============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 37 rings ring int. center anis. iso. TRP 3 1.040 15.100 2.967 -24.704 -99.200 -91.000 TRP6 3 1.020 13.987 2.592 -22.706 -99.200 -91.000 PHE 21 1.000 33.979 10.240 -12.907 -99.200 -91.000 TRP 25 1.040 20.423 19.160 -11.391 -99.200 -91.000 TRP6 25 1.020 19.578 21.280 -10.768 -99.200 -91.000 TYR 28 0.840 7.862 17.843 -11.098 -99.200 -91.000 TYR 29 0.840 8.081 12.481 -20.412 -99.200 -91.000 PHE 50 1.000 26.115 10.295 -18.362 -99.200 -91.000 HIS 62 0.900 12.969 -7.998 -10.406 -99.200 -91.000 TYR 69 0.840 10.257 6.368 -15.420 -99.200 -91.000 TYR 79 0.840 19.612 16.968 -19.161 -99.200 -91.000 PHE 84 1.000 12.632 11.989 -6.667 -99.200 -91.000 PHE 93 1.000 15.514 5.436 4.905 -99.200 -91.000 PHE 110 1.000 14.869 -0.561 4.178 -99.200 -91.000 TYR 120 0.840 15.966 -8.919 -14.146 -99.200 -91.000 TYR 126 0.840 23.373 -8.534 -18.532 -99.200 -91.000 HIS 128 0.900 25.558 -3.263 -9.350 -99.200 -91.000 PHE 149 1.000 21.692 -1.510 -12.875 -99.200 -91.000 PHE 160 1.000 38.304 -3.487 -8.920 -99.200 -91.000 TRP 164 1.040 30.738 -2.351 -0.268 -99.200 -91.000 TRP6 164 1.020 31.861 -0.363 0.364 -99.200 -91.000 PHE 172 1.000 44.223 -15.649 -7.980 -99.200 -91.000 PHE 175 1.000 35.732 -7.851 -10.636 -99.200 -91.000 TRP 182 1.040 33.511 -10.525 -0.381 -99.200 -91.000 TRP6 182 1.020 34.768 -12.204 0.695 -99.200 -91.000 PHE 184 1.000 22.524 -9.681 -0.141 -99.200 -91.000 TYR 189 0.840 30.124 -3.475 8.520 -99.200 -91.000 TYR 194 0.840 20.344 1.195 12.108 -99.200 -91.000 TYR 199 0.840 36.656 -5.449 5.412 -99.200 -91.000 TYR 215 0.840 39.713 -9.046 9.423 -99.200 -91.000 TYR 228 0.840 29.354 -13.358 12.016 -99.200 -91.000 TRP 235 1.040 31.330 -11.637 3.691 -99.200 -91.000 TRP6 235 1.020 31.125 -10.737 5.872 -99.200 -91.000 PHE 245 1.000 23.156 -12.087 -5.048 -99.200 -91.000 TYR 247 0.840 20.403 -21.010 1.351 -99.200 -91.000 PHE 255 1.000 16.650 -13.561 10.135 -99.200 -91.000 TYR 256 0.840 8.312 -15.965 8.243 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 2zv9A1 PRO 238 HA 0.05 0.01 0.15 -0.51 4.44 4.14 2zv9A1 PRO 238 HB2 0.09 -0.26 0.15 -0.04 2.28 2.21 2zv9A1 PRO 238 HB3 0.10 0.05 0.06 -0.04 2.02 2.19 2zv9A1 PRO 238 HG2 0.56 -0.03 -0.12 -0.04 2.03 2.39 2zv9A1 PRO 238 HG3 0.28 0.07 -0.03 -0.04 2.03 2.31 2zv9A1 PRO 238 HD2 0.19 -0.04 -0.05 -0.04 3.68 3.74 2zv9A1 PRO 238 HD3 0.12 0.04 -0.00 -0.04 3.65 3.77 2zv9A1 ALA 239 H -0.09 0.18 0.02 -0.55 8.40 7.97 2zv9A1 ALA 239 HA -0.12 0.20 0.83 -0.75 4.34 4.49 2zv9A1 ALA 239 HB3 -0.30 0.02 0.15 -0.04 1.41 1.24 2zv9A1 TRP 240 H 0.13 0.00 -0.47 -0.55 7.97 7.09 2zv9A1 TRP 240 HA 0.01 0.27 0.61 -0.75 4.62 4.76 2zv9A1 TRP 240 HB2 0.01 -0.02 -0.12 -0.04 3.23 3.05 2zv9A1 TRP 240 HB3 0.02 -0.08 -0.03 -0.04 3.23 3.09 2zv9A1 TRP 240 HD1 0.00 -0.07 -0.20 -0.04 7.22 6.91 2zv9A1 TRP 240 HE1 -0.01 0.00 -0.08 -0.04 10.20 10.07 2zv9A1 TRP 240 HE3 0.01 -0.06 -0.26 -0.04 7.59 7.25 2zv9A1 TRP 240 HZ2 -0.01 0.06 -0.01 -0.04 7.44 7.44 2zv9A1 TRP 240 HZ3 0.04 0.09 -0.34 -0.04 7.13 6.87 2zv9A1 TRP 240 HH2 0.00 0.03 -0.05 -0.04 7.19 7.13 2zv9A1 GLU 241 H 0.15 0.04 0.05 -0.55 8.60 8.29 2zv9A1 GLU 241 HA 0.14 0.20 0.78 -0.75 4.29 4.65 2zv9A1 GLU 241 HB2 0.10 -0.02 0.10 -0.04 2.09 2.23 2zv9A1 GLU 241 HB3 0.07 0.08 0.16 -0.04 1.99 2.26 2zv9A1 GLU 241 HG2 0.05 -0.00 -0.04 -0.04 2.34 2.30 2zv9A1 GLU 241 HG3 0.06 0.01 -0.24 -0.04 2.34 2.14 2zv9A1 ILE 242 H 0.12 0.54 0.37 -0.55 8.25 8.73 2zv9A1 ILE 242 HA 0.10 0.20 0.73 -0.75 4.18 4.45 2zv9A1 ILE 242 HB 0.21 0.01 -0.01 -0.04 1.89 2.07 2zv9A1 ILE 242 HG12 0.16 0.03 -0.10 -0.04 1.49 1.54 2zv9A1 ILE 242 HG13 0.17 -0.07 -0.27 -0.04 1.21 1.00 2zv9A1 ILE 242 HG23 0.12 0.01 -0.24 -0.04 0.93 0.78 2zv9A1 ILE 242 HD13 0.26 -0.00 -0.23 -0.04 0.88 0.87 2zv9A1 PRO 243 HA 0.04 0.02 0.57 -0.51 4.44 4.57 2zv9A1 PRO 243 HB2 0.03 -0.07 -0.01 -0.04 2.28 2.19 2zv9A1 PRO 243 HB3 0.03 0.07 0.10 -0.04 2.02 2.17 2zv9A1 PRO 243 HG2 0.05 -0.02 0.09 -0.04 2.03 2.10 2zv9A1 PRO 243 HG3 0.03 0.09 0.07 -0.04 2.03 2.18 2zv9A1 PRO 243 HD2 0.10 0.14 0.19 -0.04 3.68 4.07 2zv9A1 PRO 243 HD3 0.06 0.18 0.11 -0.04 3.65 3.96 2zv9A1 ARG 244 H 0.03 0.12 0.19 -0.55 8.46 8.25 2zv9A1 ARG 244 HA 0.10 0.09 0.35 -0.75 4.34 4.13 2zv9A1 ARG 244 HB2 -0.02 -0.02 0.18 -0.04 1.90 1.99 2zv9A1 ARG 244 HB3 0.01 -0.07 0.11 -0.04 1.80 1.81 2zv9A1 ARG 244 HG2 0.05 0.06 -0.12 -0.04 1.67 1.62 2zv9A1 ARG 244 HG3 0.07 0.02 0.03 -0.04 1.67 1.75 2zv9A1 ARG 244 HD2 -0.03 -0.02 0.01 -0.04 3.22 3.14 2zv9A1 ARG 244 HD3 -0.05 0.04 0.00 -0.04 3.22 3.16 2zv9A1 GLU 245 H 0.02 0.04 -0.20 -0.55 8.60 7.92 2zv9A1 GLU 245 HA 0.02 0.04 0.31 -0.75 4.29 3.90 2zv9A1 SER 246 H 0.05 0.56 -0.54 -0.55 8.46 7.98 2zv9A1 SER 246 HA -0.06 -0.01 0.07 -0.75 4.49 3.74 2zv9A1 SER 246 HB2 -0.24 -0.09 0.15 -0.04 3.95 3.72 2zv9A1 SER 246 HB3 -0.01 -0.03 0.07 -0.04 3.93 3.92 2zv9A1 ILE 247 H 0.07 0.64 -0.61 -0.55 8.25 7.79 2zv9A1 ILE 247 HA 0.11 0.23 1.05 -0.75 4.18 4.81 2zv9A1 ILE 247 HB 0.17 0.07 0.01 -0.04 1.89 2.10 2zv9A1 ILE 247 HG12 0.25 -0.02 -0.54 -0.04 1.49 1.14 2zv9A1 ILE 247 HG13 0.23 -0.06 -0.24 -0.04 1.21 1.10 2zv9A1 ILE 247 HG23 -0.01 -0.05 -0.37 -0.04 0.93 0.46 2zv9A1 ILE 247 HD13 0.22 0.00 -0.20 -0.04 0.88 0.86 2zv9A1 LYS 248 H 0.08 0.56 0.24 -0.55 8.42 8.76 2zv9A1 LYS 248 HA 0.00 0.19 0.94 -0.75 4.32 4.70 2zv9A1 LEU 249 H -0.11 0.22 0.03 -0.55 8.37 7.96 2zv9A1 LEU 249 HA -0.02 0.07 0.61 -0.75 4.35 4.26 2zv9A1 LEU 249 HB2 -0.47 0.01 0.09 -0.04 1.64 1.23 2zv9A1 LEU 249 HB3 -0.86 0.02 -0.15 -0.04 1.64 0.61 2zv9A1 LEU 249 HG -0.32 -0.01 -0.18 -0.04 1.64 1.09 2zv9A1 LEU 249 HD13 -0.51 -0.01 -0.24 -0.04 0.93 0.13 2zv9A1 LEU 249 HD23 -1.25 -0.00 -0.13 -0.04 0.89 -0.53 2zv9A1 VAL 250 H 0.16 0.54 0.37 -0.55 8.24 8.77 2zv9A1 VAL 250 HA 0.18 0.14 0.71 -0.75 4.13 4.40 2zv9A1 VAL 250 HB 0.05 0.05 0.15 -0.04 2.12 2.33 2zv9A1 VAL 250 HG13 0.11 -0.01 -0.11 -0.04 0.97 0.93 2zv9A1 VAL 250 HG23 0.21 0.00 -0.09 -0.04 0.95 1.03 2zv9A1 LYS 251 H 0.19 0.37 0.27 -0.55 8.42 8.70 2zv9A1 LYS 251 HA -0.07 0.15 0.95 -0.75 4.32 4.60 2zv9A1 LYS 251 HB2 -0.00 0.02 -0.07 -0.04 1.87 1.79 2zv9A1 LYS 251 HB3 -0.04 -0.05 0.12 -0.04 1.79 1.77 2zv9A1 LYS 251 HG2 -0.19 0.29 -0.19 -0.04 1.46 1.34 2zv9A1 LYS 251 HG3 -0.12 -0.04 0.07 -0.04 1.46 1.33 2zv9A1 LYS 251 HD2 -0.05 0.02 0.01 -0.04 1.69 1.63 2zv9A1 LYS 251 HD3 -0.02 -0.03 0.00 -0.04 1.68 1.59 2zv9A1 LYS 251 HE2 -0.04 -0.07 0.01 -0.04 2.99 2.84 2zv9A1 LYS 251 HE3 -0.03 0.03 -0.03 -0.04 2.99 2.92 2zv9A1 LYS 252 H -0.99 0.15 0.17 -0.55 8.42 7.19 2zv9A1 LYS 252 HA -1.87 0.05 0.62 -0.75 4.32 2.37 2zv9A1 LYS 252 HB2 -1.51 0.02 0.11 -0.04 1.87 0.46 2zv9A1 LYS 252 HB3 -0.60 0.03 0.08 -0.04 1.79 1.25 2zv9A1 LYS 252 HG2 -0.45 -0.11 -0.02 -0.04 1.46 0.84 2zv9A1 LYS 252 HG3 -0.73 -0.00 0.02 -0.04 1.46 0.70 2zv9A1 LYS 252 HD2 -0.09 -0.01 -0.07 -0.04 1.69 1.48 2zv9A1 LYS 252 HD3 -0.16 0.03 -0.02 -0.04 1.68 1.49 2zv9A1 LYS 252 HE2 -0.23 0.03 -0.10 -0.04 2.99 2.65 2zv9A1 LYS 252 HE3 -0.13 -0.07 -0.11 -0.04 2.99 2.65 2zv9A1 LEU 253 H -0.41 0.63 0.53 -0.55 8.37 8.57 2zv9A1 LEU 253 HA -0.14 0.21 0.99 -0.75 4.35 4.65 2zv9A1 LEU 253 HB2 -0.04 0.01 -0.05 -0.04 1.64 1.51 2zv9A1 LEU 253 HB3 -0.02 -0.02 0.07 -0.04 1.64 1.64 2zv9A1 LEU 253 HG -0.07 -0.07 -0.15 -0.04 1.64 1.31 2zv9A1 LEU 253 HD13 0.17 -0.01 -0.23 -0.04 0.93 0.82 2zv9A1 LEU 253 HD23 0.02 0.04 -0.08 -0.04 0.89 0.82 2zv9A1 GLY 254 H -0.17 0.08 0.28 -0.55 8.43 8.08 2zv9A1 GLY 254 HA2 -0.06 0.05 0.41 -0.51 4.01 3.91 2zv9A1 GLY 254 HA3 -0.03 0.11 0.48 -0.51 4.01 4.05 2zv9A1 ALA 255 H -0.02 0.17 0.18 -0.55 8.40 8.18 2zv9A1 ALA 255 HA 0.04 0.12 0.95 -0.75 4.34 4.70 2zv9A1 ALA 255 HB3 0.02 0.02 0.09 -0.04 1.41 1.49 2zv9A1 GLY 256 H 0.08 0.53 0.39 -0.55 8.43 8.89 2zv9A1 GLY 256 HA2 0.09 0.21 0.83 -0.51 4.01 4.62 2zv9A1 GLY 256 HA3 0.14 -0.03 0.46 -0.51 4.01 4.07 2zv9A1 GLN 257 H 0.19 0.21 0.16 -0.55 8.47 8.48 2zv9A1 GLN 257 HA -0.02 0.18 0.75 -0.75 4.36 4.52 2zv9A1 PHE 258 H 0.24 -0.19 -0.31 -0.55 8.34 7.53 2zv9A1 PHE 258 HA 0.02 0.23 0.88 -0.75 4.62 4.99 2zv9A1 PHE 258 HB2 0.06 -0.05 0.04 -0.04 3.15 3.16 2zv9A1 PHE 258 HB3 0.08 0.01 0.01 -0.04 3.06 3.12 2zv9A1 PHE 258 HD2 0.04 -0.14 -0.08 -0.04 7.28 7.06 2zv9A1 PHE 258 HE2 0.02 -0.02 -0.00 -0.04 7.38 7.34 2zv9A1 PHE 258 HZ 0.01 0.03 0.01 -0.04 7.32 7.32 2zv9A1 GLY 259 H 0.18 -0.01 0.14 -0.55 8.43 8.20 2zv9A1 GLY 259 HA2 0.09 -0.00 0.25 -0.51 4.01 3.84 2zv9A1 GLY 259 HA3 0.13 0.49 0.63 -0.51 4.01 4.76 2zv9A1 GLU 260 H 0.17 0.19 0.20 -0.55 8.60 8.61 2zv9A1 GLU 260 HA 0.12 0.35 1.16 -0.75 4.29 5.16 2zv9A1 GLU 260 HB2 0.39 -0.03 0.05 -0.04 2.09 2.46 2zv9A1 GLU 260 HB3 0.28 -0.01 0.07 -0.04 1.99 2.29 2zv9A1 GLU 260 HG2 0.13 0.02 -0.01 -0.04 2.34 2.44 2zv9A1 GLU 260 HG3 0.17 -0.06 -0.19 -0.04 2.34 2.22 2zv9A1 VAL 261 H 0.04 0.40 0.37 -0.55 8.24 8.50 2zv9A1 VAL 261 HA 0.17 0.34 0.96 -0.75 4.13 4.85 2zv9A1 VAL 261 HB 0.02 -0.07 0.10 -0.04 2.12 2.13 2zv9A1 VAL 261 HG13 0.07 0.00 -0.14 -0.04 0.97 0.86 2zv9A1 VAL 261 HG23 0.07 0.02 -0.13 -0.04 0.95 0.86 2zv9A1 TRP 262 H 0.26 0.64 0.32 -0.55 7.97 8.65 2zv9A1 TRP 262 HA -0.02 0.17 1.09 -0.75 4.62 5.11 2zv9A1 TRP 262 HB2 -0.11 -0.00 0.01 -0.04 3.23 3.09 2zv9A1 TRP 262 HB3 -0.09 0.07 -0.15 -0.04 3.23 3.03 2zv9A1 TRP 262 HD1 -0.02 -0.05 -0.35 -0.04 7.22 6.75 2zv9A1 TRP 262 HE1 0.01 -0.00 -0.10 -0.04 10.20 10.07 2zv9A1 TRP 262 HE3 -0.04 -0.01 -0.64 -0.04 7.59 6.85 2zv9A1 TRP 262 HZ2 0.01 0.00 -0.06 -0.04 7.44 7.35 2zv9A1 TRP 262 HZ3 -0.01 0.43 -0.49 -0.04 7.13 7.03 2zv9A1 TRP 262 HH2 0.00 0.04 -0.05 -0.04 7.19 7.14 2zv9A1 MET 263 H 0.02 0.67 0.33 -0.55 8.47 8.94 2zv9A1 MET 263 HA -0.15 0.19 1.02 -0.75 4.52 4.82 2zv9A1 MET 263 HB2 -0.13 0.01 0.12 -0.04 2.15 2.11 2zv9A1 MET 263 HB3 -0.15 -0.05 0.22 -0.04 2.03 2.01 2zv9A1 MET 263 HG2 -1.19 0.07 0.11 -0.04 2.63 1.57 2zv9A1 MET 263 HG3 -0.85 -0.01 0.01 -0.04 2.56 1.67 2zv9A1 MET 263 HE3 -0.11 -0.02 -0.02 -0.04 2.10 1.91 2zv9A1 GLY 264 H -0.28 0.84 0.39 -0.55 8.43 8.83 2zv9A1 GLY 264 HA2 -0.15 0.02 0.82 -0.51 4.01 4.18 2zv9A1 GLY 264 HA3 -0.07 0.05 0.33 -0.51 4.01 3.81 2zv9A1 TYR 265 H 0.08 0.50 0.31 -0.55 8.29 8.63 2zv9A1 TYR 265 HA 0.05 0.36 1.03 -0.75 4.56 5.25 2zv9A1 TYR 265 HB2 0.00 -0.06 0.05 -0.04 3.06 3.02 2zv9A1 TYR 265 HB3 0.02 -0.07 -0.25 -0.04 2.98 2.64 2zv9A1 TYR 265 HD2 0.01 0.01 -0.38 -0.04 7.15 6.74 2zv9A1 TYR 265 HE2 -0.01 -0.02 -0.10 -0.04 6.85 6.68 2zv9A1 TYR 266 H 0.30 0.71 0.19 -0.55 8.29 8.93 2zv9A1 TYR 266 HA 0.09 0.35 0.96 -0.75 4.56 5.21 2zv9A1 TYR 266 HB2 0.12 -0.01 -0.00 -0.04 3.06 3.13 2zv9A1 TYR 266 HB3 0.12 -0.02 0.12 -0.04 2.98 3.15 2zv9A1 TYR 266 HD2 0.07 -0.03 -0.07 -0.04 7.15 7.08 2zv9A1 TYR 266 HE2 0.03 -0.02 -0.07 -0.04 6.85 6.75 2zv9A1 ASN 267 H -0.26 0.89 0.28 -0.55 8.53 8.89 2zv9A1 ASN 267 HA -0.14 0.05 0.23 -0.75 4.76 4.15 2zv9A1 ASN 267 HB2 -0.19 -0.00 0.13 -0.04 2.88 2.78 2zv9A1 ASN 267 HB3 -0.47 0.02 0.12 -0.04 2.79 2.43 2zv9A1 ASN 267 HD21 -0.10 -0.00 0.05 -0.04 7.03 6.94 2zv9A1 ASN 267 HD22 -0.13 -0.00 0.07 -0.04 7.74 7.64 2zv9A1 ASN 268 H 0.02 0.12 -0.61 -0.55 8.53 7.52 2zv9A1 ASN 268 HA -0.10 -0.02 0.16 -0.75 4.76 4.05 2zv9A1 ASN 268 HB2 -0.07 0.15 -0.05 -0.04 2.88 2.87 2zv9A1 ASN 268 HB3 -0.12 -0.02 -0.01 -0.04 2.79 2.60 2zv9A1 ASN 268 HD21 -0.04 0.02 -0.12 -0.04 7.03 6.85 2zv9A1 ASN 268 HD22 -0.06 0.01 -0.07 -0.04 7.74 7.57 2zv9A1 SER 269 H 0.00 0.42 -0.62 -0.55 8.46 7.72 2zv9A1 SER 269 HA 0.00 0.07 0.47 -0.75 4.49 4.29 2zv9A1 SER 269 HB2 0.06 0.05 0.13 -0.04 3.95 4.15 2zv9A1 SER 269 HB3 0.06 -0.05 -0.01 -0.04 3.93 3.89 2zv9A1 THR 270 H 0.21 0.37 0.05 -0.55 8.28 8.36 2zv9A1 THR 270 HA 0.19 0.13 0.66 -0.75 4.39 4.61 2zv9A1 THR 270 HB 0.29 -0.07 0.06 -0.04 4.32 4.57 2zv9A1 THR 270 HG23 0.18 0.06 -0.06 -0.04 1.22 1.36 2zv9A1 LYS 271 H 0.19 0.14 0.22 -0.55 8.42 8.42 2zv9A1 LYS 271 HA -0.29 0.21 0.72 -0.75 4.32 4.21 2zv9A1 LYS 271 HB2 0.11 0.01 0.19 -0.04 1.87 2.14 2zv9A1 LYS 271 HB3 0.08 -0.06 0.13 -0.04 1.79 1.90 2zv9A1 LYS 271 HG2 -0.71 -0.01 0.01 -0.04 1.46 0.70 2zv9A1 LYS 271 HG3 -0.63 0.05 0.06 -0.04 1.46 0.91 2zv9A1 LYS 271 HD2 0.07 0.02 0.03 -0.04 1.69 1.77 2zv9A1 LYS 271 HD3 0.12 -0.05 0.01 -0.04 1.68 1.71 2zv9A1 LYS 271 HE2 0.06 -0.02 -0.01 -0.04 2.99 2.98 2zv9A1 LYS 271 HE3 -0.52 -0.01 -0.02 -0.04 2.99 2.40 2zv9A1 VAL 272 H -0.21 0.79 0.42 -0.55 8.24 8.68 2zv9A1 VAL 272 HA 0.08 0.11 0.82 -0.75 4.13 4.39 2zv9A1 VAL 272 HB 0.06 0.12 0.01 -0.04 2.12 2.27 2zv9A1 VAL 272 HG13 0.27 -0.00 -0.32 -0.04 0.97 0.88 2zv9A1 VAL 272 HG23 0.06 -0.02 -0.41 -0.04 0.95 0.54 2zv9A1 ALA 273 H 0.03 0.58 0.13 -0.55 8.40 8.59 2zv9A1 ALA 273 HA 0.07 0.27 1.08 -0.75 4.34 5.00 2zv9A1 ALA 273 HB3 0.15 -0.02 0.00 -0.04 1.41 1.50 2zv9A1 VAL 274 H 0.08 0.72 0.30 -0.55 8.24 8.78 2zv9A1 VAL 274 HA 0.02 0.28 0.96 -0.75 4.13 4.63 2zv9A1 VAL 274 HB -0.07 -0.08 0.01 -0.04 2.12 1.94 2zv9A1 VAL 274 HG13 -0.55 -0.01 -0.32 -0.04 0.97 0.05 2zv9A1 VAL 274 HG23 -0.11 0.00 -0.40 -0.04 0.95 0.41 2zv9A1 LYS 275 H 0.10 0.72 0.27 -0.55 8.42 8.96 2zv9A1 LYS 275 HA 0.17 0.19 1.02 -0.75 4.32 4.94 2zv9A1 LYS 275 HB2 0.08 -0.02 0.11 -0.04 1.87 1.99 2zv9A1 LYS 275 HB3 0.14 -0.09 0.24 -0.04 1.79 2.04 2zv9A1 LYS 275 HG2 0.37 0.07 -0.20 -0.04 1.46 1.66 2zv9A1 LYS 275 HG3 0.16 0.04 -0.00 -0.04 1.46 1.61 2zv9A1 LYS 275 HD2 -0.01 -0.04 -0.03 -0.04 1.69 1.57 2zv9A1 LYS 275 HD3 -0.12 -0.00 -0.04 -0.04 1.68 1.47 2zv9A1 LYS 275 HE2 0.08 0.03 -0.08 -0.04 2.99 2.98 2zv9A1 LYS 275 HE3 0.06 0.02 -0.08 -0.04 2.99 2.95 2zv9A1 THR 276 H 0.22 0.78 0.37 -0.55 8.28 9.09 2zv9A1 THR 276 HA 0.28 0.22 0.65 -0.75 4.39 4.78 2zv9A1 THR 276 HB 0.23 -0.08 0.18 -0.04 4.32 4.60 2zv9A1 THR 276 HG23 0.11 -0.01 -0.21 -0.04 1.22 1.07 2zv9A1 LEU 277 H -0.09 0.45 0.30 -0.55 8.37 8.48 2zv9A1 LEU 277 HA -0.31 0.20 0.98 -0.75 4.35 4.47 2zv9A1 LEU 277 HB2 -2.37 0.01 0.03 -0.04 1.64 -0.73 2zv9A1 LEU 277 HB3 -0.62 -0.01 0.25 -0.04 1.64 1.22 2zv9A1 LEU 277 HG -0.26 0.01 -0.45 -0.04 1.64 0.90 2zv9A1 LEU 277 HD13 -0.27 0.01 -0.07 -0.04 0.93 0.55 2zv9A1 LEU 277 HD23 -0.25 -0.03 0.01 -0.04 0.89 0.58 2zv9A1 LYS 278 H -0.04 0.64 0.30 -0.55 8.42 8.76 2zv9A1 LYS 278 HA -0.03 0.11 0.77 -0.75 4.32 4.42 2zv9A1 LYS 278 HB2 -0.02 0.07 -0.10 -0.04 1.87 1.79 2zv9A1 LYS 278 HB3 -0.02 0.06 -0.05 -0.04 1.79 1.74 2zv9A1 LYS 278 HG2 0.03 0.02 -0.05 -0.04 1.46 1.42 2zv9A1 LYS 278 HG3 0.05 -0.15 -0.15 -0.04 1.46 1.17 2zv9A1 LYS 278 HD2 0.03 -0.04 -0.31 -0.04 1.69 1.33 2zv9A1 LYS 278 HD3 0.01 0.04 -0.11 -0.04 1.68 1.58 2zv9A1 LYS 278 HE2 0.07 0.00 -0.08 -0.04 2.99 2.94 2zv9A1 LYS 278 HE3 0.09 -0.14 -0.21 -0.04 2.99 2.70 2zv9A1 PRO 279 HA -0.07 0.01 0.28 -0.51 4.44 4.15 2zv9A1 PRO 279 HB2 -0.04 0.01 0.02 -0.04 2.28 2.23 2zv9A1 PRO 279 HB3 -0.04 0.03 0.12 -0.04 2.02 2.08 2zv9A1 PRO 279 HG2 -0.04 -0.01 0.07 -0.04 2.03 2.01 2zv9A1 PRO 279 HG3 -0.06 0.17 0.13 -0.04 2.03 2.23 2zv9A1 PRO 279 HD2 -0.03 0.06 0.18 -0.04 3.68 3.86 2zv9A1 PRO 279 HD3 -0.04 0.24 0.41 -0.04 3.65 4.21 2zv9A1 GLY 280 H -0.04 0.15 0.16 -0.55 8.43 8.16 2zv9A1 GLY 280 HA2 -0.02 -0.04 0.34 -0.51 4.01 3.77 2zv9A1 GLY 280 HA3 -0.03 0.14 0.61 -0.51 4.01 4.21 2zv9A1 THR 281 H -0.05 0.33 -0.38 -0.55 8.28 7.63 2zv9A1 THR 281 HA -0.11 0.05 0.41 -0.75 4.39 3.99 2zv9A1 THR 281 HB -0.03 -0.12 0.20 -0.04 4.32 4.33 2zv9A1 THR 281 HG23 -0.40 -0.04 0.10 -0.04 1.22 0.84 2zv9A1 MET 282 H 0.03 0.13 0.04 -0.55 8.47 8.12 2zv9A1 MET 282 HA 0.05 0.24 0.22 -0.75 4.52 4.27 2zv9A1 MET 282 HB2 0.10 -0.20 0.23 -0.04 2.15 2.24 2zv9A1 MET 282 HB3 0.15 0.15 0.20 -0.04 2.03 2.49 2zv9A1 MET 282 HG2 0.14 -0.05 -0.03 -0.04 2.63 2.66 2zv9A1 MET 282 HG3 0.18 0.19 -0.13 -0.04 2.56 2.76 2zv9A1 MET 282 HE3 0.35 0.01 -0.13 -0.04 2.10 2.29 2zv9A1 SER 283 H 0.03 0.18 0.08 -0.55 8.46 8.21 2zv9A1 SER 283 HA 0.05 0.06 0.36 -0.75 4.49 4.20 2zv9A1 SER 283 HB2 0.11 0.09 0.20 -0.04 3.95 4.31 2zv9A1 SER 283 HB3 0.09 -0.20 0.23 -0.04 3.93 4.01 2zv9A1 VAL 284 H 0.03 0.26 0.15 -0.55 8.24 8.13 2zv9A1 VAL 284 HA 0.06 0.13 0.55 -0.75 4.13 4.12 2zv9A1 VAL 284 HB 0.02 -0.02 0.06 -0.04 2.12 2.14 2zv9A1 VAL 284 HG13 0.02 0.02 0.07 -0.04 0.97 1.04 2zv9A1 VAL 284 HG23 -0.03 0.04 0.11 -0.04 0.95 1.02 2zv9A1 GLN 285 H 0.07 -0.15 -0.57 -0.55 8.47 7.27 2zv9A1 GLN 285 HA 0.06 0.27 0.85 -0.75 4.36 4.79 2zv9A1 GLN 285 HB2 0.03 0.09 0.03 -0.04 2.15 2.27 2zv9A1 GLN 285 HB3 0.04 -0.02 0.04 -0.04 2.02 2.03 2zv9A1 GLN 285 HG2 0.04 -0.16 0.10 -0.04 2.40 2.34 2zv9A1 GLN 285 HG3 0.03 0.08 -0.36 -0.04 2.39 2.10 2zv9A1 GLN 285 HE21 0.02 0.04 -0.03 -0.04 6.97 6.95 2zv9A1 GLN 285 HE22 0.02 -0.01 -0.06 -0.04 7.69 7.59 2zv9A1 ALA 286 H 0.07 0.04 0.07 -0.55 8.40 8.03 2zv9A1 ALA 286 HA 0.03 0.07 0.32 -0.75 4.34 4.01 2zv9A1 ALA 286 HB3 0.05 0.05 0.09 -0.04 1.41 1.56 2zv9A1 PHE 287 H 0.22 0.55 -0.25 -0.55 8.34 8.31 2zv9A1 PHE 287 HA 0.02 0.08 0.58 -0.75 4.62 4.55 2zv9A1 PHE 287 HB2 0.06 0.03 0.03 -0.04 3.15 3.22 2zv9A1 PHE 287 HB3 0.03 -0.02 -0.07 -0.04 3.06 2.96 2zv9A1 PHE 287 HD2 0.05 0.01 -0.17 -0.04 7.28 7.13 2zv9A1 PHE 287 HE2 0.07 0.00 -0.29 -0.04 7.38 7.13 2zv9A1 PHE 287 HZ 0.09 0.20 -0.34 -0.04 7.32 7.23 2zv9A1 LEU 288 H 0.10 0.50 -0.50 -0.55 8.37 7.92 2zv9A1 LEU 288 HA -0.16 0.04 0.55 -0.75 4.35 4.03 2zv9A1 LEU 288 HB2 0.04 0.19 0.10 -0.04 1.64 1.93 2zv9A1 LEU 288 HB3 -0.01 -0.09 0.02 -0.04 1.64 1.52 2zv9A1 LEU 288 HG 0.22 0.03 -0.11 -0.04 1.64 1.73 2zv9A1 LEU 288 HD13 0.07 -0.00 0.04 -0.04 0.93 0.99 2zv9A1 LEU 288 HD23 0.08 -0.01 -0.10 -0.04 0.89 0.82 2zv9A1 GLU 289 H -0.03 0.25 -0.17 -0.55 8.60 8.11 2zv9A1 GLU 289 HA -0.05 0.01 0.36 -0.75 4.29 3.86 2zv9A1 GLU 289 HB2 -0.02 -0.09 0.09 -0.04 2.09 2.04 2zv9A1 GLU 289 HB3 -0.04 0.19 0.08 -0.04 1.99 2.18 2zv9A1 GLU 289 HG2 -0.03 0.12 -0.02 -0.04 2.34 2.38 2zv9A1 GLU 289 HG3 -0.04 -0.01 -0.11 -0.04 2.34 2.15 2zv9A1 GLU 290 H -0.13 0.26 -0.47 -0.55 8.60 7.71 2zv9A1 GLU 290 HA -0.06 0.15 0.21 -0.75 4.29 3.84 2zv9A1 GLU 290 HB2 -0.13 0.03 -0.05 -0.04 2.09 1.90 2zv9A1 GLU 290 HB3 -0.25 0.13 0.01 -0.04 1.99 1.84 2zv9A1 GLU 290 HG2 -0.08 0.06 -0.34 -0.04 2.34 1.94 2zv9A1 GLU 290 HG3 0.01 -0.23 -0.12 -0.04 2.34 1.96 2zv9A1 ALA 291 H -0.20 0.17 -0.21 -0.55 8.40 7.62 2zv9A1 ALA 291 HA -0.20 0.01 0.39 -0.75 4.34 3.79 2zv9A1 ALA 291 HB3 -0.18 0.02 0.05 -0.04 1.41 1.26 2zv9A1 ASN 292 H -0.14 0.79 -0.09 -0.55 8.53 8.54 2zv9A1 ASN 292 HA -0.21 -0.01 0.32 -0.75 4.76 4.10 2zv9A1 ASN 292 HB2 -0.08 0.07 0.09 -0.04 2.88 2.92 2zv9A1 ASN 292 HB3 -0.07 -0.02 -0.05 -0.04 2.79 2.60 2zv9A1 ASN 292 HD21 -0.04 -0.08 -0.12 -0.04 7.03 6.75 2zv9A1 ASN 292 HD22 -0.08 0.66 -0.21 -0.04 7.74 8.07 2zv9A1 LEU 293 H -0.14 0.56 -0.31 -0.55 8.37 7.93 2zv9A1 LEU 293 HA -0.16 0.01 0.44 -0.75 4.35 3.90 2zv9A1 LEU 293 HB2 -0.11 0.21 0.17 -0.04 1.64 1.86 2zv9A1 LEU 293 HB3 -0.25 -0.07 -0.06 -0.04 1.64 1.22 2zv9A1 LEU 293 HG -0.03 -0.07 -0.02 -0.04 1.64 1.47 2zv9A1 LEU 293 HD13 -0.01 0.08 -0.04 -0.04 0.93 0.92 2zv9A1 LEU 293 HD23 -0.08 -0.04 -0.12 -0.04 0.89 0.60 2zv9A1 MET 294 H -0.27 0.40 -0.17 -0.55 8.47 7.88 2zv9A1 MET 294 HA -0.46 0.06 0.44 -0.75 4.52 3.80 2zv9A1 MET 294 HB2 -0.29 0.10 0.11 -0.04 2.15 2.03 2zv9A1 MET 294 HB3 -0.25 -0.05 0.06 -0.04 2.03 1.75 2zv9A1 MET 294 HG2 -0.40 -0.00 0.00 -0.04 2.63 2.19 2zv9A1 MET 294 HG3 -0.17 0.30 0.05 -0.04 2.56 2.70 2zv9A1 MET 294 HE3 0.20 -0.03 -0.09 -0.04 2.10 2.14 2zv9A1 LYS 295 H -0.35 0.37 -0.40 -0.55 8.42 7.49 2zv9A1 LYS 295 HA -0.43 0.02 0.34 -0.75 4.32 3.50 2zv9A1 LYS 295 HB2 -0.21 0.22 0.02 -0.04 1.87 1.86 2zv9A1 LYS 295 HB3 -0.11 -0.07 -0.00 -0.04 1.79 1.56 2zv9A1 LYS 295 HG2 -1.64 -0.06 -0.07 -0.04 1.46 -0.35 2zv9A1 LYS 295 HG3 -0.62 0.22 -0.03 -0.04 1.46 0.99 2zv9A1 LYS 295 HD2 -0.22 0.04 0.01 -0.04 1.69 1.48 2zv9A1 LYS 295 HD3 -0.17 -0.05 -0.05 -0.04 1.68 1.36 2zv9A1 LYS 295 HE2 -0.84 -0.02 -0.15 -0.04 2.99 1.94 2zv9A1 LYS 295 HE3 -0.30 -0.04 -0.20 -0.04 2.99 2.42 2zv9A1 THR 296 H -0.20 0.30 -0.50 -0.55 8.28 7.34 2zv9A1 THR 296 HA -0.01 0.10 0.70 -0.75 4.39 4.42 2zv9A1 THR 296 HB -0.23 0.09 0.03 -0.04 4.32 4.17 2zv9A1 THR 296 HG23 0.01 -0.02 -0.01 -0.04 1.22 1.16 2zv9A1 LEU 297 H -0.26 0.29 -0.02 -0.55 8.37 7.83 2zv9A1 LEU 297 HA 0.05 0.07 0.57 -0.75 4.35 4.28 2zv9A1 LEU 297 HB2 -0.53 0.01 0.13 -0.04 1.64 1.21 2zv9A1 LEU 297 HB3 -0.17 -0.08 -0.01 -0.04 1.64 1.34 2zv9A1 LEU 297 HG -0.60 0.09 -0.05 -0.04 1.64 1.03 2zv9A1 LEU 297 HD13 -0.57 -0.03 -0.13 -0.04 0.93 0.16 2zv9A1 LEU 297 HD23 -0.69 -0.00 -0.14 -0.04 0.89 0.02 2zv9A1 GLN 298 H 0.14 0.31 0.04 -0.55 8.47 8.42 2zv9A1 GLN 298 HA -0.05 0.21 0.95 -0.75 4.36 4.72 2zv9A1 GLN 298 HB2 0.03 0.01 0.08 -0.04 2.15 2.22 2zv9A1 GLN 298 HB3 -0.00 -0.06 -0.01 -0.04 2.02 1.91 2zv9A1 GLN 298 HG2 0.04 -0.04 -0.07 -0.04 2.40 2.29 2zv9A1 GLN 298 HG3 -0.01 0.11 -0.59 -0.04 2.39 1.85 2zv9A1 GLN 298 HE21 0.44 -0.05 -0.01 -0.04 6.97 7.31 2zv9A1 GLN 298 HE22 0.28 -0.01 -0.04 -0.04 7.69 7.88 2zv9A1 HIS 299 H -0.09 0.39 0.10 -0.55 8.41 8.26 2zv9A1 HIS 299 HA -0.38 0.16 0.73 -0.75 4.63 4.39 2zv9A1 HIS 299 HB2 -1.72 0.08 -0.16 -0.04 3.26 1.43 2zv9A1 HIS 299 HB3 -0.35 -0.02 -0.09 -0.04 3.20 2.70 2zv9A1 HIS 299 HD2 -0.43 0.09 0.04 -0.04 6.97 6.63 2zv9A1 HIS 299 HE1 -0.04 0.05 -0.07 -0.04 7.75 7.65 2zv9A1 ASP 300 H -0.84 0.16 0.13 -0.55 8.40 7.30 2zv9A1 ASP 300 HA -0.10 0.14 0.37 -0.75 4.63 4.29 2zv9A1 ASP 300 HB2 -0.28 0.01 0.13 -0.04 2.71 2.53 2zv9A1 ASP 300 HB3 -0.19 0.01 0.04 -0.04 2.70 2.51 2zv9A1 LYS 301 H 0.43 0.03 -0.22 -0.55 8.42 8.10 2zv9A1 LYS 301 HA 0.05 0.28 0.83 -0.75 4.32 4.72 2zv9A1 LYS 301 HB2 0.14 -0.10 0.11 -0.04 1.87 1.98 2zv9A1 LYS 301 HB3 0.05 0.11 0.25 -0.04 1.79 2.17 2zv9A1 LYS 301 HG2 0.09 -0.14 -0.15 -0.04 1.46 1.23 2zv9A1 LYS 301 HG3 0.11 0.00 0.06 -0.04 1.46 1.58 2zv9A1 LYS 301 HD2 0.04 -0.01 0.10 -0.04 1.69 1.78 2zv9A1 LYS 301 HD3 0.03 0.15 0.02 -0.04 1.68 1.83 2zv9A1 LYS 301 HE2 0.04 -0.03 -0.02 -0.04 2.99 2.94 2zv9A1 LYS 301 HE3 0.03 -0.01 0.02 -0.04 2.99 2.99 2zv9A1 LEU 302 H 0.07 0.48 -0.52 -0.55 8.37 7.84 2zv9A1 LEU 302 HA 0.13 -0.01 0.79 -0.75 4.35 4.50 2zv9A1 LEU 302 HB2 0.07 -0.10 0.03 -0.04 1.64 1.60 2zv9A1 LEU 302 HB3 0.11 0.22 -0.06 -0.04 1.64 1.88 2zv9A1 LEU 302 HG 0.43 0.04 0.01 -0.04 1.64 2.08 2zv9A1 LEU 302 HD13 0.12 0.01 -0.20 -0.04 0.93 0.82 2zv9A1 LEU 302 HD23 0.11 0.01 -0.15 -0.04 0.89 0.82 2zv9A1 VAL 303 H 0.10 0.44 -0.03 -0.55 8.24 8.21 2zv9A1 VAL 303 HA -0.01 -0.04 0.32 -0.75 4.13 3.64 2zv9A1 VAL 303 HB 0.08 -0.02 0.03 -0.04 2.12 2.17 2zv9A1 VAL 303 HG13 -0.06 0.00 -0.14 -0.04 0.97 0.73 2zv9A1 VAL 303 HG23 -0.03 -0.00 -0.31 -0.04 0.95 0.57 2zv9A1 ARG 304 H -0.04 0.02 0.20 -0.55 8.46 8.08 2zv9A1 ARG 304 HA 0.00 0.22 0.65 -0.75 4.34 4.45 2zv9A1 ARG 304 HB2 0.06 -0.02 0.15 -0.04 1.90 2.05 2zv9A1 ARG 304 HB3 0.15 -0.09 0.00 -0.04 1.80 1.82 2zv9A1 ARG 304 HG2 0.17 0.16 0.05 -0.04 1.67 2.00 2zv9A1 ARG 304 HG3 0.06 0.04 0.03 -0.04 1.67 1.76 2zv9A1 ARG 304 HD2 0.23 -0.00 -0.02 -0.04 3.22 3.39 2zv9A1 ARG 304 HD3 0.08 -0.01 -0.03 -0.04 3.22 3.22 2zv9A1 LEU 305 H -0.03 0.26 0.15 -0.55 8.37 8.21 2zv9A1 LEU 305 HA -0.06 0.02 0.72 -0.75 4.35 4.27 2zv9A1 LEU 305 HB2 -0.19 -0.02 0.02 -0.04 1.64 1.41 2zv9A1 LEU 305 HB3 -0.24 0.08 -0.02 -0.04 1.64 1.42 2zv9A1 LEU 305 HG -0.11 0.01 -0.31 -0.04 1.64 1.19 2zv9A1 LEU 305 HD13 -0.11 0.01 -0.03 -0.04 0.93 0.76 2zv9A1 LEU 305 HD23 -0.92 0.02 -0.16 -0.04 0.89 -0.21 2zv9A1 TYR 306 H 0.12 0.69 0.47 -0.55 8.29 9.01 2zv9A1 TYR 306 HA 0.18 0.21 0.94 -0.75 4.56 5.13 2zv9A1 TYR 306 HB2 0.02 0.01 -0.13 -0.04 3.06 2.92 2zv9A1 TYR 306 HB3 -0.07 -0.03 -0.09 -0.04 2.98 2.75 2zv9A1 TYR 306 HD2 0.03 0.16 -0.32 -0.04 7.15 6.97 2zv9A1 TYR 306 HE2 0.04 0.03 -0.06 -0.04 6.85 6.81 2zv9A1 ALA 307 H 0.21 0.46 0.35 -0.55 8.40 8.88 2zv9A1 ALA 307 HA 0.48 0.13 0.55 -0.75 4.34 4.74 2zv9A1 ALA 307 HB3 0.13 0.04 -0.11 -0.04 1.41 1.44 2zv9A1 VAL 308 H 0.21 0.83 0.36 -0.55 8.24 9.09 2zv9A1 VAL 308 HA 0.15 0.10 0.79 -0.75 4.13 4.41 2zv9A1 VAL 308 HB 0.10 0.00 -0.01 -0.04 2.12 2.17 2zv9A1 VAL 308 HG13 0.02 0.01 -0.03 -0.04 0.97 0.93 2zv9A1 VAL 308 HG23 0.14 -0.02 -0.20 -0.04 0.95 0.83 2zv9A1 VAL 309 H 0.16 0.53 0.24 -0.55 8.24 8.62 2zv9A1 VAL 309 HA 0.07 0.17 0.95 -0.75 4.13 4.57 2zv9A1 VAL 309 HB -0.03 -0.05 0.25 -0.04 2.12 2.25 2zv9A1 VAL 309 HG13 -0.07 -0.02 0.05 -0.04 0.97 0.89 2zv9A1 VAL 309 HG23 0.20 0.07 -0.20 -0.04 0.95 0.97 2zv9A1 THR 310 H 0.04 0.19 0.01 -0.55 8.28 7.97 2zv9A1 THR 310 HA 0.00 0.24 0.94 -0.75 4.39 4.81 2zv9A1 THR 310 HB 0.04 0.06 0.14 -0.04 4.32 4.51 2zv9A1 THR 310 HG23 0.08 -0.01 -0.23 -0.04 1.22 1.02 2zv9A1 LYS 311 H -0.04 -0.04 0.02 -0.55 8.42 7.82 2zv9A1 LYS 311 HA -0.01 0.24 0.93 -0.75 4.32 4.73 2zv9A1 LYS 311 HB2 -0.01 -0.10 0.04 -0.04 1.87 1.76 2zv9A1 LYS 311 HB3 -0.01 0.01 -0.02 -0.04 1.79 1.74 2zv9A1 LYS 311 HG2 0.01 0.09 0.04 -0.04 1.46 1.55 2zv9A1 LYS 311 HG3 0.02 -0.05 -0.27 -0.04 1.46 1.12 2zv9A1 LYS 311 HD2 0.02 0.03 -0.04 -0.04 1.69 1.67 2zv9A1 LYS 311 HD3 0.01 -0.05 -0.05 -0.04 1.68 1.56 2zv9A1 LYS 311 HE2 0.00 0.00 -0.01 -0.04 2.99 2.94 2zv9A1 LYS 311 HE3 0.01 0.02 0.00 -0.04 2.99 2.98 2zv9A1 GLU 312 H -0.07 -0.07 0.10 -0.55 8.60 8.02 2zv9A1 GLU 312 HA -0.04 0.22 0.86 -0.75 4.29 4.57 2zv9A1 GLU 312 HB2 -0.11 0.04 0.07 -0.04 2.09 2.05 2zv9A1 GLU 312 HB3 -0.07 -0.05 0.15 -0.04 1.99 1.98 2zv9A1 GLU 312 HG2 -0.05 0.02 0.04 -0.04 2.34 2.31 2zv9A1 GLU 312 HG3 -0.04 0.08 0.01 -0.04 2.34 2.35 2zv9A1 GLU 313 H -0.06 0.09 0.12 -0.55 8.60 8.20 2zv9A1 GLU 313 HA -0.06 0.08 0.15 -0.75 4.29 3.71 2zv9A1 GLU 313 HB2 -0.04 -0.01 0.11 -0.04 2.09 2.11 2zv9A1 GLU 313 HB3 -0.05 0.02 0.11 -0.04 1.99 2.03 2zv9A1 GLU 313 HG2 -0.03 -0.00 0.01 -0.04 2.34 2.28 2zv9A1 GLU 313 HG3 -0.05 0.02 -0.08 -0.04 2.34 2.19 2zv9A1 PRO 314 HA -0.11 0.20 1.00 -0.51 4.44 5.03 2zv9A1 PRO 314 HB2 -0.14 0.01 0.01 -0.04 2.28 2.12 2zv9A1 PRO 314 HB3 -0.05 0.05 0.11 -0.04 2.02 2.09 2zv9A1 PRO 314 HG2 -0.17 0.01 0.06 -0.04 2.03 1.89 2zv9A1 PRO 314 HG3 -0.07 0.04 0.05 -0.04 2.03 2.01 2zv9A1 PRO 314 HD2 -0.15 -0.02 -0.08 -0.04 3.68 3.39 2zv9A1 PRO 314 HD3 -0.08 0.03 0.12 -0.04 3.65 3.67 2zv9A1 ILE 315 H -0.14 0.18 0.20 -0.55 8.25 7.94 2zv9A1 ILE 315 HA -0.14 0.26 0.75 -0.75 4.18 4.29 2zv9A1 ILE 315 HB -0.13 -0.08 0.17 -0.04 1.89 1.81 2zv9A1 ILE 315 HG12 0.03 -0.00 0.05 -0.04 1.49 1.52 2zv9A1 ILE 315 HG13 -0.04 0.04 0.03 -0.04 1.21 1.20 2zv9A1 ILE 315 HG23 0.26 0.01 -0.15 -0.04 0.93 1.01 2zv9A1 ILE 315 HD13 -0.06 0.00 -0.01 -0.04 0.88 0.77 2zv9A1 TYR 316 H 0.07 0.43 0.38 -0.55 8.29 8.62 2zv9A1 TYR 316 HA 0.15 0.37 0.95 -0.75 4.56 5.28 2zv9A1 TYR 316 HB2 0.08 -0.12 0.06 -0.04 3.06 3.04 2zv9A1 TYR 316 HB3 0.08 -0.01 -0.17 -0.04 2.98 2.84 2zv9A1 TYR 316 HD2 0.03 0.07 -0.27 -0.04 7.15 6.94 2zv9A1 TYR 316 HE2 -0.06 -0.00 -0.13 -0.04 6.85 6.62 2zv9A1 ILE 317 H 0.27 0.46 0.25 -0.55 8.25 8.69 2zv9A1 ILE 317 HA 0.10 0.18 0.96 -0.75 4.18 4.67 2zv9A1 ILE 317 HB 0.02 -0.06 0.19 -0.04 1.89 2.00 2zv9A1 ILE 317 HG12 -0.07 0.02 -0.01 -0.04 1.49 1.39 2zv9A1 ILE 317 HG13 0.08 0.01 -0.26 -0.04 1.21 1.01 2zv9A1 ILE 317 HG23 -0.07 -0.00 -0.12 -0.04 0.93 0.70 2zv9A1 ILE 317 HD13 -0.57 0.02 -0.03 -0.04 0.88 0.26 2zv9A1 ILE 318 H 0.09 0.76 0.28 -0.55 8.25 8.83 2zv9A1 ILE 318 HA 0.05 0.33 0.96 -0.75 4.18 4.76 2zv9A1 ILE 318 HB 0.13 -0.02 0.01 -0.04 1.89 1.97 2zv9A1 ILE 318 HG12 0.15 0.02 -0.24 -0.04 1.49 1.38 2zv9A1 ILE 318 HG13 0.09 -0.00 -0.29 -0.04 1.21 0.96 2zv9A1 ILE 318 HG23 0.11 0.01 -0.21 -0.04 0.93 0.80 2zv9A1 ILE 318 HD13 0.22 -0.02 -0.39 -0.04 0.88 0.65 2zv9A1 THR 319 H -0.04 0.52 0.33 -0.55 8.28 8.54 2zv9A1 THR 319 HA -0.26 0.05 1.13 -0.75 4.39 4.55 2zv9A1 THR 319 HB -0.15 0.23 0.07 -0.04 4.32 4.43 2zv9A1 THR 319 HG23 -0.05 -0.01 -0.28 -0.04 1.22 0.84 2zv9A1 GLU 320 H -0.64 0.66 0.22 -0.55 8.60 8.30 2zv9A1 GLU 320 HA -0.48 0.05 0.57 -0.75 4.29 3.68 2zv9A1 GLU 320 HB2 -0.32 0.09 0.19 -0.04 2.09 2.01 2zv9A1 GLU 320 HB3 -0.17 -0.09 0.14 -0.04 1.99 1.82 2zv9A1 GLU 320 HG2 -0.05 0.07 -0.24 -0.04 2.34 2.08 2zv9A1 GLU 320 HG3 0.05 0.03 0.04 -0.04 2.34 2.41 2zv9A1 PHE 321 H 0.11 0.24 0.18 -0.55 8.34 8.31 2zv9A1 PHE 321 HA -0.08 0.09 0.62 -0.75 4.62 4.50 2zv9A1 PHE 321 HB2 -0.06 -0.08 -0.34 -0.04 3.15 2.64 2zv9A1 PHE 321 HB3 -0.02 0.06 -0.07 -0.04 3.06 2.98 2zv9A1 PHE 321 HD2 -0.03 -0.02 -0.14 -0.04 7.28 7.05 2zv9A1 PHE 321 HE2 -0.03 -0.00 -0.08 -0.04 7.38 7.23 2zv9A1 PHE 321 HZ -0.03 0.07 -0.05 -0.04 7.32 7.26 2zv9A1 MET 322 H -0.55 0.21 0.02 -0.55 8.47 7.61 2zv9A1 MET 322 HA -0.34 0.04 0.73 -0.75 4.52 4.20 2zv9A1 MET 322 HB2 -0.27 -0.01 0.04 -0.04 2.15 1.87 2zv9A1 MET 322 HB3 -0.24 0.05 -0.38 -0.04 2.03 1.41 2zv9A1 MET 322 HG2 -0.16 0.10 -0.34 -0.04 2.63 2.19 2zv9A1 MET 322 HG3 -0.14 -0.00 -0.22 -0.04 2.56 2.16 2zv9A1 MET 322 HE3 -0.12 -0.03 -0.40 -0.04 2.10 1.50 2zv9A1 ALA 323 H -0.36 -0.01 0.18 -0.55 8.40 7.67 2zv9A1 ALA 323 HA -0.60 0.06 0.12 -0.75 4.34 3.17 2zv9A1 ALA 323 HB3 -0.04 -0.00 0.06 -0.04 1.41 1.38 2zv9A1 LYS 324 H -0.21 0.45 -0.05 -0.55 8.42 8.05 2zv9A1 LYS 324 HA -0.01 0.09 0.43 -0.75 4.32 4.07 2zv9A1 LYS 324 HB2 -0.32 0.07 -0.15 -0.04 1.87 1.43 2zv9A1 LYS 324 HB3 -0.09 -0.04 0.05 -0.04 1.79 1.67 2zv9A1 LYS 324 HG2 -0.08 -0.21 -0.30 -0.04 1.46 0.83 2zv9A1 LYS 324 HG3 -0.22 0.15 -0.15 -0.04 1.46 1.20 2zv9A1 LYS 324 HD2 0.36 0.00 -0.06 -0.04 1.69 1.95 2zv9A1 LYS 324 HD3 0.13 -0.01 -0.08 -0.04 1.68 1.68 2zv9A1 LYS 324 HE2 0.05 0.09 -0.00 -0.04 2.99 3.09 2zv9A1 LYS 324 HE3 0.22 -0.01 -0.04 -0.04 2.99 3.12 2zv9A1 GLY 325 H -0.20 0.33 -0.36 -0.55 8.43 7.66 2zv9A1 GLY 325 HA2 -0.11 0.02 0.29 -0.51 4.01 3.71 2zv9A1 GLY 325 HA3 -0.04 0.04 0.46 -0.51 4.01 3.96 2zv9A1 SER 326 H -0.04 0.08 0.21 -0.55 8.46 8.16 2zv9A1 SER 326 HA -0.09 0.21 0.69 -0.75 4.49 4.55 2zv9A1 SER 326 HB2 -0.06 0.18 0.22 -0.04 3.95 4.24 2zv9A1 SER 326 HB3 -0.05 0.02 0.18 -0.04 3.93 4.03 2zv9A1 LEU 327 H -0.10 0.95 0.36 -0.55 8.37 9.03 2zv9A1 LEU 327 HA -0.10 0.05 0.26 -0.75 4.35 3.81 2zv9A1 LEU 327 HB2 -0.19 -0.00 -0.06 -0.04 1.64 1.35 2zv9A1 LEU 327 HB3 -0.09 0.05 0.18 -0.04 1.64 1.74 2zv9A1 LEU 327 HG -0.06 -0.01 -0.21 -0.04 1.64 1.32 2zv9A1 LEU 327 HD13 -0.38 -0.00 -0.03 -0.04 0.93 0.48 2zv9A1 LEU 327 HD23 -0.12 -0.01 -0.09 -0.04 0.89 0.62 2zv9A1 LEU 328 H -0.02 0.31 -0.29 -0.55 8.37 7.83 2zv9A1 LEU 328 HA 0.05 0.09 0.35 -0.75 4.35 4.08 2zv9A1 LEU 328 HB2 0.02 -0.16 -0.29 -0.04 1.64 1.17 2zv9A1 LEU 328 HB3 0.01 -0.05 -0.03 -0.04 1.64 1.53 2zv9A1 LEU 328 HG 0.06 0.11 -0.18 -0.04 1.64 1.60 2zv9A1 LEU 328 HD13 0.13 0.01 -0.07 -0.04 0.93 0.95 2zv9A1 LEU 328 HD23 0.05 -0.02 -0.07 -0.04 0.89 0.81 2zv9A1 ASP 329 H 0.02 0.04 -0.20 -0.55 8.40 7.71 2zv9A1 ASP 329 HA 0.03 0.04 0.29 -0.75 4.63 4.23 2zv9A1 ASP 329 HB2 0.03 0.10 0.17 -0.04 2.71 2.97 2zv9A1 ASP 329 HB3 0.03 0.02 0.01 -0.04 2.70 2.72 2zv9A1 PHE 330 H 0.15 0.56 -0.23 -0.55 8.34 8.27 2zv9A1 PHE 330 HA -0.01 -0.05 0.35 -0.75 4.62 4.16 2zv9A1 PHE 330 HB2 -0.07 0.20 0.00 -0.04 3.15 3.25 2zv9A1 PHE 330 HB3 -0.09 0.05 0.07 -0.04 3.06 3.05 2zv9A1 PHE 330 HD2 -0.04 0.04 -0.07 -0.04 7.28 7.17 2zv9A1 PHE 330 HE2 0.19 -0.01 -0.10 -0.04 7.38 7.42 2zv9A1 PHE 330 HZ 0.14 0.01 -0.13 -0.04 7.32 7.30 2zv9A1 LEU 331 H 0.15 0.61 -0.07 -0.55 8.37 8.50 2zv9A1 LEU 331 HA 0.00 -0.00 0.29 -0.75 4.35 3.89 2zv9A1 LEU 331 HB2 0.08 0.08 0.02 -0.04 1.64 1.77 2zv9A1 LEU 331 HB3 0.14 -0.04 -0.01 -0.04 1.64 1.69 2zv9A1 LEU 331 HG 0.16 0.01 0.06 -0.04 1.64 1.83 2zv9A1 LEU 331 HD13 0.01 -0.03 -0.04 -0.04 0.93 0.82 2zv9A1 LEU 331 HD23 0.13 0.01 0.06 -0.04 0.89 1.05 2zv9A1 LYS 332 H 0.00 0.27 -0.63 -0.55 8.42 7.51 2zv9A1 LYS 332 HA 0.01 0.18 0.61 -0.75 4.32 4.37 2zv9A1 LYS 332 HB2 0.00 0.04 0.04 -0.04 1.87 1.91 2zv9A1 LYS 332 HB3 0.00 -0.11 0.06 -0.04 1.79 1.70 2zv9A1 LYS 332 HG2 0.05 0.17 -0.17 -0.04 1.46 1.47 2zv9A1 LYS 332 HG3 0.04 0.29 -0.06 -0.04 1.46 1.70 2zv9A1 LYS 332 HD2 0.03 -0.06 -0.02 -0.04 1.69 1.60 2zv9A1 LYS 332 HD3 0.05 0.17 -0.01 -0.04 1.68 1.85 2zv9A1 LYS 332 HE2 0.04 -0.08 -0.20 -0.04 2.99 2.70 2zv9A1 LYS 332 HE3 0.02 -0.03 -0.05 -0.04 2.99 2.89 2zv9A1 SER 333 H -0.12 0.42 -0.04 -0.55 8.46 8.18 2zv9A1 SER 333 HA -0.06 0.05 0.54 -0.75 4.49 4.27 2zv9A1 SER 333 HB2 -0.07 -0.16 0.16 -0.04 3.95 3.84 2zv9A1 SER 333 HB3 -0.06 0.10 0.14 -0.04 3.93 4.06 2zv9A1 ASP 334 H -0.06 0.12 0.18 -0.55 8.40 8.09 2zv9A1 ASP 334 HA -0.08 0.14 0.39 -0.75 4.63 4.33 2zv9A1 ASP 334 HB2 -0.04 -0.07 0.12 -0.04 2.71 2.68 2zv9A1 ASP 334 HB3 -0.05 0.04 0.02 -0.04 2.70 2.67 2zv9A1 GLU 335 H -0.09 0.03 -0.18 -0.55 8.60 7.81 2zv9A1 GLU 335 HA -0.06 0.08 0.39 -0.75 4.29 3.95 2zv9A1 GLU 335 HB2 -0.02 -0.03 0.05 -0.04 2.09 2.06 2zv9A1 GLU 335 HB3 -0.11 -0.02 0.03 -0.04 1.99 1.85 2zv9A1 GLU 335 HG2 -0.03 0.07 -0.38 -0.04 2.34 1.96 2zv9A1 GLU 335 HG3 0.05 -0.00 -0.03 -0.04 2.34 2.32 2zv9A1 GLY 336 H -0.37 0.08 -0.29 -0.55 8.43 7.30 2zv9A1 GLY 336 HA2 -0.50 -0.05 0.37 -0.51 4.01 3.32 2zv9A1 GLY 336 HA3 -0.52 0.30 0.22 -0.51 4.01 3.50 2zv9A1 GLY 337 H -0.16 0.48 -0.28 -0.55 8.43 7.92 2zv9A1 GLY 337 HA2 -0.43 0.12 0.43 -0.51 4.01 3.62 2zv9A1 GLY 337 HA3 -0.22 -0.03 0.28 -0.51 4.01 3.52 2zv9A1 LYS 338 H -0.08 0.27 -0.80 -0.55 8.42 7.25 2zv9A1 LYS 338 HA -0.06 0.14 0.81 -0.75 4.32 4.46 2zv9A1 LYS 338 HB2 -0.04 0.07 0.10 -0.04 1.87 1.97 2zv9A1 LYS 338 HB3 -0.02 -0.11 0.19 -0.04 1.79 1.80 2zv9A1 LYS 338 HG2 -0.06 -0.01 -0.07 -0.04 1.46 1.28 2zv9A1 LYS 338 HG3 -0.08 0.08 -0.23 -0.04 1.46 1.18 2zv9A1 LYS 338 HD2 -0.03 -0.06 0.01 -0.04 1.69 1.57 2zv9A1 LYS 338 HD3 -0.04 -0.05 -0.03 -0.04 1.68 1.52 2zv9A1 LYS 338 HE2 -0.05 0.20 -0.07 -0.04 2.99 3.03 2zv9A1 LYS 338 HE3 -0.03 -0.02 -0.06 -0.04 2.99 2.83 2zv9A1 VAL 339 H 0.11 0.48 -0.25 -0.55 8.24 8.03 2zv9A1 VAL 339 HA 0.06 0.04 0.90 -0.75 4.13 4.38 2zv9A1 VAL 339 HB 0.15 0.04 0.02 -0.04 2.12 2.29 2zv9A1 VAL 339 HG13 0.29 0.11 0.08 -0.04 0.97 1.41 2zv9A1 VAL 339 HG23 0.02 -0.01 -0.02 -0.04 0.95 0.90 2zv9A1 LEU 340 H 0.04 0.07 0.09 -0.55 8.37 8.02 2zv9A1 LEU 340 HA 0.10 0.21 0.43 -0.75 4.35 4.34 2zv9A1 LEU 340 HB2 0.02 -0.07 0.07 -0.04 1.64 1.62 2zv9A1 LEU 340 HB3 0.03 -0.04 0.17 -0.04 1.64 1.76 2zv9A1 LEU 340 HG 0.02 0.02 0.05 -0.04 1.64 1.69 2zv9A1 LEU 340 HD13 0.01 -0.00 0.03 -0.04 0.93 0.93 2zv9A1 LEU 340 HD23 0.03 0.02 -0.09 -0.04 0.89 0.81 2zv9A1 LEU 341 H 0.03 0.16 0.18 -0.55 8.37 8.20 2zv9A1 LEU 341 HA -0.05 0.09 0.36 -0.75 4.35 4.00 2zv9A1 LEU 341 HB2 0.02 0.00 0.17 -0.04 1.64 1.79 2zv9A1 LEU 341 HB3 0.01 -0.03 0.01 -0.04 1.64 1.59 2zv9A1 LEU 341 HG -0.03 0.07 0.11 -0.04 1.64 1.76 2zv9A1 LEU 341 HD13 0.04 0.03 0.12 -0.04 0.93 1.07 2zv9A1 LEU 341 HD23 0.01 0.02 0.08 -0.04 0.89 0.95 2zv9A1 PRO 342 HA -0.01 0.04 0.44 -0.51 4.44 4.40 2zv9A1 PRO 342 HB2 -0.04 0.03 0.02 -0.04 2.28 2.25 2zv9A1 PRO 342 HB3 -0.01 0.05 0.06 -0.04 2.02 2.09 2zv9A1 PRO 342 HG2 -0.00 0.01 -0.03 -0.04 2.03 1.97 2zv9A1 PRO 342 HG3 0.01 0.08 0.04 -0.04 2.03 2.13 2zv9A1 PRO 342 HD2 0.01 -0.05 0.00 -0.04 3.68 3.60 2zv9A1 PRO 342 HD3 0.02 0.15 0.07 -0.04 3.65 3.85 2zv9A1 LYS 343 H -0.10 0.33 -0.22 -0.55 8.42 7.87 2zv9A1 LYS 343 HA -0.26 0.05 0.39 -0.75 4.32 3.74 2zv9A1 LYS 343 HB2 -0.16 -0.04 0.07 -0.04 1.87 1.69 2zv9A1 LYS 343 HB3 -0.31 0.12 -0.04 -0.04 1.79 1.52 2zv9A1 LYS 343 HG2 -0.29 0.04 -0.01 -0.04 1.46 1.16 2zv9A1 LYS 343 HG3 -0.93 -0.03 0.04 -0.04 1.46 0.50 2zv9A1 LYS 343 HD2 -0.19 -0.04 0.01 -0.04 1.69 1.43 2zv9A1 LYS 343 HD3 -0.11 -0.01 -0.01 -0.04 1.68 1.51 2zv9A1 LYS 343 HE2 -0.05 -0.02 -0.01 -0.04 2.99 2.87 2zv9A1 LYS 343 HE3 -0.04 0.02 -0.01 -0.04 2.99 2.91 2zv9A1 LEU 344 H -0.16 0.33 -0.13 -0.55 8.37 7.87 2zv9A1 LEU 344 HA -0.05 0.05 0.43 -0.75 4.35 4.02 2zv9A1 LEU 344 HB2 -0.11 -0.01 0.14 -0.04 1.64 1.62 2zv9A1 LEU 344 HB3 -0.10 -0.04 -0.06 -0.04 1.64 1.40 2zv9A1 LEU 344 HG -0.06 0.13 -0.25 -0.04 1.64 1.41 2zv9A1 LEU 344 HD13 -0.28 0.00 -0.05 -0.04 0.93 0.57 2zv9A1 LEU 344 HD23 -0.06 0.02 -0.02 -0.04 0.89 0.79 2zv9A1 ILE 345 H -0.14 0.74 -0.05 -0.55 8.25 8.26 2zv9A1 ILE 345 HA -0.17 0.01 0.43 -0.75 4.18 3.69 2zv9A1 ILE 345 HB -0.16 0.12 0.08 -0.04 1.89 1.90 2zv9A1 ILE 345 HG12 -0.41 -0.03 0.01 -0.04 1.49 1.01 2zv9A1 ILE 345 HG13 -0.16 -0.01 0.04 -0.04 1.21 1.04 2zv9A1 ILE 345 HG23 -0.44 -0.02 -0.05 -0.04 0.93 0.38 2zv9A1 ILE 345 HD13 -0.02 -0.02 -0.14 -0.04 0.88 0.66 2zv9A1 ASP 346 H -0.15 0.36 -0.23 -0.55 8.40 7.83 2zv9A1 ASP 346 HA -0.05 0.02 0.46 -0.75 4.63 4.30 2zv9A1 ASP 346 HB2 -0.10 0.03 0.13 -0.04 2.71 2.74 2zv9A1 ASP 346 HB3 -0.23 0.16 0.20 -0.04 2.70 2.78 2zv9A1 PHE 347 H -0.14 0.65 -0.11 -0.55 8.34 8.19 2zv9A1 PHE 347 HA -0.02 -0.01 0.43 -0.75 4.62 4.26 2zv9A1 PHE 347 HB2 -0.04 0.24 0.24 -0.04 3.15 3.56 2zv9A1 PHE 347 HB3 -0.02 -0.09 -0.03 -0.04 3.06 2.87 2zv9A1 PHE 347 HD2 -0.01 -0.04 0.00 -0.04 7.28 7.19 2zv9A1 PHE 347 HE2 0.10 0.13 -0.03 -0.04 7.38 7.53 2zv9A1 PHE 347 HZ 0.01 -0.03 -0.07 -0.04 7.32 7.19 2zv9A1 SER 348 H 0.09 0.64 -0.14 -0.55 8.46 8.51 2zv9A1 SER 348 HA 0.09 -0.04 0.36 -0.75 4.49 4.14 2zv9A1 SER 348 HB2 -0.06 0.01 0.10 -0.04 3.95 3.95 2zv9A1 SER 348 HB3 -0.05 0.19 0.21 -0.04 3.93 4.24 2zv9A1 ALA 349 H 0.04 0.59 -0.21 -0.55 8.40 8.27 2zv9A1 ALA 349 HA 0.09 -0.00 0.41 -0.75 4.34 4.08 2zv9A1 ALA 349 HB3 -0.01 0.03 0.03 -0.04 1.41 1.42 2zv9A1 GLN 350 H 0.09 0.61 -0.15 -0.55 8.47 8.46 2zv9A1 GLN 350 HA 0.05 0.01 0.56 -0.75 4.36 4.23 2zv9A1 GLN 350 HB2 0.11 0.21 0.25 -0.04 2.15 2.68 2zv9A1 GLN 350 HB3 0.06 0.01 0.08 -0.04 2.02 2.12 2zv9A1 GLN 350 HG2 0.05 -0.07 0.08 -0.04 2.40 2.42 2zv9A1 GLN 350 HG3 0.07 0.19 0.08 -0.04 2.39 2.69 2zv9A1 GLN 350 HE21 0.21 0.24 0.12 -0.04 6.97 7.49 2zv9A1 GLN 350 HE22 0.17 0.05 -0.18 -0.04 7.69 7.68 2zv9A1 ILE 351 H 0.12 0.50 -0.17 -0.55 8.25 8.15 2zv9A1 ILE 351 HA 0.02 0.04 0.46 -0.75 4.18 3.95 2zv9A1 ILE 351 HB 0.32 0.19 0.10 -0.04 1.89 2.46 2zv9A1 ILE 351 HG12 0.01 -0.08 -0.10 -0.04 1.49 1.28 2zv9A1 ILE 351 HG13 0.06 0.17 0.03 -0.04 1.21 1.43 2zv9A1 ILE 351 HG23 0.15 -0.03 -0.13 -0.04 0.93 0.88 2zv9A1 ILE 351 HD13 0.03 -0.02 -0.14 -0.04 0.88 0.69 2zv9A1 ALA 352 H 0.15 0.52 -0.14 -0.55 8.40 8.39 2zv9A1 ALA 352 HA -0.34 -0.03 0.39 -0.75 4.34 3.60 2zv9A1 ALA 352 HB3 -0.05 0.05 0.02 -0.04 1.41 1.39 2zv9A1 GLU 353 H -0.01 0.31 -0.64 -0.55 8.60 7.71 2zv9A1 GLU 353 HA -0.02 0.03 0.50 -0.75 4.29 4.05 2zv9A1 GLU 353 HB2 0.03 0.17 0.18 -0.04 2.09 2.43 2zv9A1 GLU 353 HB3 0.04 0.15 0.19 -0.04 1.99 2.33 2zv9A1 GLU 353 HG2 0.06 -0.09 -0.06 -0.04 2.34 2.21 2zv9A1 GLU 353 HG3 0.05 -0.01 0.04 -0.04 2.34 2.38 2zv9A1 GLY 354 H -0.06 0.53 0.02 -0.55 8.43 8.38 2zv9A1 GLY 354 HA2 -0.29 -0.05 0.35 -0.51 4.01 3.51 2zv9A1 GLY 354 HA3 -0.07 0.19 0.30 -0.51 4.01 3.93 2zv9A1 MET 355 H -0.26 0.62 -0.19 -0.55 8.47 8.10 2zv9A1 MET 355 HA -0.33 0.01 0.50 -0.75 4.52 3.95 2zv9A1 MET 355 HB2 -1.01 0.14 0.07 -0.04 2.15 1.30 2zv9A1 MET 355 HB3 -2.31 -0.09 -0.01 -0.04 2.03 -0.41 2zv9A1 MET 355 HG2 -0.35 0.21 -0.00 -0.04 2.63 2.46 2zv9A1 MET 355 HG3 -0.70 -0.02 -0.07 -0.04 2.56 1.73 2zv9A1 MET 355 HE3 -0.21 -0.04 -0.00 -0.04 2.10 1.81 2zv9A1 ALA 356 H -0.18 0.44 -0.46 -0.55 8.40 7.65 2zv9A1 ALA 356 HA 0.04 -0.09 0.52 -0.75 4.34 4.05 2zv9A1 ALA 356 HB3 0.02 0.07 0.02 -0.04 1.41 1.48 2zv9A1 TYR 357 H -0.08 0.35 -0.36 -0.55 8.29 7.64 2zv9A1 TYR 357 HA -0.08 0.07 0.62 -0.75 4.56 4.41 2zv9A1 TYR 357 HB2 -0.59 -0.03 0.08 -0.04 3.06 2.48 2zv9A1 TYR 357 HB3 -0.42 0.26 0.17 -0.04 2.98 2.95 2zv9A1 TYR 357 HD2 -0.02 0.02 -0.06 -0.04 7.15 7.05 2zv9A1 TYR 357 HE2 -0.02 0.00 -0.13 -0.04 6.85 6.67 2zv9A1 ILE 358 H -0.08 0.35 -0.12 -0.55 8.25 7.85 2zv9A1 ILE 358 HA -0.29 0.08 0.32 -0.75 4.18 3.53 2zv9A1 ILE 358 HB -0.07 0.03 0.11 -0.04 1.89 1.92 2zv9A1 ILE 358 HG12 -0.02 0.02 -0.10 -0.04 1.49 1.35 2zv9A1 ILE 358 HG13 0.09 0.12 -0.02 -0.04 1.21 1.36 2zv9A1 ILE 358 HG23 0.09 0.02 -0.33 -0.04 0.93 0.67 2zv9A1 ILE 358 HD13 0.25 -0.02 -0.14 -0.04 0.88 0.93 2zv9A1 GLU 359 H -0.04 0.44 -0.16 -0.55 8.60 8.29 2zv9A1 GLU 359 HA 0.05 0.14 0.54 -0.75 4.29 4.27 2zv9A1 GLU 359 HB2 0.10 -0.04 0.09 -0.04 2.09 2.20 2zv9A1 GLU 359 HB3 0.18 -0.01 0.16 -0.04 1.99 2.27 2zv9A1 GLU 359 HG2 0.06 0.02 0.22 -0.04 2.34 2.59 2zv9A1 GLU 359 HG3 0.04 0.14 -0.01 -0.04 2.34 2.47 2zv9A1 ARG 360 H -0.04 0.24 -0.40 -0.55 8.46 7.71 2zv9A1 ARG 360 HA 0.01 0.00 0.40 -0.75 4.34 4.00 2zv9A1 ARG 360 HB2 0.01 0.28 0.28 -0.04 1.90 2.43 2zv9A1 ARG 360 HB3 -0.04 0.02 0.17 -0.04 1.80 1.91 2zv9A1 ARG 360 HG2 0.03 0.00 -0.03 -0.04 1.67 1.64 2zv9A1 ARG 360 HG3 0.03 -0.06 0.07 -0.04 1.67 1.66 2zv9A1 ARG 360 HD2 0.11 0.00 0.04 -0.04 3.22 3.33 2zv9A1 ARG 360 HD3 0.07 -0.05 0.01 -0.04 3.22 3.22 2zv9A1 LYS 361 H -0.24 0.68 0.09 -0.55 8.42 8.39 2zv9A1 LYS 361 HA -0.06 0.01 0.52 -0.75 4.32 4.03 2zv9A1 LYS 361 HB2 -0.77 0.11 0.11 -0.04 1.87 1.28 2zv9A1 LYS 361 HB3 -0.23 -0.01 -0.02 -0.04 1.79 1.50 2zv9A1 LYS 361 HG2 -0.42 -0.06 -0.07 -0.04 1.46 0.87 2zv9A1 LYS 361 HG3 0.06 0.01 0.01 -0.04 1.46 1.50 2zv9A1 LYS 361 HD2 -0.04 -0.01 0.08 -0.04 1.69 1.68 2zv9A1 LYS 361 HD3 -0.20 -0.03 0.02 -0.04 1.68 1.43 2zv9A1 LYS 361 HE2 0.00 0.15 -0.00 -0.04 2.99 3.10 2zv9A1 LYS 361 HE3 0.02 -0.04 -0.01 -0.04 2.99 2.92 2zv9A1 ASN 362 H -0.01 0.14 -1.06 -0.55 8.53 7.05 2zv9A1 ASN 362 HA -0.01 0.07 0.32 -0.75 4.76 4.38 2zv9A1 ASN 362 HB2 -0.03 0.05 -0.35 -0.04 2.88 2.51 2zv9A1 ASN 362 HB3 -0.11 -0.01 0.32 -0.04 2.79 2.95 2zv9A1 ASN 362 HD21 -0.02 -0.12 0.07 -0.04 7.03 6.92 2zv9A1 ASN 362 HD22 -0.04 0.05 0.09 -0.04 7.74 7.80 2zv9A1 TYR 363 H 0.13 0.65 0.05 -0.55 8.29 8.57 2zv9A1 TYR 363 HA -0.02 0.28 0.95 -0.75 4.56 5.01 2zv9A1 TYR 363 HB2 -0.08 -0.04 -0.06 -0.04 3.06 2.84 2zv9A1 TYR 363 HB3 -0.01 -0.05 -0.02 -0.04 2.98 2.85 2zv9A1 TYR 363 HD2 -0.07 0.03 -0.37 -0.04 7.15 6.70 2zv9A1 TYR 363 HE2 -0.06 -0.01 -0.12 -0.04 6.85 6.62 2zv9A1 ILE 364 H 0.16 0.67 0.29 -0.55 8.25 8.82 2zv9A1 ILE 364 HA 0.15 0.08 0.59 -0.75 4.18 4.25 2zv9A1 ILE 364 HB 0.15 -0.13 -0.13 -0.04 1.89 1.74 2zv9A1 ILE 364 HG12 0.04 0.15 -0.10 -0.04 1.49 1.55 2zv9A1 ILE 364 HG13 0.05 -0.05 -0.15 -0.04 1.21 1.02 2zv9A1 ILE 364 HG23 0.10 0.02 -0.40 -0.04 0.93 0.61 2zv9A1 ILE 364 HD13 0.07 0.01 -0.23 -0.04 0.88 0.69 2zv9A1 HIS 365 H 0.23 0.07 0.07 -0.55 8.41 8.23 2zv9A1 HIS 365 HA 0.10 0.21 0.68 -0.75 4.63 4.86 2zv9A1 HIS 365 HB2 0.05 0.05 -0.01 -0.04 3.26 3.32 2zv9A1 HIS 365 HB3 0.06 -0.10 0.04 -0.04 3.20 3.16 2zv9A1 HIS 365 HD2 -0.11 -0.01 -0.12 -0.04 6.97 6.70 2zv9A1 HIS 365 HE1 -0.21 0.19 0.00 -0.04 7.75 7.69 2zv9A1 ARG 366 H 0.24 0.03 -0.01 -0.55 8.46 8.16 2zv9A1 ARG 366 HA 0.21 -0.02 0.24 -0.75 4.34 4.02 2zv9A1 ARG 366 HB2 -0.09 0.40 -0.25 -0.04 1.90 1.93 2zv9A1 ARG 366 HB3 -0.17 -0.05 -0.02 -0.04 1.80 1.52 2zv9A1 ARG 366 HG2 0.02 -0.14 -0.16 -0.04 1.67 1.34 2zv9A1 ARG 366 HG3 -0.09 0.10 -0.39 -0.04 1.67 1.25 2zv9A1 ARG 366 HD2 -1.58 -0.07 -0.07 -0.04 3.22 1.46 2zv9A1 ARG 366 HD3 -0.71 -0.04 -0.11 -0.04 3.22 2.32 2zv9A1 ASP 367 H 0.47 0.08 -0.81 -0.55 8.40 7.59 2zv9A1 ASP 367 HA 0.12 0.17 0.69 -0.75 4.63 4.85 2zv9A1 ASP 367 HB2 -0.00 -0.01 -0.24 -0.04 2.71 2.42 2zv9A1 ASP 367 HB3 0.03 0.10 0.06 -0.04 2.70 2.85 2zv9A1 LEU 368 H 0.18 0.14 -0.15 -0.55 8.37 8.01 2zv9A1 LEU 368 HA -0.27 0.16 0.55 -0.75 4.35 4.04 2zv9A1 LEU 368 HB2 -0.14 -0.09 -0.03 -0.04 1.64 1.35 2zv9A1 LEU 368 HB3 0.18 0.01 0.06 -0.04 1.64 1.85 2zv9A1 LEU 368 HG 0.13 0.04 -0.40 -0.04 1.64 1.36 2zv9A1 LEU 368 HD13 -0.18 0.00 -0.08 -0.04 0.93 0.63 2zv9A1 LEU 368 HD23 0.29 0.01 -0.10 -0.04 0.89 1.05 2zv9A1 ARG 369 H -0.16 0.32 0.19 -0.55 8.46 8.26 2zv9A1 ARG 369 HA 0.09 0.14 0.47 -0.75 4.34 4.29 2zv9A1 ARG 369 HB2 -0.65 -0.07 0.02 -0.04 1.90 1.16 2zv9A1 ARG 369 HB3 -1.26 0.27 -0.15 -0.04 1.80 0.62 2zv9A1 ARG 369 HG2 -0.38 0.14 -0.35 -0.04 1.67 1.05 2zv9A1 ARG 369 HG3 -0.45 -0.22 -0.21 -0.04 1.67 0.74 2zv9A1 ARG 369 HD2 -1.88 -0.00 -0.13 -0.04 3.22 1.16 2zv9A1 ARG 369 HD3 -0.98 0.05 -0.26 -0.04 3.22 1.99 2zv9A1 ALA 370 H 0.12 0.27 0.11 -0.55 8.40 8.36 2zv9A1 ALA 370 HA -0.03 0.10 0.27 -0.75 4.34 3.93 2zv9A1 ALA 370 HB3 0.06 0.05 -0.01 -0.04 1.41 1.47 2zv9A1 ALA 371 H -0.12 0.14 -0.28 -0.55 8.40 7.59 2zv9A1 ALA 371 HA -0.06 -0.02 0.54 -0.75 4.34 4.05 2zv9A1 ALA 371 HB3 -0.12 0.03 0.03 -0.04 1.41 1.31 2zv9A1 ASN 372 H -0.15 0.48 -0.28 -0.55 8.53 8.04 2zv9A1 ASN 372 HA -0.12 0.12 0.72 -0.75 4.76 4.72 2zv9A1 ASN 372 HB2 -0.17 -0.01 0.19 -0.04 2.88 2.85 2zv9A1 ASN 372 HB3 -0.12 0.10 0.17 -0.04 2.79 2.89 2zv9A1 ASN 372 HD21 -0.14 -0.10 -0.03 -0.04 7.03 6.72 2zv9A1 ASN 372 HD22 -0.10 0.77 0.17 -0.04 7.74 8.54 2zv9A1 VAL 373 H -0.11 0.29 -0.27 -0.55 8.24 7.60 2zv9A1 VAL 373 HA -0.12 0.19 0.93 -0.75 4.13 4.38 2zv9A1 VAL 373 HB -0.10 -0.05 0.10 -0.04 2.12 2.03 2zv9A1 VAL 373 HG13 -0.12 0.02 -0.20 -0.04 0.97 0.63 2zv9A1 VAL 373 HG23 -0.09 0.01 -0.19 -0.04 0.95 0.65 2zv9A1 LEU 374 H -0.11 0.81 0.29 -0.55 8.37 8.81 2zv9A1 LEU 374 HA -0.14 0.20 0.94 -0.75 4.35 4.60 2zv9A1 LEU 374 HB2 -0.11 0.02 -0.03 -0.04 1.64 1.48 2zv9A1 LEU 374 HB3 -0.15 -0.01 -0.13 -0.04 1.64 1.31 2zv9A1 LEU 374 HG -0.11 0.02 -0.24 -0.04 1.64 1.26 2zv9A1 LEU 374 HD13 -0.09 0.01 -0.38 -0.04 0.93 0.43 2zv9A1 LEU 374 HD23 -0.09 -0.02 -0.11 -0.04 0.89 0.63 2zv9A1 VAL 375 H -0.21 0.76 0.12 -0.55 8.24 8.37 2zv9A1 VAL 375 HA -0.24 0.48 0.97 -0.75 4.13 4.58 2zv9A1 VAL 375 HB -0.45 0.04 -0.16 -0.04 2.12 1.51 2zv9A1 VAL 375 HG13 -0.57 0.04 -0.26 -0.04 0.97 0.14 2zv9A1 VAL 375 HG23 -0.53 -0.01 -0.34 -0.04 0.95 0.03 2zv9A1 SER 376 H -0.16 0.43 0.13 -0.55 8.46 8.31 2zv9A1 SER 376 HA -0.20 -0.11 0.82 -0.75 4.49 4.24 2zv9A1 SER 376 HB2 -0.11 0.16 0.06 -0.04 3.95 4.02 2zv9A1 SER 376 HB3 -0.07 -0.08 0.08 -0.04 3.93 3.82 2zv9A1 GLU 377 H -0.06 0.15 0.21 -0.55 8.60 8.35 2zv9A1 GLU 377 HA -0.03 0.16 0.45 -0.75 4.29 4.12 2zv9A1 GLU 377 HB2 0.01 -0.01 0.17 -0.04 2.09 2.23 2zv9A1 GLU 377 HB3 0.01 -0.01 0.15 -0.04 1.99 2.10 2zv9A1 GLU 377 HG2 0.04 0.03 0.01 -0.04 2.34 2.37 2zv9A1 GLU 377 HG3 0.03 0.04 -0.12 -0.04 2.34 2.25 2zv9A1 SER 378 H -0.01 0.05 -0.07 -0.55 8.46 7.88 2zv9A1 SER 378 HA 0.01 0.17 0.43 -0.75 4.49 4.35 2zv9A1 SER 378 HB2 0.01 0.07 0.13 -0.04 3.95 4.12 2zv9A1 SER 378 HB3 0.01 0.03 0.08 -0.04 3.93 4.00 2zv9A1 LEU 379 H -0.04 0.29 -1.14 -0.55 8.37 6.94 2zv9A1 LEU 379 HA -0.10 0.12 0.13 -0.75 4.35 3.75 2zv9A1 LEU 379 HB2 0.08 0.11 -0.06 -0.04 1.64 1.73 2zv9A1 LEU 379 HB3 0.29 -0.03 0.14 -0.04 1.64 2.00 2zv9A1 LEU 379 HG 0.05 0.07 -0.12 -0.04 1.64 1.60 2zv9A1 LEU 379 HD13 0.13 -0.01 -0.05 -0.04 0.93 0.97 2zv9A1 LEU 379 HD23 -0.02 0.02 -0.04 -0.04 0.89 0.80 2zv9A1 MET 380 H -0.04 -0.12 -0.38 -0.55 8.47 7.38 2zv9A1 MET 380 HA 0.03 0.17 0.66 -0.75 4.52 4.63 2zv9A1 MET 380 HB2 -0.04 -0.16 -0.01 -0.04 2.15 1.90 2zv9A1 MET 380 HB3 -0.01 0.14 -0.09 -0.04 2.03 2.03 2zv9A1 MET 380 HG2 -0.00 -0.12 -0.19 -0.04 2.63 2.28 2zv9A1 MET 380 HG3 -0.00 0.01 -0.06 -0.04 2.56 2.47 2zv9A1 MET 380 HE3 0.01 -0.00 -0.03 -0.04 2.10 2.04 2zv9A1 CYS 381 H 0.02 0.17 0.14 -0.55 8.50 8.29 2zv9A1 CYS 381 HA -0.16 0.34 0.92 -0.75 4.58 4.93 2zv9A1 CYS 381 HB2 0.01 -0.03 0.12 -0.04 2.97 3.03 2zv9A1 CYS 381 HB3 -0.09 -0.03 -0.07 -0.04 2.97 2.75 2zv9A1 LYS 382 H -0.10 0.70 0.26 -0.55 8.42 8.72 2zv9A1 LYS 382 HA -0.01 0.29 0.62 -0.75 4.32 4.46 2zv9A1 LYS 382 HB2 -0.05 -0.07 -0.17 -0.04 1.87 1.53 2zv9A1 LYS 382 HB3 0.00 -0.06 -0.46 -0.04 1.79 1.23 2zv9A1 LYS 382 HG2 -0.01 0.16 -0.30 -0.04 1.46 1.27 2zv9A1 LYS 382 HG3 -0.05 -0.06 -0.56 -0.04 1.46 0.74 2zv9A1 LYS 382 HD2 -0.04 -0.12 -0.22 -0.04 1.69 1.27 2zv9A1 LYS 382 HD3 -0.01 0.17 -0.29 -0.04 1.68 1.51 2zv9A1 LYS 382 HE2 -0.02 0.01 -0.11 -0.04 2.99 2.83 2zv9A1 LYS 382 HE3 -0.03 -0.15 -0.12 -0.04 2.99 2.65 2zv9A1 ILE 383 H 0.02 0.57 0.24 -0.55 8.25 8.54 2zv9A1 ILE 383 HA -0.12 0.10 0.73 -0.75 4.18 4.14 2zv9A1 ILE 383 HB 0.07 -0.01 0.21 -0.04 1.89 2.12 2zv9A1 ILE 383 HG12 -0.13 -0.02 0.00 -0.04 1.49 1.30 2zv9A1 ILE 383 HG13 -0.05 -0.01 0.02 -0.04 1.21 1.14 2zv9A1 ILE 383 HG23 -0.28 0.01 -0.07 -0.04 0.93 0.55 2zv9A1 ILE 383 HD13 -0.08 0.01 -0.01 -0.04 0.88 0.77 2zv9A1 ALA 384 H -0.19 0.73 0.37 -0.55 8.40 8.77 2zv9A1 ALA 384 HA -0.13 0.17 0.78 -0.75 4.34 4.41 2zv9A1 ALA 384 HB3 -0.09 -0.04 -0.02 -0.04 1.41 1.22 2zv9A1 ASP 385 H -0.14 0.10 0.08 -0.55 8.40 7.88 2zv9A1 ASP 385 HA -0.14 -0.04 0.38 -0.75 4.63 4.08 2zv9A1 ASP 385 HB2 -0.14 0.18 -0.02 -0.04 2.71 2.69 2zv9A1 ASP 385 HB3 -0.14 -0.03 0.10 -0.04 2.70 2.59 2zv9A1 PHE 386 H 0.03 0.14 -0.02 -0.55 8.34 7.93 2zv9A1 PHE 386 HA -0.38 0.21 0.73 -0.75 4.62 4.42 2zv9A1 PHE 386 HB2 -0.14 0.06 0.06 -0.04 3.15 3.08 2zv9A1 PHE 386 HB3 -0.16 0.04 0.12 -0.04 3.06 3.02 2zv9A1 PHE 386 HD2 -0.10 -0.05 -0.10 -0.04 7.28 6.98 2zv9A1 PHE 386 HE2 0.03 0.00 -0.09 -0.04 7.38 7.28 2zv9A1 PHE 386 HZ 0.02 0.03 -0.10 -0.04 7.32 7.23 2zv9A1 GLY 387 H -0.14 0.09 -0.52 -0.55 8.43 7.31 2zv9A1 GLY 387 HA2 -0.08 0.05 0.35 -0.51 4.01 3.82 2zv9A1 GLY 387 HA3 -0.11 0.03 0.20 -0.51 4.01 3.62 2zv9A1 LEU 388 H -0.17 0.10 -0.26 -0.55 8.37 7.50 2zv9A1 LEU 388 HA -0.09 0.17 0.60 -0.75 4.35 4.28 2zv9A1 LEU 388 HB2 -0.11 0.09 -0.09 -0.04 1.64 1.49 2zv9A1 LEU 388 HB3 -0.12 -0.04 -0.03 -0.04 1.64 1.41 2zv9A1 LEU 388 HG -0.08 -0.02 -0.22 -0.04 1.64 1.28 2zv9A1 LEU 388 HD13 0.03 0.02 -0.33 -0.04 0.93 0.61 2zv9A1 LEU 388 HD23 -0.05 -0.00 -0.34 -0.04 0.89 0.46 2zv9A1 ALA 389 H -0.11 0.01 -0.41 -0.55 8.40 7.34 2zv9A1 ALA 389 HA -0.02 0.14 0.53 -0.75 4.34 4.24 2zv9A1 ALA 389 HB3 0.06 -0.00 0.10 -0.04 1.41 1.53 2zv9A1 ARG 390 H 0.08 0.41 0.32 -0.55 8.46 8.72 2zv9A1 ARG 390 HA 0.05 0.18 0.82 -0.75 4.34 4.63 2zv9A1 ARG 390 HB2 -0.03 -0.04 0.04 -0.04 1.90 1.84 2zv9A1 ARG 390 HB3 -0.04 -0.21 0.19 -0.04 1.80 1.71 2zv9A1 ARG 390 HG2 -0.06 0.25 -0.41 -0.04 1.67 1.41 2zv9A1 ARG 390 HG3 -0.08 -0.06 -0.21 -0.04 1.67 1.28 2zv9A1 ARG 390 HD2 -0.03 -0.11 -0.67 -0.04 3.22 2.37 2zv9A1 ARG 390 HD3 -0.02 0.14 -0.08 -0.04 3.22 3.22 2zv9A1 VAL 391 H -0.09 0.12 0.15 -0.55 8.24 7.87 2zv9A1 VAL 391 HA -0.75 0.26 0.83 -0.75 4.13 3.71 2zv9A1 VAL 391 HB -0.44 -0.03 0.03 -0.04 2.12 1.64 2zv9A1 VAL 391 HG13 -0.13 -0.02 -0.07 -0.04 0.97 0.71 2zv9A1 VAL 391 HG23 -0.67 0.03 0.08 -0.04 0.95 0.35 2zv9A1 ILE 392 H -0.09 -0.06 -0.10 -0.55 8.25 7.45 2zv9A1 ILE 392 HA -0.07 0.17 0.36 -0.75 4.18 3.89 2zv9A1 ILE 392 HB -0.04 -0.03 0.07 -0.04 1.89 1.85 2zv9A1 ILE 392 HG12 -0.01 0.01 0.05 -0.04 1.49 1.49 2zv9A1 ILE 392 HG13 -0.02 0.02 0.07 -0.04 1.21 1.24 2zv9A1 ILE 392 HG23 -0.01 0.01 0.05 -0.04 0.93 0.93 2zv9A1 ILE 392 HD13 -0.03 0.01 0.01 -0.04 0.88 0.83 2zv9A1 GLU 401 HA 0.02 -0.12 0.25 -0.75 4.29 3.68 2zv9A1 GLY 402 H -0.00 0.08 0.05 -0.55 8.43 8.01 2zv9A1 GLY 402 HA2 0.10 0.05 -0.22 -0.51 4.01 3.43 2zv9A1 GLY 402 HA3 0.09 0.04 0.54 -0.51 4.01 4.18 2zv9A1 ALA 403 H 0.02 0.07 -0.01 -0.55 8.40 7.93 2zv9A1 ALA 403 HA -0.07 0.08 -0.33 -0.75 4.34 3.27 2zv9A1 ALA 403 HB3 0.01 0.02 0.10 -0.04 1.41 1.49 2zv9A1 LYS 404 H 0.01 0.05 0.06 -0.55 8.42 7.98 2zv9A1 LYS 404 HA -0.17 -0.02 0.36 -0.75 4.32 3.73 2zv9A1 LYS 404 HB2 -0.04 -0.03 -0.34 -0.04 1.87 1.41 2zv9A1 LYS 404 HB3 -0.07 0.17 0.59 -0.04 1.79 2.44 2zv9A1 LYS 404 HG2 -0.13 -0.03 0.00 -0.04 1.46 1.26 2zv9A1 LYS 404 HG3 -0.04 -0.02 0.00 -0.04 1.46 1.36 2zv9A1 LYS 404 HD2 -0.05 -0.01 -0.02 -0.04 1.69 1.57 2zv9A1 LYS 404 HD3 -0.09 0.07 -0.43 -0.04 1.68 1.19 2zv9A1 LYS 404 HE2 -0.10 0.03 -0.03 -0.04 2.99 2.85 2zv9A1 LYS 404 HE3 -0.04 -0.02 -0.02 -0.04 2.99 2.88 2zv9A1 PHE 405 H -0.23 0.04 0.10 -0.55 8.34 7.70 2zv9A1 PHE 405 HA 0.01 0.17 0.45 -0.75 4.62 4.48 2zv9A1 PHE 405 HB2 0.15 0.14 0.01 -0.04 3.15 3.41 2zv9A1 PHE 405 HB3 -0.03 -0.00 0.02 -0.04 3.06 3.00 2zv9A1 PHE 405 HD2 0.09 -0.01 -0.16 -0.04 7.28 7.16 2zv9A1 PHE 405 HE2 0.09 0.01 -0.05 -0.04 7.38 7.39 2zv9A1 PHE 405 HZ 0.10 0.06 -0.01 -0.04 7.32 7.43 2zv9A1 PRO 406 HA 0.14 0.09 0.38 -0.51 4.44 4.53 2zv9A1 PRO 406 HB2 0.41 -0.06 -0.00 -0.04 2.28 2.59 2zv9A1 PRO 406 HB3 -0.12 0.07 -0.00 -0.04 2.02 1.93 2zv9A1 PRO 406 HG2 0.23 0.03 -0.01 -0.04 2.03 2.23 2zv9A1 PRO 406 HG3 -0.08 0.04 -0.03 -0.04 2.03 1.92 2zv9A1 PRO 406 HD2 0.35 0.16 0.09 -0.04 3.68 4.24 2zv9A1 PRO 406 HD3 0.17 0.14 0.22 -0.04 3.65 4.15 2zv9A1 ILE 407 H 0.12 0.23 0.20 -0.55 8.25 8.26 2zv9A1 ILE 407 HA 0.23 0.08 0.21 -0.75 4.18 3.95 2zv9A1 ILE 407 HB 0.08 -0.08 0.12 -0.04 1.89 1.97 2zv9A1 ILE 407 HG12 -0.03 0.03 0.15 -0.04 1.49 1.60 2zv9A1 ILE 407 HG13 -0.03 -0.05 0.03 -0.04 1.21 1.12 2zv9A1 ILE 407 HG23 0.01 0.02 -0.11 -0.04 0.93 0.81 2zv9A1 ILE 407 HD13 -0.12 0.01 -0.02 -0.04 0.88 0.71 2zv9A1 LYS 408 H 0.30 0.05 -0.18 -0.55 8.42 8.04 2zv9A1 LYS 408 HA 0.02 0.13 0.23 -0.75 4.32 3.95 2zv9A1 LYS 408 HB2 -0.11 -0.05 -0.03 -0.04 1.87 1.64 2zv9A1 LYS 408 HB3 -0.21 0.04 0.01 -0.04 1.79 1.58 2zv9A1 LYS 408 HG2 -0.06 0.04 -0.10 -0.04 1.46 1.30 2zv9A1 LYS 408 HG3 0.06 -0.15 -0.03 -0.04 1.46 1.30 2zv9A1 LYS 408 HD2 0.02 -0.07 -0.06 -0.04 1.69 1.54 2zv9A1 LYS 408 HD3 0.07 0.14 -0.20 -0.04 1.68 1.64 2zv9A1 LYS 408 HE2 -0.01 0.03 -0.23 -0.04 2.99 2.75 2zv9A1 LYS 408 HE3 0.03 -0.26 -0.13 -0.04 2.99 2.59 2zv9A1 TRP 409 H 0.59 0.43 -0.63 -0.55 7.97 7.81 2zv9A1 TRP 409 HA 0.29 0.15 0.83 -0.75 4.62 5.14 2zv9A1 TRP 409 HB2 0.19 0.04 0.01 -0.04 3.23 3.43 2zv9A1 TRP 409 HB3 0.23 -0.00 0.08 -0.04 3.23 3.50 2zv9A1 TRP 409 HD1 0.16 0.18 0.14 -0.04 7.22 7.66 2zv9A1 TRP 409 HE1 0.10 -0.12 -0.05 -0.04 10.20 10.10 2zv9A1 TRP 409 HE3 0.12 -0.09 -0.23 -0.04 7.59 7.35 2zv9A1 TRP 409 HZ2 0.09 0.00 -0.05 -0.04 7.44 7.44 2zv9A1 TRP 409 HZ3 0.08 -0.03 -0.07 -0.04 7.13 7.06 2zv9A1 TRP 409 HH2 0.08 0.02 -0.05 -0.04 7.19 7.21 2zv9A1 THR 410 H 0.32 0.45 -0.06 -0.55 8.28 8.44 2zv9A1 THR 410 HA 0.23 0.00 0.54 -0.75 4.39 4.41 2zv9A1 THR 410 HB 0.19 0.07 0.01 -0.04 4.32 4.54 2zv9A1 THR 410 HG23 -0.03 0.00 -0.18 -0.04 1.22 0.97 2zv9A1 ALA 411 H -0.15 0.06 0.18 -0.55 8.40 7.95 2zv9A1 ALA 411 HA -1.99 0.24 0.43 -0.75 4.34 2.26 2zv9A1 ALA 411 HB3 -0.27 0.01 0.21 -0.04 1.41 1.31 2zv9A1 PRO 412 HA -0.34 0.11 0.36 -0.51 4.44 4.06 2zv9A1 PRO 412 HB2 -0.23 0.02 0.06 -0.04 2.28 2.09 2zv9A1 PRO 412 HB3 -0.22 0.06 0.06 -0.04 2.02 1.87 2zv9A1 PRO 412 HG2 -0.46 0.13 0.09 -0.04 2.03 1.75 2zv9A1 PRO 412 HG3 -0.62 0.10 0.11 -0.04 2.03 1.58 2zv9A1 PRO 412 HD2 -0.98 0.11 0.21 -0.04 3.68 2.98 2zv9A1 PRO 412 HD3 -3.01 0.21 0.24 -0.04 3.65 1.05 2zv9A1 GLU 413 H -0.25 0.21 -0.10 -0.55 8.60 7.91 2zv9A1 GLU 413 HA 0.12 0.11 0.49 -0.75 4.29 4.26 2zv9A1 GLU 413 HB2 0.06 0.02 0.10 -0.04 2.09 2.24 2zv9A1 GLU 413 HB3 -0.02 0.07 0.12 -0.04 1.99 2.11 2zv9A1 GLU 413 HG2 -0.12 0.16 -0.24 -0.04 2.34 2.10 2zv9A1 GLU 413 HG3 -0.05 -0.02 -0.01 -0.04 2.34 2.22 2zv9A1 ALA 414 H -0.35 0.19 -0.41 -0.55 8.40 7.28 2zv9A1 ALA 414 HA -0.59 -0.10 0.34 -0.75 4.34 3.23 2zv9A1 ALA 414 HB3 -1.12 0.06 -0.07 -0.04 1.41 0.24 2zv9A1 ILE 415 H -0.30 0.42 -0.17 -0.55 8.25 7.65 2zv9A1 ILE 415 HA -0.06 0.05 0.44 -0.75 4.18 3.86 2zv9A1 ILE 415 HB -0.17 0.08 0.11 -0.04 1.89 1.87 2zv9A1 ILE 415 HG12 0.13 -0.08 -0.07 -0.04 1.49 1.43 2zv9A1 ILE 415 HG13 -0.11 -0.01 -0.18 -0.04 1.21 0.87 2zv9A1 ILE 415 HG23 -0.04 -0.01 -0.17 -0.04 0.93 0.67 2zv9A1 ILE 415 HD13 -0.10 0.03 -0.09 -0.04 0.88 0.67 2zv9A1 ASN 416 H -0.24 0.55 -0.00 -0.55 8.53 8.28 2zv9A1 ASN 416 HA -0.32 0.11 0.43 -0.75 4.76 4.23 2zv9A1 ASN 416 HB2 -0.50 0.04 0.11 -0.04 2.88 2.49 2zv9A1 ASN 416 HB3 -1.00 -0.03 0.03 -0.04 2.79 1.75 2zv9A1 ASN 416 HD21 -0.14 0.00 0.02 -0.04 7.03 6.86 2zv9A1 ASN 416 HD22 -0.16 -0.03 -0.02 -0.04 7.74 7.48 2zv9A1 PHE 417 H -0.13 0.28 -0.18 -0.55 8.34 7.75 2zv9A1 PHE 417 HA -0.05 0.22 0.90 -0.75 4.62 4.93 2zv9A1 PHE 417 HB2 -0.09 0.06 0.10 -0.04 3.15 3.18 2zv9A1 PHE 417 HB3 -0.05 -0.03 0.16 -0.04 3.06 3.10 2zv9A1 PHE 417 HD2 -0.06 -0.01 0.03 -0.04 7.28 7.19 2zv9A1 PHE 417 HE2 -0.04 -0.01 -0.03 -0.04 7.38 7.26 2zv9A1 PHE 417 HZ -0.03 -0.00 -0.03 -0.04 7.32 7.22 2zv9A1 GLY 418 H -0.10 0.19 -0.35 -0.55 8.43 7.62 2zv9A1 GLY 418 HA2 -0.05 0.20 0.31 -0.51 4.01 3.96 2zv9A1 GLY 418 HA3 0.04 0.01 0.31 -0.51 4.01 3.86 2zv9A1 CYS 419 H -0.15 0.29 -0.24 -0.55 8.50 7.85 2zv9A1 CYS 419 HA 0.00 0.16 0.52 -0.75 4.58 4.50 2zv9A1 CYS 419 HB2 0.01 0.14 -0.10 -0.04 2.97 2.96 2zv9A1 CYS 419 HB3 -0.06 -0.06 -0.10 -0.04 2.97 2.71 2zv9A1 PHE 420 H 0.20 0.37 0.15 -0.55 8.34 8.50 2zv9A1 PHE 420 HA -0.03 0.01 0.75 -0.75 4.62 4.60 2zv9A1 PHE 420 HB2 -0.05 0.05 0.11 -0.04 3.15 3.23 2zv9A1 PHE 420 HB3 -0.02 -0.03 -0.07 -0.04 3.06 2.89 2zv9A1 PHE 420 HD2 -0.09 0.06 -0.07 -0.04 7.28 7.14 2zv9A1 PHE 420 HE2 -0.32 0.04 -0.07 -0.04 7.38 7.00 2zv9A1 PHE 420 HZ -1.58 -0.00 -0.12 -0.04 7.32 5.57 2zv9A1 THR 421 H 0.10 0.11 0.24 -0.55 8.28 8.18 2zv9A1 THR 421 HA 0.08 0.33 0.75 -0.75 4.39 4.80 2zv9A1 THR 421 HB 0.05 -0.05 0.14 -0.04 4.32 4.42 2zv9A1 THR 421 HG23 0.02 0.05 -0.25 -0.04 1.22 1.00 2zv9A1 ILE 422 H 0.08 0.33 0.14 -0.55 8.25 8.26 2zv9A1 ILE 422 HA 0.19 0.05 0.54 -0.75 4.18 4.21 2zv9A1 ILE 422 HB 0.11 0.20 0.16 -0.04 1.89 2.32 2zv9A1 ILE 422 HG12 0.19 0.01 0.09 -0.04 1.49 1.74 2zv9A1 ILE 422 HG13 0.32 -0.07 0.04 -0.04 1.21 1.46 2zv9A1 ILE 422 HG23 0.07 0.02 0.02 -0.04 0.93 1.00 2zv9A1 ILE 422 HD13 0.19 0.06 0.08 -0.04 0.88 1.17 2zv9A1 LYS 423 H 0.08 0.09 -0.21 -0.55 8.42 7.82 2zv9A1 LYS 423 HA 0.04 0.18 0.44 -0.75 4.32 4.23 2zv9A1 LYS 423 HB2 0.05 -0.11 0.03 -0.04 1.87 1.80 2zv9A1 LYS 423 HB3 0.06 0.17 0.08 -0.04 1.79 2.05 2zv9A1 LYS 423 HG2 0.03 -0.14 -0.01 -0.04 1.46 1.30 2zv9A1 LYS 423 HG3 0.02 -0.02 -0.06 -0.04 1.46 1.36 2zv9A1 LYS 423 HD2 0.00 0.34 0.12 -0.04 1.69 2.11 2zv9A1 LYS 423 HD3 -0.02 -0.02 -0.02 -0.04 1.68 1.58 2zv9A1 LYS 423 HE2 -0.01 -0.14 -0.01 -0.04 2.99 2.79 2zv9A1 LYS 423 HE3 -0.03 0.27 0.02 -0.04 2.99 3.21 2zv9A1 SER 424 H 0.11 0.10 -0.26 -0.55 8.46 7.87 2zv9A1 SER 424 HA 0.15 0.13 0.64 -0.75 4.49 4.65 2zv9A1 SER 424 HB2 -0.05 -0.05 0.18 -0.04 3.95 4.00 2zv9A1 SER 424 HB3 -0.03 0.06 0.22 -0.04 3.93 4.14 2zv9A1 ASN 425 H 0.24 0.32 -0.17 -0.55 8.53 8.37 2zv9A1 ASN 425 HA 0.35 0.01 0.57 -0.75 4.76 4.93 2zv9A1 ASN 425 HB2 0.37 0.26 0.25 -0.04 2.88 3.72 2zv9A1 ASN 425 HB3 0.43 0.01 0.01 -0.04 2.79 3.20 2zv9A1 ASN 425 HD21 0.26 -0.82 0.11 -0.04 7.03 6.54 2zv9A1 ASN 425 HD22 0.30 0.17 0.05 -0.04 7.74 8.22 2zv9A1 VAL 426 H 0.20 0.31 -0.24 -0.55 8.24 7.95 2zv9A1 VAL 426 HA -0.10 -0.04 0.41 -0.75 4.13 3.65 2zv9A1 VAL 426 HB -0.01 0.22 0.21 -0.04 2.12 2.50 2zv9A1 VAL 426 HG13 -0.14 0.02 -0.08 -0.04 0.97 0.73 2zv9A1 VAL 426 HG23 -0.75 0.08 -0.01 -0.04 0.95 0.23 2zv9A1 TRP 427 H 0.42 0.30 -0.12 -0.55 7.97 8.02 2zv9A1 TRP 427 HA 0.37 0.32 0.50 -0.75 4.62 5.05 2zv9A1 TRP 427 HB2 0.16 0.03 0.23 -0.04 3.23 3.62 2zv9A1 TRP 427 HB3 0.18 0.11 0.25 -0.04 3.23 3.73 2zv9A1 TRP 427 HD1 0.18 0.17 -0.57 -0.04 7.22 6.96 2zv9A1 TRP 427 HE1 -0.10 0.05 -0.27 -0.04 10.20 9.83 2zv9A1 TRP 427 HE3 0.16 0.10 0.04 -0.04 7.59 7.86 2zv9A1 TRP 427 HZ2 -0.22 0.01 -0.00 -0.04 7.44 7.19 2zv9A1 TRP 427 HZ3 0.10 0.16 -0.21 -0.04 7.13 7.15 2zv9A1 TRP 427 HH2 -0.04 0.04 0.03 -0.04 7.19 7.18 2zv9A1 SER 428 H 0.56 0.30 -0.13 -0.55 8.46 8.64 2zv9A1 SER 428 HA 0.60 0.14 0.47 -0.75 4.49 4.95 2zv9A1 SER 428 HB2 0.41 -0.02 0.18 -0.04 3.95 4.48 2zv9A1 SER 428 HB3 0.46 0.09 0.17 -0.04 3.93 4.61 2zv9A1 PHE 429 H 0.52 0.51 -0.27 -0.55 8.34 8.55 2zv9A1 PHE 429 HA 0.23 -0.06 0.41 -0.75 4.62 4.45 2zv9A1 PHE 429 HB2 0.48 -0.04 0.06 -0.04 3.15 3.61 2zv9A1 PHE 429 HB3 0.20 0.23 0.16 -0.04 3.06 3.61 2zv9A1 PHE 429 HD2 0.08 0.03 -0.13 -0.04 7.28 7.22 2zv9A1 PHE 429 HE2 0.03 -0.01 -0.09 -0.04 7.38 7.27 2zv9A1 PHE 429 HZ 0.04 0.10 -0.09 -0.04 7.32 7.33 2zv9A1 GLY 430 H 0.23 0.62 -0.08 -0.55 8.43 8.65 2zv9A1 GLY 430 HA2 -0.28 -0.04 0.45 -0.51 4.01 3.63 2zv9A1 GLY 430 HA3 -0.30 0.17 0.33 -0.51 4.01 3.70 2zv9A1 ILE 431 H 0.35 0.47 -0.17 -0.55 8.25 8.35 2zv9A1 ILE 431 HA 0.24 0.02 0.57 -0.75 4.18 4.25 2zv9A1 ILE 431 HB 0.24 0.19 0.21 -0.04 1.89 2.48 2zv9A1 ILE 431 HG12 0.09 0.13 0.04 -0.04 1.49 1.71 2zv9A1 ILE 431 HG13 0.17 0.05 0.03 -0.04 1.21 1.42 2zv9A1 ILE 431 HG23 -0.65 -0.02 -0.02 -0.04 0.93 0.21 2zv9A1 ILE 431 HD13 -0.54 -0.01 0.01 -0.04 0.88 0.29 2zv9A1 LEU 432 H 0.23 0.59 -0.07 -0.55 8.37 8.57 2zv9A1 LEU 432 HA 0.26 -0.11 0.49 -0.75 4.35 4.23 2zv9A1 LEU 432 HB2 0.23 0.01 0.04 -0.04 1.64 1.89 2zv9A1 LEU 432 HB3 -0.02 0.21 0.17 -0.04 1.64 1.96 2zv9A1 LEU 432 HG -0.09 0.07 -0.17 -0.04 1.64 1.41 2zv9A1 LEU 432 HD13 0.04 -0.08 -0.01 -0.04 0.93 0.84 2zv9A1 LEU 432 HD23 0.10 -0.03 -0.21 -0.04 0.89 0.70 2zv9A1 LEU 433 H -0.19 0.50 -0.32 -0.55 8.37 7.81 2zv9A1 LEU 433 HA -0.21 -0.01 0.52 -0.75 4.35 3.90 2zv9A1 LEU 433 HB2 -0.28 0.18 0.20 -0.04 1.64 1.71 2zv9A1 LEU 433 HB3 -0.18 -0.03 -0.06 -0.04 1.64 1.33 2zv9A1 LEU 433 HG -0.24 -0.06 0.01 -0.04 1.64 1.31 2zv9A1 LEU 433 HD13 -0.83 0.02 -0.07 -0.04 0.93 0.00 2zv9A1 LEU 433 HD23 -0.22 0.00 -0.08 -0.04 0.89 0.55 2zv9A1 TYR 434 H 0.16 0.46 -0.12 -0.55 8.29 8.24 2zv9A1 TYR 434 HA -0.00 -0.01 0.43 -0.75 4.56 4.23 2zv9A1 TYR 434 HB2 0.14 -0.01 0.12 -0.04 3.06 3.27 2zv9A1 TYR 434 HB3 0.02 0.23 0.24 -0.04 2.98 3.43 2zv9A1 TYR 434 HD2 -0.03 0.02 -0.12 -0.04 7.15 6.98 2zv9A1 TYR 434 HE2 -0.07 0.08 -0.43 -0.04 6.85 6.38 2zv9A1 GLU 435 H 0.19 0.53 -0.14 -0.55 8.60 8.64 2zv9A1 GLU 435 HA -0.05 0.09 0.34 -0.75 4.29 3.92 2zv9A1 GLU 435 HB2 0.17 0.11 0.18 -0.04 2.09 2.51 2zv9A1 GLU 435 HB3 0.12 -0.10 -0.05 -0.04 1.99 1.92 2zv9A1 GLU 435 HG2 0.30 0.19 -0.03 -0.04 2.34 2.76 2zv9A1 GLU 435 HG3 0.36 0.12 -0.01 -0.04 2.34 2.77 2zv9A1 ILE 436 H -0.05 0.44 -0.33 -0.55 8.25 7.76 2zv9A1 ILE 436 HA -0.08 -0.00 0.42 -0.75 4.18 3.76 2zv9A1 ILE 436 HB -0.10 0.11 0.22 -0.04 1.89 2.08 2zv9A1 ILE 436 HG12 0.01 -0.04 -0.01 -0.04 1.49 1.41 2zv9A1 ILE 436 HG13 -0.02 0.01 0.01 -0.04 1.21 1.16 2zv9A1 ILE 436 HG23 -0.06 0.02 -0.13 -0.04 0.93 0.72 2zv9A1 ILE 436 HD13 -0.03 -0.01 -0.10 -0.04 0.88 0.70 2zv9A1 VAL 437 H -0.16 0.63 0.02 -0.55 8.24 8.19 2zv9A1 VAL 437 HA -0.23 -0.02 0.34 -0.75 4.13 3.47 2zv9A1 VAL 437 HB -0.13 0.13 0.17 -0.04 2.12 2.24 2zv9A1 VAL 437 HG13 -0.09 0.01 -0.20 -0.04 0.97 0.65 2zv9A1 VAL 437 HG23 -0.09 -0.04 0.04 -0.04 0.95 0.82 2zv9A1 THR 438 H -0.29 0.40 -0.37 -0.55 8.28 7.48 2zv9A1 THR 438 HA -0.06 0.13 0.35 -0.75 4.39 4.05 2zv9A1 THR 438 HB -0.19 -0.05 0.05 -0.04 4.32 4.08 2zv9A1 THR 438 HG23 -0.53 0.01 -0.05 -0.04 1.22 0.60 2zv9A1 TYR 439 H -0.29 0.39 -0.52 -0.55 8.29 7.32 2zv9A1 TYR 439 HA -0.01 0.02 0.33 -0.75 4.56 4.15 2zv9A1 TYR 439 HB2 -0.04 0.10 0.24 -0.04 3.06 3.31 2zv9A1 TYR 439 HB3 -0.03 0.17 0.13 -0.04 2.98 3.21 2zv9A1 TYR 439 HD2 -0.03 0.03 -0.14 -0.04 7.15 6.96 2zv9A1 TYR 439 HE2 -0.01 -0.01 0.09 -0.04 6.85 6.88 2zv9A1 GLY 440 H -0.02 0.78 0.13 -0.55 8.43 8.78 2zv9A1 GLY 440 HA2 0.07 -0.11 0.23 -0.51 4.01 3.68 2zv9A1 GLY 440 HA3 0.07 0.05 0.13 -0.51 4.01 3.74 2zv9A1 LYS 441 H -0.04 0.08 -0.32 -0.55 8.42 7.59 2zv9A1 LYS 441 HA 0.07 0.07 0.56 -0.75 4.32 4.27 2zv9A1 LYS 441 HB2 -0.14 -0.04 -0.07 -0.04 1.87 1.58 2zv9A1 LYS 441 HB3 0.08 0.03 -0.04 -0.04 1.79 1.82 2zv9A1 LYS 441 HG2 0.03 -0.03 -0.05 -0.04 1.46 1.37 2zv9A1 LYS 441 HG3 -0.00 0.30 -0.16 -0.04 1.46 1.56 2zv9A1 LYS 441 HD2 -0.03 -0.03 -0.02 -0.04 1.69 1.57 2zv9A1 LYS 441 HD3 0.04 -0.07 -0.01 -0.04 1.68 1.59 2zv9A1 LYS 441 HE2 0.01 -0.09 0.01 -0.04 2.99 2.88 2zv9A1 LYS 441 HE3 0.02 -0.05 0.00 -0.04 2.99 2.91 2zv9A1 ILE 442 H 0.12 0.07 0.10 -0.55 8.25 7.99 2zv9A1 ILE 442 HA 0.18 0.05 0.47 -0.75 4.18 4.13 2zv9A1 ILE 442 HB 0.12 -0.03 0.10 -0.04 1.89 2.04 2zv9A1 ILE 442 HG12 0.10 -0.05 -0.03 -0.04 1.49 1.47 2zv9A1 ILE 442 HG13 0.05 0.18 -0.02 -0.04 1.21 1.39 2zv9A1 ILE 442 HG23 0.07 0.01 -0.11 -0.04 0.93 0.86 2zv9A1 ILE 442 HD13 0.28 -0.03 -0.00 -0.04 0.88 1.09 2zv9A1 PRO 443 HA -0.74 0.05 0.47 -0.51 4.44 3.72 2zv9A1 PRO 443 HB2 -0.41 -0.01 -0.06 -0.04 2.28 1.76 2zv9A1 PRO 443 HB3 -0.89 0.06 0.08 -0.04 2.02 1.23 2zv9A1 PRO 443 HG2 -1.96 -0.02 -0.05 -0.04 2.03 -0.04 2zv9A1 PRO 443 HG3 -0.58 0.07 0.01 -0.04 2.03 1.48 2zv9A1 PRO 443 HD2 -0.35 0.01 0.12 -0.04 3.68 3.43 2zv9A1 PRO 443 HD3 0.00 0.17 0.17 -0.04 3.65 3.95 2zv9A1 TYR 444 H -0.85 0.09 0.09 -0.55 8.29 7.07 2zv9A1 TYR 444 HA -0.11 0.04 0.31 -0.75 4.56 4.04 2zv9A1 TYR 444 HB2 -0.14 0.08 -0.06 -0.04 3.06 2.90 2zv9A1 TYR 444 HB3 -0.12 -0.03 0.01 -0.04 2.98 2.80 2zv9A1 TYR 444 HD2 -0.09 -0.01 -0.19 -0.04 7.15 6.83 2zv9A1 TYR 444 HE2 -0.14 0.16 -0.02 -0.04 6.85 6.81 2zv9A1 PRO 445 HA 0.04 0.04 0.24 -0.51 4.44 4.26 2zv9A1 PRO 445 HB2 0.05 -0.01 0.00 -0.04 2.28 2.28 2zv9A1 PRO 445 HB3 0.06 0.00 0.04 -0.04 2.02 2.08 2zv9A1 PRO 445 HG2 0.10 0.01 0.03 -0.04 2.03 2.12 2zv9A1 PRO 445 HG3 0.12 0.24 -0.01 -0.04 2.03 2.34 2zv9A1 PRO 445 HD2 0.02 0.07 0.11 -0.04 3.68 3.84 2zv9A1 PRO 445 HD3 -0.08 0.01 0.07 -0.04 3.65 3.62 2zv9A1 GLY 446 H 0.03 0.12 0.14 -0.55 8.43 8.18 2zv9A1 GLY 446 HA2 0.01 -0.04 0.33 -0.51 4.01 3.80 2zv9A1 GLY 446 HA3 0.01 0.12 0.49 -0.51 4.01 4.11 2zv9A1 ARG 447 H 0.02 0.58 -0.36 -0.55 8.46 8.14 2zv9A1 ARG 447 HA -0.04 0.06 0.89 -0.75 4.34 4.49 2zv9A1 ARG 447 HB2 -0.01 0.22 0.00 -0.04 1.90 2.07 2zv9A1 ARG 447 HB3 -0.12 -0.02 -0.12 -0.04 1.80 1.50 2zv9A1 ARG 447 HG2 -0.11 -0.05 -0.08 -0.04 1.67 1.40 2zv9A1 ARG 447 HG3 -0.07 0.08 -0.21 -0.04 1.67 1.43 2zv9A1 ARG 447 HD2 -0.22 0.03 -0.14 -0.04 3.22 2.85 2zv9A1 ARG 447 HD3 -0.25 -0.09 -0.27 -0.04 3.22 2.56 2zv9A1 THR 448 H -0.05 0.07 0.14 -0.55 8.28 7.90 2zv9A1 THR 448 HA -0.01 0.20 0.64 -0.75 4.39 4.46 2zv9A1 THR 448 HB -0.02 -0.05 0.14 -0.04 4.32 4.34 2zv9A1 THR 448 HG23 -0.01 0.05 0.04 -0.04 1.22 1.25 2zv9A1 ASN 449 H -0.01 0.18 0.12 -0.55 8.53 8.28 2zv9A1 ASN 449 HA -0.05 0.12 0.35 -0.75 4.76 4.43 2zv9A1 ASN 449 HB2 -0.02 -0.04 0.11 -0.04 2.88 2.89 2zv9A1 ASN 449 HB3 -0.02 0.06 -0.02 -0.04 2.79 2.76 2zv9A1 ASN 449 HD21 0.05 0.02 0.04 -0.04 7.03 7.11 2zv9A1 ASN 449 HD22 -0.00 0.04 0.04 -0.04 7.74 7.77 2zv9A1 ALA 450 H -0.04 0.04 -0.24 -0.55 8.40 7.62 2zv9A1 ALA 450 HA -0.06 0.11 0.34 -0.75 4.34 3.99 2zv9A1 ALA 450 HB3 -0.04 0.01 0.05 -0.04 1.41 1.38 2zv9A1 ASP 451 H -0.07 0.02 -0.11 -0.55 8.40 7.69 2zv9A1 ASP 451 HA -0.10 0.01 0.37 -0.75 4.63 4.16 2zv9A1 ASP 451 HB2 -0.11 0.16 0.12 -0.04 2.71 2.84 2zv9A1 ASP 451 HB3 -0.14 0.04 0.00 -0.04 2.70 2.57 2zv9A1 VAL 452 H -0.16 0.38 -0.69 -0.55 8.24 7.22 2zv9A1 VAL 452 HA -0.36 0.01 -0.12 -0.75 4.13 2.90 2zv9A1 VAL 452 HB -0.24 0.16 0.01 -0.04 2.12 2.01 2zv9A1 VAL 452 HG13 -0.56 -0.01 -0.10 -0.04 0.97 0.26 2zv9A1 VAL 452 HG23 -0.46 0.00 -0.16 -0.04 0.95 0.29 2zv9A1 MET 453 H -0.14 0.27 -0.14 -0.55 8.47 7.91 2zv9A1 MET 453 HA -0.13 0.10 0.08 -0.75 4.52 3.81 2zv9A1 MET 453 HB2 -0.13 0.03 -0.21 -0.04 2.15 1.80 2zv9A1 MET 453 HB3 -0.11 0.34 0.03 -0.04 2.03 2.25 2zv9A1 MET 453 HG2 -0.08 -0.02 -0.36 -0.04 2.63 2.13 2zv9A1 MET 453 HG3 -0.09 -0.02 -0.08 -0.04 2.56 2.32 2zv9A1 MET 453 HE3 -0.03 -0.00 -0.09 -0.04 2.10 1.93 2zv9A1 SER 454 H -0.08 0.36 0.11 -0.55 8.46 8.30 2zv9A1 SER 454 HA -0.06 0.11 0.41 -0.75 4.49 4.19 2zv9A1 SER 454 HB2 -0.07 0.00 0.13 -0.04 3.95 3.98 2zv9A1 SER 454 HB3 -0.09 0.16 0.26 -0.04 3.93 4.21 2zv9A1 ALA 455 H -0.14 0.36 0.05 -0.55 8.40 8.12 2zv9A1 ALA 455 HA -0.06 0.05 -0.05 -0.75 4.34 3.52 2zv9A1 ALA 455 HB3 -0.27 0.03 -0.10 -0.04 1.41 1.03 2zv9A1 LEU 456 H -0.09 0.22 -0.05 -0.55 8.37 7.90 2zv9A1 LEU 456 HA 0.08 0.10 0.67 -0.75 4.35 4.45 2zv9A1 LEU 456 HB2 -0.10 -0.03 0.18 -0.04 1.64 1.65 2zv9A1 LEU 456 HB3 -0.08 -0.05 0.07 -0.04 1.64 1.54 2zv9A1 LEU 456 HG -0.14 0.59 0.29 -0.04 1.64 2.34 2zv9A1 LEU 456 HD13 -0.15 -0.04 -0.01 -0.04 0.93 0.68 2zv9A1 LEU 456 HD23 0.19 -0.00 0.07 -0.04 0.89 1.11 2zv9A1 SER 457 H -0.05 0.32 -0.26 -0.55 8.46 7.92 2zv9A1 SER 457 HA -0.02 0.00 0.43 -0.75 4.49 4.14 2zv9A1 SER 457 HB2 -0.04 -0.08 0.15 -0.04 3.95 3.94 2zv9A1 SER 457 HB3 -0.07 0.06 0.17 -0.04 3.93 4.06 2zv9A1 GLN 458 H 0.02 0.22 -0.89 -0.55 8.47 7.26 2zv9A1 GLN 458 HA 0.02 0.13 0.76 -0.75 4.36 4.52 2zv9A1 GLN 458 HB2 0.03 0.08 -0.03 -0.04 2.15 2.19 2zv9A1 GLN 458 HB3 0.03 -0.05 0.09 -0.04 2.02 2.05 2zv9A1 GLN 458 HG2 -0.01 0.15 -0.26 -0.04 2.40 2.24 2zv9A1 GLN 458 HG3 -0.01 -0.08 -0.13 -0.04 2.39 2.13 2zv9A1 GLN 458 HE21 -0.01 -0.03 -0.10 -0.04 6.97 6.80 2zv9A1 GLN 458 HE22 -0.02 0.00 -0.21 -0.04 7.69 7.43 2zv9A1 GLY 459 H 0.06 0.53 -0.15 -0.55 8.43 8.32 2zv9A1 GLY 459 HA2 0.09 0.03 0.31 -0.51 4.01 3.93 2zv9A1 GLY 459 HA3 0.07 -0.00 0.40 -0.51 4.01 3.97 2zv9A1 TYR 460 H 0.18 0.28 0.10 -0.55 8.29 8.29 2zv9A1 TYR 460 HA 0.04 0.10 0.71 -0.75 4.56 4.65 2zv9A1 TYR 460 HB2 0.00 -0.00 -0.07 -0.04 3.06 2.95 2zv9A1 TYR 460 HB3 -0.01 -0.06 -0.29 -0.04 2.98 2.58 2zv9A1 TYR 460 HD2 0.03 -0.01 -0.23 -0.04 7.15 6.90 2zv9A1 TYR 460 HE2 0.16 -0.06 -0.15 -0.04 6.85 6.76 2zv9A1 ARG 461 H -0.51 0.23 0.16 -0.55 8.46 7.79 2zv9A1 ARG 461 HA -0.28 0.15 0.67 -0.75 4.34 4.12 2zv9A1 ARG 461 HB2 -0.07 -0.04 -0.04 -0.04 1.90 1.71 2zv9A1 ARG 461 HB3 0.02 0.04 -0.01 -0.04 1.80 1.81 2zv9A1 ARG 461 HG2 0.02 0.00 -0.35 -0.04 1.67 1.31 2zv9A1 ARG 461 HG3 0.10 -0.02 -0.08 -0.04 1.67 1.63 2zv9A1 ARG 461 HD2 -0.17 -0.05 0.03 -0.04 3.22 2.99 2zv9A1 ARG 461 HD3 -0.01 0.21 0.10 -0.04 3.22 3.49 2zv9A1 MET 462 H -0.47 0.12 0.04 -0.55 8.47 7.62 2zv9A1 MET 462 HA -0.15 0.08 0.51 -0.75 4.52 4.21 2zv9A1 MET 462 HB2 -0.43 -0.03 0.11 -0.04 2.15 1.75 2zv9A1 MET 462 HB3 -0.13 0.12 -0.05 -0.04 2.03 1.93 2zv9A1 MET 462 HG2 -0.24 0.04 0.06 -0.04 2.63 2.44 2zv9A1 MET 462 HG3 -0.86 0.00 0.04 -0.04 2.56 1.70 2zv9A1 MET 462 HE3 -1.12 0.03 0.03 -0.04 2.10 1.00 2zv9A1 PRO 463 HA 0.02 0.01 0.44 -0.51 4.44 4.41 2zv9A1 PRO 463 HB2 -0.03 0.09 -0.03 -0.04 2.28 2.28 2zv9A1 PRO 463 HB3 -0.00 0.00 0.11 -0.04 2.02 2.09 2zv9A1 PRO 463 HG2 0.03 0.03 0.03 -0.04 2.03 2.08 2zv9A1 PRO 463 HG3 0.06 0.01 0.07 -0.04 2.03 2.13 2zv9A1 PRO 463 HD2 0.05 0.01 0.23 -0.04 3.68 3.93 2zv9A1 PRO 463 HD3 -0.03 0.21 0.24 -0.04 3.65 4.03 2zv9A1 ARG 464 H -0.32 0.05 0.12 -0.55 8.46 7.76 2zv9A1 ARG 464 HA -0.73 -0.00 0.39 -0.75 4.34 3.25 2zv9A1 ARG 464 HB2 -1.16 -0.01 0.13 -0.04 1.90 0.81 2zv9A1 ARG 464 HB3 -0.37 -0.03 0.05 -0.04 1.80 1.41 2zv9A1 ARG 464 HG2 -0.30 0.16 -0.13 -0.04 1.67 1.35 2zv9A1 ARG 464 HG3 -0.81 -0.04 0.02 -0.04 1.67 0.80 2zv9A1 ARG 464 HD2 -0.26 -0.03 -0.00 -0.04 3.22 2.88 2zv9A1 ARG 464 HD3 -0.20 -0.03 -0.04 -0.04 3.22 2.92 2zv9A1 MET 465 H -0.09 0.06 0.15 -0.55 8.47 8.05 2zv9A1 MET 465 HA -0.00 0.12 0.58 -0.75 4.52 4.46 2zv9A1 MET 465 HB2 0.02 0.10 -0.01 -0.04 2.15 2.22 2zv9A1 MET 465 HB3 0.13 0.05 0.02 -0.04 2.03 2.19 2zv9A1 MET 465 HG2 0.02 -0.15 0.13 -0.04 2.63 2.59 2zv9A1 MET 465 HG3 0.01 0.08 -0.11 -0.04 2.56 2.49 2zv9A1 MET 465 HE3 0.29 -0.02 -0.10 -0.04 2.10 2.23 2zv9A1 GLU 466 H -0.00 0.12 0.13 -0.55 8.60 8.30 2zv9A1 GLU 466 HA -0.02 -0.01 0.47 -0.75 4.29 3.98 2zv9A1 GLU 466 HB2 0.00 0.04 0.11 -0.04 2.09 2.20 2zv9A1 GLU 466 HB3 -0.00 0.00 0.04 -0.04 1.99 1.99 2zv9A1 GLU 466 HG2 -0.01 -0.02 0.05 -0.04 2.34 2.32 2zv9A1 GLU 466 HG3 -0.01 0.01 0.05 -0.04 2.34 2.35 2zv9A1 ASN 467 H -0.00 0.07 0.15 -0.55 8.53 8.20 2zv9A1 ASN 467 HA 0.01 -0.06 0.30 -0.75 4.76 4.26 2zv9A1 ASN 467 HB2 0.03 0.28 0.02 -0.04 2.88 3.17 2zv9A1 ASN 467 HB3 0.05 -0.00 0.22 -0.04 2.79 3.02 2zv9A1 ASN 467 HD21 0.01 -0.03 -0.06 -0.04 7.03 6.91 2zv9A1 ASN 467 HD22 0.03 0.12 -0.16 -0.04 7.74 7.68 2zv9A1 CYS 468 H -0.01 0.24 -0.18 -0.55 8.50 8.01 2zv9A1 CYS 468 HA 0.01 0.19 0.83 -0.75 4.58 4.85 2zv9A1 CYS 468 HB2 -0.01 0.07 -0.10 -0.04 2.97 2.89 2zv9A1 CYS 468 HB3 -0.01 0.22 0.03 -0.04 2.97 3.17 2zv9A1 PRO 469 HA 0.03 0.08 0.45 -0.51 4.44 4.48 2zv9A1 PRO 469 HB2 0.09 -0.11 0.02 -0.04 2.28 2.24 2zv9A1 PRO 469 HB3 0.06 0.10 0.11 -0.04 2.02 2.25 2zv9A1 PRO 469 HG2 0.19 -0.09 0.10 -0.04 2.03 2.19 2zv9A1 PRO 469 HG3 0.17 0.11 0.08 -0.04 2.03 2.35 2zv9A1 PRO 469 HD2 0.04 0.16 0.23 -0.04 3.68 4.07 2zv9A1 PRO 469 HD3 0.04 0.22 0.07 -0.04 3.65 3.94 2zv9A1 ASP 470 H 0.02 0.18 0.19 -0.55 8.40 8.25 2zv9A1 ASP 470 HA 0.09 0.12 0.37 -0.75 4.63 4.46 2zv9A1 ASP 470 HB2 0.02 -0.02 0.13 -0.04 2.71 2.80 2zv9A1 ASP 470 HB3 0.05 0.06 0.07 -0.04 2.70 2.83 2zv9A1 GLU 471 H 0.03 0.10 -0.13 -0.55 8.60 8.05 2zv9A1 GLU 471 HA 0.03 0.07 0.30 -0.75 4.29 3.94 2zv9A1 GLU 471 HB2 -0.09 -0.02 0.05 -0.04 2.09 1.99 2zv9A1 GLU 471 HB3 -0.02 0.11 0.02 -0.04 1.99 2.06 2zv9A1 GLU 471 HG2 -0.23 0.10 0.04 -0.04 2.34 2.21 2zv9A1 GLU 471 HG3 -0.07 0.02 0.04 -0.04 2.34 2.29 2zv9A1 LEU 472 H 0.20 0.15 -0.35 -0.55 8.37 7.83 2zv9A1 LEU 472 HA 0.07 0.10 0.51 -0.75 4.35 4.28 2zv9A1 LEU 472 HB2 0.16 -0.06 0.09 -0.04 1.64 1.79 2zv9A1 LEU 472 HB3 0.06 0.11 0.04 -0.04 1.64 1.80 2zv9A1 LEU 472 HG -0.08 0.03 0.01 -0.04 1.64 1.56 2zv9A1 LEU 472 HD13 -0.10 -0.01 -0.12 -0.04 0.93 0.65 2zv9A1 LEU 472 HD23 -0.34 0.00 0.01 -0.04 0.89 0.52 2zv9A1 TYR 473 H 0.15 0.54 -0.08 -0.55 8.29 8.35 2zv9A1 TYR 473 HA -0.14 0.02 0.42 -0.75 4.56 4.11 2zv9A1 TYR 473 HB2 -0.03 0.03 0.03 -0.04 3.06 3.05 2zv9A1 TYR 473 HB3 -0.03 0.10 0.11 -0.04 2.98 3.12 2zv9A1 TYR 473 HD2 -0.03 0.01 -0.03 -0.04 7.15 7.07 2zv9A1 TYR 473 HE2 0.07 0.12 -0.08 -0.04 6.85 6.92 2zv9A1 ASP 474 H 0.01 0.48 -0.28 -0.55 8.40 8.06 2zv9A1 ASP 474 HA -0.24 0.02 0.44 -0.75 4.63 4.10 2zv9A1 ASP 474 HB2 -0.01 0.18 0.11 -0.04 2.71 2.95 2zv9A1 ASP 474 HB3 -0.05 -0.03 -0.02 -0.04 2.70 2.57 2zv9A1 ILE 475 H -0.09 0.37 -0.24 -0.55 8.25 7.75 2zv9A1 ILE 475 HA -0.09 0.02 0.54 -0.75 4.18 3.89 2zv9A1 ILE 475 HB -0.11 0.17 0.17 -0.04 1.89 2.08 2zv9A1 ILE 475 HG12 0.00 -0.07 0.00 -0.04 1.49 1.38 2zv9A1 ILE 475 HG13 0.02 0.19 0.14 -0.04 1.21 1.52 2zv9A1 ILE 475 HG23 -0.03 -0.02 -0.07 -0.04 0.93 0.77 2zv9A1 ILE 475 HD13 0.02 -0.02 -0.06 -0.04 0.88 0.77 2zv9A1 MET 476 H -0.35 0.49 -0.07 -0.55 8.47 8.00 2zv9A1 MET 476 HA -0.81 -0.00 0.48 -0.75 4.52 3.43 2zv9A1 MET 476 HB2 -0.65 0.11 0.19 -0.04 2.15 1.75 2zv9A1 MET 476 HB3 -1.59 -0.00 -0.03 -0.04 2.03 0.36 2zv9A1 MET 476 HG2 -0.38 0.04 0.06 -0.04 2.63 2.31 2zv9A1 MET 476 HG3 -0.26 0.07 -0.01 -0.04 2.56 2.31 2zv9A1 MET 476 HE3 -0.01 -0.02 -0.26 -0.04 2.10 1.77 2zv9A1 LYS 477 H -0.72 0.72 -0.09 -0.55 8.42 7.78 2zv9A1 LYS 477 HA -0.49 0.02 0.29 -0.75 4.32 3.38 2zv9A1 MET 478 H -0.33 0.41 -0.40 -0.55 8.47 7.60 2zv9A1 MET 478 HA -0.13 0.01 0.43 -0.75 4.52 4.07 2zv9A1 MET 478 HB2 -0.14 0.18 0.19 -0.04 2.15 2.33 2zv9A1 MET 478 HB3 -0.09 -0.07 0.04 -0.04 2.03 1.87 2zv9A1 MET 478 HG2 -0.07 -0.09 0.06 -0.04 2.63 2.49 2zv9A1 MET 478 HG3 -0.12 0.57 0.19 -0.04 2.56 3.17 2zv9A1 MET 478 HE3 0.04 -0.02 -0.00 -0.04 2.10 2.08 2zv9A1 CYS 479 H -0.40 0.45 -0.15 -0.55 8.50 7.84 2zv9A1 CYS 479 HA -0.09 -0.02 0.41 -0.75 4.58 4.13 2zv9A1 CYS 479 HB2 -0.68 0.12 0.12 -0.04 2.97 2.49 2zv9A1 CYS 479 HB3 -0.07 0.07 0.00 -0.04 2.97 2.93 2zv9A1 TRP 480 H -0.28 0.32 -0.72 -0.55 7.97 6.74 2zv9A1 TRP 480 HA -0.74 0.15 0.85 -0.75 4.62 4.12 2zv9A1 TRP 480 HB2 -0.40 0.05 0.02 -0.04 3.23 2.86 2zv9A1 TRP 480 HB3 -0.81 -0.06 0.11 -0.04 3.23 2.43 2zv9A1 TRP 480 HD1 -1.41 0.13 -0.31 -0.04 7.22 5.58 2zv9A1 TRP 480 HE1 -0.54 -0.07 -0.10 -0.04 10.20 9.45 2zv9A1 TRP 480 HE3 -0.29 -0.00 -0.10 -0.04 7.59 7.16 2zv9A1 TRP 480 HZ2 -0.25 0.04 -0.42 -0.04 7.44 6.77 2zv9A1 TRP 480 HZ3 -0.08 0.13 -0.08 -0.04 7.13 7.05 2zv9A1 TRP 480 HH2 -0.13 -0.03 -0.06 -0.04 7.19 6.93 2zv9A1 LYS 481 H 0.07 0.36 -0.27 -0.55 8.42 8.02 2zv9A1 LYS 481 HA 0.11 -0.04 0.41 -0.75 4.32 4.05 2zv9A1 LYS 481 HB2 0.06 0.06 -0.12 -0.04 1.87 1.83 2zv9A1 LYS 481 HB3 0.05 -0.17 -0.04 -0.04 1.79 1.60 2zv9A1 LYS 481 HG2 -0.01 0.00 0.07 -0.04 1.46 1.49 2zv9A1 LYS 481 HG3 -0.03 0.34 0.20 -0.04 1.46 1.93 2zv9A1 LYS 481 HD2 -0.04 -0.02 0.07 -0.04 1.69 1.66 2zv9A1 LYS 481 HD3 -0.01 -0.01 0.03 -0.04 1.68 1.65 2zv9A1 LYS 481 HE2 0.02 -0.07 0.03 -0.04 2.99 2.92 2zv9A1 LYS 481 HE3 -0.02 0.01 -0.01 -0.04 2.99 2.93 2zv9A1 GLU 482 H 0.14 0.09 0.16 -0.55 8.60 8.45 2zv9A1 GLU 482 HA 0.23 0.09 0.32 -0.75 4.29 4.18 2zv9A1 GLU 482 HB2 0.12 0.08 0.15 -0.04 2.09 2.40 2zv9A1 GLU 482 HB3 0.08 -0.11 0.14 -0.04 1.99 2.06 2zv9A1 GLU 482 HG2 0.06 -0.00 -0.01 -0.04 2.34 2.34 2zv9A1 GLU 482 HG3 0.06 -0.07 -0.18 -0.04 2.34 2.11 2zv9A1 LYS 483 H 0.07 0.07 -0.14 -0.55 8.42 7.86 2zv9A1 LYS 483 HA 0.03 0.02 0.51 -0.75 4.32 4.13 2zv9A1 LYS 483 HB2 0.02 0.02 0.08 -0.04 1.87 1.96 2zv9A1 LYS 483 HB3 0.01 -0.06 0.02 -0.04 1.79 1.72 2zv9A1 LYS 483 HG2 0.03 -0.02 0.03 -0.04 1.46 1.46 2zv9A1 LYS 483 HG3 0.01 0.04 0.02 -0.04 1.46 1.49 2zv9A1 LYS 483 HD2 0.00 -0.01 0.01 -0.04 1.69 1.65 2zv9A1 LYS 483 HD3 0.01 0.04 -0.02 -0.04 1.68 1.67 2zv9A1 LYS 483 HE2 -0.01 -0.04 -0.00 -0.04 2.99 2.90 2zv9A1 LYS 483 HE3 -0.02 0.01 -0.00 -0.04 2.99 2.95 2zv9A1 ALA 484 H 0.03 0.14 0.22 -0.55 8.40 8.24 2zv9A1 ALA 484 HA 0.09 0.23 0.33 -0.75 4.34 4.23 2zv9A1 ALA 484 HB3 0.02 -0.03 0.07 -0.04 1.41 1.43 2zv9A1 GLU 485 H 0.01 0.03 -0.20 -0.55 8.60 7.89 2zv9A1 GLU 485 HA -0.00 0.08 0.39 -0.75 4.29 4.00 2zv9A1 GLU 485 HB2 -0.01 0.05 0.03 -0.04 2.09 2.12 2zv9A1 GLU 485 HB3 -0.01 -0.02 0.07 -0.04 1.99 1.99 2zv9A1 GLU 485 HG2 -0.00 -0.16 -0.05 -0.04 2.34 2.09 2zv9A1 GLU 485 HG3 -0.01 0.07 -0.15 -0.04 2.34 2.21 2zv9A1 GLU 486 H 0.01 0.34 -0.58 -0.55 8.60 7.83 2zv9A1 GLU 486 HA -0.03 0.10 0.54 -0.75 4.29 4.15 2zv9A1 GLU 486 HB2 0.01 0.10 0.03 -0.04 2.09 2.19 2zv9A1 GLU 486 HB3 -0.01 -0.02 0.13 -0.04 1.99 2.05 2zv9A1 GLU 486 HG2 -0.02 0.04 -0.10 -0.04 2.34 2.21 2zv9A1 GLU 486 HG3 -0.00 -0.13 -0.09 -0.04 2.34 2.07 2zv9A1 ARG 487 H 0.00 0.28 -0.39 -0.55 8.46 7.79 2zv9A1 ARG 487 HA -0.04 0.23 0.77 -0.75 4.34 4.55 2zv9A1 ARG 487 HB2 0.02 -0.03 0.12 -0.04 1.90 1.97 2zv9A1 ARG 487 HB3 0.00 -0.03 0.09 -0.04 1.80 1.83 2zv9A1 ARG 487 HG2 0.08 -0.00 -0.11 -0.04 1.67 1.60 2zv9A1 ARG 487 HG3 0.10 -0.03 -0.03 -0.04 1.67 1.67 2zv9A1 ARG 487 HD2 0.20 0.06 0.00 -0.04 3.22 3.45 2zv9A1 ARG 487 HD3 0.36 0.07 -0.25 -0.04 3.22 3.35 2zv9A1 PRO 488 HA -0.17 0.07 0.24 -0.51 4.44 4.06 2zv9A1 PRO 488 HB2 0.00 0.07 -0.02 -0.04 2.28 2.29 2zv9A1 PRO 488 HB3 -0.16 -0.03 0.08 -0.04 2.02 1.87 2zv9A1 PRO 488 HG2 -0.02 0.02 -0.04 -0.04 2.03 1.95 2zv9A1 PRO 488 HG3 -0.07 0.06 0.01 -0.04 2.03 1.99 2zv9A1 PRO 488 HD2 -0.10 0.05 -0.00 -0.04 3.68 3.59 2zv9A1 PRO 488 HD3 -0.08 0.33 0.03 -0.04 3.65 3.89 2zv9A1 THR 489 H -0.05 0.04 0.19 -0.55 8.28 7.92 2zv9A1 THR 489 HA -0.09 0.26 0.82 -0.75 4.39 4.63 2zv9A1 THR 489 HB 0.04 -0.03 0.19 -0.04 4.32 4.48 2zv9A1 THR 489 HG23 -0.01 0.06 0.05 -0.04 1.22 1.28 2zv9A1 PHE 490 H 0.09 0.23 0.14 -0.55 8.34 8.25 2zv9A1 PHE 490 HA -0.14 0.13 0.48 -0.75 4.62 4.33 2zv9A1 PHE 490 HB2 -0.06 0.00 0.01 -0.04 3.15 3.06 2zv9A1 PHE 490 HB3 -0.13 0.19 -0.03 -0.04 3.06 3.04 2zv9A1 PHE 490 HD2 -0.31 -0.01 0.02 -0.04 7.28 6.94 2zv9A1 PHE 490 HE2 -0.40 0.02 -0.05 -0.04 7.38 6.91 2zv9A1 PHE 490 HZ 0.07 0.08 -0.39 -0.04 7.32 7.04 2zv9A1 ASP 491 H 0.10 0.05 -0.18 -0.55 8.40 7.82 2zv9A1 ASP 491 HA 0.06 0.17 0.58 -0.75 4.63 4.68 2zv9A1 ASP 491 HB2 0.07 0.02 0.12 -0.04 2.71 2.87 2zv9A1 ASP 491 HB3 0.07 0.01 0.01 -0.04 2.70 2.75 2zv9A1 TYR 492 H 0.14 0.06 -0.17 -0.55 8.29 7.77 2zv9A1 TYR 492 HA -0.01 0.08 0.46 -0.75 4.56 4.34 2zv9A1 TYR 492 HB2 -0.02 -0.03 0.13 -0.04 3.06 3.10 2zv9A1 TYR 492 HB3 -0.05 0.11 0.15 -0.04 2.98 3.15 2zv9A1 TYR 492 HD2 -0.03 0.02 -0.07 -0.04 7.15 7.02 2zv9A1 TYR 492 HE2 -0.03 0.03 -0.02 -0.04 6.85 6.80 2zv9A1 LEU 493 H 0.05 0.34 -0.26 -0.55 8.37 7.95 2zv9A1 LEU 493 HA -0.05 0.06 0.42 -0.75 4.35 4.03 2zv9A1 LEU 493 HB2 -0.08 0.05 0.11 -0.04 1.64 1.68 2zv9A1 LEU 493 HB3 -0.05 0.01 -0.04 -0.04 1.64 1.53 2zv9A1 LEU 493 HG -0.03 0.07 -0.02 -0.04 1.64 1.62 2zv9A1 LEU 493 HD13 -0.51 -0.02 -0.15 -0.04 0.93 0.20 2zv9A1 LEU 493 HD23 0.07 0.01 -0.05 -0.04 0.89 0.88 2zv9A1 GLN 494 H -0.00 0.45 -0.24 -0.55 8.47 8.12 2zv9A1 GLN 494 HA -0.01 0.03 0.39 -0.75 4.36 4.02 2zv9A1 GLN 494 HB2 0.01 0.09 -0.04 -0.04 2.15 2.17 2zv9A1 GLN 494 HB3 0.01 0.04 0.10 -0.04 2.02 2.13 2zv9A1 GLN 494 HG2 0.00 -0.04 -0.10 -0.04 2.40 2.22 2zv9A1 GLN 494 HG3 0.01 0.13 0.03 -0.04 2.39 2.52 2zv9A1 GLN 494 HE21 0.04 -0.02 -0.02 -0.04 6.97 6.93 2zv9A1 GLN 494 HE22 0.03 -0.01 -0.04 -0.04 7.69 7.62 2zv9A1 SER 495 H -0.05 0.50 -0.17 -0.55 8.46 8.19 2zv9A1 SER 495 HA -0.04 0.02 0.46 -0.75 4.49 4.18 2zv9A1 SER 495 HB2 -0.15 0.05 0.20 -0.04 3.95 4.02 2zv9A1 SER 495 HB3 -0.09 -0.02 -0.00 -0.04 3.93 3.77 2zv9A1 VAL 496 H -0.30 0.68 -0.01 -0.55 8.24 8.06 2zv9A1 VAL 496 HA -0.16 -0.01 0.28 -0.75 4.13 3.50 2zv9A1 VAL 496 HB -0.35 0.09 0.14 -0.04 2.12 1.96 2zv9A1 VAL 496 HG13 -0.05 -0.01 -0.10 -0.04 0.97 0.77 2zv9A1 VAL 496 HG23 -0.75 -0.02 0.05 -0.04 0.95 0.19 2zv9A1 LEU 497 H -0.09 0.47 -0.43 -0.55 8.37 7.78 2zv9A1 LEU 497 HA -0.20 0.04 0.45 -0.75 4.35 3.88 2zv9A1 LEU 497 HB2 -0.04 0.13 0.12 -0.04 1.64 1.80 2zv9A1 LEU 497 HB3 -0.10 -0.05 -0.08 -0.04 1.64 1.38 2zv9A1 LEU 497 HG -0.04 -0.00 -0.04 -0.04 1.64 1.51 2zv9A1 LEU 497 HD13 0.19 -0.03 -0.29 -0.04 0.93 0.76 2zv9A1 LEU 497 HD23 -0.24 -0.01 -0.02 -0.04 0.89 0.58 2zv9A1 ASP 498 H -0.07 0.57 -0.05 -0.55 8.40 8.31 2zv9A1 ASP 498 HA -0.08 -0.03 0.48 -0.75 4.63 4.25 2zv9A1 ASP 498 HB2 -0.03 0.16 0.17 -0.04 2.71 2.96 2zv9A1 ASP 498 HB3 0.00 -0.11 0.07 -0.04 2.70 2.62 2zv9A1 ASP 499 H -0.10 0.35 -0.65 -0.55 8.40 7.45 2zv9A1 ASP 499 HA -0.80 0.03 0.64 -0.75 4.63 3.74 2zv9A1 ASP 499 HB2 -0.05 0.12 0.17 -0.04 2.71 2.91 2zv9A1 ASP 499 HB3 -0.08 -0.07 0.07 -0.04 2.70 2.57 2zv9A1 PHE 500 H -0.45 0.13 -0.11 -0.55 8.34 7.36 2zv9A1 PHE 500 HA -0.16 0.15 0.68 -0.75 4.62 4.54 2zv9A1 PHE 500 HB2 -0.16 0.15 -0.03 -0.04 3.15 3.07 2zv9A1 PHE 500 HB3 -0.10 -0.10 -0.06 -0.04 3.06 2.77 2zv9A1 PHE 500 HD2 -0.10 0.12 -0.21 -0.04 7.28 7.05 2zv9A1 PHE 500 HE2 -0.06 -0.02 -0.05 -0.04 7.38 7.21 2zv9A1 PHE 500 HZ -0.05 -0.16 -0.31 -0.04 7.32 6.75 2zv9A1 TYR 501 H -0.29 0.13 0.09 -0.55 8.29 7.67 2zv9A1 TYR 501 HA 0.04 0.06 0.22 -0.75 4.56 4.13 2zv9A1 TYR 501 HB2 0.00 0.08 -0.20 -0.04 3.06 2.90 2zv9A1 TYR 501 HB3 0.01 0.00 0.04 -0.04 2.98 2.99 2zv9A1 TYR 501 HD2 0.01 -0.00 -0.02 -0.04 7.15 7.10 2zv9A1 TYR 501 HE2 0.01 -0.01 0.01 -0.04 6.85 6.82