A1 MET 223 HG2 -1.56 0.13 -0.02 -0.04 2.63 1.13 1t34A1 MET 223 HG3 -1.38 -0.06 -0.10 -0.04 2.56 0.97 1t34A1 MET 223 HE3 -1.43 -0.04 -0.32 -0.04 2.10 0.27 1t34A1 LEU 224 H -0.15 0.40 -0.27 -0.55 8.37 7.79 1t34A1 LEU 224 HA -0.09 0.04 0.41 -0.75 4.35 3.96 1t34A1 LEU 224 HB2 -0.08 0.11 0.15 -0.04 1.64 1.77 1t34A1 LEU 224 HB3 -0.07 -0.04 -0.01 -0.04 1.64 1.48 1t34A1 LEU 224 HG -0.01 0.07 -0.07 -0.04 1.64 1.59 1t34A1 LEU 224 HD13 -0.03 -0.03 -0.12 -0.04 0.93 0.71 1t34A1 LEU 224 HD23 -0.07 -0.00 -0.07 -0.04 0.89 0.71 1t34A1 LEU 225 H -0.13 0.55 -0.04 -0.55 8.37 8.21 1t34A1 LEU 225 HA -0.08 -0.03 0.27 -0.75 4.35 3.76 1t34A1 LEU 225 HB2 -0.09 0.09 0.09 -0.04 1.64 1.70 1t34A1 LEU 225 HB3 -0.06 -0.03 0.03 -0.04 1.64 1.53 1t34A1 LEU 225 HG -0.10 0.04 0.10 -0.04 1.64 1.64 1t34A1 LEU 225 HD13 -0.06 -0.02 -0.07 -0.04 0.93 0.74 1t34A1 LEU 225 HD23 -0.07 -0.02 -0.02 -0.04 0.89 0.75 1t34A1 ALA 226 H -0.23 0.47 -0.42 -0.55 8.40 7.68 1t34A1 ALA 226 HA -0.14 -0.02 0.37 -0.75 4.34 3.80 1t34A1 ALA 226 HB3 -0.39 0.05 0.02 -0.04 1.41 1.05 1t34A1 LEU 227 H -0.12 0.43 -0.22 -0.55 8.37 7.92 1t34A1 LEU 227 HA -0.02 0.10 0.46 -0.75 4.35 4.14 1t34A1 LEU 227 HB2 -0.07 0.11 0.25 -0.04 1.64 1.89 1t34A1 LEU 227 HB3 -0.05 -0.06 0.21 -0.04 1.64 1.70 1t34A1 LEU 227 HG -0.02 -0.03 -0.06 -0.04 1.64 1.48 1t34A1 LEU 227 HD13 0.00 -0.01 -0.04 -0.04 0.93 0.85 1t34A1 LEU 227 HD23 -0.04 -0.01 0.07 -0.04 0.89 0.87 1t34A1 ASN 228 H -0.05 0.28 -0.02 -0.55 8.53 8.19 1t34A1 ASN 228 HA -0.02 -0.01 0.31 -0.75 4.76 4.28 1t34A1 ASN 228 HB2 -0.04 0.16 0.08 -0.04 2.88 3.03 1t34A1 ASN 228 HB3 -0.03 -0.03 -0.02 -0.04 2.79 2.68 1t34A1 ASN 228 HD21 -0.04 -0.06 -0.01 -0.04 7.03 6.88 1t34A1 ASN 228 HD22 -0.03 0.01 0.00 -0.04 7.74 7.68 1t34A1 ALA 229 H -0.04 0.32 -0.50 -0.55 8.40 7.63 1t34A1 ALA 229 HA -0.01 0.01 0.47 -0.75 4.34 4.04 1t34A1 ALA 229 HB3 -0.04 0.01 0.05 -0.04 1.41 1.40 1t34A1 GLY 230 H 0.00 0.73 -0.19 -0.55 8.43 8.43 1t34A1 GLY 230 HA2 0.03 -0.02 0.29 -0.51 4.01 3.81 1t34A1 GLY 230 HA3 0.04 0.07 0.70 -0.51 4.01 4.30 1t34A1 LEU 231 H 0.03 0.49 0.13 -0.55 8.37 8.48 1t34A1 LEU 231 HA 0.30 0.11 0.90 -0.75 4.35 4.91 1t34A1 LEU 231 HB2 0.05 -0.06 0.05 -0.04 1.64 1.64 1t34A1 LEU 231 HB3 -0.17 0.02 0.00 -0.04 1.64 1.46 1t34A1 LEU 231 HG -0.02 -0.07 -0.24 -0.04 1.64 1.26 1t34A1 LEU 231 HD13 -0.14 -0.03 0.01 -0.04 0.93 0.73 1t34A1 LEU 231 HD23 -0.28 0.02 -0.14 -0.04 0.89 0.45 1t34A1 THR 232 H 0.24 0.17 0.18 -0.55 8.28 8.33 1t34A1 THR 232 HA 0.19 0.22 0.79 -0.75 4.39 4.84 1t34A1 THR 232 HB 0.13 -0.10 0.13 -0.04 4.32 4.44 1t34A1 THR 232 HG23 0.08 0.04 -0.09 -0.04 1.22 1.21 1t34A1 GLY 233 H 0.20 0.14 0.17 -0.55 8.43 8.39 1t34A1 GLY 233 HA2 0.27 0.34 0.44 -0.51 4.01 4.54 1t34A1 GLY 233 HA3 0.26 -0.01 0.33 -0.51 4.01 4.08 1t34A1 GLU 234 H 0.12 -0.09 -0.52 -0.55 8.60 7.56 1t34A1 GLU 234 HA 0.04 -0.01 0.37 -0.75 4.29 3.93 1t34A1 GLU 234 HB2 0.06 -0.07 0.08 -0.04 2.09 2.11 1t34A1 GLU 234 HB3 0.04 -0.06 0.13 -0.04 1.99 2.06 1t34A1 GLU 234 HG2 -0.01 0.07 -0.10 -0.04 2.34 2.25 1t34A1 GLU 234 HG3 0.01 -0.03 0.03 -0.04 2.34 2.31 1t34A1 ASP 235 H 0.01 0.10 0.08 -0.55 8.40 8.04 1t34A1 ASP 235 HA -0.18 0.24 0.98 -0.75 4.63 4.92 1t34A1 ASP 235 HB2 -0.57 -0.01 0.06 -0.04 2.71 2.15 1t34A1 ASP 235 HB3 -0.49 -0.00 0.10 -0.04 2.70 2.27 1t34A1 TYR 236 H 0.09 0.44 0.13 -0.55 8.29 8.40 1t34A1 TYR 236 HA -0.15 0.32 1.03 -0.75 4.56 5.01 1t34A1 TYR 236 HB2 0.05 -0.11 -0.13 -0.04 3.06 2.82 1t34A1 TYR 236 HB3 -0.45 0.00 -0.03 -0.04 2.98 2.46 1t34A1 TYR 236 HD2 -0.05 -0.07 0.08 -0.04 7.15 7.07 1t34A1 TYR 236 HE2 0.00 0.16 0.00 -0.04 6.85 6.98 1t34A1 VAL 237 H -0.28 0.61 0.32 -0.55 8.24 8.34 1t34A1 VAL 237 HA 0.01 0.14 0.72 -0.75 4.13 4.24 1t34A1 VAL 237 HB 0.32 0.12 -0.05 -0.04 2.12 2.47 1t34A1 VAL 237 HG13 -0.12 -0.02 0.04 -0.04 0.97 0.84 1t34A1 VAL 237 HG23 -0.22 0.00 -0.09 -0.04 0.95 0.60 1t34A1 PHE 238 H 0.03 0.82 0.21 -0.55 8.34 8.84 1t34A1 PHE 238 HA -0.01 0.31 1.06 -0.75 4.62 5.22 1t34A1 PHE 238 HB2 0.01 -0.02 -0.07 -0.04 3.15 3.03 1t34A1 PHE 238 HB3 0.15 -0.09 -0.15 -0.04 3.06 2.92 1t34A1 PHE 238 HD2 -0.00 -0.01 -0.23 -0.04 7.28 7.00 1t34A1 PHE 238 HE2 -0.05 0.00 -0.23 -0.04 7.38 7.06 1t34A1 PHE 238 HZ -0.24 0.02 -0.16 -0.04 7.32 6.90 1t34A1 PHE 239 H 0.15 1.03 0.49 -0.55 8.34 9.45 1t34A1 PHE 239 HA 0.13 0.32 0.93 -0.75 4.62 5.24 1t34A1 PHE 239 HB2 -0.22 -0.06 0.15 -0.04 3.15 2.98 1t34A1 PHE 239 HB3 0.12 -0.09 -0.09 -0.04 3.06 2.96 1t34A1 PHE 239 HD2 -0.35 -0.00 -0.20 -0.04 7.28 6.69 1t34A1 PHE 239 HE2 0.01 0.02 -0.14 -0.04 7.38 7.23 1t34A1 PHE 239 HZ 0.38 0.07 -0.13 -0.04 7.32 7.60 1t34A1 HIS 240 H 0.06 0.66 0.45 -0.55 8.41 9.04 1t34A1 HIS 240 HA -0.18 0.25 1.01 -0.75 4.63 4.96 1t34A1 HIS 240 HB2 -2.30 0.08 0.03 -0.04 3.26 1.03 1t34A1 HIS 240 HB3 -0.58 -0.07 0.24 -0.04 3.20 2.74 1t34A1 HIS 240 HD2 -0.07 0.25 -0.00 -0.04 6.97 7.10 1t34A1 HIS 240 HE1 -0.04 -0.12 -0.08 -0.04 7.75 7.46 1t34A1 LEU 241 H 0.10 0.72 0.22 -0.55 8.37 8.87 1t34A1 LEU 241 HA -0.04 0.13 0.53 -0.75 4.35 4.22 1t34A1 LEU 241 HB2 0.04 -0.04 0.16 -0.04 1.64 1.76 1t34A1 LEU 241 HB3 -0.05 -0.09 0.13 -0.04 1.64 1.59 1t34A1 LEU 241 HG 0.23 0.07 -0.14 -0.04 1.64 1.76 1t34A1 LEU 241 HD13 0.05 -0.00 -0.15 -0.04 0.93 0.78 1t34A1 LEU 241 HD23 0.04 0.01 -0.11 -0.04 0.89 0.79 1t34A1 ASP 242 H -0.35 0.64 0.15 -0.55 8.40 8.30 1t34A1 ASP 242 HA -0.32 0.06 0.90 -0.75 4.63 4.53 1t34A1 ASP 242 HB2 -1.14 0.06 -0.01 -0.04 2.71 1.57 1t34A1 ASP 242 HB3 -0.35 0.11 0.15 -0.04 2.70 2.58 1t34A1 VAL 243 H -0.19 0.25 -0.08 -0.55 8.24 7.67 1t34A1 VAL 243 HA -0.40 0.15 0.27 -0.75 4.13 3.40 1t34A1 VAL 243 HB -1.91 0.02 -0.05 -0.04 2.12 0.15 1t34A1 VAL 243 HG13 -0.20 0.03 -0.12 -0.04 0.97 0.65 1t34A1 VAL 243 HG23 -0.17 -0.01 0.03 -0.04 0.95 0.76 1t34A1 PHE 244 H 0.05 0.08 -0.10 -0.55 8.34 7.82 1t34A1 PHE 244 HA 0.12 0.22 0.70 -0.75 4.62 4.90 1t34A1 PHE 244 HB2 0.04 -0.05 0.02 -0.04 3.15 3.13 1t34A1 PHE 244 HB3 0.07 -0.00 0.12 -0.04 3.06 3.21 1t34A1 PHE 244 HD2 0.18 -0.05 -0.17 -0.04 7.28 7.20 1t34A1 PHE 244 HE2 0.30 0.02 0.00 -0.04 7.38 7.67 1t34A1 PHE 244 HZ 0.40 0.06 -0.01 -0.04 7.32 7.73 1t34A1 GLY 245 H -0.05 0.45 -0.63 -0.55 8.43 7.65 1t34A1 GLY 245 HA2 -0.14 0.09 0.29 -0.51 4.01 3.74 1t34A1 GLY 245 HA3 -0.07 0.07 0.27 -0.51 4.01 3.78 1t34A1 GLN 246 H 0.00 -0.00 -0.13 -0.55 8.47 7.80 1t34A1 GLN 246 HA 0.00 0.22 0.53 -0.75 4.36 4.36 1t34A1 GLN 246 HB2 0.04 -0.09 0.10 -0.04 2.15 2.15 1t34A1 GLN 246 HB3 0.03 0.03 0.05 -0.04 2.02 2.09 1t34A1 GLN 246 HG2 0.01 0.05 0.04 -0.04 2.40 2.46 1t34A1 GLN 246 HG3 0.04 0.08 -0.06 -0.04 2.39 2.41 1t34A1 GLN 246 HE21 0.06 -0.06 0.01 -0.04 6.97 6.93 1t34A1 GLN 246 HE22 0.02 0.05 0.02 -0.04 7.69 7.74 1t34A1 SER 247 H -0.04 -0.05 -0.17 -0.55 8.46 7.65 1t34A1 SER 247 HA -0.01 0.11 0.41 -0.75 4.49 4.24 1t34A1 SER 247 HB2 -0.02 0.11 0.04 -0.04 3.95 4.04 1t34A1 SER 247 HB3 0.12 -0.10 0.06 -0.04 3.93 3.97 1t34A1 LEU 248 H -0.16 0.12 -0.46 -0.55 8.37 7.32 1t34A1 LEU 248 HA -0.18 0.23 0.86 -0.75 4.35 4.50 1t34A1 LEU 248 HB2 -0.27 0.03 -0.12 -0.04 1.64 1.24 1t34A1 LEU 248 HB3 -0.31 0.01 0.01 -0.04 1.64 1.30 1t34A1 LEU 248 HG -0.40 -0.20 -0.13 -0.04 1.64 0.87 1t34A1 LEU 248 HD13 -1.04 0.01 -0.05 -0.04 0.93 -0.19 1t34A1 LEU 248 HD23 -0.63 0.02 -0.17 -0.04 0.89 0.07 1t34A1 LYS 249 H -0.11 0.13 0.12 -0.55 8.42 8.01 1t34A1 LYS 249 HA -0.04 0.17 0.91 -0.75 4.32 4.60 1t34A1 LYS 249 HB2 -0.05 -0.04 0.07 -0.04 1.87 1.81 1t34A1 LYS 249 HB3 -0.04 0.06 0.05 -0.04 1.79 1.82 1t34A1 LYS 249 HG2 -0.06 0.01 -0.01 -0.04 1.46 1.37 1t34A1 LYS 249 HG3 -0.08 0.01 -0.15 -0.04 1.46 1.20 1t34A1 LYS 249 HD2 -0.10 0.05 0.00 -0.04 1.69 1.60 1t34A1 LYS 249 HD3 -0.08 -0.03 0.01 -0.04 1.68 1.54 1t34A1 LYS 249 HE2 -0.06 -0.01 -0.01 -0.04 2.99 2.88 1t34A1 LYS 249 HE3 -0.05 0.01 -0.00 -0.04 2.99 2.91 1t34A1 SER 250 H -0.00 0.17 0.09 -0.55 8.46 8.18 1t34A1 SER 250 HA 0.05 0.15 0.66 -0.75 4.49 4.60 1t34A1 SER 250 HB2 0.04 0.09 -0.06 -0.04 3.95 3.97 1t34A1 SER 250 HB3 0.04 -0.01 -0.35 -0.04 3.93 3.57 1t34A1 ALA 251 H 0.06 0.11 0.09 -0.55 8.40 8.11 1t34A1 ALA 251 HA 0.04 0.01 0.35 -0.75 4.34 3.98 1t34A1 ALA 251 HB3 0.01 0.04 0.06 -0.04 1.41 1.48 1t34A1 GLN 252 H 0.05 0.10 -0.22 -0.55 8.47 7.85 1t34A1 GLN 252 HA 0.01 0.20 0.49 -0.75 4.36 4.31 1t34A1 GLN 252 HB2 0.05 -0.03 -0.04 -0.04 2.15 2.08 1t34A1 GLN 252 HB3 0.03 -0.02 -0.01 -0.04 2.02 1.97 1t34A1 GLN 252 HG2 0.01 0.09 -0.26 -0.04 2.40 2.19 1t34A1 GLN 252 HG3 0.00 0.00 -0.08 -0.04 2.39 2.28 1t34A1 GLN 252 HE21 -0.02 -0.02 -0.05 -0.04 6.97 6.83 1t34A1 GLN 252 HE22 -0.02 0.03 -0.17 -0.04 7.69 7.49 1t34A1 GLY 253 H 0.03 -0.04 -0.51 -0.55 8.43 7.37 1t34A1 GLY 253 HA2 0.03 0.02 0.26 -0.51 4.01 3.80 1t34A1 GLY 253 HA3 0.02 0.15 0.59 -0.51 4.01 4.26 1t34A1 LEU 254 H 0.03 0.38 -0.13 -0.55 8.37 8.11 1t34A1 LEU 254 HA 0.05 0.08 0.51 -0.75 4.35 4.23 1t34A1 LEU 254 HB2 0.03 0.01 0.17 -0.04 1.64 1.80 1t34A1 LEU 254 HB3 0.04 0.01 0.07 -0.04 1.64 1.72 1t34A1 LEU 254 HG 0.03 -0.09 -0.50 -0.04 1.64 1.04 1t34A1 LEU 254 HD13 0.02 -0.00 -0.03 -0.04 0.93 0.88 1t34A1 LEU 254 HD23 0.03 0.03 0.03 -0.04 0.89 0.94 1t34A1 VAL 255 H 0.06 0.12 -0.13 -0.55 8.24 7.74 1t34A1 VAL 255 HA 0.04 0.26 0.91 -0.75 4.13 4.60 1t34A1 VAL 255 HB 0.03 -0.07 -0.15 -0.04 2.12 1.89 1t34A1 VAL 255 HG13 0.02 0.02 -0.28 -0.04 0.97 0.69 1t34A1 VAL 255 HG23 0.02 0.03 -0.02 -0.04 0.95 0.93 1t34A1 PRO 256 HA 0.10 0.07 0.50 -0.51 4.44 4.60 1t34A1 PRO 256 HB2 0.05 0.00 0.03 -0.04 2.28 2.32 1t34A1 PRO 256 HB3 0.06 0.04 0.06 -0.04 2.02 2.14 1t34A1 PRO 256 HG2 0.03 0.02 0.13 -0.04 2.03 2.17 1t34A1 PRO 256 HG3 0.04 0.05 0.08 -0.04 2.03 2.16 1t34A1 PRO 256 HD2 0.04 0.17 0.26 -0.04 3.68 4.10 1t34A1 PRO 256 HD3 0.05 0.13 0.03 -0.04 3.65 3.82 1t34A1 GLN 257 H 0.16 0.28 0.26 -0.55 8.47 8.63 1t34A1 GLN 257 HA -0.01 0.04 0.38 -0.75 4.36 4.01 1t34A1 GLN 257 HB2 0.14 0.06 0.19 -0.04 2.15 2.50 1t34A1 GLN 257 HB3 0.05 -0.02 0.09 -0.04 2.02 2.09 1t34A1 GLN 257 HG2 -0.10 0.04 0.04 -0.04 2.40 2.33 1t34A1 GLN 257 HG3 -0.17 -0.05 -0.11 -0.04 2.39 2.01 1t34A1 GLN 257 HE21 -0.14 0.06 0.06 -0.04 6.97 6.91 1t34A1 GLN 257 HE22 -0.18 0.11 -0.13 -0.04 7.69 7.44 1t34A1 LYS 258 H -0.17 0.18 0.17 -0.55 8.42 8.06 1t34A1 LYS 258 HA -0.27 0.18 0.83 -0.75 4.32 4.31 1t34A1 LYS 258 HB2 -0.73 -0.07 0.22 -0.04 1.87 1.25 1t34A1 LYS 258 HB3 -0.74 0.01 0.08 -0.04 1.79 1.10 1t34A1 LYS 258 HG2 -0.14 0.09 0.01 -0.04 1.46 1.38 1t34A1 LYS 258 HG3 -0.18 0.02 0.17 -0.04 1.46 1.43 1t34A1 LYS 258 HD2 -0.16 0.04 0.04 -0.04 1.69 1.58 1t34A1 LYS 258 HD3 -0.37 -0.08 0.06 -0.04 1.68 1.25 1t34A1 LYS 258 HE2 -0.13 -0.09 0.01 -0.04 2.99 2.75 1t34A1 LYS 258 HE3 -0.06 0.07 0.01 -0.04 2.99 2.97 1t34A1 PRO 259 HA -0.25 0.21 0.14 -0.51 4.44 4.03 1t34A1 PRO 259 HB2 -0.12 0.03 -0.04 -0.04 2.28 2.11 1t34A1 PRO 259 HB3 -0.24 -0.03 -0.04 -0.04 2.02 1.67 1t34A1 PRO 259 HG2 -0.05 0.11 0.07 -0.04 2.03 2.12 1t34A1 PRO 259 HG3 -0.14 0.03 0.04 -0.04 2.03 1.92 1t34A1 PRO 259 HD2 -0.13 0.05 0.22 -0.04 3.68 3.78 1t34A1 PRO 259 HD3 0.08 0.47 0.46 -0.04 3.65 4.61 1t34A1 TRP 260 H -0.81 0.13 -0.08 -0.55 7.97 6.67 1t34A1 TRP 260 HA -0.20 0.12 0.39 -0.75 4.62 4.17 1t34A1 TRP 260 HB2 -0.51 -0.06 0.00 -0.04 3.23 2.62 1t34A1 TRP 260 HB3 -1.71 0.05 -0.01 -0.04 3.23 1.52 1t34A1 TRP 260 HD1 -0.48 0.09 -0.00 -0.04 7.22 6.78 1t34A1 TRP 260 HE1 -0.06 0.14 -0.02 -0.04 10.20 10.21 1t34A1 TRP 260 HE3 -0.13 -0.00 -0.65 -0.04 7.59 6.77 1t34A1 TRP 260 HZ2 -0.04 0.11 -0.04 -0.04 7.44 7.42 1t34A1 TRP 260 HZ3 -0.06 -0.49 0.10 -0.04 7.13 6.64 1t34A1 TRP 260 HH2 -0.04 0.02 -0.01 -0.04 7.19 7.12 1t34A1 GLU 261 H -1.47 0.20 -0.60 -0.55 8.60 6.18 1t34A1 GLU 261 HA -2.08 -0.16 0.26 -0.75 4.29 1.55 1t34A1 GLU 261 HB2 -0.97 -0.03 0.12 -0.04 2.09 1.16 1t34A1 GLU 261 HB3 -0.47 0.13 0.13 -0.04 1.99 1.74 1t34A1 GLU 261 HG2 -0.26 -0.15 -0.06 -0.04 2.34 1.84 1t34A1 GLU 261 HG3 -0.32 0.01 0.00 -0.04 2.34 2.00 1t34A1 ARG 262 H 0.57 -0.25 0.25 -0.55 8.46 8.48 1t34A1 ARG 262 HA 0.04 0.28 0.87 -0.75 4.34 4.77 1t34A1 ARG 262 HB2 0.19 0.22 -0.07 -0.04 1.90 2.20 1t34A1 ARG 262 HB3 0.12 -0.15 -0.06 -0.04 1.80 1.66 1t34A1 ARG 262 HG2 0.06 -0.08 -0.01 -0.04 1.67 1.59 1t34A1 ARG 262 HG3 0.04 -0.01 0.12 -0.04 1.67 1.77 1t34A1 ARG 262 HD2 0.02 -0.08 0.01 -0.04 3.22 3.13 1t34A1 ARG 262 HD3 0.01 0.41 0.01 -0.04 3.22 3.60 1t34A1 GLY 263 H 0.32 -0.12 0.19 -0.55 8.43 8.27 1t34A1 GLY 263 HA2 0.13 -0.05 0.34 -0.51 4.01 3.92 1t34A1 GLY 263 HA3 0.08 0.19 0.37 -0.51 4.01 4.13 1t34A1 ASP 264 H 0.06 -0.10 0.06 -0.55 8.40 7.88 1t34A1 ASP 264 HA 0.02 0.32 0.83 -0.75 4.63 5.05 1t34A1 ASP 264 HB2 0.00 0.07 0.12 -0.04 2.71 2.87 1t34A1 ASP 264 HB3 0.03 0.14 -0.13 -0.04 2.70 2.69 1t34A1 GLY 265 H 0.01 -0.01 0.03 -0.55 8.43 7.91 1t34A1 GLY 265 HA2 -0.02 0.08 0.36 -0.51 4.01 3.91 1t34A1 GLY 265 HA3 -0.02 0.30 0.60 -0.51 4.01 4.38 1t34A1 GLN 266 H -0.04 0.17 -0.40 -0.55 8.47 7.65 1t34A1 GLN 266 HA -0.09 0.19 0.55 -0.75 4.36 4.25 1t34A1 GLN 266 HB2 -0.05 0.00 0.01 -0.04 2.15 2.07 1t34A1 GLN 266 HB3 -0.09 0.00 0.12 -0.04 2.02 2.01 1t34A1 GLN 266 HG2 -0.06 0.03 0.02 -0.04 2.40 2.35 1t34A1 GLN 266 HG3 -0.05 0.07 -0.04 -0.04 2.39 2.33 1t34A1 GLN 266 HE21 -0.04 0.02 -0.02 -0.04 6.97 6.89 1t34A1 GLN 266 HE22 -0.03 -0.05 -0.03 -0.04 7.69 7.54 1t34A1 ASP 267 H -0.15 0.04 -0.70 -0.55 8.40 7.04 1t34A1 ASP 267 HA -0.81 0.11 0.26 -0.75 4.63 3.43 1t34A1 ASP 267 HB2 -0.19 0.10 0.01 -0.04 2.71 2.59 1t34A1 ASP 267 HB3 -0.76 0.12 0.02 -0.04 2.70 2.04 1t34A1 ARG 268 H -0.19 0.18 -0.17 -0.55 8.46 7.73 1t34A1 ARG 268 HA -0.20 0.16 0.51 -0.75 4.34 4.06 1t34A1 ARG 268 HB2 -0.10 -0.00 0.12 -0.04 1.90 1.88 1t34A1 ARG 268 HB3 -0.08 0.08 -0.05 -0.04 1.80 1.71 1t34A1 ARG 268 HG2 -0.06 0.07 0.01 -0.04 1.67 1.65 1t34A1 ARG 268 HG3 -0.08 -0.05 -0.03 -0.04 1.67 1.46 1t34A1 ARG 268 HD2 -0.04 0.04 -0.00 -0.04 3.22 3.18 1t34A1 ARG 268 HD3 -0.03 0.03 -0.00 -0.04 3.22 3.17 1t34A1 SER 269 H -0.14 0.06 -0.14 -0.55 8.46 7.70 1t34A1 SER 269 HA -0.08 0.11 0.38 -0.75 4.49 4.15 1t34A1 SER 269 HB2 -0.10 0.04 0.08 -0.04 3.95 3.94 1t34A1 SER 269 HB3 -0.07 0.06 0.07 -0.04 3.93 3.95 1t34A1 ALA 270 H -0.24 0.55 -0.21 -0.55 8.40 7.95 1t34A1 ALA 270 HA -0.03 0.02 0.28 -0.75 4.34 3.84 1t34A1 ALA 270 HB3 -0.53 0.02 0.02 -0.04 1.41 0.88 1t34A1 ARG 271 H -0.48 0.46 -0.16 -0.55 8.46 7.72 1t34A1 ARG 271 HA -0.05 -0.00 0.30 -0.75 4.34 3.83 1t34A1 ARG 271 HB2 -0.39 -0.01 0.13 -0.04 1.90 1.59 1t34A1 ARG 271 HB3 -0.17 0.10 0.11 -0.04 1.80 1.80 1t34A1 ARG 271 HG2 0.02 0.02 -0.03 -0.04 1.67 1.64 1t34A1 ARG 271 HG3 0.06 -0.01 -0.02 -0.04 1.67 1.65 1t34A1 ARG 271 HD2 -0.04 -0.05 -0.06 -0.04 3.22 3.02 1t34A1 ARG 271 HD3 -0.03 0.02 -0.19 -0.04 3.22 2.98 1t34A1 GLN 272 H -0.08 0.35 -0.41 -0.55 8.47 7.78 1t34A1 GLN 272 HA -0.00 0.03 0.34 -0.75 4.36 3.98 1t34A1 GLN 272 HB2 -0.04 0.04 0.16 -0.04 2.15 2.27 1t34A1 GLN 272 HB3 -0.02 0.03 0.11 -0.04 2.02 2.10 1t34A1 GLN 272 HG2 0.01 -0.01 0.05 -0.04 2.40 2.41 1t34A1 GLN 272 HG3 -0.01 -0.02 0.03 -0.04 2.39 2.34 1t34A1 GLN 272 HE21 -0.01 -0.02 -0.02 -0.04 6.97 6.88 1t34A1 GLN 272 HE22 -0.03 -0.02 -0.02 -0.04 7.69 7.58 1t34A1 ALA 273 H 0.01 0.42 -0.02 -0.55 8.40 8.26 1t34A1 ALA 273 HA 0.02 0.05 0.57 -0.75 4.34 4.23 1t34A1 ALA 273 HB3 -0.08 -0.02 0.12 -0.04 1.41 1.39 1t34A1 PHE 274 H 0.25 0.74 -0.05 -0.55 8.34 8.72 1t34A1 PHE 274 HA 0.18 -0.05 0.33 -0.75 4.62 4.32 1t34A1 PHE 274 HB2 0.05 0.08 -0.03 -0.04 3.15 3.21 1t34A1 PHE 274 HB3 0.37 0.01 0.08 -0.04 3.06 3.48 1t34A1 PHE 274 HD2 0.21 0.12 -0.04 -0.04 7.28 7.53 1t34A1 PHE 274 HE2 0.08 -0.04 -0.08 -0.04 7.38 7.30 1t34A1 PHE 274 HZ 0.24 -0.04 -0.16 -0.04 7.32 7.32 1t34A1 GLN 275 H 0.12 0.17 -1.23 -0.55 8.47 6.99 1t34A1 GLN 275 HA 0.01 0.06 0.64 -0.75 4.36 4.32 1t34A1 GLN 275 HB2 0.08 0.28 0.22 -0.04 2.15 2.70 1t34A1 GLN 275 HB3 0.10 -0.09 0.05 -0.04 2.02 2.04 1t34A1 GLN 275 HG2 -0.22 -0.07 0.03 -0.04 2.40 2.10 1t34A1 GLN 275 HG3 -0.02 0.12 -0.01 -0.04 2.39 2.43 1t34A1 GLN 275 HE21 -0.01 -0.10 0.00 -0.04 6.97 6.82 1t34A1 GLN 275 HE22 -0.02 0.03 -0.13 -0.04 7.69 7.53 1t34A1 ALA 276 H 0.15 0.44 0.17 -0.55 8.40 8.62 1t34A1 ALA 276 HA 0.20 0.15 0.58 -0.75 4.34 4.52 1t34A1 ALA 276 HB3 0.29 -0.03 0.04 -0.04 1.41 1.67 1t34A1 ALA 277 H 0.18 0.07 -0.72 -0.55 8.40 7.38 1t34A1 ALA 277 HA 0.22 0.27 0.74 -0.75 4.34 4.82 1t34A1 ALA 277 HB3 0.05 -0.02 -0.02 -0.04 1.41 1.38 1t34A1 LYS 278 H 0.12 0.64 0.40 -0.55 8.42 9.02 1t34A1 LYS 278 HA 0.53 0.13 0.77 -0.75 4.32 4.99 1t34A1 LYS 278 HB2 -0.13 -0.05 0.01 -0.04 1.87 1.66 1t34A1 LYS 278 HB3 0.30 0.02 0.03 -0.04 1.79 2.11 1t34A1 LYS 278 HG2 0.16 0.04 0.00 -0.04 1.46 1.62 1t34A1 LYS 278 HG3 -0.04 0.07 -0.43 -0.04 1.46 1.02 1t34A1 LYS 278 HD2 -0.07 -0.01 -0.09 -0.04 1.69 1.47 1t34A1 LYS 278 HD3 0.11 -0.06 -0.06 -0.04 1.68 1.63 1t34A1 LYS 278 HE2 -0.22 -0.17 0.01 -0.04 2.99 2.57 1t34A1 LYS 278 HE3 -0.20 0.10 -0.02 -0.04 2.99 2.82 1t34A1 ILE 279 H 0.35 0.34 0.10 -0.55 8.25 8.50 1t34A1 ILE 279 HA 0.03 0.11 1.13 -0.75 4.18 4.70 1t34A1 ILE 279 HB -0.08 -0.05 0.09 -0.04 1.89 1.81 1t34A1 ILE 279 HG12 -0.20 -0.01 -0.10 -0.04 1.49 1.14 1t34A1 ILE 279 HG13 -0.35 0.04 -0.34 -0.04 1.21 0.52 1t34A1 ILE 279 HG23 -0.25 -0.02 -0.17 -0.04 0.93 0.45 1t34A1 ILE 279 HD13 -0.53 -0.01 -0.11 -0.04 0.88 0.19 1t34A1 ILE 280 H 0.07 0.59 0.32 -0.55 8.25 8.68 1t34A1 ILE 280 HA 0.25 0.26 0.97 -0.75 4.18 4.90 1t34A1 ILE 280 HB 0.10 -0.09 0.05 -0.04 1.89 1.91 1t34A1 ILE 280 HG12 0.48 0.06 -0.15 -0.04 1.49 1.84 1t34A1 ILE 280 HG13 0.42 -0.05 -0.32 -0.04 1.21 1.22 1t34A1 ILE 280 HG23 -0.12 -0.00 -0.23 -0.04 0.93 0.54 1t34A1 ILE 280 HD13 0.20 0.00 -0.17 -0.04 0.88 0.87 1t34A1 THR 281 H 0.25 0.54 0.34 -0.55 8.28 8.86 1t34A1 THR 281 HA -0.10 0.06 0.77 -0.75 4.39 4.36 1t34A1 THR 281 HB 0.01 -0.05 0.25 -0.04 4.32 4.48 1t34A1 THR 281 HG23 -0.15 0.04 -0.19 -0.04 1.22 0.88 1t34A1 TYR 282 H -0.16 0.68 0.41 -0.55 8.29 8.66 1t34A1 TYR 282 HA -0.36 0.14 0.79 -0.75 4.56 4.38 1t34A1 TYR 282 HB2 -0.09 -0.04 0.15 -0.04 3.06 3.05 1t34A1 TYR 282 HB3 -0.19 0.10 0.12 -0.04 2.98 2.97 1t34A1 TYR 282 HD2 -0.71 0.06 -0.03 -0.04 7.15 6.43 1t34A1 TYR 282 HE2 -0.60 -0.03 -0.11 -0.04 6.85 6.07 1t34A1 LYS 283 H -0.08 0.51 0.19 -0.55 8.42 8.49 1t34A1 LYS 283 HA 0.08 0.08 0.77 -0.75 4.32 4.50 1t34A1 LYS 283 HB2 0.00 -0.09 -0.34 -0.04 1.87 1.41 1t34A1 LYS 283 HB3 -0.05 -0.00 -0.11 -0.04 1.79 1.59 1t34A1 LYS 283 HG2 -0.01 0.19 -0.31 -0.04 1.46 1.29 1t34A1 LYS 283 HG3 -0.01 -0.03 -0.05 -0.04 1.46 1.33 1t34A1 LYS 283 HD2 0.00 -0.00 -0.11 -0.04 1.69 1.53 1t34A1 LYS 283 HD3 -0.01 -0.05 -0.14 -0.04 1.68 1.44 1t34A1 LYS 283 HE2 -0.02 0.09 -0.17 -0.04 2.99 2.84 1t34A1 LYS 283 HE3 -0.02 0.02 -0.07 -0.04 2.99 2.88 1t34A1 GLU 284 H 0.09 0.11 0.10 -0.55 8.60 8.35 1t34A1 GLU 284 HA 0.01 0.13 0.68 -0.75 4.29 4.36 1t34A1 GLU 284 HB2 0.18 -0.06 0.07 -0.04 2.09 2.24 1t34A1 GLU 284 HB3 0.13 0.04 0.04 -0.04 1.99 2.15 1t34A1 GLU 284 HG2 0.25 0.18 0.01 -0.04 2.34 2.73 1t34A1 GLU 284 HG3 0.23 -0.07 0.00 -0.04 2.34 2.47 1t34A1 PRO 285 HA -0.12 0.01 0.44 -0.51 4.44 4.26 1t34A1 PRO 285 HB2 -0.58 -0.03 0.01 -0.04 2.28 1.65 1t34A1 PRO 285 HB3 -0.28 0.20 0.14 -0.04 2.02 2.05 1t34A1 PRO 285 HG2 -1.45 -0.03 0.09 -0.04 2.03 0.59 1t34A1 PRO 285 HG3 -0.42 0.12 0.16 -0.04 2.03 1.85 1t34A1 PRO 285 HD2 -0.62 0.02 0.18 -0.04 3.68 3.23 1t34A1 PRO 285 HD3 -0.26 0.24 0.32 -0.04 3.65 3.90 1t34A1 ASP 286 H -0.02 0.04 0.23 -0.55 8.40 8.11 1t34A1 ASP 286 HA 0.06 0.18 0.74 -0.75 4.63 4.85 1t34A1 ASP 286 HB2 0.01 -0.06 0.15 -0.04 2.71 2.77 1t34A1 ASP 286 HB3 0.02 0.00 -0.05 -0.04 2.70 2.63 1t34A1 ASN 287 H 0.03 -0.01 0.10 -0.55 8.53 8.10 1t34A1 ASN 287 HA 0.04 0.13 0.41 -0.75 4.76 4.60 1t34A1 ASN 287 HB2 0.05 -0.01 0.10 -0.04 2.88 2.98 1t34A1 ASN 287 HB3 0.03 0.03 0.15 -0.04 2.79 2.96 1t34A1 ASN 287 HD21 0.10 1.05 0.11 -0.04 7.03 8.25 1t34A1 ASN 287 HD22 0.08 -0.23 -0.05 -0.04 7.74 7.50 1t34A1 PRO 288 HA 0.08 0.11 0.48 -0.51 4.44 4.60 1t34A1 PRO 288 HB2 0.04 0.04 0.00 -0.04 2.28 2.32 1t34A1 PRO 288 HB3 0.04 0.07 0.13 -0.04 2.02 2.22 1t34A1 PRO 288 HG2 0.04 0.03 0.04 -0.04 2.03 2.10 1t34A1 PRO 288 HG3 0.03 0.09 0.07 -0.04 2.03 2.18 1t34A1 PRO 288 HD2 0.04 0.07 0.24 -0.04 3.68 3.98 1t34A1 PRO 288 HD3 0.04 0.19 0.20 -0.04 3.65 4.04 1t34A1 GLU 289 H 0.08 0.13 -0.24 -0.55 8.60 8.02 1t34A1 GLU 289 HA 0.09 0.10 0.43 -0.75 4.29 4.16 1t34A1 GLU 289 HB2 0.08 0.07 0.03 -0.04 2.09 2.23 1t34A1 GLU 289 HB3 0.09 0.00 -0.01 -0.04 1.99 2.04 1t34A1 GLU 289 HG2 0.05 0.07 -0.05 -0.04 2.34 2.36 1t34A1 GLU 289 HG3 0.05 0.00 -0.03 -0.04 2.34 2.32 1t34A1 TYR 290 H 0.21 0.21 -0.37 -0.55 8.29 7.79 1t34A1 TYR 290 HA 0.11 0.01 0.41 -0.75 4.56 4.35 1t34A1 TYR 290 HB2 0.04 0.14 0.02 -0.04 3.06 3.22 1t34A1 TYR 290 HB3 0.06 0.15 -0.01 -0.04 2.98 3.14 1t34A1 TYR 290 HD2 0.05 0.06 -0.13 -0.04 7.15 7.09 1t34A1 TYR 290 HE2 0.11 -0.02 -0.08 -0.04 6.85 6.82 1t34A1 LEU 291 H 0.15 0.30 -0.10 -0.55 8.37 8.17 1t34A1 LEU 291 HA -0.09 0.00 0.33 -0.75 4.35 3.84 1t34A1 LEU 291 HB2 0.05 0.08 0.13 -0.04 1.64 1.86 1t34A1 LEU 291 HB3 0.01 -0.01 0.03 -0.04 1.64 1.64 1t34A1 LEU 291 HG 0.12 0.11 0.04 -0.04 1.64 1.87 1t34A1 LEU 291 HD13 0.05 0.00 0.02 -0.04 0.93 0.96 1t34A1 LEU 291 HD23 0.05 -0.02 -0.00 -0.04 0.89 0.88 1t34A1 GLU 292 H 0.05 0.49 -0.24 -0.55 8.60 8.36 1t34A1 GLU 292 HA -0.01 0.02 0.43 -0.75 4.29 3.98 1t34A1 GLU 292 HB2 0.07 0.10 0.08 -0.04 2.09 2.29 1t34A1 GLU 292 HB3 0.03 -0.02 0.05 -0.04 1.99 2.01 1t34A1 GLU 292 HG2 0.04 0.19 0.09 -0.04 2.34 2.62 1t34A1 GLU 292 HG3 0.03 -0.01 0.01 -0.04 2.34 2.33 1t34A1 PHE 293 H 0.14 0.40 -0.43 -0.55 8.34 7.90 1t34A1 PHE 293 HA -0.08 0.04 0.50 -0.75 4.62 4.33 1t34A1 PHE 293 HB2 -0.03 0.02 0.15 -0.04 3.15 3.25 1t34A1 PHE 293 HB3 -0.05 0.18 0.31 -0.04 3.06 3.46 1t34A1 PHE 293 HD2 -0.25 0.04 -0.02 -0.04 7.28 7.01 1t34A1 PHE 293 HE2 -0.21 0.05 -0.04 -0.04 7.38 7.14 1t34A1 PHE 293 HZ -0.04 0.04 -0.20 -0.04 7.32 7.07 1t34A1 LEU 294 H -0.12 0.58 -0.02 -0.55 8.37 8.26 1t34A1 LEU 294 HA -0.45 -0.00 0.35 -0.75 4.35 3.50 1t34A1 LEU 294 HB2 -0.19 0.17 0.13 -0.04 1.64 1.71 1t34A1 LEU 294 HB3 -0.18 -0.04 0.01 -0.04 1.64 1.39 1t34A1 LEU 294 HG -0.40 0.06 -0.00 -0.04 1.64 1.26 1t34A1 LEU 294 HD13 -0.55 -0.02 -0.11 -0.04 0.93 0.21 1t34A1 LEU 294 HD23 -0.14 -0.02 -0.01 -0.04 0.89 0.67 1t34A1 LYS 295 H -0.13 0.41 -0.28 -0.55 8.42 7.87 1t34A1 LYS 295 HA -0.10 0.02 0.45 -0.75 4.32 3.93 1t34A1 LYS 295 HB2 -0.06 0.14 0.13 -0.04 1.87 2.03 1t34A1 LYS 295 HB3 -0.06 -0.02 0.03 -0.04 1.79 1.70 1t34A1 LYS 295 HG2 -0.06 -0.06 0.02 -0.04 1.46 1.32 1t34A1 LYS 295 HG3 -0.05 0.19 0.04 -0.04 1.46 1.60 1t34A1 LYS 295 HD2 -0.03 0.00 0.00 -0.04 1.69 1.62 1t34A1 LYS 295 HD3 -0.03 -0.02 -0.01 -0.04 1.68 1.58 1t34A1 LYS 295 HE2 -0.01 -0.02 -0.04 -0.04 2.99 2.88 1t34A1 LYS 295 HE3 -0.02 0.02 -0.11 -0.04 2.99 2.84 1t34A1 GLN 296 H -0.17 0.41 -0.22 -0.55 8.47 7.95 1t34A1 GLN 296 HA -0.10 0.02 0.43 -0.75 4.36 3.96 1t34A1 GLN 296 HB2 -0.16 0.12 0.22 -0.04 2.15 2.29 1t34A1 GLN 296 HB3 -0.11 -0.04 0.03 -0.04 2.02 1.86 1t34A1 GLN 296 HG2 -0.04 -0.03 0.03 -0.04 2.40 2.32 1t34A1 GLN 296 HG3 -0.05 -0.03 0.03 -0.04 2.39 2.30 1t34A1 GLN 296 HE21 0.03 -0.04 -0.03 -0.04 6.97 6.88 1t34A1 GLN 296 HE22 -0.00 -0.01 0.02 -0.04 7.69 7.66 1t34A1 LEU 297 H -0.48 0.72 -0.08 -0.55 8.37 7.97 1t34A1 LEU 297 HA -0.33 -0.02 0.27 -0.75 4.35 3.52 1t34A1 LEU 297 HB2 -1.13 0.03 0.03 -0.04 1.64 0.52 1t34A1 LEU 297 HB3 -0.52 0.04 0.17 -0.04 1.64 1.28 1t34A1 LEU 297 HG -0.23 -0.02 -0.18 -0.04 1.64 1.17 1t34A1 LEU 297 HD13 -0.25 0.04 -0.05 -0.04 0.93 0.63 1t34A1 LEU 297 HD23 -0.12 -0.01 -0.02 -0.04 0.89 0.69 1t34A1 LYS 298 H -0.20 0.75 -0.09 -0.55 8.42 8.32 1t34A1 LYS 298 HA -0.08 -0.07 0.42 -0.75 4.32 3.84 1t34A1 LYS 298 HB2 -0.10 0.13 0.24 -0.04 1.87 2.09 1t34A1 LYS 298 HB3 -0.07 -0.05 0.04 -0.04 1.79 1.66 1t34A1 LYS 298 HG2 -0.07 0.17 0.12 -0.04 1.46 1.63 1t34A1 LYS 298 HG3 -0.11 -0.03 0.09 -0.04 1.46 1.36 1t34A1 LYS 298 HD2 -0.10 -0.01 -0.14 -0.04 1.69 1.40 1t34A1 LYS 298 HD3 -0.07 -0.05 -0.00 -0.04 1.68 1.52 1t34A1 LYS 298 HE2 -0.05 -0.07 -0.04 -0.04 2.99 2.78 1t34A1 LYS 298 HE3 -0.06 0.29 -0.06 -0.04 2.99 3.13 1t34A1 LEU 299 H -0.09 0.56 -0.07 -0.55 8.37 8.22 1t34A1 LEU 299 HA -0.03 -0.01 0.37 -0.75 4.35 3.92 1t34A1 LEU 299 HB2 -0.06 0.14 0.21 -0.04 1.64 1.89 1t34A1 LEU 299 HB3 -0.03 -0.04 0.01 -0.04 1.64 1.54 1t34A1 LEU 299 HG -0.05 -0.01 0.10 -0.04 1.64 1.64 1t34A1 LEU 299 HD13 -0.04 0.01 -0.04 -0.04 0.93 0.82 1t34A1 LEU 299 HD23 -0.02 -0.02 0.03 -0.04 0.89 0.84 1t34A1 LEU 300 H -0.07 0.62 -0.20 -0.55 8.37 8.17 1t34A1 LEU 300 HA 0.03 0.04 0.43 -0.75 4.35 4.09 1t34A1 LEU 300 HB2 -0.03 0.07 0.09 -0.04 1.64 1.73 1t34A1 LEU 300 HB3 -0.06 0.05 0.08 -0.04 1.64 1.67 1t34A1 LEU 300 HG 0.17 -0.06 -0.06 -0.04 1.64 1.65 1t34A1 LEU 300 HD13 0.06 -0.01 0.02 -0.04 0.93 0.95 1t34A1 LEU 300 HD23 0.02 0.01 -0.03 -0.04 0.89 0.85 1t34A1 ALA 301 H -0.04 0.60 -0.04 -0.55 8.40 8.38 1t34A1 ALA 301 HA 0.12 -0.00 0.56 -0.75 4.34 4.26 1t34A1 ALA 301 HB3 0.00 0.01 0.11 -0.04 1.41 1.50 1t34A1 ASP 302 H 0.02 0.51 -0.05 -0.55 8.40 8.33 1t34A1 ASP 302 HA 0.04 0.12 0.55 -0.75 4.63 4.58 1t34A1 ASP 302 HB2 -0.02 0.02 0.19 -0.04 2.71 2.85 1t34A1 ASP 302 HB3 -0.01 0.10 0.18 -0.04 2.70 2.93 1t34A1 LYS 303 H 0.05 0.29 -0.26 -0.55 8.42 7.94 1t34A1 LYS 303 HA 0.01 0.06 0.23 -0.75 4.32 3.87 1t34A1 LYS 303 HB2 0.01 0.37 0.21 -0.04 1.87 2.42 1t34A1 LYS 303 HB3 0.02 -0.01 0.03 -0.04 1.79 1.79 1t34A1 LYS 303 HG2 0.00 -0.03 0.07 -0.04 1.46 1.46 1t34A1 LYS 303 HG3 0.00 -0.03 0.02 -0.04 1.46 1.41 1t34A1 LYS 303 HD2 0.00 -0.02 -0.02 -0.04 1.69 1.60 1t34A1 LYS 303 HD3 0.00 0.03 -0.09 -0.04 1.68 1.58 1t34A1 LYS 303 HE2 -0.00 -0.01 0.00 -0.04 2.99 2.94 1t34A1 LYS 303 HE3 -0.00 0.00 0.04 -0.04 2.99 2.99 1t34A1 LYS 304 H 0.10 0.28 0.02 -0.55 8.42 8.27 1t34A1 LYS 304 HA -0.06 0.19 0.92 -0.75 4.32 4.61 1t34A1 LYS 304 HB2 -0.01 0.01 -0.01 -0.04 1.87 1.82 1t34A1 LYS 304 HB3 -0.31 -0.02 -0.01 -0.04 1.79 1.41 1t34A1 LYS 304 HG2 -0.14 -0.04 0.06 -0.04 1.46 1.30 1t34A1 LYS 304 HG3 -0.07 0.08 0.10 -0.04 1.46 1.52 1t34A1 LYS 304 HD2 -0.01 0.00 -0.09 -0.04 1.69 1.55 1t34A1 LYS 304 HD3 -0.02 -0.02 -0.03 -0.04 1.68 1.57 1t34A1 LYS 304 HE2 -0.03 0.00 0.00 -0.04 2.99 2.93 1t34A1 LYS 304 HE3 -0.01 -0.01 -0.02 -0.04 2.99 2.91 1t34A1 PHE 305 H 0.20 0.16 0.09 -0.55 8.34 8.24 1t34A1 PHE 305 HA 0.00 0.18 0.94 -0.75 4.62 4.99 1t34A1 PHE 305 HB2 -0.04 0.07 0.29 -0.04 3.15 3.43 1t34A1 PHE 305 HB3 -0.06 -0.10 0.16 -0.04 3.06 3.02 1t34A1 PHE 305 HD2 -0.15 0.05 -0.06 -0.04 7.28 7.08 1t34A1 PHE 305 HE2 -0.49 -0.02 -0.13 -0.04 7.38 6.70 1t34A1 PHE 305 HZ -0.30 0.03 -0.34 -0.04 7.32 6.68 1t34A1 ASN 306 H 0.11 0.11 -0.07 -0.55 8.53 8.13 1t34A1 ASN 306 HA 0.07 0.11 0.31 -0.75 4.76 4.50 1t34A1 ASN 306 HB2 0.09 0.21 -0.17 -0.04 2.88 2.97 1t34A1 ASN 306 HB3 0.07 -0.08 0.24 -0.04 2.79 2.98 1t34A1 ASN 306 HD21 0.02 -0.01 -0.05 -0.04 7.03 6.94 1t34A1 ASN 306 HD22 0.04 -0.03 -0.04 -0.04 7.74 7.66 1t34A1 PHE 307 H 0.21 0.56 -0.08 -0.55 8.34 8.47 1t34A1 PHE 307 HA 0.00 0.14 0.85 -0.75 4.62 4.85 1t34A1 PHE 307 HB2 0.03 0.08 -0.22 -0.04 3.15 2.99 1t34A1 PHE 307 HB3 -0.01 0.04 -0.15 -0.04 3.06 2.91 1t34A1 PHE 307 HD2 -0.04 0.03 -0.23 -0.04 7.28 7.00 1t34A1 PHE 307 HE2 -0.06 -0.03 -0.09 -0.04 7.38 7.16 1t34A1 PHE 307 HZ -0.07 -0.03 -0.03 -0.04 7.32 7.14 1t34A1 THR 308 H -1.06 0.17 0.04 -0.55 8.28 6.88 1t34A1 THR 308 HA -0.18 0.20 0.85 -0.75 4.39 4.51 1t34A1 THR 308 HB -0.41 -0.04 0.14 -0.04 4.32 3.97 1t34A1 THR 308 HG23 -0.18 -0.01 -0.19 -0.04 1.22 0.80 1t34A1 VAL 309 H -0.06 0.24 0.03 -0.55 8.24 7.91 1t34A1 VAL 309 HA 0.14 0.02 0.52 -0.75 4.13 4.06 1t34A1 VAL 309 HB -0.02 -0.03 0.13 -0.04 2.12 2.15 1t34A1 VAL 309 HG13 0.01 0.00 -0.14 -0.04 0.97 0.80 1t34A1 VAL 309 HG23 0.15 -0.00 -0.09 -0.04 0.95 0.97 1t34A1 GLU 310 H -0.05 0.12 0.19 -0.55 8.60 8.32 1t34A1 GLU 310 HA -0.06 0.11 0.56 -0.75 4.29 4.15 1t34A1 GLU 310 HB2 -0.02 -0.03 0.02 -0.04 2.09 2.02 1t34A1 GLU 310 HB3 -0.04 -0.02 0.15 -0.04 1.99 2.04 1t34A1 GLU 310 HG2 -0.15 0.13 0.05 -0.04 2.34 2.32 1t34A1 GLU 310 HG3 -0.08 -0.02 0.06 -0.04 2.34 2.25 1t34A1 ASP 311 H -0.02 0.13 0.13 -0.55 8.40 8.10 1t34A1 ASP 311 HA 0.01 0.17 0.71 -0.75 4.63 4.77 1t34A1 ASP 311 HB2 -0.00 0.06 0.05 -0.04 2.71 2.78 1t34A1 ASP 311 HB3 0.03 -0.13 -0.15 -0.04 2.70 2.41 1t34A1 GLY 312 H 0.08 0.20 0.15 -0.55 8.43 8.33 1t34A1 GLY 312 HA2 0.10 0.04 0.37 -0.51 4.01 4.01 1t34A1 GLY 312 HA3 0.07 0.19 0.55 -0.51 4.01 4.32 1t34A1 LEU 313 H 0.17 0.32 0.12 -0.55 8.37 8.43 1t34A1 LEU 313 HA 0.25 0.09 0.29 -0.75 4.35 4.23 1t34A1 LEU 313 HB2 0.28 0.15 0.01 -0.04 1.64 2.03 1t34A1 LEU 313 HB3 0.34 0.00 0.05 -0.04 1.64 1.98 1t34A1 LEU 313 HG 0.20 -0.05 -0.01 -0.04 1.64 1.74 1t34A1 LEU 313 HD13 0.15 0.05 -0.09 -0.04 0.93 0.99 1t34A1 LEU 313 HD23 0.22 -0.00 -0.16 -0.04 0.89 0.91 1t34A1 LYS 314 H 0.20 0.14 -0.40 -0.55 8.42 7.81 1t34A1 LYS 314 HA 0.30 0.02 0.44 -0.75 4.32 4.33 1t34A1 LYS 314 HB2 -0.01 0.07 -0.04 -0.04 1.87 1.84 1t34A1 LYS 314 HB3 -0.15 -0.01 0.05 -0.04 1.79 1.64 1t34A1 LYS 314 HG2 -0.97 -0.07 0.07 -0.04 1.46 0.45 1t34A1 LYS 314 HG3 -0.11 0.03 0.05 -0.04 1.46 1.38 1t34A1 LYS 314 HD2 -0.11 0.08 -0.03 -0.04 1.69 1.59 1t34A1 LYS 314 HD3 -0.28 -0.01 -0.01 -0.04 1.68 1.34 1t34A1 LYS 314 HE2 -0.14 -0.04 0.00 -0.04 2.99 2.77 1t34A1 LYS 314 HE3 -0.09 0.07 0.01 -0.04 2.99 2.94 1t34A1 ASN 315 H 0.20 0.59 -0.36 -0.55 8.53 8.41 1t34A1 ASN 315 HA 0.16 0.10 0.50 -0.75 4.76 4.76 1t34A1 ASN 315 HB2 0.20 0.16 0.14 -0.04 2.88 3.35 1t34A1 ASN 315 HB3 0.19 -0.04 0.06 -0.04 2.79 2.96 1t34A1 ASN 315 HD21 0.03 0.58 0.19 -0.04 7.03 7.78 1t34A1 ASN 315 HD22 0.06 -0.22 0.15 -0.04 7.74 7.69 1t34A1 ILE 316 H 0.28 0.52 -0.25 -0.55 8.25 8.26 1t34A1 ILE 316 HA 0.24 0.04 0.51 -0.75 4.18 4.22 1t34A1 ILE 316 HB -0.01 -0.01 0.12 -0.04 1.89 1.94 1t34A1 ILE 316 HG12 0.21 0.44 0.19 -0.04 1.49 2.29 1t34A1 ILE 316 HG13 0.18 -0.06 -0.09 -0.04 1.21 1.20 1t34A1 ILE 316 HG23 0.04 0.02 0.08 -0.04 0.93 1.03 1t34A1 ILE 316 HD13 -0.26 -0.01 0.01 -0.04 0.88 0.59 1t34A1 ILE 317 H 0.29 0.37 -0.26 -0.55 8.25 8.10 1t34A1 ILE 317 HA 0.26 0.07 0.55 -0.75 4.18 4.31 1t34A1 ILE 317 HB 0.30 0.35 0.17 -0.04 1.89 2.66 1t34A1 ILE 317 HG12 0.60 0.02 0.10 -0.04 1.49 2.17 1t34A1 ILE 317 HG13 0.66 -0.13 -0.02 -0.04 1.21 1.68 1t34A1 ILE 317 HG23 0.59 -0.06 -0.24 -0.04 0.93 1.18 1t34A1 ILE 317 HD13 0.33 0.03 -0.00 -0.04 0.88 1.19 1t34A1 PRO 318 HA 0.26 0.00 0.50 -0.51 4.44 4.69 1t34A1 PRO 318 HB2 0.17 0.09 -0.02 -0.04 2.28 2.47 1t34A1 PRO 318 HB3 0.03 -0.03 -0.21 -0.04 2.02 1.77 1t34A1 PRO 318 HG2 0.20 0.18 0.12 -0.04 2.03 2.49 1t34A1 PRO 318 HG3 0.07 0.00 0.02 -0.04 2.03 2.09 1t34A1 PRO 318 HD2 0.22 -0.04 -0.03 -0.04 3.68 3.78 1t34A1 PRO 318 HD3 0.16 0.40 0.22 -0.04 3.65 4.39 1t34A1 ALA 319 H 0.26 0.40 -0.35 -0.55 8.40 8.17 1t34A1 ALA 319 HA -0.28 0.07 0.55 -0.75 4.34 3.93 1t34A1 ALA 319 HB3 0.11 0.01 0.08 -0.04 1.41 1.57 1t34A1 SER 320 H 0.15 0.44 -0.36 -0.55 8.46 8.14 1t34A1 SER 320 HA -0.01 0.01 0.47 -0.75 4.49 4.21 1t34A1 SER 320 HB2 0.07 0.08 0.28 -0.04 3.95 4.34 1t34A1 SER 320 HB3 -0.07 0.01 -0.10 -0.04 3.93 3.73 1t34A1 PHE 321 H 0.33 0.30 -0.29 -0.55 8.34 8.13 1t34A1 PHE 321 HA 0.05 0.01 0.37 -0.75 4.62 4.29 1t34A1 PHE 321 HB2 0.12 0.04 0.16 -0.04 3.15 3.42 1t34A1 PHE 321 HB3 0.12 0.05 -0.10 -0.04 3.06 3.09 1t34A1 PHE 321 HD2 0.12 0.21 -0.10 -0.04 7.28 7.47 1t34A1 PHE 321 HE2 0.08 0.00 -0.12 -0.04 7.38 7.31 1t34A1 PHE 321 HZ -0.01 -0.04 -0.02 -0.04 7.32 7.21 1t34A1 HIS 322 H 0.28 0.41 -0.32 -0.55 8.41 8.24 1t34A1 HIS 322 HA 0.12 0.07 0.23 -0.75 4.63 4.29 1t34A1 HIS 322 HB2 0.15 0.05 0.11 -0.04 3.26 3.53 1t34A1 HIS 322 HB3 -0.12 0.08 0.21 -0.04 3.20 3.31 1t34A1 HIS 322 HD2 -0.23 -0.13 0.02 -0.04 6.97 6.58 1t34A1 HIS 322 HE1 0.12 0.10 -0.21 -0.04 7.75 7.72 1t34A1 ASP 323 H 0.05 0.46 -0.20 -0.55 8.40 8.16 1t34A1 ASP 323 HA -0.08 0.02 0.34 -0.75 4.63 4.15 1t34A1 ASP 323 HB2 -0.02 0.13 0.14 -0.04 2.71 2.92 1t34A1 ASP 323 HB3 0.02 0.03 -0.05 -0.04 2.70 2.66 1t34A1 GLY 324 H -0.08 0.59 -0.26 -0.55 8.43 8.14 1t34A1 GLY 324 HA2 -0.16 0.03 0.36 -0.51 4.01 3.73 1t34A1 GLY 324 HA3 -0.15 0.06 0.27 -0.51 4.01 3.67 1t34A1 LEU 325 H -0.03 0.53 -0.28 -0.55 8.37 8.05 1t34A1 LEU 325 HA 0.04 0.04 0.34 -0.75 4.35 4.01 1t34A1 LEU 325 HB2 0.09 -0.01 0.02 -0.04 1.64 1.71 1t34A1 LEU 325 HB3 0.04 0.14 0.04 -0.04 1.64 1.82 1t34A1 LEU 325 HG 0.08 0.01 -0.16 -0.04 1.64 1.54 1t34A1 LEU 325 HD13 0.10 -0.01 -0.04 -0.04 0.93 0.94 1t34A1 LEU 325 HD23 0.13 -0.01 -0.07 -0.04 0.89 0.90 1t34A1 LEU 326 H -0.10 0.29 -0.34 -0.55 8.37 7.67 1t34A1 LEU 326 HA -0.02 0.08 0.50 -0.75 4.35 4.16 1t34A1 LEU 326 HB2 -0.06 0.08 0.19 -0.04 1.64 1.81 1t34A1 LEU 326 HB3 0.15 -0.02 -0.03 -0.04 1.64 1.71 1t34A1 LEU 326 HG -0.25 0.09 0.01 -0.04 1.64 1.44 1t34A1 LEU 326 HD13 -0.13 -0.04 -0.03 -0.04 0.93 0.70 1t34A1 LEU 326 HD23 0.01 0.02 -0.04 -0.04 0.89 0.84 1t34A1 LEU 327 H -0.32 0.65 -0.05 -0.55 8.37 8.11 1t34A1 LEU 327 HA -0.95 0.00 0.35 -0.75 4.35 3.00 1t34A1 LEU 327 HB2 -0.89 -0.06 0.02 -0.04 1.64 0.68 1t34A1 LEU 327 HB3 -0.32 0.09 0.14 -0.04 1.64 1.51 1t34A1 LEU 327 HG -0.20 0.03 -0.29 -0.04 1.64 1.15 1t34A1 LEU 327 HD13 -0.45 -0.00 -0.02 -0.04 0.93 0.43 1t34A1 LEU 327 HD23 -0.18 -0.00 -0.11 -0.04 0.89 0.56 1t34A1 TYR 328 H -0.01 0.48 -0.31 -0.55 8.29 7.90 1t34A1 TYR 328 HA -0.11 0.07 0.45 -0.75 4.56 4.21 1t34A1 TYR 328 HB2 -0.08 0.01 0.02 -0.04 3.06 2.97 1t34A1 TYR 328 HB3 -0.08 0.05 0.09 -0.04 2.98 3.00 1t34A1 TYR 328 HD2 -0.06 0.03 -0.10 -0.04 7.15 6.98 1t34A1 TYR 328 HE2 -0.08 0.01 -0.12 -0.04 6.85 6.62 1t34A1 VAL 329 H -0.02 0.47 -0.21 -0.55 8.24 7.93 1t34A1 VAL 329 HA -0.31 -0.02 0.33 -0.75 4.13 3.38 1t34A1 VAL 329 HB -0.02 0.13 0.21 -0.04 2.12 2.40 1t34A1 VAL 329 HG13 -0.02 -0.01 -0.17 -0.04 0.97 0.73 1t34A1 VAL 329 HG23 0.01 -0.00 0.02 -0.04 0.95 0.93 1t34A1 GLN 330 H -0.10 0.51 -0.27 -0.55 8.47 8.06 1t34A1 GLN 330 HA -0.02 0.01 0.48 -0.75 4.36 4.08 1t34A1 GLN 330 HB2 0.11 -0.01 0.08 -0.04 2.15 2.29 1t34A1 GLN 330 HB3 -0.05 0.16 0.10 -0.04 2.02 2.20 1t34A1 GLN 330 HG2 0.09 0.04 -0.04 -0.04 2.40 2.45 1t34A1 GLN 330 HG3 0.03 -0.05 -0.02 -0.04 2.39 2.31 1t34A1 GLN 330 HE21 0.05 -0.04 0.01 -0.04 6.97 6.95 1t34A1 GLN 330 HE22 0.04 0.01 0.03 -0.04 7.69 7.73 1t34A1 ALA 331 H -0.16 0.41 -0.24 -0.55 8.40 7.87 1t34A1 ALA 331 HA -0.09 0.01 0.33 -0.75 4.34 3.83 1t34A1 ALA 331 HB3 -0.14 0.06 0.09 -0.04 1.41 1.38 1t34A1 VAL 332 H -0.39 0.60 -0.06 -0.55 8.24 7.84 1t34A1 VAL 332 HA -0.28 0.02 0.34 -0.75 4.13 3.46 1t34A1 VAL 332 HB -0.38 0.05 0.05 -0.04 2.12 1.80 1t34A1 VAL 332 HG13 -0.41 -0.01 -0.06 -0.04 0.97 0.45 1t34A1 VAL 332 HG23 -0.94 0.10 -0.05 -0.04 0.95 0.01 1t34A1 THR 333 H -0.17 0.53 -0.28 -0.55 8.28 7.82 1t34A1 THR 333 HA -0.07 -0.02 0.43 -0.75 4.39 3.98 1t34A1 THR 333 HB -0.05 0.24 0.29 -0.04 4.32 4.76 1t34A1 THR 333 HG23 -0.00 0.05 0.08 -0.04 1.22 1.32 1t34A1 GLU 334 H -0.07 0.63 -0.07 -0.55 8.60 8.54 1t34A1 GLU 334 HA -0.03 -0.03 0.39 -0.75 4.29 3.87 1t34A1 GLU 334 HB2 -0.06 0.12 0.19 -0.04 2.09 2.30 1t34A1 GLU 334 HB3 -0.04 -0.04 -0.04 -0.04 1.99 1.83 1t34A1 GLU 334 HG2 -0.01 -0.07 0.03 -0.04 2.34 2.25 1t34A1 GLU 334 HG3 -0.01 -0.02 0.04 -0.04 2.34 2.31 1t34A1 THR 335 H -0.09 0.62 -0.21 -0.55 8.28 8.05 1t34A1 THR 335 HA -0.05 -0.03 0.37 -0.75 4.39 3.92 1t34A1 THR 335 HB -0.13 0.20 0.15 -0.04 4.32 4.51 1t34A1 THR 335 HG23 -0.07 0.01 -0.20 -0.04 1.22 0.92 1t34A1 LEU 336 H -0.07 0.56 -0.15 -0.55 8.37 8.16 1t34A1 LEU 336 HA 0.00 0.24 0.53 -0.75 4.35 4.37 1t34A1 LEU 336 HB2 -0.01 0.13 0.20 -0.04 1.64 1.93 1t34A1 LEU 336 HB3 0.07 -0.06 0.04 -0.04 1.64 1.65 1t34A1 LEU 336 HG -0.12 0.07 -0.04 -0.04 1.64 1.51 1t34A1 LEU 336 HD13 -0.13 -0.02 -0.12 -0.04 0.93 0.62 1t34A1 LEU 336 HD23 0.15 0.02 0.00 -0.04 0.89 1.02 1t34A1 ALA 337 H -0.01 0.48 -0.17 -0.55 8.40 8.15 1t34A1 ALA 337 HA 0.01 -0.01 0.32 -0.75 4.34 3.91 1t34A1 ALA 337 HB3 -0.00 0.03 0.12 -0.04 1.41 1.51 1t34A1 GLN 338 H -0.01 0.31 -0.60 -0.55 8.47 7.62 1t34A1 GLN 338 HA -0.00 0.14 0.90 -0.75 4.36 4.64 1t34A1 GLN 338 HB2 -0.02 0.09 0.08 -0.04 2.15 2.26 1t34A1 GLN 338 HB3 -0.01 -0.08 0.19 -0.04 2.02 2.07 1t34A1 GLN 338 HG2 -0.01 -0.03 0.00 -0.04 2.40 2.33 1t34A1 GLN 338 HG3 -0.01 0.02 -0.21 -0.04 2.39 2.16 1t34A1 GLN 338 HE21 -0.01 -0.04 -0.03 -0.04 6.97 6.84 1t34A1 GLN 338 HE22 -0.01 0.05 -0.04 -0.04 7.69 7.65 1t34A1 GLY 339 H 0.01 0.56 -0.24 -0.55 8.43 8.21 1t34A1 GLY 339 HA2 0.02 0.03 0.30 -0.51 4.01 3.85 1t34A1 GLY 339 HA3 0.00 -0.03 0.34 -0.51 4.01 3.81 1t34A1 GLY 340 H -0.01 0.69 0.05 -0.55 8.43 8.62 1t34A1 GLY 340 HA2 -0.01 0.02 0.81 -0.51 4.01 4.32 1t34A1 GLY 340 HA3 -0.03 0.01 0.25 -0.51 4.01 3.73 1t34A1 THR 341 H -0.01 0.05 0.13 -0.55 8.28 7.90 1t34A1 THR 341 HA 0.04 0.20 0.55 -0.75 4.39 4.42 1t34A1 THR 341 HB 0.03 0.08 0.09 -0.04 4.32 4.49 1t34A1 THR 341 HG23 -0.01 -0.06 -0.08 -0.04 1.22 1.04 1t34A1 VAL 342 H -0.08 0.18 0.13 -0.55 8.24 7.92 1t34A1 VAL 342 HA -0.25 0.16 0.39 -0.75 4.13 3.68 1t34A1 VAL 342 HB -0.43 0.01 0.01 -0.04 2.12 1.67 1t34A1 VAL 342 HG13 -1.25 0.02 -0.03 -0.04 0.97 -0.34 1t34A1 VAL 342 HG23 -0.25 0.01 -0.08 -0.04 0.95 0.59 1t34A1 THR 343 H -0.05 0.02 -0.23 -0.55 8.28 7.47 1t34A1 THR 343 HA -0.03 0.27 0.75 -0.75 4.39 4.63 1t34A1 THR 343 HB -0.01 0.08 0.21 -0.04 4.32 4.56 1t34A1 THR 343 HG23 -0.01 0.01 -0.01 -0.04 1.22 1.17 1t34A1 ASP 344 H -0.06 0.33 -0.66 -0.55 8.40 7.47 1t34A1 ASP 344 HA -0.03 0.09 0.54 -0.75 4.63 4.47 1t34A1 ASP 344 HB2 -0.06 0.28 0.13 -0.04 2.71 3.02 1t34A1 ASP 344 HB3 -0.05 -0.16 0.12 -0.04 2.70 2.58 1t34A1 GLY 345 H -0.01 0.60 0.04 -0.55 8.43 8.51 1t34A1 GLY 345 HA2 -0.00 0.08 0.34 -0.51 4.01 3.92 1t34A1 GLY 345 HA3 -0.01 0.21 0.29 -0.51 4.01 3.99 1t34A1 GLU 346 H -0.05 0.19 -0.04 -0.55 8.60 8.15 1t34A1 GLU 346 HA -0.15 0.03 0.26 -0.75 4.29 3.67 1t34A1 GLU 346 HB2 -0.07 -0.03 0.04 -0.04 2.09 2.00 1t34A1 GLU 346 HB3 -0.10 0.02 -0.01 -0.04 1.99 1.86 1t34A1 GLU 346 HG2 -0.06 0.01 0.03 -0.04 2.34 2.28 1t34A1 GLU 346 HG3 -0.08 0.01 0.04 -0.04 2.34 2.27 1t34A1 ASN 347 H -0.08 0.10 -0.55 -0.55 8.53 7.45 1t34A1 ASN 347 HA -0.11 0.04 0.42 -0.75 4.76 4.35 1t34A1 ASN 347 HB2 -0.07 0.11 0.09 -0.04 2.88 2.96 1t34A1 ASN 347 HB3 -0.07 0.03 -0.02 -0.04 2.79 2.69 1t34A1 ASN 347 HD21 -0.04 -0.02 -0.01 -0.04 7.03 6.92 1t34A1 ASN 347 HD22 -0.05 0.05 0.01 -0.04 7.74 7.72 1t34A1 ILE 348 H -0.09 0.58 0.08 -0.55 8.25 8.27 1t34A1 ILE 348 HA -0.11 0.02 0.28 -0.75 4.18 3.62 1t34A1 ILE 348 HB -0.01 0.07 0.11 -0.04 1.89 2.01 1t34A1 ILE 348 HG12 -0.17 -0.06 -0.09 -0.04 1.49 1.12 1t34A1 ILE 348 HG13 -0.10 -0.00 0.06 -0.04 1.21 1.13 1t34A1 ILE 348 HG23 -0.03 -0.03 -0.17 -0.04 0.93 0.66 1t34A1 ILE 348 HD13 -0.07 -0.04 -0.21 -0.04 0.88 0.52 1t34A1 THR 349 H -0.15 0.66 -0.25 -0.55 8.28 7.99 1t34A1 THR 349 HA -0.17 0.02 0.38 -0.75 4.39 3.86 1t34A1 THR 349 HB -0.49 0.11 0.05 -0.04 4.32 3.95 1t34A1 THR 349 HG23 -0.84 -0.04 -0.14 -0.04 1.22 0.16 1t34A1 GLN 350 H -0.32 0.47 -0.06 -0.55 8.47 8.01 1t34A1 GLN 350 HA -0.38 -0.04 0.26 -0.75 4.36 3.45 1t34A1 GLN 350 HB2 -0.16 0.09 0.14 -0.04 2.15 2.18 1t34A1 GLN 350 HB3 -0.11 -0.04 0.07 -0.04 2.02 1.89 1t34A1 GLN 350 HG2 -0.33 0.25 0.15 -0.04 2.40 2.43 1t34A1 GLN 350 HG3 -0.17 -0.08 0.03 -0.04 2.39 2.14 1t34A1 GLN 350 HE21 0.06 -0.00 -0.00 -0.04 6.97 6.98 1t34A1 GLN 350 HE22 -0.05 0.01 0.02 -0.04 7.69 7.63 1t34A1 ARG 351 H -0.13 0.42 -0.50 -0.55 8.46 7.70 1t34A1 ARG 351 HA -0.03 0.02 0.45 -0.75 4.34 4.02 1t34A1 ARG 351 HB2 -0.08 0.13 0.09 -0.04 1.90 2.00 1t34A1 ARG 351 HB3 -0.06 -0.07 -0.04 -0.04 1.80 1.59 1t34A1 ARG 351 HG2 -0.04 -0.05 0.00 -0.04 1.67 1.55 1t34A1 ARG 351 HG3 -0.06 -0.02 -0.07 -0.04 1.67 1.48 1t34A1 ARG 351 HD2 -0.09 0.07 -0.03 -0.04 3.22 3.13 1t34A1 ARG 351 HD3 -0.06 -0.08 -0.07 -0.04 3.22 2.97 1t34A1 MET 352 H -0.06 0.48 -0.24 -0.55 8.47 8.09 1t34A1 MET 352 HA 0.01 0.05 0.63 -0.75 4.52 4.46 1t34A1 MET 352 HB2 0.11 0.14 0.13 -0.04 2.15 2.50 1t34A1 MET 352 HB3 0.11 -0.18 -0.05 -0.04 2.03 1.87 1t34A1 MET 352 HG2 -0.04 0.00 -0.09 -0.04 2.63 2.47 1t34A1 MET 352 HG3 -0.02 0.40 0.05 -0.04 2.56 2.96 1t34A1 MET 352 HE3 0.14 0.01 -0.21 -0.04 2.10 2.00 1t34A1 TRP 353 H 0.15 0.25 -0.12 -0.55 7.97 7.70 1t34A1 TRP 353 HA -0.04 -0.04 0.37 -0.75 4.62 4.14 1t34A1 TRP 353 HB2 -0.02 0.03 -0.00 -0.04 3.23 3.20 1t34A1 TRP 353 HB3 -0.02 0.01 0.00 -0.04 3.23 3.18 1t34A1 TRP 353 HD1 -0.05 -0.04 -0.32 -0.04 7.22 6.77 1t34A1 TRP 353 HE1 -0.04 -0.01 -0.14 -0.04 10.20 9.97 1t34A1 TRP 353 HE3 -0.02 0.12 -0.04 -0.04 7.59 7.61 1t34A1 TRP 353 HZ2 -0.02 0.05 -0.10 -0.04 7.44 7.34 1t34A1 TRP 353 HZ3 -0.01 -0.08 -0.02 -0.04 7.13 6.98 1t34A1 TRP 353 HH2 -0.01 -0.06 0.01 -0.04 7.19 7.09 1t34A1 ASN 354 H 0.09 0.51 -0.07 -0.55 8.53 8.51 1t34A1 ASN 354 HA 0.03 -0.02 0.21 -0.75 4.76 4.22 1t34A1 ASN 354 HB2 0.11 -0.08 -0.12 -0.04 2.88 2.74 1t34A1 ASN 354 HB3 0.08 0.14 0.04 -0.04 2.79 3.01 1t34A1 ASN 354 HD21 0.03 -0.06 0.02 -0.04 7.03 6.98 1t34A1 ASN 354 HD22 0.05 0.06 0.03 -0.04 7.74 7.84 1t34A1 ARG 355 H 0.03 0.25 -0.08 -0.55 8.46 8.11 1t34A1 ARG 355 HA 0.04 0.08 0.87 -0.75 4.34 4.57 1t34A1 ARG 355 HB2 0.05 0.28 -0.44 -0.04 1.90 1.75 1t34A1 ARG 355 HB3 0.03 -0.07 -0.12 -0.04 1.80 1.60 1t34A1 ARG 355 HG2 0.05 -0.16 0.15 -0.04 1.67 1.68 1t34A1 ARG 355 HG3 0.04 0.03 0.01 -0.04 1.67 1.72 1t34A1 ARG 355 HD2 0.02 0.35 0.08 -0.04 3.22 3.63 1t34A1 ARG 355 HD3 0.06 -0.09 -0.02 -0.04 3.22 3.12 1t34A1 SER 356 H 0.04 0.18 0.20 -0.55 8.46 8.33 1t34A1 SER 356 HA -0.16 0.21 1.08 -0.75 4.49 4.87 1t34A1 SER 356 HB2 -0.18 -0.05 0.08 -0.04 3.95 3.75 1t34A1 SER 356 HB3 0.03 -0.04 0.01 -0.04 3.93 3.89 1t34A1 PHE 357 H -0.15 0.43 0.37 -0.55 8.34 8.43 1t34A1 PHE 357 HA -0.05 0.11 0.74 -0.75 4.62 4.67 1t34A1 PHE 357 HB2 -0.08 0.14 -0.46 -0.04 3.15 2.71 1t34A1 PHE 357 HB3 -0.11 -0.06 -0.10 -0.04 3.06 2.74 1t34A1 PHE 357 HD2 -0.06 -0.01 -0.16 -0.04 7.28 7.01 1t34A1 PHE 357 HE2 -0.05 -0.04 -0.07 -0.04 7.38 7.18 1t34A1 PHE 357 HZ -0.05 0.00 -0.16 -0.04 7.32 7.08 1t34A1 GLN 358 H -0.86 0.23 0.11 -0.55 8.47 7.41 1t34A1 GLN 358 HA -0.11 0.27 1.04 -0.75 4.36 4.81 1t34A1 GLN 358 HB2 -0.28 0.01 0.17 -0.04 2.15 2.01 1t34A1 GLN 358 HB3 -0.14 0.00 0.02 -0.04 2.02 1.86 1t34A1 GLN 358 HG2 -0.05 -0.02 -0.19 -0.04 2.40 2.10 1t34A1 GLN 358 HG3 -0.06 0.01 -0.03 -0.04 2.39 2.27 1t34A1 GLN 358 HE21 0.01 -0.11 -0.05 -0.04 6.97 6.79 1t34A1 GLN 358 HE22 -0.03 0.02 -0.04 -0.04 7.69 7.60 1t34A1 GLY 359 H -0.01 0.53 0.16 -0.55 8.43 8.56 1t34A1 GLY 359 HA2 0.03 0.26 0.82 -0.51 4.01 4.61 1t34A1 GLY 359 HA3 0.12 -0.01 0.31 -0.51 4.01 3.92 1t34A1 VAL 360 H 0.09 0.21 0.10 -0.55 8.24 8.09 1t34A1 VAL 360 HA 0.07 0.06 0.27 -0.75 4.13 3.78 1t34A1 VAL 360 HB -0.01 0.05 -0.06 -0.04 2.12 2.06 1t34A1 VAL 360 HG13 0.05 0.02 0.04 -0.04 0.97 1.04 1t34A1 VAL 360 HG23 -0.47 0.01 -0.00 -0.04 0.95 0.44 1t34A1 THR 361 H -0.03 0.12 -0.26 -0.55 8.28 7.57 1t34A1 THR 361 HA -0.20 0.04 0.38 -0.75 4.39 3.85 1t34A1 THR 361 HB -0.15 0.02 0.05 -0.04 4.32 4.20 1t34A1 THR 361 HG23 -0.11 0.01 -0.06 -0.04 1.22 1.02 1t34A1 GLY 362 H 0.00 0.58 -0.73 -0.55 8.43 7.74 1t34A1 GLY 362 HA2 0.02 0.03 0.30 -0.51 4.01 3.85 1t34A1 GLY 362 HA3 0.01 0.02 0.83 -0.51 4.01 4.36 1t34A1 TYR 363 H 0.12 0.10 0.18 -0.55 8.29 8.14 1t34A1 TYR 363 HA -0.02 0.22 0.61 -0.75 4.56 4.61 1t34A1 TYR 363 HB2 -0.03 -0.01 0.11 -0.04 3.06 3.09 1t34A1 TYR 363 HB3 -0.03 -0.06 0.20 -0.04 2.98 3.05 1t34A1 TYR 363 HD2 -0.03 -0.03 -0.09 -0.04 7.15 6.96 1t34A1 TYR 363 HE2 -0.02 -0.04 -0.08 -0.04 6.85 6.67 1t34A1 LEU 364 H -0.28 0.60 0.40 -0.55 8.37 8.54 1t34A1 LEU 364 HA -0.20 0.12 0.82 -0.75 4.35 4.34 1t34A1 LEU 364 HB2 -0.12 0.05 0.01 -0.04 1.64 1.54 1t34A1 LEU 364 HB3 -0.08 -0.05 -0.19 -0.04 1.64 1.29 1t34A1 LEU 364 HG 0.02 0.01 0.04 -0.04 1.64 1.68 1t34A1 LEU 364 HD13 -0.10 0.02 -0.27 -0.04 0.93 0.53 1t34A1 LEU 364 HD23 0.06 -0.01 -0.13 -0.04 0.89 0.77 1t34A1 LYS 365 H -0.21 0.19 0.12 -0.55 8.42 7.97 1t34A1 LYS 365 HA -0.21 0.36 1.07 -0.75 4.32 4.77 1t34A1 LYS 365 HB2 -0.24 -0.01 -0.06 -0.04 1.87 1.51 1t34A1 LYS 365 HB3 -0.05 -0.15 0.08 -0.04 1.79 1.64 1t34A1 LYS 365 HG2 0.03 -0.09 -0.14 -0.04 1.46 1.22 1t34A1 LYS 365 HG3 -0.04 0.02 -0.61 -0.04 1.46 0.79 1t34A1 LYS 365 HD2 -0.04 0.23 -0.45 -0.04 1.69 1.39 1t34A1 LYS 365 HD3 0.06 -0.09 -0.20 -0.04 1.68 1.41 1t34A1 LYS 365 HE2 -0.00 0.37 -0.22 -0.04 2.99 3.10 1t34A1 LYS 365 HE3 0.03 0.05 -0.42 -0.04 2.99 2.61 1t34A1 ILE 366 H -0.09 0.60 0.19 -0.55 8.25 8.40 1t34A1 ILE 366 HA -0.13 0.00 0.36 -0.75 4.18 3.66 1t34A1 ILE 366 HB -0.02 0.14 0.18 -0.04 1.89 2.15 1t34A1 ILE 366 HG12 -0.09 -0.08 -0.10 -0.04 1.49 1.18 1t34A1 ILE 366 HG13 -0.04 0.16 -0.09 -0.04 1.21 1.19 1t34A1 ILE 366 HG23 -0.12 0.01 -0.29 -0.04 0.93 0.49 1t34A1 ILE 366 HD13 -0.12 -0.03 -0.20 -0.04 0.88 0.49 1t34A1 ASP 367 H -0.17 0.35 0.08 -0.55 8.40 8.10 1t34A1 ASP 367 HA -0.06 0.23 0.48 -0.75 4.63 4.53 1t34A1 ASP 367 HB2 -0.08 -0.12 0.25 -0.04 2.71 2.73 1t34A1 ASP 367 HB3 -0.07 0.12 0.12 -0.04 2.70 2.82 1t34A1 ARG 368 H -0.06 0.19 0.19 -0.55 8.46 8.23 1t34A1 ARG 368 HA 0.05 0.18 0.46 -0.75 4.34 4.29 1t34A1 ARG 368 HB2 -0.01 -0.04 0.18 -0.04 1.90 1.98 1t34A1 ARG 368 HB3 0.03 0.05 0.08 -0.04 1.80 1.93 1t34A1 ARG 368 HG2 0.06 0.09 0.05 -0.04 1.67 1.83 1t34A1 ARG 368 HG3 0.02 -0.03 0.06 -0.04 1.67 1.68 1t34A1 ARG 368 HD2 0.02 -0.02 0.03 -0.04 3.22 3.21 1t34A1 ARG 368 HD3 0.05 0.03 0.03 -0.04 3.22 3.28 1t34A1 ASN 369 H -0.22 -0.08 -0.19 -0.55 8.53 7.49 1t34A1 ASN 369 HA -0.34 0.19 0.43 -0.75 4.76 4.30 1t34A1 ASN 369 HB2 -0.16 -0.03 0.06 -0.04 2.88 2.71 1t34A1 ASN 369 HB3 -0.26 -0.08 0.03 -0.04 2.79 2.44 1t34A1 ASN 369 HD21 -0.17 0.28 0.12 -0.04 7.03 7.22 1t34A1 ASN 369 HD22 -0.25 -0.11 -0.12 -0.04 7.74 7.22 1t34A1 GLY 370 H -0.73 0.06 -0.34 -0.55 8.43 6.87 1t34A1 GLY 370 HA2 -1.88 0.07 0.18 -0.51 4.01 1.87 1t34A1 GLY 370 HA3 -1.94 0.31 0.78 -0.51 4.01 2.65 1t34A1 ASP 371 H -0.40 -0.09 0.04 -0.55 8.40 7.40 1t34A1 ASP 371 HA -0.24 0.35 1.14 -0.75 4.63 5.12 1t34A1 ASP 371 HB2 -0.19 -0.13 0.00 -0.04 2.71 2.35 1t34A1 ASP 371 HB3 -0.17 0.08 -0.09 -0.04 2.70 2.48 1t34A1 ARG 372 H -0.16 0.80 0.29 -0.55 8.46 8.83 1t34A1 ARG 372 HA -0.13 0.10 0.40 -0.75 4.34 3.96 1t34A1 ARG 372 HB2 -0.13 -0.02 0.02 -0.04 1.90 1.73 1t34A1 ARG 372 HB3 -0.14 0.09 -0.10 -0.04 1.80 1.60 1t34A1 ARG 372 HG2 -0.12 0.18 -0.58 -0.04 1.67 1.11 1t34A1 ARG 372 HG3 -0.12 -0.17 -0.07 -0.04 1.67 1.27 1t34A1 ARG 372 HD2 -0.12 0.24 -0.06 -0.04 3.22 3.23 1t34A1 ARG 372 HD3 -0.15 -0.14 -0.26 -0.04 3.22 2.62 1t34A1 ASP 373 H -0.08 0.61 0.38 -0.55 8.40 8.76 1t34A1 ASP 373 HA -0.01 0.01 0.45 -0.75 4.63 4.33 1t34A1 ASP 373 HB2 -0.01 -0.06 0.13 -0.04 2.71 2.72 1t34A1 ASP 373 HB3 0.03 -0.21 -0.20 -0.04 2.70 2.28 1t34A1 THR 374 H 0.08 0.15 0.20 -0.55 8.28 8.16 1t34A1 THR 374 HA -0.15 0.20 0.88 -0.75 4.39 4.57 1t34A1 THR 374 HB 0.08 -0.04 0.02 -0.04 4.32 4.34 1t34A1 THR 374 HG23 -0.51 0.03 -0.01 -0.04 1.22 0.68 1t34A1 ASP 375 H -0.20 0.19 0.24 -0.55 8.40 8.09 1t34A1 ASP 375 HA 0.15 0.31 0.89 -0.75 4.63 5.24 1t34A1 ASP 375 HB2 -0.08 0.01 0.17 -0.04 2.71 2.76 1t34A1 ASP 375 HB3 -0.00 0.02 0.04 -0.04 2.70 2.71 1t34A1 PHE 376 H 0.25 0.38 0.26 -0.55 8.34 8.67 1t34A1 PHE 376 HA -0.02 0.08 0.98 -0.75 4.62 4.91 1t34A1 PHE 376 HB2 -0.79 -0.03 -0.01 -0.04 3.15 2.28 1t34A1 PHE 376 HB3 -0.75 0.12 -0.11 -0.04 3.06 2.28 1t34A1 PHE 376 HD2 -0.11 0.18 -0.27 -0.04 7.28 7.04 1t34A1 PHE 376 HE2 -0.02 -0.05 -0.28 -0.04 7.38 6.99 1t34A1 PHE 376 HZ 0.21 -0.06 -0.14 -0.04 7.32 7.28 1t34A1 SER 377 H 0.12 0.34 -0.05 -0.55 8.46 8.33 1t34A1 SER 377 HA 0.04 0.28 0.97 -0.75 4.49 5.03 1t34A1 SER 377 HB2 0.10 0.02 0.03 -0.04 3.95 4.06 1t34A1 SER 377 HB3 -0.28 -0.01 0.02 -0.04 3.93 3.62 1t34A1 LEU 378 H 0.10 0.55 0.22 -0.55 8.37 8.70 1t34A1 LEU 378 HA 0.36 0.19 0.95 -0.75 4.35 5.09 1t34A1 LEU 378 HB2 0.53 0.01 -0.10 -0.04 1.64 2.04 1t34A1 LEU 378 HB3 0.29 -0.07 0.09 -0.04 1.64 1.91 1t34A1 LEU 378 HG 0.31 0.05 -0.35 -0.04 1.64 1.61 1t34A1 LEU 378 HD13 0.52 0.00 -0.18 -0.04 0.93 1.23 1t34A1 LEU 378 HD23 0.32 0.01 -0.13 -0.04 0.89 1.06 1t34A1 TRP 379 H 0.75 0.59 0.22 -0.55 7.97 8.99 1t34A1 TRP 379 HA 0.16 0.09 0.56 -0.75 4.62 4.68 1t34A1 TRP 379 HB2 0.19 -0.05 0.09 -0.04 3.23 3.42 1t34A1 TRP 379 HB3 0.32 -0.02 -0.07 -0.04 3.23 3.41 1t34A1 TRP 379 HD1 0.09 0.26 0.05 -0.04 7.22 7.58 1t34A1 TRP 379 HE1 0.05 0.04 -0.04 -0.04 10.20 10.21 1t34A1 TRP 379 HE3 0.15 0.05 -0.37 -0.04 7.59 7.37 1t34A1 TRP 379 HZ2 0.06 -0.00 -0.01 -0.04 7.44 7.44 1t34A1 TRP 379 HZ3 0.06 0.11 0.04 -0.04 7.13 7.30 1t34A1 TRP 379 HH2 0.05 0.01 0.00 -0.04 7.19 7.21 1t34A1 ASP 380 H 0.37 0.45 0.30 -0.55 8.40 8.97 1t34A1 ASP 380 HA 0.27 0.17 0.67 -0.75 4.63 4.99 1t34A1 ASP 380 HB2 0.11 0.01 -0.21 -0.04 2.71 2.58 1t34A1 ASP 380 HB3 -0.01 0.02 -0.02 -0.04 2.70 2.64 1t34A1 MET 381 H -0.69 0.31 0.17 -0.55 8.47 7.71 1t34A1 MET 381 HA -0.48 0.15 0.51 -0.75 4.52 3.94 1t34A1 MET 381 HB2 -0.30 -0.01 -0.23 -0.04 2.15 1.57 1t34A1 MET 381 HB3 -1.36 -0.03 -0.05 -0.04 2.03 0.55 1t34A1 MET 381 HG2 -0.35 0.24 0.13 -0.04 2.63 2.61 1t34A1 MET 381 HG3 -0.35 -0.08 -0.06 -0.04 2.56 2.04 1t34A1 MET 381 HE3 0.20 -0.00 -0.04 -0.04 2.10 2.21 1t34A1 ASP 382 H -0.12 0.29 -0.04 -0.55 8.40 7.97 1t34A1 ASP 382 HA -0.06 0.24 0.58 -0.75 4.63 4.63 1t34A1 ASP 382 HB2 -0.02 0.22 0.19 -0.04 2.71 3.06 1t34A1 ASP 382 HB3 -0.01 -0.56 0.23 -0.04 2.70 2.32 1t34A1 PRO 383 HA -0.26 0.12 0.41 -0.51 4.44 4.19 1t34A1 PRO 383 HB2 -0.01 0.02 -0.02 -0.04 2.28 2.23 1t34A1 PRO 383 HB3 -0.09 0.07 0.12 -0.04 2.02 2.08 1t34A1 PRO 383 HG2 0.03 -0.03 0.12 -0.04 2.03 2.10 1t34A1 PRO 383 HG3 0.08 0.11 0.11 -0.04 2.03 2.29 1t34A1 PRO 383 HD2 -0.02 0.03 0.34 -0.04 3.68 3.99 1t34A1 PRO 383 HD3 -0.10 0.33 0.28 -0.04 3.65 4.12 1t34A1 GLU 384 H -0.02 -0.06 -0.47 -0.55 8.60 7.50 1t34A1 GLU 384 HA -0.01 0.25 0.75 -0.75 4.29 4.52 1t34A1 GLU 384 HB2 0.01 -0.05 0.02 -0.04 2.09 2.04 1t34A1 GLU 384 HB3 0.01 0.02 -0.01 -0.04 1.99 1.96 1t34A1 GLU 384 HG2 0.01 -0.02 -0.20 -0.04 2.34 2.08 1t34A1 GLU 384 HG3 0.02 0.01 -0.03 -0.04 2.34 2.30 1t34A1 THR 385 H -0.01 -0.07 0.05 -0.55 8.28 7.70 1t34A1 THR 385 HA 0.02 0.27 0.98 -0.75 4.39 4.90 1t34A1 THR 385 HB 0.03 -0.01 0.10 -0.04 4.32 4.41 1t34A1 THR 385 HG23 0.02 0.01 -0.06 -0.04 1.22 1.15 1t34A1 GLY 386 H -0.03 0.54 0.17 -0.55 8.43 8.57 1t34A1 GLY 386 HA2 -0.07 0.13 0.19 -0.51 4.01 3.76 1t34A1 GLY 386 HA3 0.04 0.06 0.21 -0.51 4.01 3.81 1t34A1 ALA 387 H 0.04 0.03 -0.53 -0.55 8.40 7.39 1t34A1 ALA 387 HA 0.15 0.11 0.66 -0.75 4.34 4.50 1t34A1 ALA 387 HB3 0.07 -0.00 -0.16 -0.04 1.41 1.28 1t34A1 PHE 388 H 0.37 0.30 0.29 -0.55 8.34 8.76 1t34A1 PHE 388 HA 0.17 0.25 0.35 -0.75 4.62 4.63 1t34A1 PHE 388 HB2 0.10 0.02 0.13 -0.04 3.15 3.37 1t34A1 PHE 388 HB3 0.31 -0.10 -0.13 -0.04 3.06 3.10 1t34A1 PHE 388 HD2 0.25 -0.08 -0.15 -0.04 7.28 7.26 1t34A1 PHE 388 HE2 0.38 0.05 0.02 -0.04 7.38 7.79 1t34A1 PHE 388 HZ 0.29 0.45 0.03 -0.04 7.32 8.05 1t34A1 ARG 389 H 0.27 0.75 0.42 -0.55 8.46 9.35 1t34A1 ARG 389 HA 0.37 -0.01 0.68 -0.75 4.34 4.62 1t34A1 ARG 389 HB2 -0.03 -0.03 0.07 -0.04 1.90 1.87 1t34A1 ARG 389 HB3 0.08 0.04 -0.26 -0.04 1.80 1.62 1t34A1 ARG 389 HG2 -0.27 0.02 -0.22 -0.04 1.67 1.17 1t34A1 ARG 389 HG3 -0.30 0.02 -0.09 -0.04 1.67 1.25 1t34A1 ARG 389 HD2 -0.04 -0.04 -0.03 -0.04 3.22 3.07 1t34A1 ARG 389 HD3 -0.08 0.14 0.10 -0.04 3.22 3.34 1t34A1 VAL 390 H -0.82 0.09 0.12 -0.55 8.24 7.08 1t34A1 VAL 390 HA -0.61 0.02 0.34 -0.75 4.13 3.12 1t34A1 VAL 390 HB -0.44 0.02 0.08 -0.04 2.12 1.75 1t34A1 VAL 390 HG13 -0.29 -0.01 -0.13 -0.04 0.97 0.50 1t34A1 VAL 390 HG23 -1.59 -0.01 0.04 -0.04 0.95 -0.65 1t34A1 VAL 391 H -0.09 0.46 0.40 -0.55 8.24 8.46 1t34A1 VAL 391 HA -0.07 0.24 0.95 -0.75 4.13 4.50 1t34A1 VAL 391 HB 0.03 -0.05 -0.06 -0.04 2.12 1.99 1t34A1 VAL 391 HG13 -0.21 0.08 -0.12 -0.04 0.97 0.67 1t34A1 VAL 391 HG23 0.06 0.01 -0.13 -0.04 0.95 0.85 1t34A1 LEU 392 H -0.01 0.11 0.24 -0.55 8.37 8.17 1t34A1 LEU 392 HA 0.08 0.17 0.65 -0.75 4.35 4.50 1t34A1 LEU 392 HB2 0.15 0.01 -0.17 -0.04 1.64 1.59 1t34A1 LEU 392 HB3 0.22 -0.04 -0.11 -0.04 1.64 1.67 1t34A1 LEU 392 HG 0.12 0.06 -0.09 -0.04 1.64 1.69 1t34A1 LEU 392 HD13 0.18 0.01 -0.12 -0.04 0.93 0.96 1t34A1 LEU 392 HD23 0.12 0.02 -0.18 -0.04 0.89 0.81 1t34A1 ASN 393 H 0.11 0.52 0.19 -0.55 8.53 8.81 1t34A1 ASN 393 HA 0.13 0.19 0.91 -0.75 4.76 5.24 1t34A1 ASN 393 HB2 0.04 0.13 -0.02 -0.04 2.88 2.99 1t34A1 ASN 393 HB3 0.05 -0.04 -0.07 -0.04 2.79 2.70 1t34A1 ASN 393 HD21 -0.07 -0.11 -0.02 -0.04 7.03 6.79 1t34A1 ASN 393 HD22 -0.01 0.45 -0.04 -0.04 7.74 8.10 1t34A1 TYR 394 H 0.25 0.34 0.21 -0.55 8.29 8.54 1t34A1 TYR 394 HA 0.16 0.40 0.98 -0.75 4.56 5.34 1t34A1 TYR 394 HB2 0.50 0.04 -0.15 -0.04 3.06 3.41 1t34A1 TYR 394 HB3 0.29 -0.06 0.16 -0.04 2.98 3.33 1t34A1 TYR 394 HD2 0.25 -0.07 -0.20 -0.04 7.15 7.08 1t34A1 TYR 394 HE2 0.16 0.07 -0.13 -0.04 6.85 6.91 1t34A1 ASN 395 H -0.21 0.52 0.19 -0.55 8.53 8.48 1t34A1 ASN 395 HA -0.09 0.08 0.68 -0.75 4.76 4.67 1t34A1 ASN 395 HB2 -0.11 0.16 0.12 -0.04 2.88 3.01 1t34A1 ASN 395 HB3 -0.19 -0.20 0.07 -0.04 2.79 2.43 1t34A1 ASN 395 HD21 -0.15 0.06 0.02 -0.04 7.03 6.91 1t34A1 ASN 395 HD22 -0.10 0.09 0.01 -0.04 7.74 7.70 1t34A1 GLY 396 H -0.03 0.14 0.05 -0.55 8.43 8.04 1t34A1 GLY 396 HA2 0.10 0.22 0.41 -0.51 4.01 4.23 1t34A1 GLY 396 HA3 0.06 -0.01 0.05 -0.51 4.01 3.60 1t34A1 THR 397 H 0.01 0.01 -0.06 -0.55 8.28 7.69 1t34A1 THR 397 HA 0.03 0.19 0.50 -0.75 4.39 4.35 1t34A1 THR 397 HB 0.08 -0.06 0.06 -0.04 4.32 4.36 1t34A1 THR 397 HG23 0.09 0.03 -0.08 -0.04 1.22 1.22 1t34A1 SER 398 H -0.08 -0.07 -0.13 -0.55 8.46 7.63 1t34A1 SER 398 HA -0.04 0.18 0.31 -0.75 4.49 4.18 1t34A1 SER 398 HB2 -0.06 0.08 0.05 -0.04 3.95 3.98 1t34A1 SER 398 HB3 -0.09 -0.06 0.06 -0.04 3.93 3.79 1t34A1 GLN 399 H -0.23 0.04 -0.71 -0.55 8.47 7.03 1t34A1 GLN 399 HA -0.58 0.20 0.22 -0.75 4.36 3.45 1t34A1 GLN 399 HB2 0.02 0.11 -0.02 -0.04 2.15 2.21 1t34A1 GLN 399 HB3 0.15 -0.05 0.11 -0.04 2.02 2.19 1t34A1 GLN 399 HG2 0.03 0.18 -0.17 -0.04 2.40 2.39 1t34A1 GLN 399 HG3 0.01 0.10 -0.35 -0.04 2.39 2.11 1t34A1 GLN 399 HE21 0.06 -0.06 0.01 -0.04 6.97 6.93 1t34A1 GLN 399 HE22 0.07 0.06 0.03 -0.04 7.69 7.81 1t34A1 GLU 400 H -0.22 -0.11 -0.26 -0.55 8.60 7.46 1t34A1 GLU 400 HA 0.03 0.28 1.02 -0.75 4.29 4.86 1t34A1 GLU 400 HB2 -0.05 -0.15 -0.05 -0.04 2.09 1.80 1t34A1 GLU 400 HB3 -0.00 0.04 -0.09 -0.04 1.99 1.90 1t34A1 GLU 400 HG2 0.00 0.03 -0.02 -0.04 2.34 2.32 1t34A1 GLU 400 HG3 -0.03 0.31 -0.25 -0.04 2.34 2.34 1t34A1 LEU 401 H 0.09 0.23 0.17 -0.55 8.37 8.30 1t34A1 LEU 401 HA 0.19 0.32 0.97 -0.75 4.35 5.08 1t34A1 LEU 401 HB2 0.11 0.01 0.18 -0.04 1.64 1.91 1t34A1 LEU 401 HB3 0.13 -0.00 -0.04 -0.04 1.64 1.69 1t34A1 LEU 401 HG 0.35 -0.05 -0.20 -0.04 1.64 1.70 1t34A1 LEU 401 HD13 0.05 0.01 -0.22 -0.04 0.93 0.73 1t34A1 LEU 401 HD23 0.33 0.03 -0.21 -0.04 0.89 0.99 1t34A1 MET 402 H 0.09 0.62 0.35 -0.55 8.47 8.99 1t34A1 MET 402 HA 0.05 0.15 1.02 -0.75 4.52 4.99 1t34A1 MET 402 HB2 0.02 -0.05 0.01 -0.04 2.15 2.09 1t34A1 MET 402 HB3 0.02 0.07 -0.00 -0.04 2.03 2.08 1t34A1 MET 402 HG2 0.01 -0.01 -0.25 -0.04 2.63 2.34 1t34A1 MET 402 HG3 0.00 -0.04 -0.05 -0.04 2.56 2.44 1t34A1 MET 402 HE3 0.00 -0.01 0.01 -0.04 2.10 2.06 1t34A1 ALA 403 H 0.05 0.12 0.16 -0.55 8.40 8.18 1t34A1 ALA 403 HA 0.07 0.17 0.46 -0.75 4.34 4.28 1t34A1 ALA 403 HB3 0.05 0.03 0.14 -0.04 1.41 1.60 1t34A1 VAL 404 H 0.08 0.43 0.08 -0.55 8.24 8.28 1t34A1 VAL 404 HA 0.03 0.13 0.88 -0.75 4.13 4.42 1t34A1 VAL 404 HB 0.02 0.05 -0.20 -0.04 2.12 1.94 1t34A1 VAL 404 HG13 0.01 -0.01 -0.18 -0.04 0.97 0.74 1t34A1 VAL 404 HG23 0.00 0.01 -0.35 -0.04 0.95 0.57 1t34A1 SER 405 H 0.03 0.15 0.09 -0.55 8.46 8.18 1t34A1 SER 405 HA -0.01 0.02 0.31 -0.75 4.49 4.05 1t34A1 SER 405 HB2 0.16 0.14 0.18 -0.04 3.95 4.39 1t34A1 SER 405 HB3 0.01 -0.00 0.13 -0.04 3.93 4.03 1t34A1 GLU 406 H -0.02 0.02 -0.22 -0.55 8.60 7.84 1t34A1 GLU 406 HA -0.03 0.01 0.19 -0.75 4.29 3.70 1t34A1 GLU 406 HB2 -0.14 0.12 0.06 -0.04 2.09 2.09 1t34A1 GLU 406 HB3 -0.06 0.00 0.11 -0.04 1.99 2.00 1t34A1 GLU 406 HG2 -0.06 -0.17 -0.40 -0.04 2.34 1.67 1t34A1 GLU 406 HG3 -0.06 0.03 -0.11 -0.04 2.34 2.16 1t34A1 HIS 407 H 0.06 0.13 -0.36 -0.55 8.41 7.70 1t34A1 HIS 407 HA 0.01 0.13 0.80 -0.75 4.63 4.82 1t34A1 HIS 407 HB2 0.00 0.02 0.15 -0.04 3.26 3.40 1t34A1 HIS 407 HB3 0.01 0.01 0.01 -0.04 3.20 3.18 1t34A1 HIS 407 HD2 0.00 -0.05 0.01 -0.04 6.97 6.90 1t34A1 HIS 407 HE1 -0.01 -0.12 0.01 -0.04 7.75 7.59 1t34A1 LYS 408 H 0.12 0.21 0.18 -0.55 8.42 8.37 1t34A1 LYS 408 HA 0.07 0.14 0.86 -0.75 4.32 4.64 1t34A1 LYS 408 HB2 0.06 -0.04 -0.06 -0.04 1.87 1.79 1t34A1 LYS 408 HB3 0.06 0.08 -0.06 -0.04 1.79 1.84 1t34A1 LYS 408 HG2 0.07 0.07 0.01 -0.04 1.46 1.57 1t34A1 LYS 408 HG3 0.07 -0.05 0.13 -0.04 1.46 1.57 1t34A1 LYS 408 HD2 0.05 -0.02 0.00 -0.04 1.69 1.68 1t34A1 LYS 408 HD3 0.04 -0.00 -0.14 -0.04 1.68 1.54 1t34A1 LYS 408 HE2 0.05 0.05 -0.02 -0.04 2.99 3.03 1t34A1 LYS 408 HE3 0.03 -0.02 -0.02 -0.04 2.99 2.94 1t34A1 LEU 409 H 0.04 0.12 0.08 -0.55 8.37 8.06 1t34A1 LEU 409 HA -0.07 -0.03 0.32 -0.75 4.35 3.82 1t34A1 LEU 409 HB2 0.04 -0.03 0.10 -0.04 1.64 1.70 1t34A1 LEU 409 HB3 -0.39 0.14 -0.15 -0.04 1.64 1.19 1t34A1 LEU 409 HG -0.09 0.04 -0.04 -0.04 1.64 1.50 1t34A1 LEU 409 HD13 0.08 -0.02 -0.13 -0.04 0.93 0.82 1t34A1 LEU 409 HD23 0.19 0.00 -0.07 -0.04 0.89 0.98 1t34A1 TYR 410 H -0.12 0.05 0.18 -0.55 8.29 7.85 1t34A1 TYR 410 HA -0.14 0.03 0.44 -0.75 4.56 4.13 1t34A1 TYR 410 HB2 -0.12 0.01 0.16 -0.04 3.06 3.07 1t34A1 TYR 410 HB3 -0.24 0.01 0.18 -0.04 2.98 2.89 1t34A1 TYR 410 HD2 -0.08 0.06 -0.04 -0.04 7.15 7.05 1t34A1 TYR 410 HE2 0.04 -0.03 -0.09 -0.04 6.85 6.73 1t34A1 TRP 411 H -0.48 0.18 0.09 -0.55 7.97 7.22 1t34A1 TRP 411 HA -0.44 0.23 0.57 -0.75 4.62 4.23 1t34A1 TRP 411 HB2 -0.15 0.13 -0.33 -0.04 3.23 2.83 1t34A1 TRP 411 HB3 -0.14 0.01 -0.50 -0.04 3.23 2.56 1t34A1 TRP 411 HD1 -0.02 0.08 -0.20 -0.04 7.22 7.04 1t34A1 TRP 411 HE1 -0.02 -0.06 -0.10 -0.04 10.20 9.98 1t34A1 TRP 411 HE3 -0.07 -0.06 0.08 -0.04 7.59 7.49 1t34A1 TRP 411 HZ2 0.18 -0.06 -0.06 -0.04 7.44 7.47 1t34A1 TRP 411 HZ3 0.07 0.04 0.03 -0.04 7.13 7.23 1t34A1 TRP 411 HH2 0.28 -0.06 -0.03 -0.04 7.19 7.33 1t34A1 PRO 412 HA 0.01 0.05 0.35 -0.51 4.44 4.33 1t34A1 PRO 412 HB2 0.06 0.07 -0.05 -0.04 2.28 2.32 1t34A1 PRO 412 HB3 0.13 -0.02 0.03 -0.04 2.02 2.12 1t34A1 PRO 412 HG2 0.21 -0.13 -0.13 -0.04 2.03 1.93 1t34A1 PRO 412 HG3 0.31 0.02 0.03 -0.04 2.03 2.34 1t34A1 PRO 412 HD2 0.39 0.32 0.09 -0.04 3.68 4.43 1t34A1 PRO 412 HD3 -0.23 0.21 0.00 -0.04 3.65 3.59 1t34A1 LEU 413 H -0.01 0.27 -0.18 -0.55 8.37 7.90 1t34A1 LEU 413 HA -0.13 0.07 0.52 -0.75 4.35 4.06 1t34A1 LEU 413 HB2 -0.13 0.12 0.10 -0.04 1.64 1.69 1t34A1 LEU 413 HB3 -0.53 -0.02 0.03 -0.04 1.64 1.07 1t34A1 LEU 413 HG -0.12 -0.06 0.05 -0.04 1.64 1.47 1t34A1 LEU 413 HD13 -0.05 0.02 0.05 -0.04 0.93 0.91 1t34A1 LEU 413 HD23 -0.34 -0.01 0.08 -0.04 0.89 0.59 1t34A1 GLY 414 H -0.02 0.38 -0.78 -0.55 8.43 7.46 1t34A1 GLY 414 HA2 0.03 0.03 0.35 -0.51 4.01 3.90 1t34A1 GLY 414 HA3 -0.08 0.08 0.70 -0.51 4.01 4.20 1t34A1 TYR 415 H -0.37 0.12 -0.65 -0.55 8.29 6.84 1t34A1 TYR 415 HA -0.19 0.23 0.85 -0.75 4.56 4.68 1t34A1 TYR 415 HB2 -0.27 0.13 0.08 -0.04 3.06 2.96 1t34A1 TYR 415 HB3 -0.12 -0.06 -0.05 -0.04 2.98 2.72 1t34A1 TYR 415 HD2 -0.17 0.04 -0.26 -0.04 7.15 6.72 1t34A1 TYR 415 HE2 -0.09 -0.04 -0.02 -0.04 6.85 6.66 1t34A1 PRO 416 HA -2.83 0.09 0.52 -0.51 4.44 1.71 1t34A1 PRO 416 HB2 -0.74 0.17 -0.04 -0.04 2.28 1.62 1t34A1 PRO 416 HB3 -0.96 -0.05 0.07 -0.04 2.02 1.04 1t34A1 PRO 416 HG2 -0.56 0.07 0.10 -0.04 2.03 1.59 1t34A1 PRO 416 HG3 -0.45 0.01 0.08 -0.04 2.03 1.63 1t34A1 PRO 416 HD2 -0.27 0.04 0.22 -0.04 3.68 3.62 1t34A1 PRO 416 HD3 -0.51 0.12 0.10 -0.04 3.65 3.32 1t34A1 PRO 417 HA -0.06 0.04 0.60 -0.51 4.44 4.51 1t34A1 PRO 417 HB2 -0.10 0.11 0.02 -0.04 2.28 2.27 1t34A1 PRO 417 HB3 -0.08 0.20 0.22 -0.04 2.02 2.33 1t34A1 PRO 417 HG2 -0.03 -0.06 -0.15 -0.04 2.03 1.75 1t34A1 PRO 417 HG3 -0.01 0.18 -0.21 -0.04 2.03 1.95 1t34A1 PRO 417 HD2 -0.93 -0.02 0.17 -0.04 3.68 2.86 1t34A1 PRO 417 HD3 -0.55 0.15 0.20 -0.04 3.65 3.41 1t34A1 PRO 418 HA 0.41 0.15 0.41 -0.51 4.44 4.90 1t34A1 PRO 418 HB2 0.02 -0.14 0.09 -0.04 2.28 2.21 1t34A1 PRO 418 HB3 -0.01 0.04 0.15 -0.04 2.02 2.15 1t34A1 PRO 418 HG2 -0.08 0.53 0.18 -0.04 2.03 2.61 1t34A1 PRO 418 HG3 -0.07 -0.03 0.08 -0.04 2.03 1.97 1t34A1 PRO 418 HD2 -0.07 0.09 0.25 -0.04 3.68 3.91 1t34A1 PRO 418 HD3 -0.06 0.11 0.26 -0.04 3.65 3.92 1t34A1 ASP 419 H 0.43 0.16 0.22 -0.55 8.40 8.67 1t34A1 ASP 419 HA -0.32 0.06 0.55 -0.75 4.63 4.17 1t34A1 ASP 419 HB2 -0.06 0.16 0.42 -0.04 2.71 3.19 1t34A1 ASP 419 HB3 -0.67 0.07 0.24 -0.04 2.70 2.31 1t34A1 VAL 420 H -0.04 0.15 -1.17 -0.55 8.24 6.63 1t34A1 VAL 420 HA -0.13 0.12 0.67 -0.75 4.13 4.03 1t34A1 VAL 420 HB -0.09 -0.06 -0.05 -0.04 2.12 1.88 1t34A1 VAL 420 HG13 -0.16 0.03 -0.16 -0.04 0.97 0.63 1t34A1 VAL 420 HG23 -0.20 -0.04 -0.16 -0.04 0.95 0.51 1t34A1 PRO 421 HA -0.26 0.17 0.52 -0.51 4.44 4.36 1t34A1 PRO 421 HB2 -0.29 -0.12 -0.07 -0.04 2.28 1.76 1t34A1 PRO 421 HB3 -0.42 0.12 0.01 -0.04 2.02 1.69 1t34A1 PRO 421 HG2 -0.45 -0.12 -0.31 -0.04 2.03 1.11 1t34A1 PRO 421 HG3 -1.24 0.09 -0.24 -0.04 2.03 0.60 1t34A1 PRO 421 HD2 -0.46 0.04 0.08 -0.04 3.68 3.30 1t34A1 PRO 421 HD3 -0.91 0.20 -0.03 -0.04 3.65 2.87 1t34A1 LYS 422 H -0.16 0.13 0.13 -0.55 8.42 7.96 1t34A1 LYS 422 HA -0.09 0.12 0.29 -0.75 4.32 3.88 1t34A1 LYS 422 HB2 -0.09 0.02 0.17 -0.04 1.87 1.93 1t34A1 LYS 422 HB3 -0.07 -0.06 0.06 -0.04 1.79 1.68 1t34A1 LYS 422 HG2 -0.05 0.05 0.10 -0.04 1.46 1.52 1t34A1 LYS 422 HG3 -0.05 0.00 0.05 -0.04 1.46 1.43 1t34A1 LYS 422 HD2 -0.04 -0.04 -0.03 -0.04 1.69 1.55 1t34A1 LYS 422 HD3 -0.04 0.01 -0.17 -0.04 1.68 1.44 1t34A1 LYS 422 HE2 -0.03 -0.00 0.01 -0.04 2.99 2.93 1t34A1 LYS 422 HE3 -0.02 0.03 0.02 -0.04 2.99 2.98 1t34A1 CYS 423 H -0.11 -0.02 -0.23 -0.55 8.50 7.59 1t34A1 CYS 423 HA -0.06 0.25 1.01 -0.75 4.58 5.02 1t34A1 CYS 423 HB2 -0.05 -0.00 -0.07 -0.04 2.97 2.82 1t34A1 CYS 423 HB3 -0.05 -0.06 0.11 -0.04 2.97 2.92 1t34A1 GLY 424 H -0.09 0.24 0.15 -0.55 8.43 8.17 1t34A1 GLY 424 HA2 -0.08 0.19 0.43 -0.51 4.01 4.04 1t34A1 GLY 424 HA3 -0.02 -0.02 0.33 -0.51 4.01 3.79 1t34A1 PHE 425 H 0.14 0.16 0.13 -0.55 8.34 8.22 1t34A1 PHE 425 HA -0.01 0.22 0.62 -0.75 4.62 4.70 1t34A1 PHE 425 HB2 -0.01 -0.06 0.13 -0.04 3.15 3.16 1t34A1 PHE 425 HB3 -0.00 0.04 0.06 -0.04 3.06 3.12 1t34A1 PHE 425 HD2 -0.00 -0.02 0.06 -0.04 7.28 7.28 1t34A1 PHE 425 HE2 0.01 0.01 -0.19 -0.04 7.38 7.17 1t34A1 PHE 425 HZ -0.00 -0.02 -0.27 -0.04 7.32 6.99 1t34A1 ASP 426 H 0.08 -0.01 -0.27 -0.55 8.40 7.65 1t34A1 ASP 426 HA 0.07 0.28 0.59 -0.75 4.63 4.82 1t34A1 ASP 426 HB2 0.03 0.02 0.03 -0.04 2.71 2.75 1t34A1 ASP 426 HB3 0.05 0.03 -0.05 -0.04 2.70 2.70