============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 51 rings ring int. center anis. iso. TYR 33 0.840 13.312 5.650 -19.301 -99.200 -91.000 HIS 38 0.900 12.448 11.446 -15.546 -99.200 -91.000 TYR 39 0.840 8.639 14.180 -8.989 -99.200 -91.000 PHE 40 1.000 5.995 12.743 -16.689 -99.200 -91.000 PHE 42 1.000 -1.012 14.759 -16.437 -99.200 -91.000 PHE 59 1.000 -2.906 13.730 -5.351 -99.200 -91.000 PHE 68 1.000 4.441 4.173 3.029 -99.200 -91.000 TYR 91 0.840 2.952 -10.614 18.774 -99.200 -91.000 TRP 92 1.040 -6.126 -7.573 21.877 -99.200 -91.000 TRP6 92 1.020 -7.591 -6.734 20.209 -99.200 -91.000 TRP 100 1.040 -9.841 -14.646 17.365 -99.200 -91.000 TRP6 100 1.020 -8.826 -13.354 15.665 -99.200 -91.000 TYR 111 0.840 -4.505 -8.630 2.746 -99.200 -91.000 PHE 133 1.000 -14.757 -6.924 13.528 -99.200 -91.000 TYR 134 0.840 -10.270 -7.793 15.001 -99.200 -91.000 TRP 137 1.040 -14.149 -13.347 11.546 -99.200 -91.000 TRP6 137 1.020 -12.175 -14.618 11.913 -99.200 -91.000 TRP 141 1.040 -13.674 -19.961 3.189 -99.200 -91.000 TRP6 141 1.020 -13.808 -17.596 3.082 -99.200 -91.000 TYR 149 0.840 -7.196 -5.561 0.037 -99.200 -91.000 PHE 157 1.000 1.810 -7.773 10.406 -99.200 -91.000 TYR 169 0.840 0.826 1.651 11.989 -99.200 -91.000 PHE 178 1.000 5.357 7.447 7.251 -99.200 -91.000 HIS 185 0.900 7.626 17.738 2.993 -99.200 -91.000 TRP 187 1.040 2.338 14.818 6.423 -99.200 -91.000 TRP6 187 1.020 3.967 15.903 7.720 -99.200 -91.000 HIS 197 0.900 2.079 22.368 0.549 -99.200 -91.000 TYR 198 0.840 -5.575 15.908 3.330 -99.200 -91.000 TRP 200 1.040 -10.550 20.138 -0.102 -99.200 -91.000 TRP6 200 1.020 -11.519 19.516 1.962 -99.200 -91.000 TYR 202 0.840 -13.141 17.500 -5.695 -99.200 -91.000 HIS 209 0.900 -9.393 16.329 3.190 -99.200 -91.000 TYR 220 0.840 -9.082 3.063 6.406 -99.200 -91.000 TRP 232 1.040 6.547 3.118 -0.204 -99.200 -91.000 TRP6 232 1.020 7.583 2.277 1.764 -99.200 -91.000 TYR 258 0.840 5.824 -13.439 3.579 -99.200 -91.000 TRP 259 1.040 -0.189 -16.613 2.191 -99.200 -91.000 TRP6 259 1.020 -1.082 -18.625 3.053 -99.200 -91.000 TYR 265 0.840 4.210 -16.033 -6.902 -99.200 -91.000 TRP 270 1.040 5.519 -3.517 -1.507 -99.200 -91.000 TRP6 270 1.020 4.789 -1.720 -2.883 -99.200 -91.000 TRP 275 1.040 8.439 -7.694 -16.645 -99.200 -91.000 TRP6 275 1.020 6.431 -6.671 -17.394 -99.200 -91.000 TRP 311 1.040 2.533 -5.043 -12.420 -99.200 -91.000 TRP6 311 1.020 2.763 -3.511 -14.244 -99.200 -91.000 HIS 313 0.900 -0.395 -5.041 -9.028 -99.200 -91.000 PHE 321 1.000 -7.714 12.130 -1.852 -99.200 -91.000 TYR 324 0.840 -1.602 0.199 -10.201 -99.200 -91.000 PHE 327 1.000 8.258 -1.769 -6.655 -99.200 -91.000 TYR 343 0.840 -8.862 6.197 -11.721 -99.200 -91.000 TYR 353 0.840 0.729 -4.405 -19.518 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 2zc7A1 PRO 2 HA -0.04 -0.11 0.14 -0.51 4.44 3.91 2zc7A1 PRO 2 HB2 -0.25 0.01 -0.06 -0.04 2.28 1.94 2zc7A1 PRO 2 HB3 -0.11 -0.17 -0.15 -0.04 2.02 1.54 2zc7A1 PRO 2 HG2 -0.09 0.05 -0.05 -0.04 2.03 1.90 2zc7A1 PRO 2 HG3 -0.05 -0.04 0.02 -0.04 2.03 1.92 2zc7A1 PRO 2 HD2 -0.05 -0.04 0.06 -0.04 3.68 3.60 2zc7A1 PRO 2 HD3 0.00 0.13 0.16 -0.04 3.65 3.90 2zc7A1 MET 3 H 0.04 0.11 0.07 -0.55 8.47 8.14 2zc7A1 MET 3 HA 0.17 0.10 0.15 -0.75 4.52 4.18 2zc7A1 MET 3 HB2 0.06 -0.04 0.16 -0.04 2.15 2.29 2zc7A1 MET 3 HB3 0.06 -0.02 0.04 -0.04 2.03 2.07 2zc7A1 MET 3 HG2 0.11 0.02 0.04 -0.04 2.63 2.76 2zc7A1 MET 3 HG3 0.21 0.04 0.05 -0.04 2.56 2.82 2zc7A1 MET 3 HE3 0.07 0.00 0.05 -0.04 2.10 2.18 2zc7A1 SER 4 H -0.02 -0.03 -0.21 -0.55 8.46 7.64 2zc7A1 SER 4 HA -0.01 0.10 0.37 -0.75 4.49 4.20 2zc7A1 SER 4 HB2 -0.00 0.09 0.11 -0.04 3.95 4.11 2zc7A1 SER 4 HB3 -0.02 -0.02 0.10 -0.04 3.93 3.94 2zc7A1 GLU 5 H -0.01 0.15 0.23 -0.55 8.60 8.42 2zc7A1 GLU 5 HA -0.13 0.22 0.61 -0.75 4.29 4.24 2zc7A1 GLU 5 HB2 0.01 0.10 0.17 -0.04 2.09 2.34 2zc7A1 GLU 5 HB3 0.02 -0.06 0.16 -0.04 1.99 2.07 2zc7A1 GLU 5 HG2 0.01 0.03 0.10 -0.04 2.34 2.43 2zc7A1 GLU 5 HG3 0.06 0.05 0.06 -0.04 2.34 2.47 2zc7A1 LYS 6 H 0.00 0.07 -0.03 -0.55 8.42 7.91 2zc7A1 LYS 6 HA 0.04 0.12 0.47 -0.75 4.32 4.20 2zc7A1 LYS 6 HB2 0.00 -0.05 0.09 -0.04 1.87 1.87 2zc7A1 LYS 6 HB3 0.01 0.06 -0.01 -0.04 1.79 1.81 2zc7A1 LYS 6 HG2 0.01 0.01 0.05 -0.04 1.46 1.49 2zc7A1 LYS 6 HG3 0.02 0.05 0.03 -0.04 1.46 1.52 2zc7A1 LYS 6 HD2 0.04 0.05 0.01 -0.04 1.69 1.75 2zc7A1 LYS 6 HD3 0.04 -0.13 -0.10 -0.04 1.68 1.45 2zc7A1 LYS 6 HE2 0.02 0.01 0.02 -0.04 2.99 3.00 2zc7A1 LYS 6 HE3 0.02 0.04 0.01 -0.04 2.99 3.03 2zc7A1 GLN 7 H -0.03 0.01 -0.32 -0.55 8.47 7.58 2zc7A1 GLN 7 HA -0.04 0.04 0.41 -0.75 4.36 4.02 2zc7A1 GLN 7 HB2 -0.08 0.32 -0.01 -0.04 2.15 2.33 2zc7A1 GLN 7 HB3 -0.06 0.04 -0.01 -0.04 2.02 1.96 2zc7A1 GLN 7 HG2 -0.02 0.04 -0.01 -0.04 2.40 2.36 2zc7A1 GLN 7 HG3 -0.02 -0.15 0.02 -0.04 2.39 2.20 2zc7A1 GLN 7 HE21 -0.01 0.02 -0.00 -0.04 6.97 6.94 2zc7A1 GLN 7 HE22 -0.01 0.04 -0.01 -0.04 7.69 7.67 2zc7A1 LEU 8 H -0.11 0.56 -0.20 -0.55 8.37 8.07 2zc7A1 LEU 8 HA -0.18 0.06 0.41 -0.75 4.35 3.88 2zc7A1 LEU 8 HB2 -0.21 0.24 0.21 -0.04 1.64 1.84 2zc7A1 LEU 8 HB3 0.07 0.04 0.11 -0.04 1.64 1.81 2zc7A1 LEU 8 HG 0.08 -0.07 -0.07 -0.04 1.64 1.55 2zc7A1 LEU 8 HD13 -0.36 0.01 -0.03 -0.04 0.93 0.51 2zc7A1 LEU 8 HD23 -0.61 0.01 -0.04 -0.04 0.89 0.22 2zc7A1 ALA 9 H 0.06 0.69 -0.05 -0.55 8.40 8.55 2zc7A1 ALA 9 HA -0.52 -0.01 0.36 -0.75 4.34 3.41 2zc7A1 ALA 9 HB3 0.20 0.00 0.13 -0.04 1.41 1.71 2zc7A1 GLU 10 H -0.05 0.45 -0.37 -0.55 8.60 8.07 2zc7A1 GLU 10 HA -0.03 -0.05 0.34 -0.75 4.29 3.81 2zc7A1 GLU 10 HB2 -0.01 -0.06 0.08 -0.04 2.09 2.05 2zc7A1 GLU 10 HB3 -0.04 0.12 0.20 -0.04 1.99 2.23 2zc7A1 GLU 10 HG2 -0.03 0.09 -0.24 -0.04 2.34 2.12 2zc7A1 GLU 10 HG3 -0.02 -0.08 -0.07 -0.04 2.34 2.13 2zc7A1 VAL 11 H -0.10 0.56 -0.04 -0.55 8.24 8.10 2zc7A1 VAL 11 HA -0.06 -0.02 0.32 -0.75 4.13 3.62 2zc7A1 VAL 11 HB -0.14 0.11 0.13 -0.04 2.12 2.18 2zc7A1 VAL 11 HG13 -0.05 -0.00 -0.10 -0.04 0.97 0.78 2zc7A1 VAL 11 HG23 -0.07 0.04 0.04 -0.04 0.95 0.93 2zc7A1 VAL 12 H -0.28 0.45 -0.38 -0.55 8.24 7.48 2zc7A1 VAL 12 HA -0.13 0.08 0.54 -0.75 4.13 3.87 2zc7A1 VAL 12 HB -0.79 0.09 0.13 -0.04 2.12 1.51 2zc7A1 VAL 12 HG13 -0.03 -0.03 -0.16 -0.04 0.97 0.71 2zc7A1 VAL 12 HG23 -0.48 0.02 -0.09 -0.04 0.95 0.36 2zc7A1 GLU 13 H -0.09 0.62 0.12 -0.55 8.60 8.71 2zc7A1 GLU 13 HA -0.05 -0.06 0.42 -0.75 4.29 3.85 2zc7A1 GLU 13 HB2 0.03 0.16 0.18 -0.04 2.09 2.42 2zc7A1 GLU 13 HB3 0.07 -0.04 -0.10 -0.04 1.99 1.88 2zc7A1 GLU 13 HG2 0.42 -0.05 0.04 -0.04 2.34 2.71 2zc7A1 GLU 13 HG3 0.34 -0.01 0.08 -0.04 2.34 2.71 2zc7A1 ARG 14 H -0.04 0.80 -0.05 -0.55 8.46 8.62 2zc7A1 ARG 14 HA -0.02 -0.02 0.41 -0.75 4.34 3.95 2zc7A1 ARG 14 HB2 -0.02 -0.07 0.06 -0.04 1.90 1.84 2zc7A1 ARG 14 HB3 -0.02 -0.04 0.08 -0.04 1.80 1.78 2zc7A1 ARG 14 HG2 -0.04 0.22 0.01 -0.04 1.67 1.82 2zc7A1 ARG 14 HG3 -0.02 0.00 -0.25 -0.04 1.67 1.36 2zc7A1 ARG 14 HD2 -0.01 -0.07 -0.07 -0.04 3.22 3.02 2zc7A1 ARG 14 HD3 -0.02 -0.06 -0.21 -0.04 3.22 2.88 2zc7A1 THR 15 H -0.07 0.28 -0.66 -0.55 8.28 7.29 2zc7A1 THR 15 HA -0.03 0.16 0.96 -0.75 4.39 4.72 2zc7A1 THR 15 HB -0.03 0.16 0.15 -0.04 4.32 4.56 2zc7A1 THR 15 HG23 0.01 0.00 -0.06 -0.04 1.22 1.13 2zc7A1 VAL 16 H -0.16 0.66 0.18 -0.55 8.24 8.37 2zc7A1 VAL 16 HA -0.18 0.02 0.28 -0.75 4.13 3.50 2zc7A1 VAL 16 HB -0.65 0.00 0.03 -0.04 2.12 1.46 2zc7A1 VAL 16 HG13 -1.00 -0.01 -0.24 -0.04 0.97 -0.32 2zc7A1 VAL 16 HG23 -0.14 0.03 -0.05 -0.04 0.95 0.75 2zc7A1 THR 17 H -0.23 0.55 0.03 -0.55 8.28 8.09 2zc7A1 THR 17 HA -0.15 -0.01 0.40 -0.75 4.39 3.87 2zc7A1 THR 17 HB -0.05 0.15 0.08 -0.04 4.32 4.46 2zc7A1 THR 17 HG23 0.00 -0.02 -0.08 -0.04 1.22 1.08 2zc7A1 PRO 18 HA -0.04 -0.00 0.42 -0.51 4.44 4.31 2zc7A1 PRO 18 HB2 -0.03 0.06 -0.09 -0.04 2.28 2.18 2zc7A1 PRO 18 HB3 -0.03 -0.04 0.08 -0.04 2.02 1.99 2zc7A1 PRO 18 HG2 -0.04 0.25 0.04 -0.04 2.03 2.24 2zc7A1 PRO 18 HG3 -0.03 -0.03 0.05 -0.04 2.03 1.99 2zc7A1 PRO 18 HD2 -0.08 0.09 -0.49 -0.04 3.68 3.16 2zc7A1 PRO 18 HD3 -0.04 0.04 0.00 -0.04 3.65 3.60 2zc7A1 LEU 19 H -0.09 0.37 -0.54 -0.55 8.37 7.56 2zc7A1 LEU 19 HA -0.07 0.01 0.49 -0.75 4.35 4.03 2zc7A1 LEU 19 HB2 -0.06 0.10 0.04 -0.04 1.64 1.69 2zc7A1 LEU 19 HB3 -0.13 0.18 0.12 -0.04 1.64 1.77 2zc7A1 LEU 19 HG -0.28 -0.03 -0.30 -0.04 1.64 0.98 2zc7A1 LEU 19 HD13 0.03 -0.02 -0.03 -0.04 0.93 0.86 2zc7A1 LEU 19 HD23 0.05 -0.01 -0.12 -0.04 0.89 0.77 2zc7A1 MET 20 H -0.14 0.61 0.04 -0.55 8.47 8.42 2zc7A1 MET 20 HA -0.17 -0.03 0.43 -0.75 4.52 4.00 2zc7A1 MET 20 HB2 -0.08 0.06 0.10 -0.04 2.15 2.19 2zc7A1 MET 20 HB3 -0.06 0.14 -0.03 -0.04 2.03 2.04 2zc7A1 MET 20 HG2 -0.13 -0.05 -0.11 -0.04 2.63 2.30 2zc7A1 MET 20 HG3 -0.20 0.27 -0.03 -0.04 2.56 2.56 2zc7A1 MET 20 HE3 0.06 0.03 -0.45 -0.04 2.10 1.69 2zc7A1 LYS 21 H -0.07 0.43 -0.16 -0.55 8.42 8.07 2zc7A1 LYS 21 HA -0.04 0.06 0.51 -0.75 4.32 4.09 2zc7A1 LYS 21 HB2 -0.03 0.06 0.11 -0.04 1.87 1.96 2zc7A1 LYS 21 HB3 -0.03 -0.04 0.03 -0.04 1.79 1.71 2zc7A1 LYS 21 HG2 -0.03 -0.04 -0.01 -0.04 1.46 1.34 2zc7A1 LYS 21 HG3 -0.03 0.24 0.01 -0.04 1.46 1.64 2zc7A1 LYS 21 HD2 -0.01 -0.01 -0.02 -0.04 1.69 1.60 2zc7A1 LYS 21 HD3 -0.01 -0.02 -0.02 -0.04 1.68 1.59 2zc7A1 LYS 21 HE2 -0.01 0.02 -0.12 -0.04 2.99 2.84 2zc7A1 LYS 21 HE3 -0.00 -0.03 -0.05 -0.04 2.99 2.87 2zc7A1 ALA 22 H -0.05 0.55 -0.08 -0.55 8.40 8.27 2zc7A1 ALA 22 HA -0.02 0.01 0.39 -0.75 4.34 3.96 2zc7A1 ALA 22 HB3 -0.02 -0.01 0.12 -0.04 1.41 1.46 2zc7A1 GLN 23 H -0.09 0.34 -0.45 -0.55 8.47 7.72 2zc7A1 GLN 23 HA -0.01 0.20 0.90 -0.75 4.36 4.69 2zc7A1 GLN 23 HB2 -0.29 0.06 0.01 -0.04 2.15 1.88 2zc7A1 GLN 23 HB3 -0.08 -0.06 0.06 -0.04 2.02 1.90 2zc7A1 GLN 23 HG2 -0.07 0.08 -0.06 -0.04 2.40 2.31 2zc7A1 GLN 23 HG3 -0.09 -0.07 -0.07 -0.04 2.39 2.12 2zc7A1 GLN 23 HE21 0.07 -0.06 -0.04 -0.04 6.97 6.90 2zc7A1 GLN 23 HE22 0.07 -0.00 -0.07 -0.04 7.69 7.64 2zc7A1 ALA 24 H -0.06 0.30 -0.30 -0.55 8.40 7.80 2zc7A1 ALA 24 HA -0.05 0.06 0.30 -0.75 4.34 3.90 2zc7A1 ALA 24 HB3 -0.02 0.01 0.07 -0.04 1.41 1.42 2zc7A1 ILE 25 H -0.10 0.30 -0.03 -0.55 8.25 7.86 2zc7A1 ILE 25 HA -0.03 0.13 0.42 -0.75 4.18 3.94 2zc7A1 ILE 25 HB -0.12 -0.09 0.03 -0.04 1.89 1.66 2zc7A1 ILE 25 HG12 -0.31 -0.00 -0.06 -0.04 1.49 1.07 2zc7A1 ILE 25 HG13 -0.57 -0.03 -0.12 -0.04 1.21 0.45 2zc7A1 ILE 25 HG23 0.00 -0.06 -0.15 -0.04 0.93 0.68 2zc7A1 ILE 25 HD13 -0.34 0.04 -0.20 -0.04 0.88 0.35 2zc7A1 PRO 26 HA -0.06 0.07 0.48 -0.51 4.44 4.42 2zc7A1 PRO 26 HB2 -0.07 0.13 0.11 -0.04 2.28 2.41 2zc7A1 PRO 26 HB3 -0.25 -0.09 0.07 -0.04 2.02 1.71 2zc7A1 PRO 26 HG2 -0.55 0.01 0.09 -0.04 2.03 1.55 2zc7A1 PRO 26 HG3 -0.27 0.04 0.03 -0.04 2.03 1.79 2zc7A1 PRO 26 HD2 0.04 0.11 0.14 -0.04 3.68 3.93 2zc7A1 PRO 26 HD3 -0.03 0.29 0.34 -0.04 3.65 4.22 2zc7A1 GLY 27 H 0.11 0.17 0.03 -0.55 8.43 8.19 2zc7A1 GLY 27 HA2 0.17 0.21 0.67 -0.51 4.01 4.55 2zc7A1 GLY 27 HA3 0.22 0.08 0.18 -0.51 4.01 3.99 2zc7A1 MET 28 H 0.29 0.59 0.26 -0.55 8.47 9.07 2zc7A1 MET 28 HA 0.09 0.28 0.88 -0.75 4.52 5.01 2zc7A1 MET 28 HB2 0.07 0.06 -0.17 -0.04 2.15 2.07 2zc7A1 MET 28 HB3 0.15 -0.09 -0.09 -0.04 2.03 1.95 2zc7A1 MET 28 HG2 0.17 -0.07 -0.32 -0.04 2.63 2.36 2zc7A1 MET 28 HG3 0.07 0.13 -0.13 -0.04 2.56 2.59 2zc7A1 MET 28 HE3 -0.09 0.00 -0.14 -0.04 2.10 1.83 2zc7A1 ALA 29 H -0.22 0.75 0.40 -0.55 8.40 8.79 2zc7A1 ALA 29 HA 0.20 0.17 1.05 -0.75 4.34 5.00 2zc7A1 ALA 29 HB3 0.12 -0.03 0.03 -0.04 1.41 1.49 2zc7A1 VAL 30 H 0.26 0.69 0.37 -0.55 8.24 9.02 2zc7A1 VAL 30 HA 0.20 0.38 1.28 -0.75 4.13 5.24 2zc7A1 VAL 30 HB 0.51 -0.03 0.11 -0.04 2.12 2.67 2zc7A1 VAL 30 HG13 0.29 0.01 -0.13 -0.04 0.97 1.11 2zc7A1 VAL 30 HG23 0.24 -0.02 -0.21 -0.04 0.95 0.91 2zc7A1 ALA 31 H 0.22 0.64 0.41 -0.55 8.40 9.13 2zc7A1 ALA 31 HA 0.31 0.35 1.10 -0.75 4.34 5.35 2zc7A1 ALA 31 HB3 0.25 -0.03 0.01 -0.04 1.41 1.59 2zc7A1 VAL 32 H 0.27 0.58 0.32 -0.55 8.24 8.86 2zc7A1 VAL 32 HA 0.17 0.33 1.17 -0.75 4.13 5.04 2zc7A1 VAL 32 HB 0.41 -0.05 0.11 -0.04 2.12 2.55 2zc7A1 VAL 32 HG13 0.16 0.02 -0.21 -0.04 0.97 0.90 2zc7A1 VAL 32 HG23 0.19 -0.01 -0.08 -0.04 0.95 1.01 2zc7A1 ILE 33 H 0.09 0.59 0.14 -0.55 8.25 8.53 2zc7A1 ILE 33 HA 0.07 0.36 0.69 -0.75 4.18 4.54 2zc7A1 ILE 33 HB -0.02 -0.09 0.05 -0.04 1.89 1.78 2zc7A1 ILE 33 HG12 -0.05 0.05 -0.21 -0.04 1.49 1.23 2zc7A1 ILE 33 HG13 -0.01 0.00 -0.32 -0.04 1.21 0.85 2zc7A1 ILE 33 HG23 -0.05 0.01 -0.32 -0.04 0.93 0.53 2zc7A1 ILE 33 HD13 0.01 -0.02 -0.25 -0.04 0.88 0.58 2zc7A1 TYR 34 H 0.27 0.65 0.15 -0.55 8.29 8.81 2zc7A1 TYR 34 HA 0.02 0.10 0.89 -0.75 4.56 4.82 2zc7A1 TYR 34 HB2 0.06 -0.02 -0.16 -0.04 3.06 2.91 2zc7A1 TYR 34 HB3 0.13 0.04 0.08 -0.04 2.98 3.19 2zc7A1 TYR 34 HD2 0.02 0.01 -0.05 -0.04 7.15 7.09 2zc7A1 TYR 34 HE2 -0.00 -0.07 -0.06 -0.04 6.85 6.68 2zc7A1 GLU 35 H -0.31 0.28 0.15 -0.55 8.60 8.17 2zc7A1 GLU 35 HA -0.20 0.10 0.35 -0.75 4.29 3.78 2zc7A1 GLU 35 HB2 -0.09 0.14 0.27 -0.04 2.09 2.36 2zc7A1 GLU 35 HB3 -0.14 -0.02 0.18 -0.04 1.99 1.97 2zc7A1 GLU 35 HG2 -0.91 -0.03 -0.11 -0.04 2.34 1.25 2zc7A1 GLU 35 HG3 -0.44 0.04 -0.28 -0.04 2.34 1.62 2zc7A1 GLY 36 H -0.08 0.37 -0.18 -0.55 8.43 8.00 2zc7A1 GLY 36 HA2 -0.07 -0.01 0.20 -0.51 4.01 3.62 2zc7A1 GLY 36 HA3 -0.07 0.06 0.30 -0.51 4.01 3.79 2zc7A1 GLN 37 H 0.00 0.25 -0.45 -0.55 8.47 7.73 2zc7A1 GLN 37 HA -0.11 0.25 1.02 -0.75 4.36 4.77 2zc7A1 GLN 37 HB2 -0.17 -0.03 0.10 -0.04 2.15 2.01 2zc7A1 GLN 37 HB3 -0.06 0.05 -0.13 -0.04 2.02 1.84 2zc7A1 GLN 37 HG2 0.14 0.32 0.11 -0.04 2.40 2.92 2zc7A1 GLN 37 HG3 -0.45 -0.02 -0.15 -0.04 2.39 1.72 2zc7A1 GLN 37 HE21 0.14 -0.09 0.01 -0.04 6.97 6.99 2zc7A1 GLN 37 HE22 0.40 -0.00 0.00 -0.04 7.69 8.05 2zc7A1 PRO 38 HA -0.14 0.20 0.67 -0.51 4.44 4.66 2zc7A1 PRO 38 HB2 -0.47 -0.04 -0.11 -0.04 2.28 1.62 2zc7A1 PRO 38 HB3 -0.05 -0.00 -0.03 -0.04 2.02 1.90 2zc7A1 PRO 38 HG2 -0.24 -0.01 0.07 -0.04 2.03 1.80 2zc7A1 PRO 38 HG3 -0.05 0.04 -0.00 -0.04 2.03 1.97 2zc7A1 PRO 38 HD2 -0.17 0.10 0.23 -0.04 3.68 3.79 2zc7A1 PRO 38 HD3 -0.10 0.19 0.07 -0.04 3.65 3.77 2zc7A1 HIS 39 H -0.14 0.40 0.32 -0.55 8.41 8.45 2zc7A1 HIS 39 HA -0.50 0.10 0.81 -0.75 4.63 4.29 2zc7A1 HIS 39 HB2 -0.09 -0.01 0.18 -0.04 3.26 3.30 2zc7A1 HIS 39 HB3 -0.44 -0.04 0.05 -0.04 3.20 2.73 2zc7A1 HIS 39 HD2 0.05 0.16 0.00 -0.04 6.97 7.14 2zc7A1 HIS 39 HE1 0.01 -0.05 -0.01 -0.04 7.75 7.65 2zc7A1 TYR 40 H -0.51 0.16 0.16 -0.55 8.29 7.54 2zc7A1 TYR 40 HA -0.19 0.40 1.22 -0.75 4.56 5.24 2zc7A1 TYR 40 HB2 -0.14 -0.03 0.05 -0.04 3.06 2.91 2zc7A1 TYR 40 HB3 -0.06 0.00 0.00 -0.04 2.98 2.88 2zc7A1 TYR 40 HD2 -0.05 0.08 -0.09 -0.04 7.15 7.05 2zc7A1 TYR 40 HE2 -0.04 0.04 -0.10 -0.04 6.85 6.70 2zc7A1 PHE 41 H 0.21 0.71 0.36 -0.55 8.34 9.06 2zc7A1 PHE 41 HA -0.08 0.08 0.77 -0.75 4.62 4.64 2zc7A1 PHE 41 HB2 0.28 -0.02 0.08 -0.04 3.15 3.44 2zc7A1 PHE 41 HB3 0.07 0.01 0.03 -0.04 3.06 3.13 2zc7A1 PHE 41 HD2 0.10 0.01 -0.09 -0.04 7.28 7.26 2zc7A1 PHE 41 HE2 0.03 -0.01 -0.08 -0.04 7.38 7.29 2zc7A1 PHE 41 HZ -0.08 0.00 -0.19 -0.04 7.32 7.02 2zc7A1 THR 42 H -0.25 0.22 0.19 -0.55 8.28 7.90 2zc7A1 THR 42 HA 0.05 0.24 1.05 -0.75 4.39 4.98 2zc7A1 THR 42 HB 0.04 0.30 -0.05 -0.04 4.32 4.56 2zc7A1 THR 42 HG23 0.06 -0.08 -0.35 -0.04 1.22 0.82 2zc7A1 PHE 43 H 0.24 0.56 0.35 -0.55 8.34 8.94 2zc7A1 PHE 43 HA 0.08 0.13 1.00 -0.75 4.62 5.07 2zc7A1 PHE 43 HB2 0.07 -0.01 0.01 -0.04 3.15 3.19 2zc7A1 PHE 43 HB3 0.05 0.01 -0.03 -0.04 3.06 3.06 2zc7A1 PHE 43 HD2 0.08 0.08 -0.13 -0.04 7.28 7.27 2zc7A1 PHE 43 HE2 0.09 0.01 -0.14 -0.04 7.38 7.30 2zc7A1 PHE 43 HZ 0.01 -0.03 -0.14 -0.04 7.32 7.13 2zc7A1 GLY 44 H 0.16 0.09 0.20 -0.55 8.43 8.33 2zc7A1 GLY 44 HA2 0.09 0.00 0.43 -0.51 4.01 4.02 2zc7A1 GLY 44 HA3 0.12 0.35 0.55 -0.51 4.01 4.52 2zc7A1 LYS 45 H 0.07 0.78 0.21 -0.55 8.42 8.92 2zc7A1 LYS 45 HA 0.09 0.22 1.22 -0.75 4.32 5.10 2zc7A1 LYS 45 HB2 0.04 -0.11 -0.32 -0.04 1.87 1.44 2zc7A1 LYS 45 HB3 0.06 0.13 -0.19 -0.04 1.79 1.75 2zc7A1 LYS 45 HG2 0.02 0.05 0.05 -0.04 1.46 1.53 2zc7A1 LYS 45 HG3 -0.02 -0.03 -0.03 -0.04 1.46 1.35 2zc7A1 LYS 45 HD2 0.03 0.03 -0.19 -0.04 1.69 1.52 2zc7A1 LYS 45 HD3 0.04 -0.02 -0.31 -0.04 1.68 1.35 2zc7A1 LYS 45 HE2 0.02 0.02 -0.05 -0.04 2.99 2.93 2zc7A1 LYS 45 HE3 0.01 -0.02 -0.03 -0.04 2.99 2.91 2zc7A1 ALA 46 H 0.11 0.51 -0.03 -0.55 8.40 8.44 2zc7A1 ALA 46 HA 0.12 0.11 0.57 -0.75 4.34 4.39 2zc7A1 ALA 46 HB3 0.06 -0.01 -0.11 -0.04 1.41 1.31 2zc7A1 ASP 47 H 0.15 0.34 -0.05 -0.55 8.40 8.29 2zc7A1 ASP 47 HA 0.38 0.13 0.78 -0.75 4.63 5.17 2zc7A1 ASP 47 HB2 0.29 0.18 -0.15 -0.04 2.71 2.99 2zc7A1 ASP 47 HB3 0.16 -0.06 0.10 -0.04 2.70 2.86 2zc7A1 VAL 48 H 0.35 0.26 0.01 -0.55 8.24 8.30 2zc7A1 VAL 48 HA 0.01 0.14 0.55 -0.75 4.13 4.08 2zc7A1 VAL 48 HB -0.05 -0.02 0.08 -0.04 2.12 2.10 2zc7A1 VAL 48 HG13 -0.10 0.02 -0.08 -0.04 0.97 0.77 2zc7A1 VAL 48 HG23 -0.43 0.04 -0.04 -0.04 0.95 0.48 2zc7A1 ALA 49 H 0.06 0.08 -0.01 -0.55 8.40 7.99 2zc7A1 ALA 49 HA -0.01 0.13 0.42 -0.75 4.34 4.13 2zc7A1 ALA 49 HB3 -0.07 0.01 0.06 -0.04 1.41 1.37 2zc7A1 ALA 50 H 0.05 -0.02 -0.26 -0.55 8.40 7.62 2zc7A1 ALA 50 HA 0.02 0.15 0.47 -0.75 4.34 4.22 2zc7A1 ALA 50 HB3 0.06 -0.01 -0.00 -0.04 1.41 1.42 2zc7A1 ASN 51 H 0.04 0.08 -0.71 -0.55 8.53 7.39 2zc7A1 ASN 51 HA 0.04 0.05 0.30 -0.75 4.76 4.39 2zc7A1 ASN 51 HB2 0.02 0.02 -0.20 -0.04 2.88 2.67 2zc7A1 ASN 51 HB3 0.03 0.07 0.20 -0.04 2.79 3.04 2zc7A1 ASN 51 HD21 0.02 -0.04 0.00 -0.04 7.03 6.97 2zc7A1 ASN 51 HD22 0.02 -0.01 0.03 -0.04 7.74 7.74 2zc7A1 LYS 52 H 0.08 0.33 0.04 -0.55 8.42 8.32 2zc7A1 LYS 52 HA 0.06 0.24 0.76 -0.75 4.32 4.63 2zc7A1 LYS 52 HB2 0.11 -0.22 0.08 -0.04 1.87 1.79 2zc7A1 LYS 52 HB3 0.08 0.12 -0.05 -0.04 1.79 1.90 2zc7A1 LYS 52 HG2 0.06 0.08 -0.07 -0.04 1.46 1.49 2zc7A1 LYS 52 HG3 0.08 -0.08 -0.15 -0.04 1.46 1.26 2zc7A1 LYS 52 HD2 0.11 -0.03 -0.06 -0.04 1.69 1.66 2zc7A1 LYS 52 HD3 0.07 0.05 -0.06 -0.04 1.68 1.70 2zc7A1 LYS 52 HE2 0.04 -0.01 -0.04 -0.04 2.99 2.94 2zc7A1 LYS 52 HE3 0.06 -0.05 -0.04 -0.04 2.99 2.92 2zc7A1 PRO 53 HA 0.08 0.27 0.77 -0.51 4.44 5.04 2zc7A1 PRO 53 HB2 0.05 0.11 -0.10 -0.04 2.28 2.30 2zc7A1 PRO 53 HB3 0.05 0.03 0.05 -0.04 2.02 2.11 2zc7A1 PRO 53 HG2 0.04 -0.03 0.02 -0.04 2.03 2.02 2zc7A1 PRO 53 HG3 0.04 0.04 0.05 -0.04 2.03 2.11 2zc7A1 PRO 53 HD2 0.05 0.04 0.23 -0.04 3.68 3.96 2zc7A1 PRO 53 HD3 0.04 0.31 0.18 -0.04 3.65 4.14 2zc7A1 VAL 54 H 0.12 0.58 0.11 -0.55 8.24 8.50 2zc7A1 VAL 54 HA 0.12 0.02 0.56 -0.75 4.13 4.08 2zc7A1 VAL 54 HB 0.20 0.02 -0.00 -0.04 2.12 2.30 2zc7A1 VAL 54 HG13 0.37 -0.01 -0.28 -0.04 0.97 1.00 2zc7A1 VAL 54 HG23 0.29 -0.05 -0.30 -0.04 0.95 0.85 2zc7A1 THR 55 H 0.08 0.10 0.18 -0.55 8.28 8.09 2zc7A1 THR 55 HA 0.04 0.27 0.68 -0.75 4.39 4.63 2zc7A1 THR 55 HB 0.00 0.05 0.16 -0.04 4.32 4.50 2zc7A1 THR 55 HG23 0.04 0.07 -0.17 -0.04 1.22 1.13 2zc7A1 PRO 56 HA -0.10 0.08 0.51 -0.51 4.44 4.41 2zc7A1 PRO 56 HB2 -0.25 0.05 -0.03 -0.04 2.28 2.01 2zc7A1 PRO 56 HB3 -0.62 0.01 0.06 -0.04 2.02 1.43 2zc7A1 PRO 56 HG2 -0.04 0.09 0.03 -0.04 2.03 2.07 2zc7A1 PRO 56 HG3 -0.07 0.06 -0.03 -0.04 2.03 1.95 2zc7A1 PRO 56 HD2 -0.04 0.12 0.17 -0.04 3.68 3.88 2zc7A1 PRO 56 HD3 -0.01 0.19 0.16 -0.04 3.65 3.94 2zc7A1 GLN 57 H -0.08 0.06 -0.34 -0.55 8.47 7.56 2zc7A1 GLN 57 HA -0.22 0.10 0.71 -0.75 4.36 4.20 2zc7A1 GLN 57 HB2 -0.21 0.02 -0.03 -0.04 2.15 1.89 2zc7A1 GLN 57 HB3 -0.64 0.03 0.05 -0.04 2.02 1.41 2zc7A1 GLN 57 HG2 -0.24 0.02 -0.06 -0.04 2.40 2.07 2zc7A1 GLN 57 HG3 -0.14 -0.06 -0.03 -0.04 2.39 2.12 2zc7A1 GLN 57 HE21 -0.01 0.02 -0.03 -0.04 6.97 6.92 2zc7A1 GLN 57 HE22 -0.04 -0.02 -0.02 -0.04 7.69 7.57 2zc7A1 THR 58 H 0.01 0.09 -0.21 -0.55 8.28 7.62 2zc7A1 THR 58 HA 0.02 0.29 0.55 -0.75 4.39 4.50 2zc7A1 THR 58 HB 0.11 0.01 0.10 -0.04 4.32 4.50 2zc7A1 THR 58 HG23 -0.29 0.04 -0.05 -0.04 1.22 0.88 2zc7A1 LEU 59 H 0.00 0.59 0.21 -0.55 8.37 8.62 2zc7A1 LEU 59 HA 0.03 0.26 0.47 -0.75 4.35 4.36 2zc7A1 LEU 59 HB2 -0.13 -0.09 -0.06 -0.04 1.64 1.32 2zc7A1 LEU 59 HB3 -0.16 -0.03 -0.14 -0.04 1.64 1.26 2zc7A1 LEU 59 HG 0.08 0.07 -0.12 -0.04 1.64 1.63 2zc7A1 LEU 59 HD13 0.01 -0.02 -0.16 -0.04 0.93 0.71 2zc7A1 LEU 59 HD23 0.12 -0.01 -0.27 -0.04 0.89 0.69 2zc7A1 PHE 60 H 0.18 0.79 0.37 -0.55 8.34 9.12 2zc7A1 PHE 60 HA 0.15 0.19 0.80 -0.75 4.62 5.00 2zc7A1 PHE 60 HB2 0.08 -0.02 -0.11 -0.04 3.15 3.06 2zc7A1 PHE 60 HB3 0.20 0.05 -0.15 -0.04 3.06 3.12 2zc7A1 PHE 60 HD2 0.36 0.06 -0.29 -0.04 7.28 7.37 2zc7A1 PHE 60 HE2 0.17 -0.02 -0.18 -0.04 7.38 7.31 2zc7A1 PHE 60 HZ 0.17 -0.04 -0.26 -0.04 7.32 7.16 2zc7A1 GLU 61 H -1.50 0.17 0.01 -0.55 8.60 6.74 2zc7A1 GLU 61 HA -0.26 0.20 0.78 -0.75 4.29 4.26 2zc7A1 GLU 61 HB2 -1.14 -0.03 0.09 -0.04 2.09 0.96 2zc7A1 GLU 61 HB3 -0.18 -0.02 -0.03 -0.04 1.99 1.72 2zc7A1 GLU 61 HG2 -0.16 0.10 -0.03 -0.04 2.34 2.21 2zc7A1 GLU 61 HG3 -0.42 0.05 -0.08 -0.04 2.34 1.85 2zc7A1 LEU 62 H -0.07 0.65 0.21 -0.55 8.37 8.61 2zc7A1 LEU 62 HA 0.07 0.06 0.31 -0.75 4.35 4.04 2zc7A1 LEU 62 HB2 -0.04 0.38 0.03 -0.04 1.64 1.96 2zc7A1 LEU 62 HB3 0.05 -0.12 -0.24 -0.04 1.64 1.28 2zc7A1 LEU 62 HG 0.11 -0.03 -0.21 -0.04 1.64 1.46 2zc7A1 LEU 62 HD13 0.06 0.01 -0.21 -0.04 0.93 0.75 2zc7A1 LEU 62 HD23 -0.03 -0.01 -0.31 -0.04 0.89 0.50 2zc7A1 GLY 63 H 0.05 0.13 -0.29 -0.55 8.43 7.77 2zc7A1 GLY 63 HA2 0.17 0.22 0.30 -0.51 4.01 4.19 2zc7A1 GLY 63 HA3 0.13 0.02 0.24 -0.51 4.01 3.89 2zc7A1 SER 64 H 0.14 -0.00 0.39 -0.55 8.46 8.44 2zc7A1 SER 64 HA 0.18 0.31 0.49 -0.75 4.49 4.73 2zc7A1 SER 64 HB2 0.15 0.15 0.41 -0.04 3.95 4.62 2zc7A1 SER 64 HB3 0.29 0.06 0.26 -0.04 3.93 4.50 2zc7A1 ILE 65 H 0.11 0.38 -0.53 -0.55 8.25 7.65 2zc7A1 ILE 65 HA 0.02 0.12 0.31 -0.75 4.18 3.88 2zc7A1 ILE 65 HB 0.11 0.00 -0.12 -0.04 1.89 1.85 2zc7A1 ILE 65 HG12 0.08 0.06 -0.38 -0.04 1.49 1.20 2zc7A1 ILE 65 HG13 0.10 -0.06 -0.37 -0.04 1.21 0.84 2zc7A1 ILE 65 HG23 0.12 -0.01 -0.14 -0.04 0.93 0.86 2zc7A1 ILE 65 HD13 0.13 0.02 -0.25 -0.04 0.88 0.73 2zc7A1 SER 66 H 0.10 0.56 -0.42 -0.55 8.46 8.16 2zc7A1 SER 66 HA 0.23 -0.02 0.29 -0.75 4.49 4.24 2zc7A1 SER 66 HB2 0.07 0.18 -0.39 -0.04 3.95 3.76 2zc7A1 SER 66 HB3 0.04 0.03 -0.11 -0.04 3.93 3.84 2zc7A1 LYS 67 H 0.09 0.54 -0.52 -0.55 8.42 7.98 2zc7A1 LYS 67 HA 0.08 0.05 0.40 -0.75 4.32 4.10 2zc7A1 LYS 67 HB2 0.10 0.23 0.17 -0.04 1.87 2.33 2zc7A1 LYS 67 HB3 0.11 -0.06 0.14 -0.04 1.79 1.94 2zc7A1 LYS 67 HG2 0.10 -0.08 0.14 -0.04 1.46 1.58 2zc7A1 LYS 67 HG3 0.13 0.16 0.21 -0.04 1.46 1.91 2zc7A1 LYS 67 HD2 0.27 0.08 0.15 -0.04 1.69 2.15 2zc7A1 LYS 67 HD3 0.23 -0.02 0.11 -0.04 1.68 1.95 2zc7A1 LYS 67 HE2 -0.39 -0.05 -0.01 -0.04 2.99 2.50 2zc7A1 LYS 67 HE3 0.05 -0.10 0.06 -0.04 2.99 2.96 2zc7A1 THR 68 H -0.09 0.51 -0.45 -0.55 8.28 7.70 2zc7A1 THR 68 HA -0.42 0.15 0.60 -0.75 4.39 3.97 2zc7A1 THR 68 HB -1.25 0.01 -0.01 -0.04 4.32 3.02 2zc7A1 THR 68 HG23 -1.30 0.00 -0.16 -0.04 1.22 -0.28 2zc7A1 PHE 69 H 0.14 0.33 -0.16 -0.55 8.34 8.09 2zc7A1 PHE 69 HA 0.04 0.07 0.51 -0.75 4.62 4.48 2zc7A1 PHE 69 HB2 -0.07 0.22 0.16 -0.04 3.15 3.42 2zc7A1 PHE 69 HB3 -0.13 -0.07 -0.05 -0.04 3.06 2.77 2zc7A1 PHE 69 HD2 -0.40 0.02 -0.05 -0.04 7.28 6.81 2zc7A1 PHE 69 HE2 -0.77 0.01 -0.18 -0.04 7.38 6.39 2zc7A1 PHE 69 HZ -1.00 -0.01 -0.17 -0.04 7.32 6.09 2zc7A1 THR 70 H 0.20 0.52 -0.02 -0.55 8.28 8.42 2zc7A1 THR 70 HA 0.25 -0.05 0.31 -0.75 4.39 4.15 2zc7A1 THR 70 HB 0.14 0.16 0.07 -0.04 4.32 4.65 2zc7A1 THR 70 HG23 0.20 -0.03 -0.07 -0.04 1.22 1.28 2zc7A1 GLY 71 H 0.11 0.50 -0.42 -0.55 8.43 8.07 2zc7A1 GLY 71 HA2 0.17 -0.05 0.32 -0.51 4.01 3.95 2zc7A1 GLY 71 HA3 0.09 0.41 0.19 -0.51 4.01 4.19 2zc7A1 VAL 72 H 0.21 0.48 -0.16 -0.55 8.24 8.22 2zc7A1 VAL 72 HA 0.18 0.11 0.41 -0.75 4.13 4.07 2zc7A1 VAL 72 HB 0.48 0.05 0.12 -0.04 2.12 2.73 2zc7A1 VAL 72 HG13 0.23 -0.03 -0.18 -0.04 0.97 0.95 2zc7A1 VAL 72 HG23 0.22 0.06 0.06 -0.04 0.95 1.25 2zc7A1 LEU 73 H 0.15 0.66 -0.23 -0.55 8.37 8.40 2zc7A1 LEU 73 HA 0.02 0.01 0.39 -0.75 4.35 4.02 2zc7A1 LEU 73 HB2 -0.06 -0.01 -0.00 -0.04 1.64 1.53 2zc7A1 LEU 73 HB3 0.02 0.14 0.06 -0.04 1.64 1.82 2zc7A1 LEU 73 HG -0.12 0.02 -0.26 -0.04 1.64 1.24 2zc7A1 LEU 73 HD13 -0.17 -0.02 -0.19 -0.04 0.93 0.50 2zc7A1 LEU 73 HD23 -0.41 -0.03 -0.12 -0.04 0.89 0.29 2zc7A1 GLY 74 H 0.16 0.61 -0.21 -0.55 8.43 8.45 2zc7A1 GLY 74 HA2 -0.04 -0.00 0.41 -0.51 4.01 3.87 2zc7A1 GLY 74 HA3 0.33 0.07 0.25 -0.51 4.01 4.15 2zc7A1 GLY 75 H 0.15 0.56 -0.15 -0.55 8.43 8.44 2zc7A1 GLY 75 HA2 0.12 -0.01 0.47 -0.51 4.01 4.08 2zc7A1 GLY 75 HA3 0.12 0.17 0.39 -0.51 4.01 4.18 2zc7A1 ASP 76 H 0.07 0.55 -0.21 -0.55 8.40 8.26 2zc7A1 ASP 76 HA 0.04 0.16 0.56 -0.75 4.63 4.63 2zc7A1 ASP 76 HB2 0.05 -0.00 0.06 -0.04 2.71 2.77 2zc7A1 ASP 76 HB3 0.02 0.13 0.11 -0.04 2.70 2.91 2zc7A1 ALA 77 H 0.02 0.43 -0.30 -0.55 8.40 7.99 2zc7A1 ALA 77 HA -0.01 0.04 0.46 -0.75 4.34 4.07 2zc7A1 ALA 77 HB3 -0.05 0.03 0.05 -0.04 1.41 1.40 2zc7A1 ILE 78 H 0.05 0.34 -0.31 -0.55 8.25 7.78 2zc7A1 ILE 78 HA 0.05 0.29 0.64 -0.75 4.18 4.40 2zc7A1 ILE 78 HB 0.08 0.13 0.18 -0.04 1.89 2.24 2zc7A1 ILE 78 HG12 0.09 -0.15 -0.07 -0.04 1.49 1.31 2zc7A1 ILE 78 HG13 0.09 0.14 0.02 -0.04 1.21 1.42 2zc7A1 ILE 78 HG23 0.07 -0.01 -0.02 -0.04 0.93 0.92 2zc7A1 ILE 78 HD13 0.13 -0.03 -0.10 -0.04 0.88 0.83 2zc7A1 ALA 79 H 0.04 0.54 -0.03 -0.55 8.40 8.41 2zc7A1 ALA 79 HA 0.03 0.03 0.40 -0.75 4.34 4.05 2zc7A1 ALA 79 HB3 0.03 0.01 0.11 -0.04 1.41 1.52 2zc7A1 ARG 80 H 0.02 0.20 -0.64 -0.55 8.46 7.49 2zc7A1 ARG 80 HA 0.01 0.06 0.62 -0.75 4.34 4.27 2zc7A1 ARG 80 HB2 0.01 0.07 0.14 -0.04 1.90 2.08 2zc7A1 ARG 80 HB3 0.00 -0.03 0.08 -0.04 1.80 1.81 2zc7A1 ARG 80 HG2 -0.00 -0.06 0.04 -0.04 1.67 1.61 2zc7A1 ARG 80 HG3 0.00 0.05 0.03 -0.04 1.67 1.71 2zc7A1 ARG 80 HD2 -0.01 0.02 -0.07 -0.04 3.22 3.11 2zc7A1 ARG 80 HD3 -0.01 -0.02 -0.01 -0.04 3.22 3.13 2zc7A1 GLY 81 H 0.03 0.51 -0.34 -0.55 8.43 8.08 2zc7A1 GLY 81 HA2 0.04 0.03 0.30 -0.51 4.01 3.86 2zc7A1 GLY 81 HA3 0.02 0.04 0.53 -0.51 4.01 4.09 2zc7A1 GLU 82 H 0.03 0.37 -0.08 -0.55 8.60 8.36 2zc7A1 GLU 82 HA 0.04 0.09 0.47 -0.75 4.29 4.14 2zc7A1 GLU 82 HB2 0.01 0.06 0.12 -0.04 2.09 2.24 2zc7A1 GLU 82 HB3 0.02 -0.05 -0.02 -0.04 1.99 1.90 2zc7A1 GLU 82 HG2 0.01 0.03 -0.07 -0.04 2.34 2.26 2zc7A1 GLU 82 HG3 0.01 0.03 -0.13 -0.04 2.34 2.20 2zc7A1 ILE 83 H 0.05 0.32 -0.04 -0.55 8.25 8.02 2zc7A1 ILE 83 HA 0.22 0.18 0.73 -0.75 4.18 4.56 2zc7A1 ILE 83 HB -0.22 -0.04 -0.03 -0.04 1.89 1.56 2zc7A1 ILE 83 HG12 -0.02 -0.04 -0.26 -0.04 1.49 1.12 2zc7A1 ILE 83 HG13 0.03 -0.08 -0.54 -0.04 1.21 0.59 2zc7A1 ILE 83 HG23 -0.07 0.01 -0.20 -0.04 0.93 0.63 2zc7A1 ILE 83 HD13 -0.07 0.01 -0.11 -0.04 0.88 0.67 2zc7A1 SER 84 H 0.18 0.24 0.12 -0.55 8.46 8.45 2zc7A1 SER 84 HA 0.08 0.26 0.91 -0.75 4.49 4.98 2zc7A1 SER 84 HB2 0.08 0.17 -0.02 -0.04 3.95 4.14 2zc7A1 SER 84 HB3 0.11 -0.01 0.07 -0.04 3.93 4.07 2zc7A1 LEU 85 H 0.08 0.27 0.08 -0.55 8.37 8.26 2zc7A1 LEU 85 HA 0.07 0.02 0.34 -0.75 4.35 4.04 2zc7A1 LEU 85 HB2 0.06 0.03 0.12 -0.04 1.64 1.81 2zc7A1 LEU 85 HB3 0.03 0.03 -0.03 -0.04 1.64 1.62 2zc7A1 LEU 85 HG -0.20 0.02 -0.04 -0.04 1.64 1.39 2zc7A1 LEU 85 HD13 -0.02 -0.01 -0.16 -0.04 0.93 0.69 2zc7A1 LEU 85 HD23 0.02 0.04 -0.04 -0.04 0.89 0.87 2zc7A1 GLY 86 H 0.08 0.06 -0.32 -0.55 8.43 7.71 2zc7A1 GLY 86 HA2 0.08 0.08 0.31 -0.51 4.01 3.97 2zc7A1 GLY 86 HA3 0.07 0.04 0.24 -0.51 4.01 3.86 2zc7A1 ASP 87 H 0.13 0.25 -0.37 -0.55 8.40 7.87 2zc7A1 ASP 87 HA 0.13 0.10 0.21 -0.75 4.63 4.31 2zc7A1 ASP 87 HB2 0.35 0.06 0.10 -0.04 2.71 3.18 2zc7A1 ASP 87 HB3 0.27 0.11 0.05 -0.04 2.70 3.09 2zc7A1 PRO 88 HA 0.17 0.22 0.50 -0.51 4.44 4.81 2zc7A1 PRO 88 HB2 0.11 -0.09 0.00 -0.04 2.28 2.26 2zc7A1 PRO 88 HB3 0.13 0.05 0.12 -0.04 2.02 2.27 2zc7A1 PRO 88 HG2 0.07 0.05 0.06 -0.04 2.03 2.16 2zc7A1 PRO 88 HG3 0.09 0.07 0.07 -0.04 2.03 2.22 2zc7A1 PRO 88 HD2 0.09 0.08 0.19 -0.04 3.68 4.00 2zc7A1 PRO 88 HD3 0.10 0.17 0.16 -0.04 3.65 4.03 2zc7A1 VAL 89 H 0.24 0.72 0.33 -0.55 8.24 8.98 2zc7A1 VAL 89 HA 0.26 0.03 0.35 -0.75 4.13 4.01 2zc7A1 VAL 89 HB 0.34 0.08 0.13 -0.04 2.12 2.62 2zc7A1 VAL 89 HG13 0.03 -0.01 -0.16 -0.04 0.97 0.80 2zc7A1 VAL 89 HG23 0.29 0.03 -0.25 -0.04 0.95 0.98 2zc7A1 THR 90 H 0.18 0.19 -0.15 -0.55 8.28 7.95 2zc7A1 THR 90 HA 0.05 0.10 0.26 -0.75 4.39 4.06 2zc7A1 THR 90 HB 0.13 -0.06 -0.00 -0.04 4.32 4.34 2zc7A1 THR 90 HG23 0.05 -0.00 -0.21 -0.04 1.22 1.02 2zc7A1 LYS 91 H 0.09 0.53 -0.61 -0.55 8.42 7.88 2zc7A1 LYS 91 HA -0.10 0.09 0.61 -0.75 4.32 4.17 2zc7A1 LYS 91 HB2 -0.09 -0.05 0.06 -0.04 1.87 1.75 2zc7A1 LYS 91 HB3 -0.07 0.16 0.09 -0.04 1.79 1.92 2zc7A1 LYS 91 HG2 -0.94 0.02 -0.08 -0.04 1.46 0.42 2zc7A1 LYS 91 HG3 -0.48 0.01 0.04 -0.04 1.46 0.98 2zc7A1 LYS 91 HD2 -0.14 0.03 0.01 -0.04 1.69 1.55 2zc7A1 LYS 91 HD3 -0.11 -0.02 0.03 -0.04 1.68 1.53 2zc7A1 LYS 91 HE2 -0.00 -0.00 0.04 -0.04 2.99 2.98 2zc7A1 LYS 91 HE3 0.05 -0.03 0.03 -0.04 2.99 3.00 2zc7A1 TYR 92 H 0.15 0.66 -0.03 -0.55 8.29 8.52 2zc7A1 TYR 92 HA 0.00 0.17 0.77 -0.75 4.56 4.75 2zc7A1 TYR 92 HB2 0.00 0.05 0.06 -0.04 3.06 3.13 2zc7A1 TYR 92 HB3 -0.06 -0.02 0.11 -0.04 2.98 2.97 2zc7A1 TYR 92 HD2 0.00 0.08 0.02 -0.04 7.15 7.21 2zc7A1 TYR 92 HE2 0.02 0.06 -0.01 -0.04 6.85 6.87 2zc7A1 TRP 93 H 0.19 0.16 -0.23 -0.55 7.97 7.55 2zc7A1 TRP 93 HA -0.05 0.14 0.60 -0.75 4.62 4.56 2zc7A1 TRP 93 HB2 -0.12 0.05 -0.18 -0.04 3.23 2.95 2zc7A1 TRP 93 HB3 -0.20 -0.03 0.08 -0.04 3.23 3.04 2zc7A1 TRP 93 HD1 -0.06 0.01 -0.02 -0.04 7.22 7.10 2zc7A1 TRP 93 HE1 -0.04 -0.02 -0.03 -0.04 10.20 10.07 2zc7A1 TRP 93 HE3 -0.39 0.04 -0.06 -0.04 7.59 7.14 2zc7A1 TRP 93 HZ2 0.01 0.01 0.01 -0.04 7.44 7.43 2zc7A1 TRP 93 HZ3 -0.11 0.02 -0.08 -0.04 7.13 6.92 2zc7A1 TRP 93 HH2 0.15 -0.09 -0.23 -0.04 7.19 6.99 2zc7A1 PRO 94 HA 0.01 0.23 0.37 -0.51 4.44 4.54 2zc7A1 PRO 94 HB2 0.02 -0.02 -0.01 -0.04 2.28 2.22 2zc7A1 PRO 94 HB3 0.01 0.09 0.08 -0.04 2.02 2.16 2zc7A1 PRO 94 HG2 0.07 -0.04 -0.01 -0.04 2.03 2.01 2zc7A1 PRO 94 HG3 0.03 0.07 -0.00 -0.04 2.03 2.08 2zc7A1 PRO 94 HD2 0.17 0.07 -0.05 -0.04 3.68 3.84 2zc7A1 PRO 94 HD3 0.06 0.24 -0.24 -0.04 3.65 3.66 2zc7A1 GLU 95 H 0.05 0.05 -0.48 -0.55 8.60 7.68 2zc7A1 GLU 95 HA -0.10 0.10 0.40 -0.75 4.29 3.94 2zc7A1 GLU 95 HB2 -0.22 -0.00 -0.01 -0.04 2.09 1.81 2zc7A1 GLU 95 HB3 -0.13 -0.03 0.08 -0.04 1.99 1.87 2zc7A1 GLU 95 HG2 0.06 -0.02 -0.01 -0.04 2.34 2.33 2zc7A1 GLU 95 HG3 0.02 0.04 -0.07 -0.04 2.34 2.29 2zc7A1 LEU 96 H -0.39 0.59 -0.37 -0.55 8.37 7.65 2zc7A1 LEU 96 HA -0.55 -0.00 0.54 -0.75 4.35 3.59 2zc7A1 LEU 96 HB2 -0.67 0.04 0.12 -0.04 1.64 1.10 2zc7A1 LEU 96 HB3 -0.45 0.01 0.20 -0.04 1.64 1.36 2zc7A1 LEU 96 HG -1.77 0.04 -0.05 -0.04 1.64 -0.18 2zc7A1 LEU 96 HD13 -1.06 -0.03 -0.06 -0.04 0.93 -0.26 2zc7A1 LEU 96 HD23 -1.21 -0.02 -0.05 -0.04 0.89 -0.43 2zc7A1 THR 97 H -0.15 0.29 0.06 -0.55 8.28 7.93 2zc7A1 THR 97 HA -0.01 0.21 0.60 -0.75 4.39 4.43 2zc7A1 THR 97 HB -0.01 -0.05 0.07 -0.04 4.32 4.30 2zc7A1 THR 97 HG23 -0.04 0.01 -0.07 -0.04 1.22 1.08 2zc7A1 GLY 98 H 0.04 0.03 -0.07 -0.55 8.43 7.89 2zc7A1 GLY 98 HA2 0.08 0.02 0.46 -0.51 4.01 4.06 2zc7A1 GLY 98 HA3 0.20 0.13 0.35 -0.51 4.01 4.18 2zc7A1 LYS 99 H 0.05 0.13 0.21 -0.55 8.42 8.26 2zc7A1 LYS 99 HA 0.07 0.12 0.40 -0.75 4.32 4.15 2zc7A1 LYS 99 HB2 -0.01 0.01 0.12 -0.04 1.87 1.95 2zc7A1 LYS 99 HB3 0.01 0.02 0.12 -0.04 1.79 1.90 2zc7A1 LYS 99 HG2 0.02 0.04 0.07 -0.04 1.46 1.56 2zc7A1 LYS 99 HG3 0.03 -0.03 0.16 -0.04 1.46 1.57 2zc7A1 LYS 99 HD2 -0.00 0.01 0.04 -0.04 1.69 1.70 2zc7A1 LYS 99 HD3 0.00 -0.01 0.04 -0.04 1.68 1.68 2zc7A1 LYS 99 HE2 0.00 -0.01 0.06 -0.04 2.99 3.00 2zc7A1 LYS 99 HE3 -0.01 0.01 0.06 -0.04 2.99 3.01 2zc7A1 GLN 100 H 0.00 0.08 -0.19 -0.55 8.47 7.82 2zc7A1 GLN 100 HA -0.16 0.08 0.42 -0.75 4.36 3.95 2zc7A1 GLN 100 HB2 -0.58 0.05 -0.14 -0.04 2.15 1.44 2zc7A1 GLN 100 HB3 -0.46 0.03 0.13 -0.04 2.02 1.67 2zc7A1 GLN 100 HG2 -0.29 0.11 0.08 -0.04 2.40 2.26 2zc7A1 GLN 100 HG3 -0.11 -0.22 0.09 -0.04 2.39 2.11 2zc7A1 GLN 100 HE21 0.54 0.10 0.08 -0.04 6.97 7.64 2zc7A1 GLN 100 HE22 -0.13 0.36 0.07 -0.04 7.69 7.95 2zc7A1 TRP 101 H 0.23 0.26 -0.45 -0.55 7.97 7.46 2zc7A1 TRP 101 HA 0.15 0.11 0.50 -0.75 4.62 4.62 2zc7A1 TRP 101 HB2 0.04 0.29 0.01 -0.04 3.23 3.52 2zc7A1 TRP 101 HB3 0.06 -0.13 0.08 -0.04 3.23 3.21 2zc7A1 TRP 101 HD1 0.05 -0.08 -0.06 -0.04 7.22 7.09 2zc7A1 TRP 101 HE1 0.21 0.69 0.03 -0.04 10.20 11.09 2zc7A1 TRP 101 HE3 0.10 -0.06 0.05 -0.04 7.59 7.63 2zc7A1 TRP 101 HZ2 0.22 0.01 0.01 -0.04 7.44 7.64 2zc7A1 TRP 101 HZ3 -0.04 -0.07 -0.06 -0.04 7.13 6.92 2zc7A1 TRP 101 HH2 -0.31 -0.04 -0.05 -0.04 7.19 6.75 2zc7A1 GLN 102 H 0.12 0.31 -0.17 -0.55 8.47 8.18 2zc7A1 GLN 102 HA 0.20 0.75 2.61 -0.75 4.36 7.17 2zc7A1 GLN 102 HB2 0.12 0.03 0.02 -0.04 2.15 2.27 2zc7A1 GLN 102 HB3 0.09 0.02 0.06 -0.04 2.02 2.15 2zc7A1 GLN 102 HG2 0.13 -0.38 0.28 -0.04 2.40 2.38 2zc7A1 GLN 102 HG3 0.15 0.02 0.10 -0.04 2.39 2.63 2zc7A1 GLN 102 HE21 0.06 0.01 -0.00 -0.04 6.97 7.00 2zc7A1 GLN 102 HE22 0.08 0.02 -0.02 -0.04 7.69 7.74 2zc7A1 GLY 103 H 0.11 0.14 0.12 -0.55 8.43 8.26 2zc7A1 GLY 103 HA2 0.09 -0.01 0.34 -0.51 4.01 3.92 2zc7A1 GLY 103 HA3 0.07 0.22 0.73 -0.51 4.01 4.53 2zc7A1 ILE 104 H 0.15 0.15 -0.67 -0.55 8.25 7.33 2zc7A1 ILE 104 HA 0.14 0.06 0.62 -0.75 4.18 4.25 2zc7A1 ILE 104 HB 0.35 0.08 0.18 -0.04 1.89 2.46 2zc7A1 ILE 104 HG12 0.06 0.01 -0.02 -0.04 1.49 1.50 2zc7A1 ILE 104 HG13 0.04 0.15 -0.16 -0.04 1.21 1.20 2zc7A1 ILE 104 HG23 0.19 -0.04 -0.08 -0.04 0.93 0.96 2zc7A1 ILE 104 HD13 -0.32 -0.03 -0.02 -0.04 0.88 0.46 2zc7A1 ARG 105 H 0.15 0.14 0.16 -0.55 8.46 8.36 2zc7A1 ARG 105 HA 0.17 0.18 0.83 -0.75 4.34 4.77 2zc7A1 ARG 105 HB2 0.13 -0.26 0.04 -0.04 1.90 1.77 2zc7A1 ARG 105 HB3 0.12 0.30 0.02 -0.04 1.80 2.20 2zc7A1 ARG 105 HG2 0.11 0.20 -0.01 -0.04 1.67 1.93 2zc7A1 ARG 105 HG3 0.13 -0.09 -0.25 -0.04 1.67 1.42 2zc7A1 ARG 105 HD2 0.12 0.15 0.02 -0.04 3.22 3.47 2zc7A1 ARG 105 HD3 0.16 -0.16 0.05 -0.04 3.22 3.23 2zc7A1 MET 106 H 0.15 0.84 0.13 -0.55 8.47 9.05 2zc7A1 MET 106 HA 0.17 -0.03 0.44 -0.75 4.52 4.34 2zc7A1 MET 106 HB2 0.11 0.10 0.14 -0.04 2.15 2.46 2zc7A1 MET 106 HB3 0.21 -0.05 -0.05 -0.04 2.03 2.10 2zc7A1 MET 106 HG2 0.17 0.09 -0.16 -0.04 2.63 2.69 2zc7A1 MET 106 HG3 -0.19 0.02 -0.06 -0.04 2.56 2.29 2zc7A1 MET 106 HE3 -0.69 0.01 -0.12 -0.04 2.10 1.26 2zc7A1 LEU 107 H 0.06 0.75 -0.03 -0.55 8.37 8.60 2zc7A1 LEU 107 HA -0.17 0.03 0.36 -0.75 4.35 3.81 2zc7A1 LEU 107 HB2 0.02 -0.05 -0.01 -0.04 1.64 1.56 2zc7A1 LEU 107 HB3 0.10 -0.00 -0.02 -0.04 1.64 1.68 2zc7A1 LEU 107 HG 0.30 -0.02 -0.35 -0.04 1.64 1.52 2zc7A1 LEU 107 HD13 -0.18 -0.00 -0.04 -0.04 0.93 0.67 2zc7A1 LEU 107 HD23 0.00 0.02 -0.08 -0.04 0.89 0.79 2zc7A1 ASP 108 H 0.11 0.21 -0.32 -0.55 8.40 7.86 2zc7A1 ASP 108 HA 0.10 0.05 0.23 -0.75 4.63 4.26 2zc7A1 ASP 108 HB2 0.12 0.10 0.02 -0.04 2.71 2.91 2zc7A1 ASP 108 HB3 0.09 -0.09 -0.40 -0.04 2.70 2.26 2zc7A1 LEU 109 H 0.05 0.47 -0.22 -0.55 8.37 8.12 2zc7A1 LEU 109 HA 0.01 -0.04 0.44 -0.75 4.35 4.00 2zc7A1 LEU 109 HB2 0.14 0.14 0.16 -0.04 1.64 2.04 2zc7A1 LEU 109 HB3 0.12 -0.02 -0.04 -0.04 1.64 1.67 2zc7A1 LEU 109 HG 0.20 0.05 -0.08 -0.04 1.64 1.76 2zc7A1 LEU 109 HD13 0.10 -0.02 -0.15 -0.04 0.93 0.81 2zc7A1 LEU 109 HD23 0.19 -0.00 -0.02 -0.04 0.89 1.01 2zc7A1 ALA 110 H -0.36 0.66 -0.02 -0.55 8.40 8.14 2zc7A1 ALA 110 HA -0.57 -0.05 0.29 -0.75 4.34 3.25 2zc7A1 ALA 110 HB3 -1.44 0.01 0.04 -0.04 1.41 -0.03 2zc7A1 THR 111 H -0.29 0.24 -0.58 -0.55 8.28 7.10 2zc7A1 THR 111 HA -0.74 0.22 0.91 -0.75 4.39 4.03 2zc7A1 THR 111 HB 0.05 -0.02 0.06 -0.04 4.32 4.36 2zc7A1 THR 111 HG23 -0.17 0.03 -0.23 -0.04 1.22 0.81 2zc7A1 TYR 112 H -0.32 0.32 -0.08 -0.55 8.29 7.67 2zc7A1 TYR 112 HA -0.07 -0.05 0.41 -0.75 4.56 4.10 2zc7A1 TYR 112 HB2 -0.09 0.07 -0.02 -0.04 3.06 2.97 2zc7A1 TYR 112 HB3 -0.06 0.42 0.10 -0.04 2.98 3.39 2zc7A1 TYR 112 HD2 -0.08 0.07 -0.00 -0.04 7.15 7.10 2zc7A1 TYR 112 HE2 -0.07 0.03 0.04 -0.04 6.85 6.81 2zc7A1 THR 113 H -0.10 0.43 -0.00 -0.55 8.28 8.06 2zc7A1 THR 113 HA -0.18 0.51 0.71 -0.75 4.39 4.68 2zc7A1 THR 113 HB -0.49 0.14 -0.32 -0.04 4.32 3.60 2zc7A1 THR 113 HG23 0.09 -0.06 -0.07 -0.04 1.22 1.13 2zc7A1 ALA 114 H 0.03 0.14 -0.08 -0.55 8.40 7.94 2zc7A1 ALA 114 HA 0.10 0.08 0.51 -0.75 4.34 4.27 2zc7A1 ALA 114 HB3 -0.01 0.00 -0.05 -0.04 1.41 1.31 2zc7A1 GLY 115 H 0.23 0.06 -0.18 -0.55 8.43 8.00 2zc7A1 GLY 115 HA2 0.42 0.05 0.15 -0.51 4.01 4.11 2zc7A1 GLY 115 HA3 0.27 0.40 0.87 -0.51 4.01 5.04 2zc7A1 GLY 116 H 0.38 -0.08 0.05 -0.55 8.43 8.23 2zc7A1 GLY 116 HA2 0.56 0.12 0.20 -0.51 4.01 4.37 2zc7A1 GLY 116 HA3 0.30 0.15 0.85 -0.51 4.01 4.80 2zc7A1 LEU 117 H 0.02 -0.11 -0.03 -0.55 8.37 7.71 2zc7A1 LEU 117 HA -0.78 0.12 0.38 -0.75 4.35 3.32 2zc7A1 LEU 117 HB2 -0.14 -0.08 -0.01 -0.04 1.64 1.36 2zc7A1 LEU 117 HB3 -0.13 0.01 -0.20 -0.04 1.64 1.27 2zc7A1 LEU 117 HG -1.46 -0.03 -0.15 -0.04 1.64 -0.04 2zc7A1 LEU 117 HD13 -0.12 0.01 -0.09 -0.04 0.93 0.68 2zc7A1 LEU 117 HD23 -1.08 0.03 -0.09 -0.04 0.89 -0.29 2zc7A1 PRO 118 HA 0.13 0.17 0.48 -0.51 4.44 4.71 2zc7A1 PRO 118 HB2 0.11 -0.04 0.08 -0.04 2.28 2.38 2zc7A1 PRO 118 HB3 0.18 0.07 0.11 -0.04 2.02 2.34 2zc7A1 PRO 118 HG2 0.23 -0.02 -0.08 -0.04 2.03 2.12 2zc7A1 PRO 118 HG3 0.38 0.03 0.07 -0.04 2.03 2.46 2zc7A1 PRO 118 HD2 0.04 0.01 0.11 -0.04 3.68 3.80 2zc7A1 PRO 118 HD3 0.13 0.20 0.16 -0.04 3.65 4.10 2zc7A1 LEU 119 H 0.09 0.18 0.16 -0.55 8.37 8.25 2zc7A1 LEU 119 HA 0.05 0.23 0.61 -0.75 4.35 4.48 2zc7A1 LEU 119 HB2 0.08 0.15 0.20 -0.04 1.64 2.03 2zc7A1 LEU 119 HB3 0.06 -0.11 0.16 -0.04 1.64 1.71 2zc7A1 LEU 119 HG 0.05 -0.07 -0.14 -0.04 1.64 1.43 2zc7A1 LEU 119 HD13 0.17 -0.00 0.04 -0.04 0.93 1.09 2zc7A1 LEU 119 HD23 0.05 0.01 0.02 -0.04 0.89 0.94 2zc7A1 GLN 120 H 0.04 0.15 -0.12 -0.55 8.47 7.98 2zc7A1 GLN 120 HA 0.02 0.11 0.91 -0.75 4.36 4.64 2zc7A1 GLN 120 HB2 -0.02 -0.03 -0.06 -0.04 2.15 2.00 2zc7A1 GLN 120 HB3 -0.04 0.14 -0.08 -0.04 2.02 2.01 2zc7A1 GLN 120 HG2 -0.00 -0.04 -0.13 -0.04 2.40 2.19 2zc7A1 GLN 120 HG3 -0.03 0.01 -0.05 -0.04 2.39 2.27 2zc7A1 GLN 120 HE21 -0.11 0.01 -0.05 -0.04 6.97 6.78 2zc7A1 GLN 120 HE22 -0.03 0.00 -0.07 -0.04 7.69 7.55 2zc7A1 VAL 121 H 0.00 0.11 0.04 -0.55 8.24 7.84 2zc7A1 VAL 121 HA -0.40 0.11 0.54 -0.75 4.13 3.63 2zc7A1 VAL 121 HB -0.05 -0.01 0.07 -0.04 2.12 2.09 2zc7A1 VAL 121 HG13 -0.27 0.04 -0.06 -0.04 0.97 0.64 2zc7A1 VAL 121 HG23 0.03 -0.00 -0.06 -0.04 0.95 0.88 2zc7A1 PRO 122 HA -0.12 0.08 0.42 -0.51 4.44 4.31 2zc7A1 PRO 122 HB2 -0.20 -0.10 0.07 -0.04 2.28 2.01 2zc7A1 PRO 122 HB3 -0.10 0.04 0.12 -0.04 2.02 2.04 2zc7A1 PRO 122 HG2 -0.27 0.07 0.09 -0.04 2.03 1.87 2zc7A1 PRO 122 HG3 -0.15 0.10 0.09 -0.04 2.03 2.04 2zc7A1 PRO 122 HD2 -1.36 0.04 0.20 -0.04 3.68 2.53 2zc7A1 PRO 122 HD3 -0.82 0.25 0.27 -0.04 3.65 3.31 2zc7A1 ASP 123 H -0.05 0.16 0.16 -0.55 8.40 8.12 2zc7A1 ASP 123 HA -0.04 0.22 0.54 -0.75 4.63 4.59 2zc7A1 ASP 123 HB2 -0.01 0.02 0.08 -0.04 2.71 2.76 2zc7A1 ASP 123 HB3 -0.01 0.06 0.11 -0.04 2.70 2.81 2zc7A1 GLU 124 H -0.05 0.02 -0.39 -0.55 8.60 7.64 2zc7A1 GLU 124 HA -0.01 0.08 0.34 -0.75 4.29 3.94 2zc7A1 GLU 124 HB2 -0.04 0.02 -0.08 -0.04 2.09 1.95 2zc7A1 GLU 124 HB3 -0.00 0.01 0.00 -0.04 1.99 1.95 2zc7A1 GLU 124 HG2 -0.00 0.05 -0.00 -0.04 2.34 2.35 2zc7A1 GLU 124 HG3 -0.01 0.03 0.00 -0.04 2.34 2.32 2zc7A1 VAL 125 H -0.08 0.38 -0.49 -0.55 8.24 7.49 2zc7A1 VAL 125 HA -0.01 -0.05 0.54 -0.75 4.13 3.86 2zc7A1 VAL 125 HB -0.16 0.25 0.08 -0.04 2.12 2.25 2zc7A1 VAL 125 HG13 -0.00 -0.06 -0.23 -0.04 0.97 0.64 2zc7A1 VAL 125 HG23 -0.15 -0.01 -0.12 -0.04 0.95 0.64 2zc7A1 LYS 126 H 0.01 0.10 0.21 -0.55 8.42 8.19 2zc7A1 LYS 126 HA 0.01 0.22 0.89 -0.75 4.32 4.69 2zc7A1 LYS 126 HB2 0.01 -0.00 0.06 -0.04 1.87 1.90 2zc7A1 LYS 126 HB3 0.01 -0.03 0.06 -0.04 1.79 1.79 2zc7A1 LYS 126 HG2 0.01 -0.03 -0.04 -0.04 1.46 1.36 2zc7A1 LYS 126 HG3 0.00 0.13 -0.35 -0.04 1.46 1.19 2zc7A1 LYS 126 HD2 0.00 0.16 -0.10 -0.04 1.69 1.71 2zc7A1 LYS 126 HD3 0.01 -0.08 -0.02 -0.04 1.68 1.55 2zc7A1 LYS 126 HE2 0.01 -0.05 -0.01 -0.04 2.99 2.89 2zc7A1 LYS 126 HE3 0.01 -0.05 -0.03 -0.04 2.99 2.88 2zc7A1 ASP 127 H 0.04 0.03 0.11 -0.55 8.40 8.03 2zc7A1 ASP 127 HA 0.03 0.24 0.48 -0.75 4.63 4.63 2zc7A1 ASP 127 HB2 0.03 -0.05 0.24 -0.04 2.71 2.88 2zc7A1 ASP 127 HB3 0.03 0.21 -0.07 -0.04 2.70 2.82 2zc7A1 ASN 128 H 0.05 0.24 0.16 -0.55 8.53 8.43 2zc7A1 ASN 128 HA 0.15 0.12 0.44 -0.75 4.76 4.72 2zc7A1 ASN 128 HB2 0.07 -0.02 0.16 -0.04 2.88 3.05 2zc7A1 ASN 128 HB3 0.13 0.09 -0.04 -0.04 2.79 2.93 2zc7A1 ASN 128 HD21 -0.03 0.05 0.02 -0.04 7.03 7.03 2zc7A1 ASN 128 HD22 0.01 -0.07 0.08 -0.04 7.74 7.73 2zc7A1 ALA 129 H 0.09 0.08 -0.08 -0.55 8.40 7.95 2zc7A1 ALA 129 HA 0.11 0.17 0.56 -0.75 4.34 4.43 2zc7A1 ALA 129 HB3 0.06 0.03 0.06 -0.04 1.41 1.52 2zc7A1 SER 130 H 0.07 0.05 -0.11 -0.55 8.46 7.92 2zc7A1 SER 130 HA 0.07 0.14 0.41 -0.75 4.49 4.36 2zc7A1 SER 130 HB2 0.04 0.09 0.04 -0.04 3.95 4.08 2zc7A1 SER 130 HB3 0.04 0.07 0.09 -0.04 3.93 4.10 2zc7A1 LEU 131 H 0.16 0.24 -0.43 -0.55 8.37 7.80 2zc7A1 LEU 131 HA 0.20 0.08 0.42 -0.75 4.35 4.29 2zc7A1 LEU 131 HB2 0.17 0.03 0.00 -0.04 1.64 1.81 2zc7A1 LEU 131 HB3 0.35 0.05 0.08 -0.04 1.64 2.08 2zc7A1 LEU 131 HG 0.72 0.03 -0.12 -0.04 1.64 2.24 2zc7A1 LEU 131 HD13 0.21 -0.00 -0.06 -0.04 0.93 1.04 2zc7A1 LEU 131 HD23 0.21 -0.01 -0.09 -0.04 0.89 0.96 2zc7A1 LEU 132 H 0.26 0.38 -0.16 -0.55 8.37 8.31 2zc7A1 LEU 132 HA -0.37 0.04 0.39 -0.75 4.35 3.64 2zc7A1 LEU 132 HB2 0.18 0.19 0.29 -0.04 1.64 2.26 2zc7A1 LEU 132 HB3 -0.01 0.02 0.14 -0.04 1.64 1.75 2zc7A1 LEU 132 HG -0.18 -0.02 -0.00 -0.04 1.64 1.40 2zc7A1 LEU 132 HD13 -0.08 -0.01 -0.02 -0.04 0.93 0.79 2zc7A1 LEU 132 HD23 -0.79 -0.00 -0.15 -0.04 0.89 -0.09 2zc7A1 ARG 133 H 0.06 0.54 -0.06 -0.55 8.46 8.44 2zc7A1 ARG 133 HA 0.01 0.02 0.39 -0.75 4.34 4.01 2zc7A1 ARG 133 HB2 0.08 0.06 0.08 -0.04 1.90 2.08 2zc7A1 ARG 133 HB3 0.06 -0.00 0.02 -0.04 1.80 1.83 2zc7A1 ARG 133 HG2 0.02 -0.01 0.03 -0.04 1.67 1.66 2zc7A1 ARG 133 HG3 0.04 0.19 0.05 -0.04 1.67 1.91 2zc7A1 ARG 133 HD2 0.04 -0.02 -0.04 -0.04 3.22 3.16 2zc7A1 ARG 133 HD3 0.03 0.02 -0.02 -0.04 3.22 3.21 2zc7A1 PHE 134 H 0.19 0.26 -0.52 -0.55 8.34 7.72 2zc7A1 PHE 134 HA 0.02 0.02 0.38 -0.75 4.62 4.29 2zc7A1 PHE 134 HB2 -0.05 -0.05 0.11 -0.04 3.15 3.11 2zc7A1 PHE 134 HB3 -0.13 0.05 0.25 -0.04 3.06 3.19 2zc7A1 PHE 134 HD2 -0.41 -0.00 0.03 -0.04 7.28 6.86 2zc7A1 PHE 134 HE2 -0.29 -0.00 -0.00 -0.04 7.38 7.04 2zc7A1 PHE 134 HZ -0.14 0.02 -0.01 -0.04 7.32 7.15 2zc7A1 TYR 135 H -0.00 0.45 -0.09 -0.55 8.29 8.10 2zc7A1 TYR 135 HA -0.09 0.05 0.38 -0.75 4.56 4.15 2zc7A1 TYR 135 HB2 -0.33 0.06 0.13 -0.04 3.06 2.88 2zc7A1 TYR 135 HB3 -0.28 -0.01 0.00 -0.04 2.98 2.66 2zc7A1 TYR 135 HD2 0.20 0.03 -0.05 -0.04 7.15 7.29 2zc7A1 TYR 135 HE2 0.21 -0.04 -0.05 -0.04 6.85 6.93 2zc7A1 GLN 136 H 0.01 0.52 -0.07 -0.55 8.47 8.38 2zc7A1 GLN 136 HA 0.17 -0.04 0.49 -0.75 4.36 4.22 2zc7A1 GLN 136 HB2 -0.00 0.05 0.15 -0.04 2.15 2.31 2zc7A1 GLN 136 HB3 0.02 -0.05 0.01 -0.04 2.02 1.96 2zc7A1 GLN 136 HG2 -0.23 0.12 0.03 -0.04 2.40 2.28 2zc7A1 GLN 136 HG3 -0.11 -0.06 -0.03 -0.04 2.39 2.15 2zc7A1 GLN 136 HE21 -0.13 -0.60 0.29 -0.04 6.97 6.48 2zc7A1 GLN 136 HE22 -0.17 0.13 0.17 -0.04 7.69 7.77 2zc7A1 ASN 137 H 0.09 0.47 -0.21 -0.55 8.53 8.33 2zc7A1 ASN 137 HA 0.06 0.12 0.72 -0.75 4.76 4.91 2zc7A1 ASN 137 HB2 0.08 0.12 0.10 -0.04 2.88 3.15 2zc7A1 ASN 137 HB3 0.06 -0.07 0.11 -0.04 2.79 2.85 2zc7A1 ASN 137 HD21 0.02 -0.06 -0.03 -0.04 7.03 6.92 2zc7A1 ASN 137 HD22 0.02 0.03 0.03 -0.04 7.74 7.78 2zc7A1 TRP 138 H 0.25 0.19 -0.36 -0.55 7.97 7.51 2zc7A1 TRP 138 HA -0.08 -0.03 0.52 -0.75 4.62 4.28 2zc7A1 TRP 138 HB2 -0.35 -0.03 0.04 -0.04 3.23 2.86 2zc7A1 TRP 138 HB3 -0.04 0.09 0.09 -0.04 3.23 3.33 2zc7A1 TRP 138 HD1 -0.04 -0.04 -0.07 -0.04 7.22 7.03 2zc7A1 TRP 138 HE1 -0.07 0.31 -0.58 -0.04 10.20 9.82 2zc7A1 TRP 138 HE3 -0.34 0.12 -0.11 -0.04 7.59 7.21 2zc7A1 TRP 138 HZ2 -0.11 -0.16 -0.90 -0.04 7.44 6.22 2zc7A1 TRP 138 HZ3 -1.52 0.02 -0.17 -0.04 7.13 5.42 2zc7A1 TRP 138 HH2 -0.35 0.21 -0.30 -0.04 7.19 6.70 2zc7A1 GLN 139 H -0.42 0.14 0.12 -0.55 8.47 7.76 2zc7A1 GLN 139 HA -0.73 0.20 0.88 -0.75 4.36 3.95 2zc7A1 GLN 139 HB2 -0.25 0.02 -0.03 -0.04 2.15 1.85 2zc7A1 GLN 139 HB3 -0.31 -0.06 0.14 -0.04 2.02 1.76 2zc7A1 GLN 139 HG2 -0.22 -0.09 -0.01 -0.04 2.40 2.04 2zc7A1 GLN 139 HG3 -0.37 0.20 -0.09 -0.04 2.39 2.10 2zc7A1 GLN 139 HE21 -0.18 -0.07 0.00 -0.04 6.97 6.68 2zc7A1 GLN 139 HE22 -0.20 -0.00 -0.00 -0.04 7.69 7.44 2zc7A1 PRO 140 HA -0.74 0.05 0.30 -0.51 4.44 3.53 2zc7A1 PRO 140 HB2 -0.44 -0.02 -0.06 -0.04 2.28 1.72 2zc7A1 PRO 140 HB3 -0.39 0.14 0.10 -0.04 2.02 1.82 2zc7A1 PRO 140 HG2 -0.60 0.01 0.08 -0.04 2.03 1.47 2zc7A1 PRO 140 HG3 -1.39 0.05 -0.02 -0.04 2.03 0.64 2zc7A1 PRO 140 HD2 -0.73 0.03 0.22 -0.04 3.68 3.16 2zc7A1 PRO 140 HD3 -1.55 0.33 0.06 -0.04 3.65 2.44 2zc7A1 GLN 141 H -0.50 0.58 0.40 -0.55 8.47 8.40 2zc7A1 GLN 141 HA -0.56 0.19 1.00 -0.75 4.36 4.24 2zc7A1 GLN 141 HB2 -2.19 -0.01 0.09 -0.04 2.15 0.00 2zc7A1 GLN 141 HB3 -1.11 -0.07 0.10 -0.04 2.02 0.90 2zc7A1 GLN 141 HG2 -0.44 0.09 0.01 -0.04 2.40 2.02 2zc7A1 GLN 141 HG3 -0.47 -0.07 0.03 -0.04 2.39 1.84 2zc7A1 GLN 141 HE21 -0.18 -0.07 -0.02 -0.04 6.97 6.66 2zc7A1 GLN 141 HE22 -0.17 -0.03 -0.00 -0.04 7.69 7.46 2zc7A1 TRP 142 H -0.25 0.31 0.18 -0.55 7.97 7.67 2zc7A1 TRP 142 HA -0.03 0.15 0.78 -0.75 4.62 4.76 2zc7A1 TRP 142 HB2 0.01 -0.04 -0.06 -0.04 3.23 3.10 2zc7A1 TRP 142 HB3 -0.00 -0.03 0.05 -0.04 3.23 3.20 2zc7A1 TRP 142 HD1 -0.01 0.01 -0.07 -0.04 7.22 7.11 2zc7A1 TRP 142 HE1 0.00 -0.01 -0.08 -0.04 10.20 10.07 2zc7A1 TRP 142 HE3 0.05 -0.13 -0.37 -0.04 7.59 7.09 2zc7A1 TRP 142 HZ2 0.02 0.01 -0.04 -0.04 7.44 7.38 2zc7A1 TRP 142 HZ3 0.07 -0.04 -0.17 -0.04 7.13 6.95 2zc7A1 TRP 142 HH2 0.04 0.03 -0.03 -0.04 7.19 7.19 2zc7A1 LYS 143 H 0.19 0.06 0.09 -0.55 8.42 8.20 2zc7A1 LYS 143 HA 0.03 0.14 0.44 -0.75 4.32 4.18 2zc7A1 LYS 143 HB2 0.10 -0.04 0.03 -0.04 1.87 1.92 2zc7A1 LYS 143 HB3 0.06 0.10 0.08 -0.04 1.79 1.99 2zc7A1 LYS 143 HG2 0.07 -0.07 0.05 -0.04 1.46 1.48 2zc7A1 LYS 143 HG3 0.05 -0.01 0.02 -0.04 1.46 1.48 2zc7A1 LYS 143 HD2 0.01 0.04 0.02 -0.04 1.69 1.72 2zc7A1 LYS 143 HD3 -0.01 0.04 -0.11 -0.04 1.68 1.56 2zc7A1 LYS 143 HE2 -0.02 -0.00 -0.03 -0.04 2.99 2.90 2zc7A1 LYS 143 HE3 -0.01 0.00 -0.04 -0.04 2.99 2.89 2zc7A1 PRO 144 HA 0.12 0.06 0.45 -0.51 4.44 4.55 2zc7A1 PRO 144 HB2 0.11 0.06 -0.12 -0.04 2.28 2.28 2zc7A1 PRO 144 HB3 0.09 0.07 0.05 -0.04 2.02 2.20 2zc7A1 PRO 144 HG2 0.07 -0.02 0.05 -0.04 2.03 2.08 2zc7A1 PRO 144 HG3 0.04 0.16 -0.00 -0.04 2.03 2.18 2zc7A1 PRO 144 HD2 0.04 0.01 0.23 -0.04 3.68 3.91 2zc7A1 PRO 144 HD3 0.00 0.20 0.22 -0.04 3.65 4.03 2zc7A1 GLY 145 H 0.10 0.63 0.32 -0.55 8.43 8.93 2zc7A1 GLY 145 HA2 0.29 -0.03 0.31 -0.51 4.01 4.07 2zc7A1 GLY 145 HA3 0.32 0.08 0.50 -0.51 4.01 4.40 2zc7A1 THR 146 H 0.03 0.05 0.00 -0.55 8.28 7.82 2zc7A1 THR 146 HA 0.13 0.35 1.17 -0.75 4.39 5.29 2zc7A1 THR 146 HB 0.05 -0.07 0.02 -0.04 4.32 4.27 2zc7A1 THR 146 HG23 0.11 0.02 -0.23 -0.04 1.22 1.08 2zc7A1 THR 147 H -0.08 0.06 0.14 -0.55 8.28 7.85 2zc7A1 THR 147 HA -0.28 0.25 1.03 -0.75 4.39 4.64 2zc7A1 THR 147 HB -0.10 -0.09 -0.04 -0.04 4.32 4.04 2zc7A1 THR 147 HG23 -1.24 0.02 -0.34 -0.04 1.22 -0.39 2zc7A1 ARG 148 H -0.27 0.83 0.25 -0.55 8.46 8.72 2zc7A1 ARG 148 HA -0.17 0.26 0.78 -0.75 4.34 4.45 2zc7A1 ARG 148 HB2 -0.29 -0.05 -0.08 -0.04 1.90 1.44 2zc7A1 ARG 148 HB3 -0.14 0.03 0.12 -0.04 1.80 1.76 2zc7A1 ARG 148 HG2 0.02 -0.05 -0.20 -0.04 1.67 1.40 2zc7A1 ARG 148 HG3 0.01 0.17 -0.05 -0.04 1.67 1.76 2zc7A1 ARG 148 HD2 0.01 -0.04 -0.09 -0.04 3.22 3.06 2zc7A1 ARG 148 HD3 0.01 -0.00 -0.07 -0.04 3.22 3.12 2zc7A1 LEU 149 H 0.03 0.86 0.31 -0.55 8.37 9.02 2zc7A1 LEU 149 HA -0.00 0.25 0.58 -0.75 4.35 4.42 2zc7A1 LEU 149 HB2 0.16 -0.05 -0.07 -0.04 1.64 1.64 2zc7A1 LEU 149 HB3 0.20 -0.13 0.10 -0.04 1.64 1.77 2zc7A1 LEU 149 HG 0.11 0.13 -0.28 -0.04 1.64 1.57 2zc7A1 LEU 149 HD13 0.12 0.02 -0.14 -0.04 0.93 0.89 2zc7A1 LEU 149 HD23 0.29 0.01 -0.12 -0.04 0.89 1.03 2zc7A1 TYR 150 H 0.03 0.29 -0.01 -0.55 8.29 8.05 2zc7A1 TYR 150 HA -0.86 -0.03 0.45 -0.75 4.56 3.37 2zc7A1 TYR 150 HB2 -0.26 0.18 0.20 -0.04 3.06 3.14 2zc7A1 TYR 150 HB3 -0.16 -0.02 0.19 -0.04 2.98 2.94 2zc7A1 TYR 150 HD2 -0.36 -0.00 -0.05 -0.04 7.15 6.70 2zc7A1 TYR 150 HE2 -0.05 -0.01 0.02 -0.04 6.85 6.78 2zc7A1 ALA 151 H -0.90 0.14 0.24 -0.55 8.40 7.33 2zc7A1 ALA 151 HA -0.12 0.11 0.93 -0.75 4.34 4.51 2zc7A1 ALA 151 HB3 0.05 0.07 -0.28 -0.04 1.41 1.20 2zc7A1 ASN 152 H -0.02 0.88 0.39 -0.55 8.53 9.24 2zc7A1 ASN 152 HA 0.04 0.06 0.49 -0.75 4.76 4.60 2zc7A1 ASN 152 HB2 0.08 0.07 0.30 -0.04 2.88 3.29 2zc7A1 ASN 152 HB3 0.19 -0.09 0.04 -0.04 2.79 2.90 2zc7A1 ASN 152 HD21 -0.04 -0.01 -0.00 -0.04 7.03 6.94 2zc7A1 ASN 152 HD22 -0.01 -0.08 0.06 -0.04 7.74 7.67 2zc7A1 ALA 153 H 0.08 0.41 -0.20 -0.55 8.40 8.15 2zc7A1 ALA 153 HA 0.23 -0.01 0.30 -0.75 4.34 4.10 2zc7A1 ALA 153 HB3 0.23 0.05 -0.15 -0.04 1.41 1.49 2zc7A1 SER 154 H 0.10 0.20 -0.61 -0.55 8.46 7.60 2zc7A1 SER 154 HA 0.08 0.08 0.65 -0.75 4.49 4.54 2zc7A1 SER 154 HB2 0.04 -0.07 0.06 -0.04 3.95 3.94 2zc7A1 SER 154 HB3 0.17 0.11 0.22 -0.04 3.93 4.39 2zc7A1 ILE 155 H 0.11 0.36 0.16 -0.55 8.25 8.33 2zc7A1 ILE 155 HA 0.05 0.02 0.31 -0.75 4.18 3.80 2zc7A1 ILE 155 HB -0.15 0.13 0.17 -0.04 1.89 1.99 2zc7A1 ILE 155 HG12 0.10 -0.06 -0.01 -0.04 1.49 1.48 2zc7A1 ILE 155 HG13 0.03 -0.08 0.10 -0.04 1.21 1.22 2zc7A1 ILE 155 HG23 0.12 0.04 0.03 -0.04 0.93 1.08 2zc7A1 ILE 155 HD13 -0.04 0.06 0.10 -0.04 0.88 0.96 2zc7A1 GLY 156 H 0.08 0.57 -0.29 -0.55 8.43 8.23 2zc7A1 GLY 156 HA2 -0.06 -0.06 0.28 -0.51 4.01 3.65 2zc7A1 GLY 156 HA3 0.02 0.12 0.29 -0.51 4.01 3.93 2zc7A1 LEU 157 H 0.09 0.38 -0.38 -0.55 8.37 7.90 2zc7A1 LEU 157 HA -0.06 -0.08 0.37 -0.75 4.35 3.83 2zc7A1 LEU 157 HB2 0.01 0.04 0.09 -0.04 1.64 1.74 2zc7A1 LEU 157 HB3 -0.03 0.17 0.12 -0.04 1.64 1.86 2zc7A1 LEU 157 HG -0.11 -0.03 -0.17 -0.04 1.64 1.28 2zc7A1 LEU 157 HD13 -0.19 -0.03 -0.01 -0.04 0.93 0.65 2zc7A1 LEU 157 HD23 -0.55 0.01 -0.05 -0.04 0.89 0.26 2zc7A1 PHE 158 H 0.13 0.53 -0.14 -0.55 8.34 8.30 2zc7A1 PHE 158 HA -0.09 0.00 0.37 -0.75 4.62 4.15 2zc7A1 PHE 158 HB2 -0.08 -0.07 -0.21 -0.04 3.15 2.75 2zc7A1 PHE 158 HB3 -0.08 0.17 0.03 -0.04 3.06 3.13 2zc7A1 PHE 158 HD2 -0.08 0.02 -0.06 -0.04 7.28 7.11 2zc7A1 PHE 158 HE2 -0.07 0.01 -0.10 -0.04 7.38 7.17 2zc7A1 PHE 158 HZ -0.06 0.02 -0.11 -0.04 7.32 7.12 2zc7A1 GLY 159 H -0.01 0.58 -0.32 -0.55 8.43 8.14 2zc7A1 GLY 159 HA2 -0.22 0.05 0.32 -0.51 4.01 3.64 2zc7A1 GLY 159 HA3 -0.16 0.05 0.28 -0.51 4.01 3.67 2zc7A1 ALA 160 H -0.20 0.47 -0.04 -0.55 8.40 8.08 2zc7A1 ALA 160 HA -0.11 -0.07 0.42 -0.75 4.34 3.82 2zc7A1 ALA 160 HB3 -0.22 -0.01 0.08 -0.04 1.41 1.22 2zc7A1 LEU 161 H -0.23 0.61 -0.20 -0.55 8.37 8.00 2zc7A1 LEU 161 HA -0.19 0.07 0.60 -0.75 4.35 4.08 2zc7A1 LEU 161 HB2 -0.19 0.21 0.14 -0.04 1.64 1.76 2zc7A1 LEU 161 HB3 -0.21 -0.02 -0.02 -0.04 1.64 1.35 2zc7A1 LEU 161 HG 0.03 0.00 -0.13 -0.04 1.64 1.49 2zc7A1 LEU 161 HD13 -0.43 -0.01 -0.12 -0.04 0.93 0.33 2zc7A1 LEU 161 HD23 0.01 -0.01 -0.12 -0.04 0.89 0.73 2zc7A1 ALA 162 H -0.46 0.67 -0.05 -0.55 8.40 8.01 2zc7A1 ALA 162 HA -0.45 -0.01 0.28 -0.75 4.34 3.40 2zc7A1 ALA 162 HB3 -0.70 0.01 0.04 -0.04 1.41 0.73 2zc7A1 VAL 163 H -0.16 0.24 -0.52 -0.55 8.24 7.26 2zc7A1 VAL 163 HA -0.11 0.12 0.58 -0.75 4.13 3.96 2zc7A1 VAL 163 HB -0.10 -0.00 -0.01 -0.04 2.12 1.96 2zc7A1 VAL 163 HG13 -0.14 0.00 -0.06 -0.04 0.97 0.74 2zc7A1 VAL 163 HG23 -0.03 -0.02 -0.12 -0.04 0.95 0.74 2zc7A1 LYS 164 H -0.08 0.49 -0.22 -0.55 8.42 8.05 2zc7A1 LYS 164 HA -0.06 0.00 0.50 -0.75 4.32 4.02 2zc7A1 LYS 164 HB2 0.01 0.22 0.20 -0.04 1.87 2.26 2zc7A1 LYS 164 HB3 -0.02 -0.05 0.07 -0.04 1.79 1.75 2zc7A1 LYS 164 HG2 -0.10 -0.13 0.06 -0.04 1.46 1.25 2zc7A1 LYS 164 HG3 -0.13 0.17 0.13 -0.04 1.46 1.59 2zc7A1 LYS 164 HD2 -0.14 0.04 0.13 -0.04 1.69 1.68 2zc7A1 LYS 164 HD3 -0.07 0.03 0.11 -0.04 1.68 1.72 2zc7A1 LYS 164 HE2 -0.20 -0.11 0.03 -0.04 2.99 2.67 2zc7A1 LYS 164 HE3 -0.43 -0.09 0.00 -0.04 2.99 2.43 2zc7A1 PRO 165 HA 0.01 0.08 0.46 -0.51 4.44 4.48 2zc7A1 PRO 165 HB2 0.03 -0.01 -0.03 -0.04 2.28 2.23 2zc7A1 PRO 165 HB3 0.05 0.05 0.13 -0.04 2.02 2.21 2zc7A1 PRO 165 HG2 0.21 0.14 -0.01 -0.04 2.03 2.33 2zc7A1 PRO 165 HG3 0.16 -0.01 0.02 -0.04 2.03 2.16 2zc7A1 PRO 165 HD2 -0.02 0.31 -0.13 -0.04 3.68 3.81 2zc7A1 PRO 165 HD3 0.07 0.15 0.06 -0.04 3.65 3.89 2zc7A1 SER 166 H -0.04 0.28 -0.56 -0.55 8.46 7.60 2zc7A1 SER 166 HA -0.03 0.13 0.54 -0.75 4.49 4.38 2zc7A1 SER 166 HB2 -0.06 -0.05 0.04 -0.04 3.95 3.84 2zc7A1 SER 166 HB3 -0.06 0.03 0.03 -0.04 3.93 3.89 2zc7A1 GLY 167 H -0.04 0.31 -0.17 -0.55 8.43 7.99 2zc7A1 GLY 167 HA2 -0.03 0.07 0.28 -0.51 4.01 3.82 2zc7A1 GLY 167 HA3 -0.03 0.07 0.47 -0.51 4.01 4.01 2zc7A1 MET 168 H -0.06 0.13 -0.23 -0.55 8.47 7.76 2zc7A1 MET 168 HA -0.05 0.13 0.80 -0.75 4.52 4.65 2zc7A1 MET 168 HB2 -0.10 0.03 -0.03 -0.04 2.15 2.01 2zc7A1 MET 168 HB3 -0.09 -0.15 -0.03 -0.04 2.03 1.72 2zc7A1 MET 168 HG2 -0.06 -0.00 -0.15 -0.04 2.63 2.38 2zc7A1 MET 168 HG3 -0.06 0.16 -0.26 -0.04 2.56 2.36 2zc7A1 MET 168 HE3 -0.08 0.02 -0.03 -0.04 2.10 1.97 2zc7A1 SER 169 H -0.05 0.09 0.14 -0.55 8.46 8.09 2zc7A1 SER 169 HA -0.04 0.18 0.49 -0.75 4.49 4.36 2zc7A1 SER 169 HB2 -0.02 -0.04 0.16 -0.04 3.95 4.00 2zc7A1 SER 169 HB3 -0.03 0.14 0.15 -0.04 3.93 4.15 2zc7A1 TYR 170 H 0.05 0.15 0.13 -0.55 8.29 8.07 2zc7A1 TYR 170 HA -0.13 0.23 0.35 -0.75 4.56 4.25 2zc7A1 TYR 170 HB2 -0.12 0.10 0.06 -0.04 3.06 3.06 2zc7A1 TYR 170 HB3 -0.11 -0.11 0.05 -0.04 2.98 2.78 2zc7A1 TYR 170 HD2 -0.13 0.07 -0.27 -0.04 7.15 6.77 2zc7A1 TYR 170 HE2 -0.12 0.09 -0.16 -0.04 6.85 6.61 2zc7A1 GLU 171 H 0.02 0.06 -0.11 -0.55 8.60 8.02 2zc7A1 GLU 171 HA -0.08 0.10 0.28 -0.75 4.29 3.83 2zc7A1 GLU 171 HB2 0.02 -0.00 0.06 -0.04 2.09 2.13 2zc7A1 GLU 171 HB3 -0.01 -0.02 0.07 -0.04 1.99 1.98 2zc7A1 GLU 171 HG2 -0.01 0.06 -0.23 -0.04 2.34 2.12 2zc7A1 GLU 171 HG3 0.01 -0.02 0.04 -0.04 2.34 2.32 2zc7A1 GLN 172 H -0.09 -0.01 -0.41 -0.55 8.47 7.42 2zc7A1 GLN 172 HA -0.09 0.08 0.31 -0.75 4.36 3.90 2zc7A1 GLN 172 HB2 -0.06 -0.05 0.06 -0.04 2.15 2.07 2zc7A1 GLN 172 HB3 -0.08 0.01 0.06 -0.04 2.02 1.97 2zc7A1 GLN 172 HG2 -0.08 -0.00 -0.10 -0.04 2.40 2.18 2zc7A1 GLN 172 HG3 -0.05 0.00 0.01 -0.04 2.39 2.31 2zc7A1 GLN 172 HE21 -0.05 0.08 -0.06 -0.04 6.97 6.90 2zc7A1 GLN 172 HE22 -0.05 -0.01 -0.06 -0.04 7.69 7.52 2zc7A1 ALA 173 H -0.21 0.61 -0.23 -0.55 8.40 8.03 2zc7A1 ALA 173 HA -0.17 0.04 0.36 -0.75 4.34 3.81 2zc7A1 ALA 173 HB3 -0.27 0.03 0.00 -0.04 1.41 1.14 2zc7A1 ILE 174 H -0.58 0.57 -0.07 -0.55 8.25 7.62 2zc7A1 ILE 174 HA -0.49 0.06 0.32 -0.75 4.18 3.32 2zc7A1 ILE 174 HB -0.87 0.04 0.00 -0.04 1.89 1.02 2zc7A1 ILE 174 HG12 -1.41 -0.01 -0.17 -0.04 1.49 -0.14 2zc7A1 ILE 174 HG13 -1.13 -0.10 -0.00 -0.04 1.21 -0.07 2zc7A1 ILE 174 HG23 -0.47 0.03 -0.05 -0.04 0.93 0.40 2zc7A1 ILE 174 HD13 -0.14 0.02 -0.15 -0.04 0.88 0.56 2zc7A1 THR 175 H -0.37 0.44 -0.31 -0.55 8.28 7.48 2zc7A1 THR 175 HA -0.30 -0.01 0.43 -0.75 4.39 3.75 2zc7A1 THR 175 HB -0.11 0.08 0.18 -0.04 4.32 4.42 2zc7A1 THR 175 HG23 0.02 -0.00 -0.05 -0.04 1.22 1.15 2zc7A1 THR 176 H -0.16 0.66 0.04 -0.55 8.28 8.27 2zc7A1 THR 176 HA -0.07 0.01 0.51 -0.75 4.39 4.09 2zc7A1 THR 176 HB -0.10 0.08 0.12 -0.04 4.32 4.38 2zc7A1 THR 176 HG23 -0.05 -0.01 -0.09 -0.04 1.22 1.03 2zc7A1 ARG 177 H -0.17 0.61 -0.10 -0.55 8.46 8.24 2zc7A1 ARG 177 HA -0.05 0.14 0.70 -0.75 4.34 4.37 2zc7A1 ARG 177 HB2 -0.11 0.01 -0.05 -0.04 1.90 1.71 2zc7A1 ARG 177 HB3 -0.05 -0.05 0.02 -0.04 1.80 1.67 2zc7A1 ARG 177 HG2 -0.09 -0.15 -0.19 -0.04 1.67 1.20 2zc7A1 ARG 177 HG3 -0.13 0.03 0.04 -0.04 1.67 1.57 2zc7A1 ARG 177 HD2 -0.05 -0.01 -0.05 -0.04 3.22 3.07 2zc7A1 ARG 177 HD3 -0.06 -0.02 -0.06 -0.04 3.22 3.04 2zc7A1 VAL 178 H -0.19 0.27 -0.14 -0.55 8.24 7.63 2zc7A1 VAL 178 HA 0.08 0.19 0.92 -0.75 4.13 4.56 2zc7A1 VAL 178 HB -0.27 0.07 0.14 -0.04 2.12 2.03 2zc7A1 VAL 178 HG13 0.30 -0.01 -0.15 -0.04 0.97 1.08 2zc7A1 VAL 178 HG23 0.04 -0.01 -0.25 -0.04 0.95 0.70 2zc7A1 PHE 179 H -0.36 0.55 0.23 -0.55 8.34 8.21 2zc7A1 PHE 179 HA -0.08 0.00 0.27 -0.75 4.62 4.06 2zc7A1 PHE 179 HB2 -0.19 0.02 0.22 -0.04 3.15 3.16 2zc7A1 PHE 179 HB3 -0.27 0.19 0.07 -0.04 3.06 3.01 2zc7A1 PHE 179 HD2 -0.24 -0.00 -0.07 -0.04 7.28 6.93 2zc7A1 PHE 179 HE2 -0.73 -0.08 -0.19 -0.04 7.38 6.33 2zc7A1 PHE 179 HZ -0.58 -0.04 -0.21 -0.04 7.32 6.45 2zc7A1 LYS 180 H 0.01 0.67 0.05 -0.55 8.42 8.60 2zc7A1 LYS 180 HA -0.02 -0.03 0.28 -0.75 4.32 3.79 2zc7A1 LYS 180 HB2 -0.02 0.15 0.11 -0.04 1.87 2.07 2zc7A1 LYS 180 HB3 -0.02 -0.05 -0.04 -0.04 1.79 1.64 2zc7A1 LYS 180 HG2 -0.03 0.04 -0.11 -0.04 1.46 1.32 2zc7A1 LYS 180 HG3 -0.03 -0.06 -0.04 -0.04 1.46 1.30 2zc7A1 LYS 180 HD2 -0.06 -0.04 -0.24 -0.04 1.69 1.31 2zc7A1 LYS 180 HD3 -0.01 0.00 -0.04 -0.04 1.68 1.59 2zc7A1 LYS 180 HE2 -0.16 0.02 -0.04 -0.04 2.99 2.78 2zc7A1 LYS 180 HE3 -0.04 -0.04 -0.04 -0.04 2.99 2.84 2zc7A1 PRO 181 HA 0.01 0.02 0.33 -0.51 4.44 4.30 2zc7A1 PRO 181 HB2 0.04 0.08 -0.15 -0.04 2.28 2.22 2zc7A1 PRO 181 HB3 0.02 -0.06 0.04 -0.04 2.02 1.98 2zc7A1 PRO 181 HG2 0.00 0.17 -0.23 -0.04 2.03 1.94 2zc7A1 PRO 181 HG3 -0.01 0.04 0.03 -0.04 2.03 2.05 2zc7A1 PRO 181 HD2 0.02 0.06 -0.83 -0.04 3.68 2.88 2zc7A1 PRO 181 HD3 -0.02 0.18 -0.16 -0.04 3.65 3.61 2zc7A1 LEU 182 H 0.08 0.31 -0.72 -0.55 8.37 7.49 2zc7A1 LEU 182 HA 0.07 0.13 0.60 -0.75 4.35 4.39 2zc7A1 LEU 182 HB2 0.20 0.09 0.01 -0.04 1.64 1.89 2zc7A1 LEU 182 HB3 0.19 -0.06 0.04 -0.04 1.64 1.77 2zc7A1 LEU 182 HG 0.18 0.14 -0.05 -0.04 1.64 1.86 2zc7A1 LEU 182 HD13 0.46 -0.03 -0.08 -0.04 0.93 1.24 2zc7A1 LEU 182 HD23 0.09 -0.01 -0.16 -0.04 0.89 0.77 2zc7A1 LYS 183 H 0.02 0.55 -0.31 -0.55 8.42 8.12 2zc7A1 LYS 183 HA -0.04 0.04 0.26 -0.75 4.32 3.83 2zc7A1 LYS 183 HB2 0.01 0.12 -0.06 -0.04 1.87 1.89 2zc7A1 LYS 183 HB3 -0.01 -0.12 0.19 -0.04 1.79 1.80 2zc7A1 LYS 183 HG2 -0.01 -0.09 0.01 -0.04 1.46 1.33 2zc7A1 LYS 183 HG3 -0.01 0.18 -0.02 -0.04 1.46 1.58 2zc7A1 LYS 183 HD2 0.00 0.12 -0.10 -0.04 1.69 1.67 2zc7A1 LYS 183 HD3 0.00 0.00 -0.09 -0.04 1.68 1.55 2zc7A1 LYS 183 HE2 -0.00 -0.06 -0.01 -0.04 2.99 2.87 2zc7A1 LYS 183 HE3 -0.00 -0.01 -0.02 -0.04 2.99 2.92 2zc7A1 LEU 184 H -0.02 0.66 -0.18 -0.55 8.37 8.29 2zc7A1 LEU 184 HA -0.12 0.03 0.64 -0.75 4.35 4.14 2zc7A1 LEU 184 HB2 -0.16 -0.00 0.16 -0.04 1.64 1.60 2zc7A1 LEU 184 HB3 -0.28 -0.13 0.03 -0.04 1.64 1.22 2zc7A1 LEU 184 HG 0.12 0.10 -0.20 -0.04 1.64 1.63 2zc7A1 LEU 184 HD13 0.30 -0.02 -0.13 -0.04 0.93 1.04 2zc7A1 LEU 184 HD23 0.10 0.02 -0.20 -0.04 0.89 0.76 2zc7A1 ASP 185 H -0.22 0.41 -0.33 -0.55 8.40 7.71 2zc7A1 ASP 185 HA -0.45 0.15 0.49 -0.75 4.63 4.07 2zc7A1 ASP 185 HB2 -0.47 0.00 -0.05 -0.04 2.71 2.16 2zc7A1 ASP 185 HB3 -0.40 -0.01 0.07 -0.04 2.70 2.32 2zc7A1 HIS 186 H -0.45 0.06 -0.36 -0.55 8.41 7.11 2zc7A1 HIS 186 HA -0.78 0.25 0.79 -0.75 4.63 4.14 2zc7A1 HIS 186 HB2 -0.21 -0.10 0.06 -0.04 3.26 2.97 2zc7A1 HIS 186 HB3 -0.05 0.04 0.13 -0.04 3.20 3.28 2zc7A1 HIS 186 HD2 -0.12 -0.01 -0.08 -0.04 6.97 6.72 2zc7A1 HIS 186 HE1 0.07 0.00 -0.07 -0.04 7.75 7.71 2zc7A1 THR 187 H -1.18 0.35 -0.36 -0.55 8.28 6.54 2zc7A1 THR 187 HA -0.75 0.28 0.90 -0.75 4.39 4.07 2zc7A1 THR 187 HB -1.33 0.12 0.07 -0.04 4.32 3.14 2zc7A1 THR 187 HG23 -1.47 -0.00 -0.22 -0.04 1.22 -0.51 2zc7A1 TRP 188 H -0.33 0.66 0.24 -0.55 7.97 8.00 2zc7A1 TRP 188 HA -0.14 0.21 0.99 -0.75 4.62 4.92 2zc7A1 TRP 188 HB2 -0.21 -0.05 -0.54 -0.04 3.23 2.39 2zc7A1 TRP 188 HB3 -0.13 0.04 -0.08 -0.04 3.23 3.01 2zc7A1 TRP 188 HD1 -0.28 0.06 -0.21 -0.04 7.22 6.75 2zc7A1 TRP 188 HE1 -0.10 0.06 -0.18 -0.04 10.20 9.93 2zc7A1 TRP 188 HE3 -0.09 -0.03 -0.06 -0.04 7.59 7.37 2zc7A1 TRP 188 HZ2 0.01 -0.02 -0.01 -0.04 7.44 7.38 2zc7A1 TRP 188 HZ3 -0.09 -0.04 -0.02 -0.04 7.13 6.95 2zc7A1 TRP 188 HH2 -0.10 -0.01 0.01 -0.04 7.19 7.04 2zc7A1 ILE 189 H 0.19 0.10 0.12 -0.55 8.25 8.11 2zc7A1 ILE 189 HA 0.01 0.24 0.69 -0.75 4.18 4.38 2zc7A1 ILE 189 HB 0.06 -0.05 0.09 -0.04 1.89 1.95 2zc7A1 ILE 189 HG12 0.15 0.02 -0.09 -0.04 1.49 1.53 2zc7A1 ILE 189 HG13 0.08 -0.08 -0.07 -0.04 1.21 1.10 2zc7A1 ILE 189 HG23 0.00 -0.02 -0.09 -0.04 0.93 0.78 2zc7A1 ILE 189 HD13 0.08 0.01 -0.16 -0.04 0.88 0.77 2zc7A1 ASN 190 H 0.07 0.08 0.05 -0.55 8.53 8.18 2zc7A1 ASN 190 HA -0.08 0.18 0.75 -0.75 4.76 4.86 2zc7A1 ASN 190 HB2 -0.04 -0.04 0.05 -0.04 2.88 2.80 2zc7A1 ASN 190 HB3 -0.07 0.08 -0.05 -0.04 2.79 2.71 2zc7A1 ASN 190 HD21 -0.02 -0.06 -0.09 -0.04 7.03 6.82 2zc7A1 ASN 190 HD22 -0.03 0.08 -0.02 -0.04 7.74 7.72 2zc7A1 VAL 191 H -0.25 0.17 -0.04 -0.55 8.24 7.58 2zc7A1 VAL 191 HA -0.91 0.11 0.41 -0.75 4.13 2.99 2zc7A1 VAL 191 HB -0.62 0.01 -0.08 -0.04 2.12 1.38 2zc7A1 VAL 191 HG13 -0.46 -0.00 -0.02 -0.04 0.97 0.45 2zc7A1 VAL 191 HG23 -0.50 0.05 -0.23 -0.04 0.95 0.22 2zc7A1 PRO 192 HA -0.31 0.06 0.43 -0.51 4.44 4.11 2zc7A1 PRO 192 HB2 -0.50 -0.09 -0.02 -0.04 2.28 1.63 2zc7A1 PRO 192 HB3 -0.35 0.03 0.10 -0.04 2.02 1.76 2zc7A1 PRO 192 HG2 -1.80 0.09 0.03 -0.04 2.03 0.31 2zc7A1 PRO 192 HG3 -0.75 0.08 0.06 -0.04 2.03 1.38 2zc7A1 PRO 192 HD2 -1.99 0.08 0.10 -0.04 3.68 1.83 2zc7A1 PRO 192 HD3 -1.88 0.24 0.22 -0.04 3.65 2.19 2zc7A1 LYS 193 H -0.16 0.17 0.17 -0.55 8.42 8.04 2zc7A1 LYS 193 HA -0.10 0.15 0.42 -0.75 4.32 4.04 2zc7A1 LYS 193 HB2 -0.07 -0.03 0.06 -0.04 1.87 1.79 2zc7A1 LYS 193 HB3 -0.05 0.05 0.04 -0.04 1.79 1.78 2zc7A1 LYS 193 HG2 -0.07 -0.02 0.08 -0.04 1.46 1.41 2zc7A1 LYS 193 HG3 -0.04 0.03 0.03 -0.04 1.46 1.44 2zc7A1 LYS 193 HD2 -0.05 0.03 0.02 -0.04 1.69 1.65 2zc7A1 LYS 193 HD3 -0.08 0.03 0.01 -0.04 1.68 1.60 2zc7A1 LYS 193 HE2 -0.02 0.01 0.00 -0.04 2.99 2.95 2zc7A1 LYS 193 HE3 -0.03 0.01 -0.01 -0.04 2.99 2.93 2zc7A1 ALA 194 H -0.13 0.05 -0.11 -0.55 8.40 7.65 2zc7A1 ALA 194 HA -0.07 0.12 0.39 -0.75 4.34 4.03 2zc7A1 ALA 194 HB3 -0.07 0.02 0.05 -0.04 1.41 1.36 2zc7A1 GLU 195 H -0.21 0.30 -0.79 -0.55 8.60 7.36 2zc7A1 GLU 195 HA -0.06 0.21 0.85 -0.75 4.29 4.54 2zc7A1 GLU 195 HB2 -0.41 0.07 -0.07 -0.04 2.09 1.63 2zc7A1 GLU 195 HB3 -0.01 -0.00 0.05 -0.04 1.99 1.98 2zc7A1 GLU 195 HG2 -0.08 -0.10 -0.31 -0.04 2.34 1.81 2zc7A1 GLU 195 HG3 -0.08 0.04 -0.07 -0.04 2.34 2.19 2zc7A1 GLU 196 H -0.12 0.35 -0.21 -0.55 8.60 8.08 2zc7A1 GLU 196 HA -0.04 0.04 0.31 -0.75 4.29 3.85 2zc7A1 GLU 196 HB2 -0.07 0.26 0.22 -0.04 2.09 2.46 2zc7A1 GLU 196 HB3 -0.03 0.00 -0.08 -0.04 1.99 1.85 2zc7A1 GLU 196 HG2 0.00 0.01 0.00 -0.04 2.34 2.31 2zc7A1 GLU 196 HG3 -0.02 0.02 -0.00 -0.04 2.34 2.29 2zc7A1 ALA 197 H -0.12 0.11 -0.39 -0.55 8.40 7.45 2zc7A1 ALA 197 HA -0.04 0.08 0.33 -0.75 4.34 3.95 2zc7A1 ALA 197 HB3 -0.18 0.01 -0.01 -0.04 1.41 1.19 2zc7A1 HIS 198 H -0.17 0.37 -0.33 -0.55 8.41 7.74 2zc7A1 HIS 198 HA 0.00 0.05 0.32 -0.75 4.63 4.25 2zc7A1 HIS 198 HB2 0.00 0.14 0.05 -0.04 3.26 3.41 2zc7A1 HIS 198 HB3 -0.00 0.09 0.05 -0.04 3.20 3.30 2zc7A1 HIS 198 HD2 -0.00 -0.01 -0.16 -0.04 6.97 6.75 2zc7A1 HIS 198 HE1 0.00 -0.01 -0.02 -0.04 7.75 7.68 2zc7A1 TYR 199 H 0.07 0.48 -0.47 -0.55 8.29 7.82 2zc7A1 TYR 199 HA -0.15 -0.02 0.52 -0.75 4.56 4.16 2zc7A1 TYR 199 HB2 -0.20 -0.10 0.03 -0.04 3.06 2.75 2zc7A1 TYR 199 HB3 -0.27 0.12 0.16 -0.04 2.98 2.96 2zc7A1 TYR 199 HD2 -0.32 0.07 -0.05 -0.04 7.15 6.81 2zc7A1 TYR 199 HE2 -0.50 -0.08 -0.10 -0.04 6.85 6.13 2zc7A1 ALA 200 H 0.01 0.43 0.33 -0.55 8.40 8.62 2zc7A1 ALA 200 HA -0.01 -0.01 0.39 -0.75 4.34 3.96 2zc7A1 ALA 200 HB3 -0.11 0.00 0.13 -0.04 1.41 1.39 2zc7A1 TRP 201 H 0.20 0.52 0.35 -0.55 7.97 8.49 2zc7A1 TRP 201 HA -0.11 0.10 0.81 -0.75 4.62 4.67 2zc7A1 TRP 201 HB2 -0.27 -0.04 0.23 -0.04 3.23 3.11 2zc7A1 TRP 201 HB3 -0.59 -0.01 0.12 -0.04 3.23 2.71 2zc7A1 TRP 201 HD1 -0.04 -0.07 0.07 -0.04 7.22 7.14 2zc7A1 TRP 201 HE1 -0.06 -0.01 -0.03 -0.04 10.20 10.05 2zc7A1 TRP 201 HE3 -0.67 -0.02 -0.26 -0.04 7.59 6.59 2zc7A1 TRP 201 HZ2 -0.10 -0.02 -0.04 -0.04 7.44 7.24 2zc7A1 TRP 201 HZ3 -0.53 -0.07 -0.13 -0.04 7.13 6.36 2zc7A1 TRP 201 HH2 -0.18 -0.03 -0.04 -0.04 7.19 6.89 2zc7A1 GLY 202 H 0.04 0.39 0.28 -0.55 8.43 8.59 2zc7A1 GLY 202 HA2 -0.73 0.23 0.93 -0.51 4.01 3.93 2zc7A1 GLY 202 HA3 -0.51 -0.18 0.31 -0.51 4.01 3.11 2zc7A1 TYR 203 H 0.03 0.67 0.31 -0.55 8.29 8.75 2zc7A1 TYR 203 HA -0.01 0.31 1.00 -0.75 4.56 5.11 2zc7A1 TYR 203 HB2 -0.02 0.16 0.26 -0.04 3.06 3.42 2zc7A1 TYR 203 HB3 -0.01 -0.13 -0.01 -0.04 2.98 2.79 2zc7A1 TYR 203 HD2 -0.03 0.12 -0.21 -0.04 7.15 6.98 2zc7A1 TYR 203 HE2 0.01 0.06 -0.06 -0.04 6.85 6.81 2zc7A1 ARG 204 H 0.05 0.37 0.20 -0.55 8.46 8.53 2zc7A1 ARG 204 HA 0.07 0.33 1.07 -0.75 4.34 5.06 2zc7A1 ARG 204 HB2 0.05 -0.02 -0.11 -0.04 1.90 1.78 2zc7A1 ARG 204 HB3 0.03 -0.14 0.13 -0.04 1.80 1.79 2zc7A1 ARG 204 HG2 0.04 -0.03 -0.13 -0.04 1.67 1.50 2zc7A1 ARG 204 HG3 0.05 0.16 0.12 -0.04 1.67 1.96 2zc7A1 ARG 204 HD2 0.05 -0.09 -0.01 -0.04 3.22 3.13 2zc7A1 ARG 204 HD3 0.03 -0.05 -0.02 -0.04 3.22 3.15 2zc7A1 ASP 205 H 0.04 0.08 0.09 -0.55 8.40 8.06 2zc7A1 ASP 205 HA 0.04 0.35 1.05 -0.75 4.63 5.31 2zc7A1 ASP 205 HB2 0.02 -0.05 0.20 -0.04 2.71 2.84 2zc7A1 ASP 205 HB3 0.02 0.04 0.17 -0.04 2.70 2.89 2zc7A1 GLY 206 H 0.07 0.33 -0.38 -0.55 8.43 7.91 2zc7A1 GLY 206 HA2 0.08 0.08 0.26 -0.51 4.01 3.92 2zc7A1 GLY 206 HA3 0.04 0.11 0.54 -0.51 4.01 4.19 2zc7A1 LYS 207 H 0.06 -0.19 -0.42 -0.55 8.42 7.31 2zc7A1 LYS 207 HA -0.01 0.21 0.84 -0.75 4.32 4.61 2zc7A1 LYS 207 HB2 -0.00 -0.22 0.06 -0.04 1.87 1.67 2zc7A1 LYS 207 HB3 -0.05 0.09 -0.14 -0.04 1.79 1.66 2zc7A1 LYS 207 HG2 -0.02 -0.01 -0.01 -0.04 1.46 1.38 2zc7A1 LYS 207 HG3 -0.04 0.02 0.01 -0.04 1.46 1.41 2zc7A1 LYS 207 HD2 -0.02 0.04 -0.09 -0.04 1.69 1.58 2zc7A1 LYS 207 HD3 0.01 0.05 -0.38 -0.04 1.68 1.31 2zc7A1 LYS 207 HE2 -0.01 -0.04 0.00 -0.04 2.99 2.91 2zc7A1 LYS 207 HE3 -0.02 -0.03 -0.01 -0.04 2.99 2.89 2zc7A1 ALA 208 H -0.20 0.13 0.17 -0.55 8.40 7.96 2zc7A1 ALA 208 HA -0.63 0.45 0.76 -0.75 4.34 4.17 2zc7A1 ALA 208 HB3 -0.66 -0.02 0.14 -0.04 1.41 0.83 2zc7A1 VAL 209 H -0.09 0.67 0.37 -0.55 8.24 8.64 2zc7A1 VAL 209 HA 0.07 0.15 0.88 -0.75 4.13 4.48 2zc7A1 VAL 209 HB 0.08 0.06 -0.04 -0.04 2.12 2.18 2zc7A1 VAL 209 HG13 -0.00 0.01 -0.33 -0.04 0.97 0.60 2zc7A1 VAL 209 HG23 0.06 0.01 -0.25 -0.04 0.95 0.72 2zc7A1 HIS 210 H 0.16 0.24 0.17 -0.55 8.41 8.44 2zc7A1 HIS 210 HA 0.14 0.15 0.85 -0.75 4.63 5.01 2zc7A1 HIS 210 HB2 -0.01 0.01 0.03 -0.04 3.26 3.25 2zc7A1 HIS 210 HB3 -0.01 0.02 0.08 -0.04 3.20 3.25 2zc7A1 HIS 210 HD2 -0.13 -0.02 0.16 -0.04 6.97 6.93 2zc7A1 HIS 210 HE1 -1.96 0.04 -0.08 -0.04 7.75 5.71 2zc7A1 VAL 211 H 0.21 0.12 0.10 -0.55 8.24 8.12 2zc7A1 VAL 211 HA 0.15 -0.05 0.41 -0.75 4.13 3.88 2zc7A1 VAL 211 HB 0.16 -0.05 0.13 -0.04 2.12 2.31 2zc7A1 VAL 211 HG13 0.11 0.02 -0.08 -0.04 0.97 0.98 2zc7A1 VAL 211 HG23 0.24 0.05 -0.01 -0.04 0.95 1.19 2zc7A1 SER 212 H 0.10 0.03 0.18 -0.55 8.46 8.23 2zc7A1 SER 212 HA 0.09 0.15 0.65 -0.75 4.49 4.62 2zc7A1 SER 212 HB2 0.06 -0.07 0.13 -0.04 3.95 4.03 2zc7A1 SER 212 HB3 0.06 0.11 0.07 -0.04 3.93 4.13 2zc7A1 PRO 213 HA 0.05 -0.02 0.41 -0.51 4.44 4.37 2zc7A1 PRO 213 HB2 0.03 0.02 0.03 -0.04 2.28 2.32 2zc7A1 PRO 213 HB3 0.02 -0.02 0.09 -0.04 2.02 2.07 2zc7A1 PRO 213 HG2 0.03 0.03 0.09 -0.04 2.03 2.13 2zc7A1 PRO 213 HG3 0.03 0.04 0.09 -0.04 2.03 2.15 2zc7A1 PRO 213 HD2 0.05 0.08 0.21 -0.04 3.68 3.98 2zc7A1 PRO 213 HD3 0.06 0.19 0.22 -0.04 3.65 4.08 2zc7A1 GLY 214 H 0.03 0.17 0.23 -0.55 8.43 8.31 2zc7A1 GLY 214 HA2 0.05 0.17 0.51 -0.51 4.01 4.23 2zc7A1 GLY 214 HA3 0.14 0.10 0.27 -0.51 4.01 4.01 2zc7A1 MET 215 H 0.02 0.32 0.11 -0.55 8.47 8.38 2zc7A1 MET 215 HA -0.01 -0.01 0.49 -0.75 4.52 4.24 2zc7A1 MET 215 HB2 -0.00 0.12 0.08 -0.04 2.15 2.31 2zc7A1 MET 215 HB3 0.03 -0.01 -0.11 -0.04 2.03 1.90 2zc7A1 MET 215 HG2 0.01 0.25 -0.16 -0.04 2.63 2.69 2zc7A1 MET 215 HG3 0.03 -0.05 -0.29 -0.04 2.56 2.21 2zc7A1 MET 215 HE3 0.02 -0.01 -0.18 -0.04 2.10 1.90 2zc7A1 LEU 216 H -0.07 0.12 0.16 -0.55 8.37 8.03 2zc7A1 LEU 216 HA -0.16 -0.03 0.28 -0.75 4.35 3.69 2zc7A1 LEU 216 HB2 0.02 0.20 0.05 -0.04 1.64 1.87 2zc7A1 LEU 216 HB3 -0.06 -0.03 0.09 -0.04 1.64 1.60 2zc7A1 LEU 216 HG 0.05 -0.10 -0.41 -0.04 1.64 1.14 2zc7A1 LEU 216 HD13 0.21 0.00 -0.18 -0.04 0.93 0.92 2zc7A1 LEU 216 HD23 -0.06 0.03 -0.12 -0.04 0.89 0.70 2zc7A1 ASP 217 H -0.18 0.35 -0.38 -0.55 8.40 7.64 2zc7A1 ASP 217 HA -1.49 0.12 0.33 -0.75 4.63 2.84 2zc7A1 ASP 217 HB2 -0.44 0.05 -0.09 -0.04 2.71 2.19 2zc7A1 ASP 217 HB3 -0.15 0.08 -0.02 -0.04 2.70 2.57 2zc7A1 ALA 218 H -0.24 0.12 -0.05 -0.55 8.40 7.68 2zc7A1 ALA 218 HA -0.16 0.08 0.29 -0.75 4.34 3.79 2zc7A1 ALA 218 HB3 -0.07 0.01 -0.02 -0.04 1.41 1.28 2zc7A1 GLU 219 H -0.42 -0.04 -0.47 -0.55 8.60 7.12 2zc7A1 GLU 219 HA -0.69 0.08 0.33 -0.75 4.29 3.25 2zc7A1 GLU 219 HB2 -0.31 0.03 0.12 -0.04 2.09 1.88 2zc7A1 GLU 219 HB3 -0.31 0.15 0.11 -0.04 1.99 1.90 2zc7A1 GLU 219 HG2 -0.50 0.04 -0.01 -0.04 2.34 1.82 2zc7A1 GLU 219 HG3 -1.76 0.00 -0.12 -0.04 2.34 0.42 2zc7A1 ALA 220 H -0.28 0.33 -0.13 -0.55 8.40 7.77 2zc7A1 ALA 220 HA 0.02 0.20 0.79 -0.75 4.34 4.59 2zc7A1 ALA 220 HB3 0.10 0.00 0.08 -0.04 1.41 1.55 2zc7A1 TYR 221 H -0.41 0.60 0.15 -0.55 8.29 8.08 2zc7A1 TYR 221 HA 0.04 0.35 0.38 -0.75 4.56 4.57 2zc7A1 TYR 221 HB2 0.05 -0.07 0.10 -0.04 3.06 3.09 2zc7A1 TYR 221 HB3 0.05 0.13 -0.34 -0.04 2.98 2.78 2zc7A1 TYR 221 HD2 0.02 -0.01 -0.18 -0.04 7.15 6.93 2zc7A1 TYR 221 HE2 0.01 0.04 -0.12 -0.04 6.85 6.74 2zc7A1 GLY 222 H -0.19 0.26 0.08 -0.55 8.43 8.03 2zc7A1 GLY 222 HA2 -0.04 0.10 0.44 -0.51 4.01 4.00 2zc7A1 GLY 222 HA3 -0.16 -0.11 0.09 -0.51 4.01 3.32 2zc7A1 VAL 223 H -0.05 0.07 -0.09 -0.55 8.24 7.61 2zc7A1 VAL 223 HA -0.12 0.31 0.74 -0.75 4.13 4.30 2zc7A1 VAL 223 HB -0.20 -0.08 -0.02 -0.04 2.12 1.79 2zc7A1 VAL 223 HG13 -0.68 -0.00 -0.26 -0.04 0.97 -0.01 2zc7A1 VAL 223 HG23 -0.16 0.01 -0.09 -0.04 0.95 0.66 2zc7A1 LYS 224 H -0.18 0.63 0.32 -0.55 8.42 8.62 2zc7A1 LYS 224 HA -0.17 0.26 1.02 -0.75 4.32 4.67 2zc7A1 LYS 224 HB2 -0.16 -0.08 -0.01 -0.04 1.87 1.58 2zc7A1 LYS 224 HB3 -0.33 0.02 -0.12 -0.04 1.79 1.32 2zc7A1 LYS 224 HG2 -0.56 -0.03 -0.19 -0.04 1.46 0.64 2zc7A1 LYS 224 HG3 -0.23 0.00 -0.26 -0.04 1.46 0.94 2zc7A1 LYS 224 HD2 -0.16 0.10 -0.20 -0.04 1.69 1.39 2zc7A1 LYS 224 HD3 -0.35 -0.15 -0.16 -0.04 1.68 0.98 2zc7A1 LYS 224 HE2 -0.08 -0.14 -0.09 -0.04 2.99 2.64 2zc7A1 LYS 224 HE3 -0.09 0.10 -0.23 -0.04 2.99 2.73 2zc7A1 THR 225 H -0.07 0.50 0.29 -0.55 8.28 8.44 2zc7A1 THR 225 HA -0.18 0.34 0.93 -0.75 4.39 4.72 2zc7A1 THR 225 HB -0.06 0.19 -0.12 -0.04 4.32 4.29 2zc7A1 THR 225 HG23 -0.27 -0.08 -0.03 -0.04 1.22 0.79 2zc7A1 ASN 226 H -0.06 0.05 0.13 -0.55 8.53 8.10 2zc7A1 ASN 226 HA 0.15 0.47 0.89 -0.75 4.76 5.52 2zc7A1 ASN 226 HB2 -0.03 0.17 -0.04 -0.04 2.88 2.94 2zc7A1 ASN 226 HB3 -0.02 0.15 -0.40 -0.04 2.79 2.48 2zc7A1 ASN 226 HD21 -0.15 -0.08 0.02 -0.04 7.03 6.78 2zc7A1 ASN 226 HD22 -0.12 0.18 0.00 -0.04 7.74 7.76 2zc7A1 VAL 227 H 0.00 0.35 0.14 -0.55 8.24 8.18 2zc7A1 VAL 227 HA 0.02 0.10 0.42 -0.75 4.13 3.91 2zc7A1 VAL 227 HB 0.02 0.06 -0.01 -0.04 2.12 2.15 2zc7A1 VAL 227 HG13 -0.32 0.01 -0.07 -0.04 0.97 0.55 2zc7A1 VAL 227 HG23 0.08 -0.00 -0.27 -0.04 0.95 0.72 2zc7A1 GLN 228 H -0.20 0.25 -0.10 -0.55 8.47 7.87 2zc7A1 GLN 228 HA -0.13 0.11 0.36 -0.75 4.36 3.94 2zc7A1 GLN 228 HB2 -0.11 -0.07 0.07 -0.04 2.15 2.00 2zc7A1 GLN 228 HB3 -0.05 0.07 -0.02 -0.04 2.02 1.99 2zc7A1 GLN 228 HG2 -0.43 0.01 -0.02 -0.04 2.40 1.93 2zc7A1 GLN 228 HG3 -0.37 0.08 0.06 -0.04 2.39 2.12 2zc7A1 GLN 228 HE21 -0.11 0.01 -0.09 -0.04 6.97 6.73 2zc7A1 GLN 228 HE22 -0.13 -0.01 -0.07 -0.04 7.69 7.44 2zc7A1 ASP 229 H -0.05 0.08 -0.14 -0.55 8.40 7.75 2zc7A1 ASP 229 HA 0.02 0.16 0.42 -0.75 4.63 4.48 2zc7A1 ASP 229 HB2 -0.11 -0.04 0.01 -0.04 2.71 2.53 2zc7A1 ASP 229 HB3 -0.12 0.07 -0.08 -0.04 2.70 2.52 2zc7A1 MET 230 H 0.03 0.33 -0.44 -0.55 8.47 7.85 2zc7A1 MET 230 HA 0.23 0.04 0.27 -0.75 4.52 4.30 2zc7A1 MET 230 HB2 0.07 0.26 0.03 -0.04 2.15 2.48 2zc7A1 MET 230 HB3 0.11 0.04 -0.05 -0.04 2.03 2.10 2zc7A1 MET 230 HG2 0.11 -0.01 -0.16 -0.04 2.63 2.53 2zc7A1 MET 230 HG3 0.18 0.01 -0.11 -0.04 2.56 2.60 2zc7A1 MET 230 HE3 0.34 0.01 -0.14 -0.04 2.10 2.28 2zc7A1 ALA 231 H 0.11 0.57 -0.22 -0.55 8.40 8.31 2zc7A1 ALA 231 HA 0.10 0.00 0.34 -0.75 4.34 4.03 2zc7A1 ALA 231 HB3 0.21 0.02 0.05 -0.04 1.41 1.65 2zc7A1 SER 232 H 0.11 0.44 -0.26 -0.55 8.46 8.20 2zc7A1 SER 232 HA 0.04 0.02 0.32 -0.75 4.49 4.12 2zc7A1 SER 232 HB2 0.09 0.00 0.11 -0.04 3.95 4.12 2zc7A1 SER 232 HB3 0.10 0.06 -0.16 -0.04 3.93 3.90 2zc7A1 TRP 233 H 0.30 0.51 -0.28 -0.55 7.97 7.95 2zc7A1 TRP 233 HA 0.01 0.04 0.40 -0.75 4.62 4.31 2zc7A1 TRP 233 HB2 0.15 -0.01 -0.00 -0.04 3.23 3.32 2zc7A1 TRP 233 HB3 0.07 0.13 0.08 -0.04 3.23 3.46 2zc7A1 TRP 233 HD1 0.05 0.00 -0.17 -0.04 7.22 7.06 2zc7A1 TRP 233 HE1 -0.51 -0.01 -0.18 -0.04 10.20 9.46 2zc7A1 TRP 233 HE3 0.07 0.03 -0.06 -0.04 7.59 7.59 2zc7A1 TRP 233 HZ2 -0.54 0.12 -0.52 -0.04 7.44 6.45 2zc7A1 TRP 233 HZ3 0.07 0.02 -0.09 -0.04 7.13 7.08 2zc7A1 TRP 233 HH2 -0.08 -0.00 -0.05 -0.04 7.19 7.02 2zc7A1 VAL 234 H 0.07 0.45 -0.27 -0.55 8.24 7.94 2zc7A1 VAL 234 HA -0.60 0.03 0.30 -0.75 4.13 3.11 2zc7A1 VAL 234 HB -0.10 0.10 0.08 -0.04 2.12 2.16 2zc7A1 VAL 234 HG13 -0.42 -0.02 -0.21 -0.04 0.97 0.27 2zc7A1 VAL 234 HG23 0.07 0.07 -0.07 -0.04 0.95 0.97 2zc7A1 MET 235 H -0.13 0.62 -0.09 -0.55 8.47 8.32 2zc7A1 MET 235 HA -0.23 -0.02 0.25 -0.75 4.52 3.77 2zc7A1 MET 235 HB2 -0.07 0.07 0.05 -0.04 2.15 2.16 2zc7A1 MET 235 HB3 -0.10 0.02 -0.08 -0.04 2.03 1.84 2zc7A1 MET 235 HG2 -0.10 -0.06 -0.14 -0.04 2.63 2.30 2zc7A1 MET 235 HG3 -0.07 0.04 -0.08 -0.04 2.56 2.41 2zc7A1 MET 235 HE3 -0.00 -0.01 -0.24 -0.04 2.10 1.81 2zc7A1 VAL 236 H -0.16 0.43 -0.40 -0.55 8.24 7.56 2zc7A1 VAL 236 HA -0.13 0.09 0.40 -0.75 4.13 3.74 2zc7A1 VAL 236 HB -0.11 0.10 0.10 -0.04 2.12 2.17 2zc7A1 VAL 236 HG13 -0.06 -0.02 -0.13 -0.04 0.97 0.71 2zc7A1 VAL 236 HG23 -0.00 0.01 -0.01 -0.04 0.95 0.91 2zc7A1 ASN 237 H -0.56 0.53 -0.12 -0.55 8.53 7.84 2zc7A1 ASN 237 HA -0.36 0.01 0.41 -0.75 4.76 4.07 2zc7A1 ASN 237 HB2 -0.97 0.06 0.08 -0.04 2.88 2.01 2zc7A1 ASN 237 HB3 -0.60 -0.03 -0.05 -0.04 2.79 2.06 2zc7A1 ASN 237 HD21 -3.41 -0.14 -0.07 -0.04 7.03 3.38 2zc7A1 ASN 237 HD22 -1.42 0.80 0.10 -0.04 7.74 7.18 2zc7A1 MET 238 H -0.57 0.53 -0.31 -0.55 8.47 7.58 2zc7A1 MET 238 HA -0.09 -0.04 0.34 -0.75 4.52 3.99 2zc7A1 MET 238 HB2 -0.41 0.14 -0.00 -0.04 2.15 1.84 2zc7A1 MET 238 HB3 -0.19 0.05 -0.15 -0.04 2.03 1.71 2zc7A1 MET 238 HG2 -0.04 -0.07 -0.11 -0.04 2.63 2.38 2zc7A1 MET 238 HG3 -0.10 -0.05 -0.19 -0.04 2.56 2.17 2zc7A1 MET 238 HE3 -0.20 -0.02 -0.32 -0.04 2.10 1.52 2zc7A1 LYS 239 H -0.19 0.34 -0.49 -0.55 8.42 7.52 2zc7A1 LYS 239 HA -0.09 0.10 0.73 -0.75 4.32 4.30 2zc7A1 LYS 239 HB2 -0.11 0.12 -0.00 -0.04 1.87 1.84 2zc7A1 LYS 239 HB3 -0.08 -0.12 0.15 -0.04 1.79 1.70 2zc7A1 LYS 239 HG2 -0.08 0.15 -0.10 -0.04 1.46 1.39 2zc7A1 LYS 239 HG3 -0.07 -0.03 -0.04 -0.04 1.46 1.27 2zc7A1 LYS 239 HD2 -0.06 -0.08 -0.05 -0.04 1.69 1.47 2zc7A1 LYS 239 HD3 -0.06 -0.02 0.04 -0.04 1.68 1.60 2zc7A1 LYS 239 HE2 -0.05 0.09 0.01 -0.04 2.99 2.99 2zc7A1 LYS 239 HE3 -0.05 -0.01 -0.02 -0.04 2.99 2.86 2zc7A1 PRO 240 HA -0.08 0.14 0.48 -0.51 4.44 4.47 2zc7A1 PRO 240 HB2 -0.05 -0.05 -0.01 -0.04 2.28 2.13 2zc7A1 PRO 240 HB3 -0.06 -0.01 0.07 -0.04 2.02 1.99 2zc7A1 PRO 240 HG2 -0.07 0.02 -0.05 -0.04 2.03 1.89 2zc7A1 PRO 240 HG3 -0.12 0.16 -0.01 -0.04 2.03 2.02 2zc7A1 PRO 240 HD2 -0.07 0.00 0.05 -0.04 3.68 3.62 2zc7A1 PRO 240 HD3 -0.11 0.30 -0.51 -0.04 3.65 3.29 2zc7A1 ASP 241 H -0.05 0.20 -0.16 -0.55 8.40 7.84 2zc7A1 ASP 241 HA -0.03 0.00 0.31 -0.75 4.63 4.16 2zc7A1 ASP 241 HB2 -0.03 0.02 0.05 -0.04 2.71 2.71 2zc7A1 ASP 241 HB3 -0.03 -0.00 0.07 -0.04 2.70 2.69 2zc7A1 SER 242 H -0.05 0.32 -0.85 -0.55 8.46 7.33 2zc7A1 SER 242 HA -0.03 0.05 0.58 -0.75 4.49 4.33 2zc7A1 SER 242 HB2 -0.04 -0.08 0.15 -0.04 3.95 3.94 2zc7A1 SER 242 HB3 -0.05 -0.06 0.06 -0.04 3.93 3.85 2zc7A1 LEU 243 H -0.03 0.29 -0.32 -0.55 8.37 7.76 2zc7A1 LEU 243 HA -0.01 0.22 0.85 -0.75 4.35 4.65 2zc7A1 LEU 243 HB2 -0.02 0.17 0.18 -0.04 1.64 1.93 2zc7A1 LEU 243 HB3 -0.00 -0.38 0.21 -0.04 1.64 1.43 2zc7A1 LEU 243 HG -0.03 0.11 -0.07 -0.04 1.64 1.61 2zc7A1 LEU 243 HD13 0.00 -0.03 -0.05 -0.04 0.93 0.81 2zc7A1 LEU 243 HD23 -0.00 0.04 -0.03 -0.04 0.89 0.85 2zc7A1 GLN 244 H -0.00 0.01 0.09 -0.55 8.47 8.02 2zc7A1 GLN 244 HA -0.01 0.40 1.08 -0.75 4.36 5.08 2zc7A1 GLN 244 HB2 -0.00 -0.08 0.03 -0.04 2.15 2.06 2zc7A1 GLN 244 HB3 -0.00 0.04 0.14 -0.04 2.02 2.15 2zc7A1 GLN 244 HG2 -0.00 -0.02 -0.27 -0.04 2.40 2.07 2zc7A1 GLN 244 HG3 -0.00 -0.01 -0.04 -0.04 2.39 2.30 2zc7A1 GLN 244 HE21 -0.01 -0.05 -0.05 -0.04 6.97 6.82 2zc7A1 GLN 244 HE22 -0.01 0.21 -0.28 -0.04 7.69 7.57 2zc7A1 ASP 245 H -0.01 0.10 -0.11 -0.55 8.40 7.84 2zc7A1 ASP 245 HA -0.00 -0.00 0.37 -0.75 4.63 4.24 2zc7A1 ASP 245 HB2 -0.01 0.01 -0.02 -0.04 2.71 2.65 2zc7A1 ASP 245 HB3 -0.00 0.16 0.27 -0.04 2.70 3.08 2zc7A1 ASN 246 H 0.00 -0.05 0.08 -0.55 8.53 8.02 2zc7A1 ASN 246 HA 0.00 0.36 0.67 -0.75 4.76 5.04 2zc7A1 ASN 246 HB2 0.00 -0.12 0.22 -0.04 2.88 2.95 2zc7A1 ASN 246 HB3 0.00 0.24 0.02 -0.04 2.79 3.00 2zc7A1 ASN 246 HD21 0.01 0.05 -0.01 -0.04 7.03 7.04 2zc7A1 ASN 246 HD22 0.00 0.14 -0.04 -0.04 7.74 7.80 2zc7A1 SER 247 H 0.01 0.26 0.14 -0.55 8.46 8.32 2zc7A1 SER 247 HA 0.02 0.13 0.43 -0.75 4.49 4.31 2zc7A1 SER 247 HB2 0.01 0.07 0.10 -0.04 3.95 4.09 2zc7A1 SER 247 HB3 0.01 -0.02 0.10 -0.04 3.93 3.98 2zc7A1 LEU 248 H 0.02 0.05 -0.17 -0.55 8.37 7.72 2zc7A1 LEU 248 HA 0.05 0.17 0.54 -0.75 4.35 4.35 2zc7A1 LEU 248 HB2 0.03 0.10 0.10 -0.04 1.64 1.83 2zc7A1 LEU 248 HB3 0.03 -0.09 0.06 -0.04 1.64 1.60 2zc7A1 LEU 248 HG 0.07 -0.02 -0.15 -0.04 1.64 1.51 2zc7A1 LEU 248 HD13 0.12 0.02 0.03 -0.04 0.93 1.05 2zc7A1 LEU 248 HD23 0.07 0.08 -0.01 -0.04 0.89 0.99 2zc7A1 ARG 249 H 0.01 -0.03 -0.15 -0.55 8.46 7.74 2zc7A1 ARG 249 HA -0.00 0.15 0.39 -0.75 4.34 4.13 2zc7A1 ARG 249 HB2 0.00 -0.23 0.16 -0.04 1.90 1.79 2zc7A1 ARG 249 HB3 0.00 0.14 0.12 -0.04 1.80 2.02 2zc7A1 ARG 249 HG2 -0.02 0.07 -0.07 -0.04 1.67 1.61 2zc7A1 ARG 249 HG3 -0.01 -0.02 -0.04 -0.04 1.67 1.56 2zc7A1 ARG 249 HD2 -0.02 0.09 -0.12 -0.04 3.22 3.13 2zc7A1 ARG 249 HD3 -0.01 -0.09 -0.01 -0.04 3.22 3.07 2zc7A1 LYS 250 H 0.02 0.40 -0.15 -0.55 8.42 8.13 2zc7A1 LYS 250 HA 0.02 0.04 0.35 -0.75 4.32 3.97 2zc7A1 LYS 250 HB2 0.02 0.07 0.11 -0.04 1.87 2.03 2zc7A1 LYS 250 HB3 0.03 0.02 0.01 -0.04 1.79 1.80 2zc7A1 LYS 250 HG2 0.01 -0.01 -0.01 -0.04 1.46 1.42 2zc7A1 LYS 250 HG3 0.01 0.01 0.01 -0.04 1.46 1.45 2zc7A1 LYS 250 HD2 0.01 -0.03 -0.13 -0.04 1.69 1.50 2zc7A1 LYS 250 HD3 0.02 0.03 -0.02 -0.04 1.68 1.66 2zc7A1 LYS 250 HE2 0.01 0.01 -0.06 -0.04 2.99 2.90 2zc7A1 LYS 250 HE3 0.00 -0.04 -0.13 -0.04 2.99 2.78 2zc7A1 GLY 251 H 0.04 0.29 -0.43 -0.55 8.43 7.78 2zc7A1 GLY 251 HA2 0.08 -0.05 0.11 -0.51 4.01 3.64 2zc7A1 GLY 251 HA3 0.07 0.11 0.20 -0.51 4.01 3.89 2zc7A1 LEU 252 H 0.04 0.59 -0.07 -0.55 8.37 8.38 2zc7A1 LEU 252 HA 0.06 -0.01 0.46 -0.75 4.35 4.11 2zc7A1 LEU 252 HB2 -0.02 0.10 0.15 -0.04 1.64 1.83 2zc7A1 LEU 252 HB3 -0.08 0.04 0.02 -0.04 1.64 1.58 2zc7A1 LEU 252 HG 0.02 0.05 0.02 -0.04 1.64 1.69 2zc7A1 LEU 252 HD13 -0.04 -0.01 -0.11 -0.04 0.93 0.73 2zc7A1 LEU 252 HD23 -0.23 -0.01 -0.09 -0.04 0.89 0.51 2zc7A1 THR 253 H 0.02 0.37 -0.27 -0.55 8.28 7.86 2zc7A1 THR 253 HA -0.00 0.05 0.43 -0.75 4.39 4.12 2zc7A1 THR 253 HB 0.01 0.10 0.17 -0.04 4.32 4.56 2zc7A1 THR 253 HG23 -0.01 -0.01 -0.10 -0.04 1.22 1.06 2zc7A1 LEU 254 H 0.07 0.57 -0.04 -0.55 8.37 8.42 2zc7A1 LEU 254 HA 0.11 0.04 0.49 -0.75 4.35 4.23 2zc7A1 LEU 254 HB2 0.12 0.11 0.22 -0.04 1.64 2.05 2zc7A1 LEU 254 HB3 0.18 -0.08 0.05 -0.04 1.64 1.75 2zc7A1 LEU 254 HG 0.07 0.24 0.08 -0.04 1.64 1.99 2zc7A1 LEU 254 HD13 0.08 -0.02 -0.00 -0.04 0.93 0.95 2zc7A1 LEU 254 HD23 0.09 -0.02 -0.01 -0.04 0.89 0.90 2zc7A1 ALA 255 H 0.16 0.45 -0.20 -0.55 8.40 8.26 2zc7A1 ALA 255 HA 0.25 -0.08 0.41 -0.75 4.34 4.16 2zc7A1 ALA 255 HB3 0.30 0.03 0.05 -0.04 1.41 1.75 2zc7A1 GLN 256 H 0.13 0.31 -0.44 -0.55 8.47 7.92 2zc7A1 GLN 256 HA 0.15 0.11 0.78 -0.75 4.36 4.65 2zc7A1 GLN 256 HB2 -0.02 0.14 0.07 -0.04 2.15 2.29 2zc7A1 GLN 256 HB3 -0.06 -0.08 0.08 -0.04 2.02 1.92 2zc7A1 GLN 256 HG2 -0.24 -0.05 -0.03 -0.04 2.40 2.04 2zc7A1 GLN 256 HG3 -0.33 -0.04 -0.13 -0.04 2.39 1.84 2zc7A1 GLN 256 HE21 -0.14 0.44 0.01 -0.04 6.97 7.24 2zc7A1 GLN 256 HE22 -0.20 -0.04 -0.03 -0.04 7.69 7.38 2zc7A1 SER 257 H 0.13 0.31 -0.36 -0.55 8.46 7.99 2zc7A1 SER 257 HA -0.10 0.08 0.55 -0.75 4.49 4.26 2zc7A1 SER 257 HB2 -0.18 0.05 0.07 -0.04 3.95 3.85 2zc7A1 SER 257 HB3 -0.38 0.07 -0.09 -0.04 3.93 3.50 2zc7A1 ARG 258 H -0.23 0.63 0.06 -0.55 8.46 8.37 2zc7A1 ARG 258 HA 0.09 0.13 0.58 -0.75 4.34 4.39 2zc7A1 ARG 258 HB2 -0.19 -0.07 0.11 -0.04 1.90 1.71 2zc7A1 ARG 258 HB3 -0.06 -0.04 -0.02 -0.04 1.80 1.63 2zc7A1 ARG 258 HG2 -0.06 0.06 -0.34 -0.04 1.67 1.29 2zc7A1 ARG 258 HG3 -0.16 0.14 -0.19 -0.04 1.67 1.42 2zc7A1 ARG 258 HD2 -0.41 0.01 -0.08 -0.04 3.22 2.70 2zc7A1 ARG 258 HD3 -1.05 -0.04 -0.09 -0.04 3.22 1.99 2zc7A1 TYR 259 H 0.28 0.61 0.28 -0.55 8.29 8.91 2zc7A1 TYR 259 HA -0.18 0.15 0.84 -0.75 4.56 4.61 2zc7A1 TYR 259 HB2 0.18 0.17 0.04 -0.04 3.06 3.41 2zc7A1 TYR 259 HB3 -0.26 -0.10 0.00 -0.04 2.98 2.58 2zc7A1 TYR 259 HD2 -0.00 0.13 -0.03 -0.04 7.15 7.21 2zc7A1 TYR 259 HE2 0.02 0.04 -0.06 -0.04 6.85 6.81 2zc7A1 TRP 260 H 0.36 0.19 0.26 -0.55 7.97 8.22 2zc7A1 TRP 260 HA 0.12 0.29 0.76 -0.75 4.62 5.04 2zc7A1 TRP 260 HB2 0.13 -0.07 -0.06 -0.04 3.23 3.18 2zc7A1 TRP 260 HB3 0.08 0.00 -0.17 -0.04 3.23 3.10 2zc7A1 TRP 260 HD1 0.12 0.04 -0.19 -0.04 7.22 7.15 2zc7A1 TRP 260 HE1 -0.01 -0.04 -0.19 -0.04 10.20 9.92 2zc7A1 TRP 260 HE3 0.05 -0.10 -0.91 -0.04 7.59 6.60 2zc7A1 TRP 260 HZ2 0.04 -0.11 -0.15 -0.04 7.44 7.18 2zc7A1 TRP 260 HZ3 0.04 0.22 -0.08 -0.04 7.13 7.26 2zc7A1 TRP 260 HH2 0.05 0.06 0.02 -0.04 7.19 7.28 2zc7A1 ARG 261 H 0.29 0.58 0.27 -0.55 8.46 9.04 2zc7A1 ARG 261 HA -0.10 0.34 1.08 -0.75 4.34 4.91 2zc7A1 ARG 261 HB2 0.15 -0.03 -0.02 -0.04 1.90 1.97 2zc7A1 ARG 261 HB3 0.06 -0.09 0.15 -0.04 1.80 1.88 2zc7A1 ARG 261 HG2 -0.16 0.05 -0.11 -0.04 1.67 1.42 2zc7A1 ARG 261 HG3 -0.75 0.13 -0.05 -0.04 1.67 0.96 2zc7A1 ARG 261 HD2 0.27 -0.02 -0.06 -0.04 3.22 3.37 2zc7A1 ARG 261 HD3 0.05 -0.06 -0.03 -0.04 3.22 3.14 2zc7A1 VAL 262 H -0.05 0.73 0.10 -0.55 8.24 8.46 2zc7A1 VAL 262 HA 0.01 0.20 0.90 -0.75 4.13 4.48 2zc7A1 VAL 262 HB 0.03 -0.04 0.07 -0.04 2.12 2.14 2zc7A1 VAL 262 HG13 -0.03 0.03 -0.11 -0.04 0.97 0.82 2zc7A1 VAL 262 HG23 0.04 0.01 -0.21 -0.04 0.95 0.76 2zc7A1 GLY 263 H -0.03 0.18 0.08 -0.55 8.43 8.11 2zc7A1 GLY 263 HA2 -0.04 0.02 0.37 -0.51 4.01 3.86 2zc7A1 GLY 263 HA3 -0.04 0.03 0.54 -0.51 4.01 4.03 2zc7A1 ALA 264 H -0.04 0.14 0.25 -0.55 8.40 8.20 2zc7A1 ALA 264 HA -0.09 0.15 0.56 -0.75 4.34 4.21 2zc7A1 ALA 264 HB3 -0.03 -0.02 0.10 -0.04 1.41 1.42 2zc7A1 MET 265 H -0.09 0.54 -0.19 -0.55 8.47 8.19 2zc7A1 MET 265 HA -0.01 0.28 1.33 -0.75 4.52 5.37 2zc7A1 MET 265 HB2 0.16 0.08 0.14 -0.04 2.15 2.49 2zc7A1 MET 265 HB3 0.08 -0.11 -0.05 -0.04 2.03 1.91 2zc7A1 MET 265 HG2 0.07 -0.05 0.00 -0.04 2.63 2.62 2zc7A1 MET 265 HG3 0.02 0.23 0.12 -0.04 2.56 2.90 2zc7A1 MET 265 HE3 0.15 -0.06 -0.42 -0.04 2.10 1.72 2zc7A1 TYR 266 H 0.25 0.84 0.44 -0.55 8.29 9.26 2zc7A1 TYR 266 HA 0.17 0.36 1.11 -0.75 4.56 5.45 2zc7A1 TYR 266 HB2 0.11 -0.05 0.03 -0.04 3.06 3.12 2zc7A1 TYR 266 HB3 0.11 -0.01 0.01 -0.04 2.98 3.05 2zc7A1 TYR 266 HD2 0.08 0.04 -0.15 -0.04 7.15 7.08 2zc7A1 TYR 266 HE2 0.04 -0.06 -0.09 -0.04 6.85 6.71 2zc7A1 GLN 267 H 0.39 0.34 0.26 -0.55 8.47 8.91 2zc7A1 GLN 267 HA 0.32 0.12 0.78 -0.75 4.36 4.83 2zc7A1 GLN 267 HB2 0.29 -0.04 0.01 -0.04 2.15 2.37 2zc7A1 GLN 267 HB3 0.52 -0.14 0.18 -0.04 2.02 2.54 2zc7A1 GLN 267 HG2 0.18 0.03 0.02 -0.04 2.40 2.60 2zc7A1 GLN 267 HG3 0.25 0.22 -0.06 -0.04 2.39 2.76 2zc7A1 GLN 267 HE21 0.37 -0.05 -0.14 -0.04 6.97 7.11 2zc7A1 GLN 267 HE22 0.21 0.43 0.00 -0.04 7.69 8.29 2zc7A1 GLY 268 H 0.33 0.60 0.34 -0.55 8.43 9.16 2zc7A1 GLY 268 HA2 0.48 0.31 0.81 -0.51 4.01 5.10 2zc7A1 GLY 268 HA3 0.34 0.14 0.38 -0.51 4.01 4.36 2zc7A1 LEU 269 H 0.28 0.37 0.22 -0.55 8.37 8.70 2zc7A1 LEU 269 HA -0.09 0.14 0.79 -0.75 4.35 4.44 2zc7A1 LEU 269 HB2 0.13 -0.05 0.18 -0.04 1.64 1.86 2zc7A1 LEU 269 HB3 -0.01 -0.08 0.12 -0.04 1.64 1.62 2zc7A1 LEU 269 HG -0.02 0.13 -0.10 -0.04 1.64 1.61 2zc7A1 LEU 269 HD13 0.03 -0.03 -0.12 -0.04 0.93 0.77 2zc7A1 LEU 269 HD23 -0.54 0.00 -0.12 -0.04 0.89 0.20 2zc7A1 GLY 270 H 0.01 0.31 -0.03 -0.55 8.43 8.18 2zc7A1 GLY 270 HA2 0.08 -0.05 0.29 -0.51 4.01 3.83 2zc7A1 GLY 270 HA3 -0.08 0.15 0.48 -0.51 4.01 4.05 2zc7A1 TRP 271 H 0.17 0.38 -0.60 -0.55 7.97 7.37 2zc7A1 TRP 271 HA 0.16 0.07 0.44 -0.75 4.62 4.54 2zc7A1 TRP 271 HB2 0.11 0.19 0.01 -0.04 3.23 3.50 2zc7A1 TRP 271 HB3 0.09 0.02 -0.06 -0.04 3.23 3.24 2zc7A1 TRP 271 HD1 0.07 0.06 -0.17 -0.04 7.22 7.15 2zc7A1 TRP 271 HE1 -0.16 -0.01 -0.05 -0.04 10.20 9.93 2zc7A1 TRP 271 HE3 0.11 0.17 -0.22 -0.04 7.59 7.62 2zc7A1 TRP 271 HZ2 -0.51 -0.01 -0.15 -0.04 7.44 6.73 2zc7A1 TRP 271 HZ3 0.14 -0.05 -0.28 -0.04 7.13 6.90 2zc7A1 TRP 271 HH2 0.11 -0.06 -0.17 -0.04 7.19 7.03 2zc7A1 GLU 272 H 0.55 0.46 0.40 -0.55 8.60 9.46 2zc7A1 GLU 272 HA 0.34 0.23 0.97 -0.75 4.29 5.08 2zc7A1 GLU 272 HB2 0.41 -0.01 0.15 -0.04 2.09 2.59 2zc7A1 GLU 272 HB3 0.35 -0.02 0.11 -0.04 1.99 2.39 2zc7A1 GLU 272 HG2 0.30 0.02 -0.00 -0.04 2.34 2.62 2zc7A1 GLU 272 HG3 0.31 0.09 -0.25 -0.04 2.34 2.44 2zc7A1 MET 273 H 0.30 0.58 0.42 -0.55 8.47 9.22 2zc7A1 MET 273 HA 0.15 0.39 1.15 -0.75 4.52 5.45 2zc7A1 MET 273 HB2 0.22 -0.01 -0.02 -0.04 2.15 2.30 2zc7A1 MET 273 HB3 0.11 -0.03 -0.05 -0.04 2.03 2.02 2zc7A1 MET 273 HG2 -0.03 0.04 -0.12 -0.04 2.63 2.48 2zc7A1 MET 273 HG3 -0.08 -0.01 -0.12 -0.04 2.56 2.31 2zc7A1 MET 273 HE3 0.19 0.05 -0.50 -0.04 2.10 1.80 2zc7A1 LEU 274 H 0.21 0.49 0.36 -0.55 8.37 8.88 2zc7A1 LEU 274 HA 0.23 0.21 0.85 -0.75 4.35 4.89 2zc7A1 LEU 274 HB2 0.16 -0.06 0.03 -0.04 1.64 1.73 2zc7A1 LEU 274 HB3 0.10 0.04 0.06 -0.04 1.64 1.80 2zc7A1 LEU 274 HG 0.10 0.08 -0.11 -0.04 1.64 1.67 2zc7A1 LEU 274 HD13 0.04 -0.02 -0.20 -0.04 0.93 0.70 2zc7A1 LEU 274 HD23 -0.02 -0.02 -0.12 -0.04 0.89 0.69 2zc7A1 ASN 275 H 0.22 0.17 0.14 -0.55 8.53 8.51 2zc7A1 ASN 275 HA 0.18 0.14 0.62 -0.75 4.76 4.94 2zc7A1 ASN 275 HB2 0.10 -0.06 0.16 -0.04 2.88 3.05 2zc7A1 ASN 275 HB3 0.08 0.12 0.11 -0.04 2.79 3.06 2zc7A1 ASN 275 HD21 0.18 0.00 0.01 -0.04 7.03 7.18 2zc7A1 ASN 275 HD22 0.13 -0.03 0.04 -0.04 7.74 7.84 2zc7A1 TRP 276 H 0.33 0.50 0.11 -0.55 7.97 8.36 2zc7A1 TRP 276 HA 0.10 0.02 0.60 -0.75 4.62 4.59 2zc7A1 TRP 276 HB2 0.11 -0.02 -0.45 -0.04 3.23 2.83 2zc7A1 TRP 276 HB3 0.04 -0.10 -0.27 -0.04 3.23 2.86 2zc7A1 TRP 276 HD1 0.03 -0.04 -0.12 -0.04 7.22 7.05 2zc7A1 TRP 276 HE1 0.05 0.01 -0.03 -0.04 10.20 10.19 2zc7A1 TRP 276 HE3 0.28 0.08 -0.01 -0.04 7.59 7.90 2zc7A1 TRP 276 HZ2 0.06 0.07 -0.01 -0.04 7.44 7.52 2zc7A1 TRP 276 HZ3 0.13 0.04 0.02 -0.04 7.13 7.28 2zc7A1 TRP 276 HH2 -0.03 0.04 -0.01 -0.04 7.19 7.15 2zc7A1 PRO 277 HA -3.82 -0.01 0.31 -0.51 4.44 0.41 2zc7A1 PRO 277 HB2 -0.53 -0.00 -0.13 -0.04 2.28 1.58 2zc7A1 PRO 277 HB3 -0.87 0.03 -0.04 -0.04 2.02 1.10 2zc7A1 PRO 277 HG2 -0.31 0.02 0.01 -0.04 2.03 1.71 2zc7A1 PRO 277 HG3 -0.63 0.02 -0.07 -0.04 2.03 1.31 2zc7A1 PRO 277 HD2 -0.27 0.04 0.53 -0.04 3.68 3.93 2zc7A1 PRO 277 HD3 -0.21 0.18 -0.68 -0.04 3.65 2.89 2zc7A1 VAL 278 H -1.22 0.18 0.11 -0.55 8.24 6.75 2zc7A1 VAL 278 HA -0.17 0.24 1.05 -0.75 4.13 4.50 2zc7A1 VAL 278 HB 0.13 0.42 -0.25 -0.04 2.12 2.38 2zc7A1 VAL 278 HG13 0.32 -0.04 -0.07 -0.04 0.97 1.14 2zc7A1 VAL 278 HG23 -0.11 0.02 -0.08 -0.04 0.95 0.75 2zc7A1 ASP 279 H -0.13 0.18 0.16 -0.55 8.40 8.07 2zc7A1 ASP 279 HA -0.13 0.08 0.51 -0.75 4.63 4.34 2zc7A1 ASP 279 HB2 -0.11 0.14 0.17 -0.04 2.71 2.87 2zc7A1 ASP 279 HB3 -0.12 -0.12 0.15 -0.04 2.70 2.56 2zc7A1 ALA 280 H -0.31 0.20 0.20 -0.55 8.40 7.94 2zc7A1 ALA 280 HA -1.05 0.14 0.41 -0.75 4.34 3.08 2zc7A1 ALA 280 HB3 -0.77 0.04 0.08 -0.04 1.41 0.72 2zc7A1 LYS 281 H -0.21 0.08 -0.15 -0.55 8.42 7.58 2zc7A1 LYS 281 HA -0.14 0.09 0.34 -0.75 4.32 3.85 2zc7A1 LYS 281 HB2 -0.10 0.03 0.07 -0.04 1.87 1.82 2zc7A1 LYS 281 HB3 -0.11 -0.04 0.04 -0.04 1.79 1.64 2zc7A1 LYS 281 HG2 -0.08 0.03 -0.29 -0.04 1.46 1.08 2zc7A1 LYS 281 HG3 -0.07 0.01 -0.00 -0.04 1.46 1.35 2zc7A1 LYS 281 HD2 -0.06 0.01 -0.02 -0.04 1.69 1.58 2zc7A1 LYS 281 HD3 -0.06 0.01 -0.04 -0.04 1.68 1.54 2zc7A1 LYS 281 HE2 -0.04 0.02 -0.03 -0.04 2.99 2.90 2zc7A1 LYS 281 HE3 -0.05 0.01 -0.06 -0.04 2.99 2.86 2zc7A1 THR 282 H -0.15 0.06 -0.27 -0.55 8.28 7.37 2zc7A1 THR 282 HA -0.08 0.07 0.41 -0.75 4.39 4.04 2zc7A1 THR 282 HB -0.12 0.13 0.12 -0.04 4.32 4.40 2zc7A1 THR 282 HG23 -0.06 0.03 -0.12 -0.04 1.22 1.03 2zc7A1 VAL 283 H -0.21 0.38 -0.16 -0.55 8.24 7.70 2zc7A1 VAL 283 HA -0.07 0.10 0.39 -0.75 4.13 3.80 2zc7A1 VAL 283 HB -0.35 0.03 -0.01 -0.04 2.12 1.76 2zc7A1 VAL 283 HG13 -0.45 0.02 -0.07 -0.04 0.97 0.42 2zc7A1 VAL 283 HG23 -0.37 0.01 -0.10 -0.04 0.95 0.44 2zc7A1 VAL 284 H -0.19 0.61 -0.05 -0.55 8.24 8.05 2zc7A1 VAL 284 HA -0.06 0.00 0.38 -0.75 4.13 3.70 2zc7A1 VAL 284 HB -0.13 0.05 0.09 -0.04 2.12 2.09 2zc7A1 VAL 284 HG13 -0.06 0.01 -0.09 -0.04 0.97 0.78 2zc7A1 VAL 284 HG23 -0.16 0.00 -0.05 -0.04 0.95 0.70 2zc7A1 GLU 285 H -0.08 0.48 -0.19 -0.55 8.60 8.26 2zc7A1 GLU 285 HA -0.04 -0.03 0.46 -0.75 4.29 3.93 2zc7A1 GLU 285 HB2 -0.06 0.18 0.15 -0.04 2.09 2.32 2zc7A1 GLU 285 HB3 -0.04 -0.06 0.04 -0.04 1.99 1.89 2zc7A1 GLU 285 HG2 -0.05 -0.08 0.00 -0.04 2.34 2.17 2zc7A1 GLU 285 HG3 -0.07 0.12 0.14 -0.04 2.34 2.48 2zc7A1 GLY 286 H -0.04 0.50 -0.20 -0.55 8.43 8.15 2zc7A1 GLY 286 HA2 -0.02 0.00 0.47 -0.51 4.01 3.96 2zc7A1 GLY 286 HA3 0.01 0.09 0.32 -0.51 4.01 3.91 2zc7A1 SER 287 H -0.01 0.28 -0.63 -0.55 8.46 7.55 2zc7A1 SER 287 HA -0.01 0.16 0.63 -0.75 4.49 4.51 2zc7A1 SER 287 HB2 -0.02 -0.12 -0.02 -0.04 3.95 3.75 2zc7A1 SER 287 HB3 0.07 0.05 -0.02 -0.04 3.93 4.00 2zc7A1 ASP 288 H -0.03 0.35 -0.22 -0.55 8.40 7.95 2zc7A1 ASP 288 HA -0.04 -0.03 0.53 -0.75 4.63 4.34 2zc7A1 ASP 288 HB2 -0.03 0.13 0.21 -0.04 2.71 2.97 2zc7A1 ASP 288 HB3 -0.03 -0.01 0.08 -0.04 2.70 2.70 2zc7A1 ASN 289 H -0.03 0.12 0.22 -0.55 8.53 8.29 2zc7A1 ASN 289 HA -0.05 0.12 0.38 -0.75 4.76 4.46 2zc7A1 ASN 289 HB2 -0.02 -0.04 0.12 -0.04 2.88 2.90 2zc7A1 ASN 289 HB3 -0.01 0.07 -0.01 -0.04 2.79 2.79 2zc7A1 ASN 289 HD21 -0.01 0.03 0.03 -0.04 7.03 7.04 2zc7A1 ASN 289 HD22 -0.01 0.01 0.04 -0.04 7.74 7.74 2zc7A1 LYS 290 H -0.02 0.03 -0.19 -0.55 8.42 7.68 2zc7A1 LYS 290 HA -0.01 0.09 0.32 -0.75 4.32 3.97 2zc7A1 LYS 290 HB2 -0.01 -0.06 0.04 -0.04 1.87 1.79 2zc7A1 LYS 290 HB3 -0.01 0.07 -0.04 -0.04 1.79 1.77 2zc7A1 LYS 290 HG2 -0.00 0.05 0.04 -0.04 1.46 1.50 2zc7A1 LYS 290 HG3 -0.01 -0.06 0.03 -0.04 1.46 1.38 2zc7A1 LYS 290 HD2 -0.01 -0.02 0.01 -0.04 1.69 1.63 2zc7A1 LYS 290 HD3 -0.01 0.03 0.01 -0.04 1.68 1.68 2zc7A1 LYS 290 HE2 0.00 0.02 0.01 -0.04 2.99 2.98 2zc7A1 LYS 290 HE3 -0.00 -0.02 0.01 -0.04 2.99 2.94 2zc7A1 VAL 291 H -0.03 0.20 -0.47 -0.55 8.24 7.40 2zc7A1 VAL 291 HA -0.03 0.17 0.86 -0.75 4.13 4.38 2zc7A1 VAL 291 HB -0.03 0.10 0.11 -0.04 2.12 2.27 2zc7A1 VAL 291 HG13 -0.02 0.01 -0.08 -0.04 0.97 0.84 2zc7A1 VAL 291 HG23 -0.02 -0.04 -0.11 -0.04 0.95 0.74 2zc7A1 ALA 292 H -0.04 0.57 0.09 -0.55 8.40 8.46 2zc7A1 ALA 292 HA -0.06 0.08 0.43 -0.75 4.34 4.03 2zc7A1 ALA 292 HB3 -0.11 0.01 0.03 -0.04 1.41 1.30 2zc7A1 LEU 293 H -0.04 0.35 -0.16 -0.55 8.37 7.96 2zc7A1 LEU 293 HA -0.00 0.14 0.87 -0.75 4.35 4.60 2zc7A1 LEU 293 HB2 -0.01 0.13 0.08 -0.04 1.64 1.81 2zc7A1 LEU 293 HB3 0.03 -0.06 0.15 -0.04 1.64 1.71 2zc7A1 LEU 293 HG -0.07 -0.08 0.00 -0.04 1.64 1.46 2zc7A1 LEU 293 HD13 -0.00 -0.03 0.02 -0.04 0.93 0.87 2zc7A1 LEU 293 HD23 -0.10 0.03 -0.12 -0.04 0.89 0.65 2zc7A1 ALA 294 H -0.02 0.23 -0.43 -0.55 8.40 7.63 2zc7A1 ALA 294 HA 0.02 0.04 0.58 -0.75 4.34 4.22 2zc7A1 ALA 294 HB3 -0.02 0.06 0.09 -0.04 1.41 1.51 2zc7A1 PRO 295 HA -0.21 0.36 0.78 -0.51 4.44 4.87 2zc7A1 PRO 295 HB2 -0.96 -0.03 -0.05 -0.04 2.28 1.20 2zc7A1 PRO 295 HB3 -0.41 -0.02 0.04 -0.04 2.02 1.59 2zc7A1 PRO 295 HG2 -0.01 -0.01 0.12 -0.04 2.03 2.08 2zc7A1 PRO 295 HG3 0.30 -0.00 0.08 -0.04 2.03 2.36 2zc7A1 PRO 295 HD2 0.01 0.05 0.25 -0.04 3.68 3.95 2zc7A1 PRO 295 HD3 0.08 0.12 0.22 -0.04 3.65 4.03 2zc7A1 LEU 296 H -0.24 0.65 0.36 -0.55 8.37 8.58 2zc7A1 LEU 296 HA -0.19 0.18 0.99 -0.75 4.35 4.58 2zc7A1 LEU 296 HB2 -0.10 -0.03 0.05 -0.04 1.64 1.52 2zc7A1 LEU 296 HB3 -0.09 -0.03 0.09 -0.04 1.64 1.57 2zc7A1 LEU 296 HG -0.08 0.19 -0.37 -0.04 1.64 1.34 2zc7A1 LEU 296 HD13 -0.04 -0.03 -0.07 -0.04 0.93 0.75 2zc7A1 LEU 296 HD23 -0.07 0.04 -0.07 -0.04 0.89 0.76 2zc7A1 PRO 297 HA -0.17 0.17 0.64 -0.51 4.44 4.58 2zc7A1 PRO 297 HB2 -0.04 -0.03 0.08 -0.04 2.28 2.24 2zc7A1 PRO 297 HB3 -0.06 0.04 0.13 -0.04 2.02 2.09 2zc7A1 PRO 297 HG2 -0.07 -0.01 0.10 -0.04 2.03 2.01 2zc7A1 PRO 297 HG3 -0.14 0.03 0.07 -0.04 2.03 1.95 2zc7A1 PRO 297 HD2 -0.09 0.05 0.24 -0.04 3.68 3.84 2zc7A1 PRO 297 HD3 -0.15 0.19 0.23 -0.04 3.65 3.88 2zc7A1 ALA 298 H -0.05 0.79 0.34 -0.55 8.40 8.93 2zc7A1 ALA 298 HA 0.07 0.22 0.95 -0.75 4.34 4.83 2zc7A1 ALA 298 HB3 -0.29 -0.02 -0.24 -0.04 1.41 0.81 2zc7A1 ARG 299 H 0.23 0.56 0.25 -0.55 8.46 8.94 2zc7A1 ARG 299 HA 0.24 0.13 0.90 -0.75 4.34 4.86 2zc7A1 ARG 299 HB2 0.10 -0.02 0.10 -0.04 1.90 2.05 2zc7A1 ARG 299 HB3 0.12 -0.03 0.19 -0.04 1.80 2.04 2zc7A1 ARG 299 HG2 0.06 -0.05 0.00 -0.04 1.67 1.64 2zc7A1 ARG 299 HG3 0.07 0.13 -0.09 -0.04 1.67 1.74 2zc7A1 ARG 299 HD2 0.05 -0.03 0.03 -0.04 3.22 3.23 2zc7A1 ARG 299 HD3 0.09 0.04 0.11 -0.04 3.22 3.42 2zc7A1 GLU 300 H 0.16 0.18 0.16 -0.55 8.60 8.54 2zc7A1 GLU 300 HA -0.91 0.19 0.63 -0.75 4.29 3.44 2zc7A1 GLU 300 HB2 -0.43 0.05 0.14 -0.04 2.09 1.81 2zc7A1 GLU 300 HB3 -0.25 -0.08 0.01 -0.04 1.99 1.62 2zc7A1 GLU 300 HG2 -0.58 0.14 -0.17 -0.04 2.34 1.68 2zc7A1 GLU 300 HG3 -1.88 0.06 0.06 -0.04 2.34 0.54 2zc7A1 VAL 301 H -0.35 0.55 -0.03 -0.55 8.24 7.86 2zc7A1 VAL 301 HA -0.07 0.03 0.58 -0.75 4.13 3.92 2zc7A1 VAL 301 HB -0.15 0.11 0.03 -0.04 2.12 2.07 2zc7A1 VAL 301 HG13 -0.09 0.04 -0.05 -0.04 0.97 0.83 2zc7A1 VAL 301 HG23 0.07 -0.02 -0.29 -0.04 0.95 0.66 2zc7A1 ASN 302 H -0.07 0.10 0.06 -0.55 8.53 8.07 2zc7A1 ASN 302 HA -0.08 -0.00 0.27 -0.75 4.76 4.19 2zc7A1 ASN 302 HB2 -0.04 -0.03 0.08 -0.04 2.88 2.85 2zc7A1 ASN 302 HB3 -0.04 -0.02 -0.19 -0.04 2.79 2.50 2zc7A1 ASN 302 HD21 -0.02 -0.03 -0.02 -0.04 7.03 6.92 2zc7A1 ASN 302 HD22 -0.03 -0.00 -0.03 -0.04 7.74 7.64 2zc7A1 PRO 303 HA -0.05 -0.03 0.35 -0.51 4.44 4.19 2zc7A1 PRO 303 HB2 -0.06 0.21 0.50 -0.04 2.28 2.89 2zc7A1 PRO 303 HB3 -0.05 -0.03 0.09 -0.04 2.02 1.99 2zc7A1 PRO 303 HG2 -0.04 0.04 -0.30 -0.04 2.03 1.69 2zc7A1 PRO 303 HG3 -0.03 -0.04 0.01 -0.04 2.03 1.93 2zc7A1 PRO 303 HD2 -0.03 -0.00 -0.13 -0.04 3.68 3.47 2zc7A1 PRO 303 HD3 -0.03 0.06 0.16 -0.04 3.65 3.79 2zc7A1 PRO 304 HA -0.26 0.22 0.42 -0.51 4.44 4.31 2zc7A1 PRO 304 HB2 -0.36 -0.04 -0.06 -0.04 2.28 1.78 2zc7A1 PRO 304 HB3 -0.98 0.05 -0.14 -0.04 2.02 0.91 2zc7A1 PRO 304 HG2 0.00 -0.07 0.03 -0.04 2.03 1.96 2zc7A1 PRO 304 HG3 0.01 0.03 0.05 -0.04 2.03 2.08 2zc7A1 PRO 304 HD2 -0.05 -0.01 0.18 -0.04 3.68 3.76 2zc7A1 PRO 304 HD3 -0.07 0.16 0.11 -0.04 3.65 3.81 2zc7A1 ALA 305 H -0.19 0.23 0.22 -0.55 8.40 8.11 2zc7A1 ALA 305 HA -0.12 0.05 0.39 -0.75 4.34 3.91 2zc7A1 ALA 305 HB3 -0.15 -0.03 0.09 -0.04 1.41 1.27 2zc7A1 PRO 306 HA -0.10 0.14 0.50 -0.51 4.44 4.46 2zc7A1 PRO 306 HB2 -0.06 0.04 0.05 -0.04 2.28 2.27 2zc7A1 PRO 306 HB3 -0.06 -0.01 0.06 -0.04 2.02 1.97 2zc7A1 PRO 306 HG2 -0.07 0.02 -0.05 -0.04 2.03 1.89 2zc7A1 PRO 306 HG3 -0.05 -0.03 0.03 -0.04 2.03 1.94 2zc7A1 PRO 306 HD2 -0.09 0.01 0.18 -0.04 3.68 3.75 2zc7A1 PRO 306 HD3 -0.08 0.18 0.15 -0.04 3.65 3.86 2zc7A1 PRO 307 HA -0.08 0.18 0.36 -0.51 4.44 4.38 2zc7A1 PRO 307 HB2 -0.06 -0.10 -0.03 -0.04 2.28 2.05 2zc7A1 PRO 307 HB3 -0.07 0.07 -0.04 -0.04 2.02 1.94 2zc7A1 PRO 307 HG2 -0.04 -0.07 0.03 -0.04 2.03 1.91 2zc7A1 PRO 307 HG3 -0.03 0.12 -0.19 -0.04 2.03 1.89 2zc7A1 PRO 307 HD2 -0.05 -0.02 0.13 -0.04 3.68 3.70 2zc7A1 PRO 307 HD3 -0.05 0.18 0.09 -0.04 3.65 3.83 2zc7A1 VAL 308 H -0.09 0.21 0.09 -0.55 8.24 7.90 2zc7A1 VAL 308 HA -0.05 0.14 0.92 -0.75 4.13 4.39 2zc7A1 VAL 308 HB -0.05 -0.01 0.06 -0.04 2.12 2.08 2zc7A1 VAL 308 HG13 -0.13 0.05 -0.03 -0.04 0.97 0.82 2zc7A1 VAL 308 HG23 -0.01 -0.08 -0.20 -0.04 0.95 0.61 2zc7A1 ASN 309 H -0.03 0.18 0.08 -0.55 8.53 8.21 2zc7A1 ASN 309 HA -0.06 0.15 0.39 -0.75 4.76 4.49 2zc7A1 ASN 309 HB2 -0.02 -0.02 0.09 -0.04 2.88 2.89 2zc7A1 ASN 309 HB3 -0.03 -0.03 -0.03 -0.04 2.79 2.66 2zc7A1 ASN 309 HD21 -0.04 0.01 -0.01 -0.04 7.03 6.96 2zc7A1 ASN 309 HD22 -0.03 -0.02 0.00 -0.04 7.74 7.65 2zc7A1 ALA 310 H 0.02 0.08 -0.26 -0.55 8.40 7.70 2zc7A1 ALA 310 HA 0.13 0.06 0.73 -0.75 4.34 4.50 2zc7A1 ALA 310 HB3 0.13 0.03 0.14 -0.04 1.41 1.68 2zc7A1 SER 311 H -0.01 0.49 0.03 -0.55 8.46 8.42 2zc7A1 SER 311 HA 0.20 0.07 0.90 -0.75 4.49 4.91 2zc7A1 SER 311 HB2 -0.14 0.01 -0.04 -0.04 3.95 3.73 2zc7A1 SER 311 HB3 0.01 -0.01 -0.03 -0.04 3.93 3.85 2zc7A1 TRP 312 H 0.32 0.75 0.21 -0.55 7.97 8.70 2zc7A1 TRP 312 HA -0.26 0.17 0.79 -0.75 4.62 4.57 2zc7A1 TRP 312 HB2 0.29 -0.05 0.03 -0.04 3.23 3.47 2zc7A1 TRP 312 HB3 0.06 -0.01 0.13 -0.04 3.23 3.37 2zc7A1 TRP 312 HD1 -0.61 -0.01 -0.25 -0.04 7.22 6.32 2zc7A1 TRP 312 HE1 0.11 -0.02 -0.16 -0.04 10.20 10.09 2zc7A1 TRP 312 HE3 -0.47 -0.01 -0.04 -0.04 7.59 7.03 2zc7A1 TRP 312 HZ2 0.40 -0.02 -0.15 -0.04 7.44 7.62 2zc7A1 TRP 312 HZ3 -0.23 0.02 -0.10 -0.04 7.13 6.78 2zc7A1 TRP 312 HH2 0.13 0.01 -0.36 -0.04 7.19 6.93 2zc7A1 VAL 313 H -0.80 0.75 0.26 -0.55 8.24 7.90 2zc7A1 VAL 313 HA -0.22 0.29 1.06 -0.75 4.13 4.50 2zc7A1 VAL 313 HB -2.39 -0.09 0.14 -0.04 2.12 -0.26 2zc7A1 VAL 313 HG13 -0.94 0.01 -0.11 -0.04 0.97 -0.11 2zc7A1 VAL 313 HG23 -0.59 0.02 -0.10 -0.04 0.95 0.24 2zc7A1 HIS 314 H 0.40 0.78 0.40 -0.55 8.41 9.44 2zc7A1 HIS 314 HA 0.03 0.18 0.86 -0.75 4.63 4.95 2zc7A1 HIS 314 HB2 -0.02 0.09 0.22 -0.04 3.26 3.51 2zc7A1 HIS 314 HB3 -0.09 -0.10 -0.22 -0.04 3.20 2.74 2zc7A1 HIS 314 HD2 0.31 0.15 0.01 -0.04 6.97 7.39 2zc7A1 HIS 314 HE1 0.28 0.01 -0.12 -0.04 7.75 7.87 2zc7A1 LYS 315 H -0.00 0.61 0.33 -0.55 8.42 8.80 2zc7A1 LYS 315 HA 0.03 0.08 0.51 -0.75 4.32 4.19 2zc7A1 LYS 315 HB2 0.13 0.11 -0.11 -0.04 1.87 1.96 2zc7A1 LYS 315 HB3 0.05 -0.11 0.01 -0.04 1.79 1.69 2zc7A1 LYS 315 HG2 -0.07 -0.08 -0.07 -0.04 1.46 1.20 2zc7A1 LYS 315 HG3 0.06 0.02 -0.30 -0.04 1.46 1.19 2zc7A1 LYS 315 HD2 0.08 -0.13 0.19 -0.04 1.69 1.79 2zc7A1 LYS 315 HD3 0.13 0.29 0.15 -0.04 1.68 2.21 2zc7A1 LYS 315 HE2 0.32 0.05 0.09 -0.04 2.99 3.41 2zc7A1 LYS 315 HE3 0.18 0.03 0.04 -0.04 2.99 3.20 2zc7A1 THR 316 H 0.04 0.21 0.17 -0.55 8.28 8.16 2zc7A1 THR 316 HA 0.29 0.18 1.04 -0.75 4.39 5.14 2zc7A1 THR 316 HB 0.23 -0.02 0.12 -0.04 4.32 4.60 2zc7A1 THR 316 HG23 -0.04 -0.00 0.01 -0.04 1.22 1.14 2zc7A1 GLY 317 H 0.13 0.81 0.36 -0.55 8.43 9.19 2zc7A1 GLY 317 HA2 0.10 0.05 0.96 -0.51 4.01 4.62 2zc7A1 GLY 317 HA3 0.11 0.03 0.43 -0.51 4.01 4.08 2zc7A1 SER 318 H 0.10 0.11 0.32 -0.55 8.46 8.44 2zc7A1 SER 318 HA 0.14 0.35 1.01 -0.75 4.49 5.24 2zc7A1 SER 318 HB2 0.05 -0.07 0.05 -0.04 3.95 3.94 2zc7A1 SER 318 HB3 0.07 0.19 0.21 -0.04 3.93 4.37 2zc7A1 THR 319 H 0.19 0.53 0.32 -0.55 8.28 8.77 2zc7A1 THR 319 HA 0.04 0.17 0.52 -0.75 4.39 4.38 2zc7A1 THR 319 HB 0.15 -0.10 0.21 -0.04 4.32 4.54 2zc7A1 THR 319 HG23 0.14 0.02 -0.03 -0.04 1.22 1.31 2zc7A1 GLY 320 H 0.09 0.12 0.11 -0.55 8.43 8.21 2zc7A1 GLY 320 HA2 0.07 0.15 0.51 -0.51 4.01 4.23 2zc7A1 GLY 320 HA3 0.07 0.02 0.31 -0.51 4.01 3.91 2zc7A1 GLY 321 H 0.26 -0.04 -0.28 -0.55 8.43 7.82 2zc7A1 GLY 321 HA2 0.07 0.38 0.63 -0.51 4.01 4.58 2zc7A1 GLY 321 HA3 0.07 -0.02 0.08 -0.51 4.01 3.63 2zc7A1 PHE 322 H 0.35 0.05 -0.20 -0.55 8.34 7.99 2zc7A1 PHE 322 HA 0.22 0.19 0.91 -0.75 4.62 5.19 2zc7A1 PHE 322 HB2 0.17 -0.18 -0.00 -0.04 3.15 3.10 2zc7A1 PHE 322 HB3 0.22 0.23 0.00 -0.04 3.06 3.47 2zc7A1 PHE 322 HD2 0.33 -0.02 -0.15 -0.04 7.28 7.39 2zc7A1 PHE 322 HE2 0.17 0.05 -0.02 -0.04 7.38 7.54 2zc7A1 PHE 322 HZ 0.06 0.34 -0.37 -0.04 7.32 7.30 2zc7A1 GLY 323 H 0.35 0.66 0.19 -0.55 8.43 9.08 2zc7A1 GLY 323 HA2 0.14 0.14 1.05 -0.51 4.01 4.83 2zc7A1 GLY 323 HA3 0.13 0.01 0.44 -0.51 4.01 4.09 2zc7A1 SER 324 H 0.14 0.69 0.47 -0.55 8.46 9.21 2zc7A1 SER 324 HA 0.17 0.33 1.18 -0.75 4.49 5.42 2zc7A1 SER 324 HB2 0.14 0.07 0.11 -0.04 3.95 4.23 2zc7A1 SER 324 HB3 0.12 -0.02 0.09 -0.04 3.93 4.08 2zc7A1 TYR 325 H 0.22 0.54 0.40 -0.55 8.29 8.90 2zc7A1 TYR 325 HA 0.12 0.20 0.97 -0.75 4.56 5.09 2zc7A1 TYR 325 HB2 0.07 0.01 -0.17 -0.04 3.06 2.93 2zc7A1 TYR 325 HB3 0.13 -0.01 0.04 -0.04 2.98 3.10 2zc7A1 TYR 325 HD2 0.14 -0.03 -0.11 -0.04 7.15 7.11 2zc7A1 TYR 325 HE2 0.27 -0.02 -0.19 -0.04 6.85 6.87 2zc7A1 VAL 326 H -0.51 0.56 0.34 -0.55 8.24 8.08 2zc7A1 VAL 326 HA -0.05 0.29 1.03 -0.75 4.13 4.66 2zc7A1 VAL 326 HB 0.31 -0.03 0.08 -0.04 2.12 2.43 2zc7A1 VAL 326 HG13 0.26 0.03 -0.07 -0.04 0.97 1.14 2zc7A1 VAL 326 HG23 0.20 -0.03 -0.13 -0.04 0.95 0.95 2zc7A1 ALA 327 H -0.10 0.59 0.36 -0.55 8.40 8.70 2zc7A1 ALA 327 HA -0.36 0.37 0.92 -0.75 4.34 4.52 2zc7A1 ALA 327 HB3 -0.63 -0.02 -0.08 -0.04 1.41 0.64 2zc7A1 PHE 328 H -0.86 0.64 0.42 -0.55 8.34 8.00 2zc7A1 PHE 328 HA -0.48 0.16 0.71 -0.75 4.62 4.25 2zc7A1 PHE 328 HB2 -0.32 0.03 0.07 -0.04 3.15 2.88 2zc7A1 PHE 328 HB3 -0.31 -0.03 -0.03 -0.04 3.06 2.66 2zc7A1 PHE 328 HD2 -0.40 -0.05 -0.24 -0.04 7.28 6.55 2zc7A1 PHE 328 HE2 -1.37 0.05 -0.22 -0.04 7.38 5.80 2zc7A1 PHE 328 HZ -1.19 0.05 -0.17 -0.04 7.32 5.96 2zc7A1 ILE 329 H -0.22 0.75 0.27 -0.55 8.25 8.49 2zc7A1 ILE 329 HA -0.41 0.52 1.07 -0.75 4.18 4.61 2zc7A1 ILE 329 HB -0.44 -0.12 0.28 -0.04 1.89 1.57 2zc7A1 ILE 329 HG12 -0.82 0.10 0.11 -0.04 1.49 0.85 2zc7A1 ILE 329 HG13 -0.76 -0.08 -0.43 -0.04 1.21 -0.10 2zc7A1 ILE 329 HG23 -0.60 -0.02 0.13 -0.04 0.93 0.40 2zc7A1 ILE 329 HD13 -1.13 -0.02 -0.04 -0.04 0.88 -0.34 2zc7A1 PRO 330 HA -0.05 0.03 0.55 -0.51 4.44 4.47 2zc7A1 PRO 330 HB2 -0.06 -0.05 0.14 -0.04 2.28 2.26 2zc7A1 PRO 330 HB3 -0.04 0.34 0.25 -0.04 2.02 2.53 2zc7A1 PRO 330 HG2 -0.13 0.07 0.08 -0.04 2.03 2.01 2zc7A1 PRO 330 HG3 0.03 0.04 0.05 -0.04 2.03 2.11 2zc7A1 PRO 330 HD2 -0.18 0.25 0.39 -0.04 3.68 4.10 2zc7A1 PRO 330 HD3 -0.41 0.16 0.07 -0.04 3.65 3.44 2zc7A1 GLU 331 H -0.09 0.38 -0.07 -0.55 8.60 8.28 2zc7A1 GLU 331 HA -0.03 0.04 0.34 -0.75 4.29 3.89 2zc7A1 GLU 331 HB2 0.02 -0.06 -0.37 -0.04 2.09 1.64 2zc7A1 GLU 331 HB3 0.00 -0.06 0.09 -0.04 1.99 1.98 2zc7A1 GLU 331 HG2 0.08 -0.00 -0.20 -0.04 2.34 2.18 2zc7A1 GLU 331 HG3 0.02 0.03 -0.10 -0.04 2.34 2.25 2zc7A1 LYS 332 H -0.12 0.08 -0.07 -0.55 8.42 7.76 2zc7A1 LYS 332 HA -0.04 0.13 0.64 -0.75 4.32 4.29 2zc7A1 LYS 332 HB2 -0.16 0.00 0.08 -0.04 1.87 1.76 2zc7A1 LYS 332 HB3 -0.06 0.00 0.13 -0.04 1.79 1.82 2zc7A1 LYS 332 HG2 0.06 0.01 -0.01 -0.04 1.46 1.48 2zc7A1 LYS 332 HG3 -0.05 -0.07 0.03 -0.04 1.46 1.33 2zc7A1 LYS 332 HD2 0.32 -0.03 -0.00 -0.04 1.69 1.94 2zc7A1 LYS 332 HD3 -0.17 0.01 0.02 -0.04 1.68 1.50 2zc7A1 LYS 332 HE2 0.09 0.12 0.01 -0.04 2.99 3.17 2zc7A1 LYS 332 HE3 0.02 -0.04 0.04 -0.04 2.99 2.96 2zc7A1 GLN 333 H -0.10 0.27 -0.47 -0.55 8.47 7.63 2zc7A1 GLN 333 HA -0.09 0.06 0.26 -0.75 4.36 3.83 2zc7A1 GLN 333 HB2 -0.10 0.08 -0.16 -0.04 2.15 1.93 2zc7A1 GLN 333 HB3 -0.09 -0.18 0.16 -0.04 2.02 1.86 2zc7A1 GLN 333 HG2 -0.07 0.19 -0.06 -0.04 2.40 2.42 2zc7A1 GLN 333 HG3 -0.07 -0.07 -0.06 -0.04 2.39 2.15 2zc7A1 GLN 333 HE21 -0.08 0.16 -0.08 -0.04 6.97 6.93 2zc7A1 GLN 333 HE22 -0.07 0.52 0.20 -0.04 7.69 8.31 2zc7A1 LEU 334 H -0.13 0.33 -0.06 -0.55 8.37 7.96 2zc7A1 LEU 334 HA -0.04 0.36 0.99 -0.75 4.35 4.90 2zc7A1 LEU 334 HB2 -0.10 0.04 -0.09 -0.04 1.64 1.45 2zc7A1 LEU 334 HB3 -0.19 -0.08 0.07 -0.04 1.64 1.40 2zc7A1 LEU 334 HG -0.04 -0.01 -0.08 -0.04 1.64 1.47 2zc7A1 LEU 334 HD13 0.15 0.07 0.13 -0.04 0.93 1.23 2zc7A1 LEU 334 HD23 -0.02 0.00 0.03 -0.04 0.89 0.86 2zc7A1 GLY 335 H -0.01 0.58 0.39 -0.55 8.43 8.85 2zc7A1 GLY 335 HA2 -0.12 0.21 0.88 -0.51 4.01 4.47 2zc7A1 GLY 335 HA3 -0.05 0.00 0.36 -0.51 4.01 3.81 2zc7A1 ILE 336 H -0.04 0.68 0.43 -0.55 8.25 8.77 2zc7A1 ILE 336 HA 0.10 0.36 0.97 -0.75 4.18 4.85 2zc7A1 ILE 336 HB 0.07 0.02 -0.10 -0.04 1.89 1.84 2zc7A1 ILE 336 HG12 0.17 -0.04 -0.19 -0.04 1.49 1.39 2zc7A1 ILE 336 HG13 0.16 0.08 0.06 -0.04 1.21 1.47 2zc7A1 ILE 336 HG23 0.11 -0.00 -0.07 -0.04 0.93 0.92 2zc7A1 ILE 336 HD13 0.14 -0.02 -0.07 -0.04 0.88 0.89 2zc7A1 VAL 337 H 0.15 0.57 0.40 -0.55 8.24 8.80 2zc7A1 VAL 337 HA 0.12 0.27 1.01 -0.75 4.13 4.77 2zc7A1 VAL 337 HB 0.14 -0.11 0.15 -0.04 2.12 2.26 2zc7A1 VAL 337 HG13 0.11 -0.01 -0.18 -0.04 0.97 0.84 2zc7A1 VAL 337 HG23 0.12 -0.00 -0.26 -0.04 0.95 0.77 2zc7A1 MET 338 H 0.16 0.65 0.29 -0.55 8.47 9.02 2zc7A1 MET 338 HA 0.13 0.21 0.99 -0.75 4.52 5.10 2zc7A1 MET 338 HB2 0.27 -0.04 0.22 -0.04 2.15 2.56 2zc7A1 MET 338 HB3 0.19 0.03 0.02 -0.04 2.03 2.24 2zc7A1 MET 338 HG2 0.17 0.02 -0.09 -0.04 2.63 2.69 2zc7A1 MET 338 HG3 0.21 -0.07 -0.43 -0.04 2.56 2.23 2zc7A1 MET 338 HE3 0.20 0.01 -0.05 -0.04 2.10 2.22 2zc7A1 LEU 339 H -0.08 0.80 0.34 -0.55 8.37 8.89 2zc7A1 LEU 339 HA -0.05 0.10 0.89 -0.75 4.35 4.53 2zc7A1 LEU 339 HB2 -1.04 -0.08 0.13 -0.04 1.64 0.61 2zc7A1 LEU 339 HB3 -0.68 0.01 -0.07 -0.04 1.64 0.86 2zc7A1 LEU 339 HG -0.06 0.02 -0.13 -0.04 1.64 1.42 2zc7A1 LEU 339 HD13 0.10 0.00 -0.32 -0.04 0.93 0.68 2zc7A1 LEU 339 HD23 0.05 0.01 -0.23 -0.04 0.89 0.67 2zc7A1 ALA 340 H 0.12 0.37 0.23 -0.55 8.40 8.58 2zc7A1 ALA 340 HA 0.13 0.17 0.97 -0.75 4.34 4.86 2zc7A1 ALA 340 HB3 0.23 0.07 0.14 -0.04 1.41 1.81 2zc7A1 ASN 341 H 0.35 0.38 0.18 -0.55 8.53 8.90 2zc7A1 ASN 341 HA -0.34 0.06 0.92 -0.75 4.76 4.64 2zc7A1 ASN 341 HB2 -0.25 0.28 0.39 -0.04 2.88 3.26 2zc7A1 ASN 341 HB3 0.24 -0.10 0.08 -0.04 2.79 2.98 2zc7A1 ASN 341 HD21 0.23 0.23 0.16 -0.04 7.03 7.61 2zc7A1 ASN 341 HD22 0.26 0.17 0.26 -0.04 7.74 8.38 2zc7A1 LYS 342 H 0.19 0.19 -0.46 -0.55 8.42 7.79 2zc7A1 LYS 342 HA 0.10 0.25 0.43 -0.75 4.32 4.34 2zc7A1 LYS 342 HB2 0.09 0.11 0.29 -0.04 1.87 2.32 2zc7A1 LYS 342 HB3 0.08 -0.17 0.02 -0.04 1.79 1.68 2zc7A1 LYS 342 HG2 0.06 0.05 -0.23 -0.04 1.46 1.30 2zc7A1 LYS 342 HG3 0.17 -0.05 -0.56 -0.04 1.46 0.98 2zc7A1 LYS 342 HD2 0.10 0.21 0.16 -0.04 1.69 2.12 2zc7A1 LYS 342 HD3 0.06 -0.01 0.05 -0.04 1.68 1.74 2zc7A1 LYS 342 HE2 0.11 -0.01 -0.15 -0.04 2.99 2.90 2zc7A1 LYS 342 HE3 0.08 -0.03 0.06 -0.04 2.99 3.06 2zc7A1 SER 343 H 0.14 0.27 -0.19 -0.55 8.46 8.13 2zc7A1 SER 343 HA 0.15 0.03 0.41 -0.75 4.49 4.32 2zc7A1 SER 343 HB2 0.14 0.12 -0.06 -0.04 3.95 4.11 2zc7A1 SER 343 HB3 0.11 0.07 0.09 -0.04 3.93 4.16 2zc7A1 TYR 344 H 0.12 0.19 0.12 -0.55 8.29 8.17 2zc7A1 TYR 344 HA 0.03 0.20 0.78 -0.75 4.56 4.82 2zc7A1 TYR 344 HB2 0.02 -0.00 0.07 -0.04 3.06 3.10 2zc7A1 TYR 344 HB3 0.03 0.09 -0.11 -0.04 2.98 2.95 2zc7A1 TYR 344 HD2 0.04 0.15 -0.04 -0.04 7.15 7.26 2zc7A1 TYR 344 HE2 0.04 0.03 -0.16 -0.04 6.85 6.73 2zc7A1 PRO 345 HA -0.04 0.00 0.40 -0.51 4.44 4.29 2zc7A1 PRO 345 HB2 0.02 -0.10 0.07 -0.04 2.28 2.24 2zc7A1 PRO 345 HB3 -0.00 -0.00 0.13 -0.04 2.02 2.11 2zc7A1 PRO 345 HG2 0.05 0.06 0.09 -0.04 2.03 2.19 2zc7A1 PRO 345 HG3 0.04 0.06 0.11 -0.04 2.03 2.20 2zc7A1 PRO 345 HD2 0.19 0.10 0.13 -0.04 3.68 4.06 2zc7A1 PRO 345 HD3 0.13 0.22 0.23 -0.04 3.65 4.18 2zc7A1 ASN 346 H -0.08 0.11 0.19 -0.55 8.53 8.21 2zc7A1 ASN 346 HA -0.18 0.10 0.52 -0.75 4.76 4.44 2zc7A1 ASN 346 HB2 -0.07 0.03 0.19 -0.04 2.88 2.99 2zc7A1 ASN 346 HB3 -0.07 0.04 0.05 -0.04 2.79 2.77 2zc7A1 ASN 346 HD21 -0.07 -0.03 -0.01 -0.04 7.03 6.89 2zc7A1 ASN 346 HD22 -0.08 0.06 0.05 -0.04 7.74 7.72 2zc7A1 PRO 347 HA -0.06 0.13 0.41 -0.51 4.44 4.42 2zc7A1 PRO 347 HB2 -0.03 0.02 -0.05 -0.04 2.28 2.18 2zc7A1 PRO 347 HB3 -0.04 0.09 0.01 -0.04 2.02 2.04 2zc7A1 PRO 347 HG2 -0.03 -0.00 0.06 -0.04 2.03 2.02 2zc7A1 PRO 347 HG3 -0.04 0.11 -0.08 -0.04 2.03 1.98 2zc7A1 PRO 347 HD2 -0.04 0.02 -0.02 -0.04 3.68 3.59 2zc7A1 PRO 347 HD3 -0.05 0.15 0.09 -0.04 3.65 3.79 2zc7A1 ALA 348 H -0.03 0.25 -0.43 -0.55 8.40 7.64 2zc7A1 ALA 348 HA 0.03 0.04 0.42 -0.75 4.34 4.08 2zc7A1 ALA 348 HB3 0.16 0.06 -0.02 -0.04 1.41 1.57 2zc7A1 ARG 349 H -0.15 0.36 -0.32 -0.55 8.46 7.79 2zc7A1 ARG 349 HA 0.05 0.07 0.37 -0.75 4.34 4.08 2zc7A1 ARG 349 HB2 -0.37 0.07 0.11 -0.04 1.90 1.67 2zc7A1 ARG 349 HB3 -0.13 -0.05 -0.04 -0.04 1.80 1.54 2zc7A1 ARG 349 HG2 -0.75 -0.02 -0.11 -0.04 1.67 0.76 2zc7A1 ARG 349 HG3 -0.44 0.17 0.05 -0.04 1.67 1.40 2zc7A1 ARG 349 HD2 -0.10 -0.04 -0.01 -0.04 3.22 3.03 2zc7A1 ARG 349 HD3 -0.12 -0.03 -0.26 -0.04 3.22 2.78 2zc7A1 VAL 350 H -0.25 0.48 -0.06 -0.55 8.24 7.86 2zc7A1 VAL 350 HA -0.39 0.03 0.22 -0.75 4.13 3.24 2zc7A1 VAL 350 HB -0.07 0.03 0.06 -0.04 2.12 2.10 2zc7A1 VAL 350 HG13 0.15 0.01 -0.27 -0.04 0.97 0.82 2zc7A1 VAL 350 HG23 -0.15 0.07 -0.04 -0.04 0.95 0.78 2zc7A1 GLU 351 H -0.04 0.68 -0.14 -0.55 8.60 8.56 2zc7A1 GLU 351 HA 0.02 -0.04 0.36 -0.75 4.29 3.89 2zc7A1 GLU 351 HB2 -0.02 -0.02 0.08 -0.04 2.09 2.08 2zc7A1 GLU 351 HB3 0.01 0.06 0.14 -0.04 1.99 2.17 2zc7A1 GLU 351 HG2 0.04 0.06 -0.23 -0.04 2.34 2.16 2zc7A1 GLU 351 HG3 0.02 -0.07 -0.05 -0.04 2.34 2.20 2zc7A1 ALA 352 H 0.06 0.52 -0.31 -0.55 8.40 8.12 2zc7A1 ALA 352 HA 0.08 -0.00 0.32 -0.75 4.34 3.99 2zc7A1 ALA 352 HB3 0.09 0.03 0.04 -0.04 1.41 1.52 2zc7A1 ALA 353 H 0.16 0.60 -0.15 -0.55 8.40 8.47 2zc7A1 ALA 353 HA 0.24 0.00 0.37 -0.75 4.34 4.20 2zc7A1 ALA 353 HB3 0.53 0.01 -0.04 -0.04 1.41 1.87 2zc7A1 TYR 354 H 0.39 0.66 -0.16 -0.55 8.29 8.62 2zc7A1 TYR 354 HA 0.46 -0.01 0.37 -0.75 4.56 4.62 2zc7A1 TYR 354 HB2 -0.06 0.05 0.06 -0.04 3.06 3.07 2zc7A1 TYR 354 HB3 0.03 0.10 0.12 -0.04 2.98 3.18 2zc7A1 TYR 354 HD2 -0.38 0.04 -0.17 -0.04 7.15 6.60 2zc7A1 TYR 354 HE2 -0.00 0.05 -0.05 -0.04 6.85 6.82 2zc7A1 ARG 355 H 0.25 0.60 -0.11 -0.55 8.46 8.64 2zc7A1 ARG 355 HA 0.16 -0.04 0.36 -0.75 4.34 4.06 2zc7A1 ARG 355 HB2 0.11 0.17 0.17 -0.04 1.90 2.31 2zc7A1 ARG 355 HB3 0.07 -0.02 -0.04 -0.04 1.80 1.78 2zc7A1 ARG 355 HG2 0.11 -0.07 0.01 -0.04 1.67 1.68 2zc7A1 ARG 355 HG3 0.16 0.03 0.04 -0.04 1.67 1.86 2zc7A1 ARG 355 HD2 0.06 0.01 -0.14 -0.04 3.22 3.12 2zc7A1 ARG 355 HD3 0.05 0.01 -0.04 -0.04 3.22 3.20 2zc7A1 ILE 356 H 0.11 0.50 -0.15 -0.55 8.25 8.16 2zc7A1 ILE 356 HA 0.02 0.06 0.39 -0.75 4.18 3.90 2zc7A1 ILE 356 HB 0.10 0.03 0.11 -0.04 1.89 2.08 2zc7A1 ILE 356 HG12 -0.01 0.21 0.02 -0.04 1.49 1.66 2zc7A1 ILE 356 HG13 0.04 0.03 0.07 -0.04 1.21 1.31 2zc7A1 ILE 356 HG23 0.02 -0.03 -0.21 -0.04 0.93 0.66 2zc7A1 ILE 356 HD13 0.03 -0.04 -0.04 -0.04 0.88 0.79 2zc7A1 LEU 357 H 0.12 0.71 -0.04 -0.55 8.37 8.61 2zc7A1 LEU 357 HA 0.04 0.00 0.34 -0.75 4.35 3.97 2zc7A1 LEU 357 HB2 0.21 0.06 0.07 -0.04 1.64 1.94 2zc7A1 LEU 357 HB3 -0.01 -0.06 -0.06 -0.04 1.64 1.47 2zc7A1 LEU 357 HG 0.08 0.10 -0.05 -0.04 1.64 1.73 2zc7A1 LEU 357 HD13 -0.41 -0.02 -0.21 -0.04 0.93 0.25 2zc7A1 LEU 357 HD23 0.01 -0.02 -0.22 -0.04 0.89 0.61 2zc7A1 SER 358 H -0.08 0.82 -0.06 -0.55 8.46 8.59 2zc7A1 SER 358 HA 0.07 0.01 0.47 -0.75 4.49 4.27 2zc7A1 SER 358 HB2 -0.00 -0.10 0.11 -0.04 3.95 3.91 2zc7A1 SER 358 HB3 -0.52 -0.02 0.09 -0.04 3.93 3.44 2zc7A1 ALA 359 H 0.02 0.41 -0.55 -0.55 8.40 7.74 2zc7A1 ALA 359 HA 0.04 0.08 0.78 -0.75 4.34 4.48 2zc7A1 ALA 359 HB3 0.01 -0.00 0.12 -0.04 1.41 1.50 2zc7A1 LEU 360 H 0.06 0.41 -0.39 -0.55 8.37 7.91 2zc7A1 LEU 360 HA 0.07 0.22 0.75 -0.75 4.35 4.64 2zc7A1 LEU 360 HB2 0.12 0.06 0.06 -0.04 1.64 1.84 2zc7A1 LEU 360 HB3 0.24 -0.05 0.00 -0.04 1.64 1.79 2zc7A1 LEU 360 HG 0.02 0.26 -0.15 -0.04 1.64 1.73 2zc7A1 LEU 360 HD13 0.06 -0.03 -0.11 -0.04 0.93 0.80 2zc7A1 LEU 360 HD23 -0.13 0.02 -0.19 -0.04 0.89 0.55