============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. HIS 29 0.900 55.358 66.116 8.731 -99.200 -91.000 HIS 31 0.900 48.392 57.254 8.666 -99.200 -91.000 PHE 33 1.000 43.993 64.675 16.988 -99.200 -91.000 PHE 34 1.000 41.207 58.090 15.546 -99.200 -91.000 PHE 37 1.000 33.313 61.869 23.187 -99.200 -91.000 PHE 66 1.000 40.240 68.266 24.534 -99.200 -91.000 TYR 70 0.840 33.858 61.487 28.355 -99.200 -91.000 PHE 83 1.000 24.627 63.775 42.247 -99.200 -91.000 TYR 85 0.840 30.172 67.211 41.305 -99.200 -91.000 PHE 162 1.000 39.232 48.897 43.401 -99.200 -91.000 PHE 175 1.000 41.371 51.446 47.085 -99.200 -91.000 TYR 176 0.840 43.657 44.116 47.908 -99.200 -91.000 PHE 182 1.000 40.728 43.477 43.611 -99.200 -91.000 HIS 239 0.900 39.939 28.915 31.337 -99.200 -91.000 PHE 257 1.000 34.326 40.038 32.339 -99.200 -91.000 PHE 263 1.000 21.970 44.467 31.674 -99.200 -91.000 TYR 264 0.840 24.212 40.054 31.972 -99.200 -91.000 TYR 267 0.840 18.875 47.020 35.415 -99.200 -91.000 TYR 268 0.840 18.991 39.934 33.388 -99.200 -91.000 PHE 282 1.000 27.683 36.568 22.564 -99.200 -91.000 TYR 297 0.840 32.828 49.734 25.376 -99.200 -91.000 TYR 299 0.840 23.661 51.260 21.313 -99.200 -91.000 PHE 308 1.000 20.306 41.442 26.716 -99.200 -91.000 ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 2fv7B1 VAL 15 HA 0.03 -0.14 0.16 -0.75 4.13 3.43 2fv7B1 VAL 15 HB 0.01 -0.03 -0.01 -0.04 2.12 2.05 2fv7B1 VAL 15 HG13 0.01 0.03 -0.26 -0.04 0.97 0.70 2fv7B1 VAL 15 HG23 0.01 -0.02 0.01 -0.04 0.95 0.91 2fv7B1 ALA 16 H 0.05 0.04 -0.03 -0.55 8.40 7.91 2fv7B1 ALA 16 HA 0.07 0.01 0.38 -0.75 4.34 4.05 2fv7B1 ALA 16 HB3 0.06 -0.00 -0.16 -0.04 1.41 1.27 2fv7B1 ALA 17 H 0.09 0.29 0.33 -0.55 8.40 8.56 2fv7B1 ALA 17 HA -0.05 0.15 0.71 -0.75 4.34 4.39 2fv7B1 ALA 17 HB3 -0.12 0.01 0.16 -0.04 1.41 1.41 2fv7B1 VAL 18 H 0.09 0.44 0.17 -0.55 8.24 8.40 2fv7B1 VAL 18 HA 0.05 0.25 0.99 -0.75 4.13 4.66 2fv7B1 VAL 18 HB 0.11 -0.07 0.01 -0.04 2.12 2.13 2fv7B1 VAL 18 HG13 0.07 -0.01 -0.27 -0.04 0.97 0.72 2fv7B1 VAL 18 HG23 0.18 0.02 -0.22 -0.04 0.95 0.89 2fv7B1 VAL 19 H 0.04 0.78 0.27 -0.55 8.24 8.78 2fv7B1 VAL 19 HA 0.05 0.12 1.03 -0.75 4.13 4.59 2fv7B1 VAL 19 HB 0.02 0.10 0.16 -0.04 2.12 2.36 2fv7B1 VAL 19 HG13 0.02 -0.04 -0.21 -0.04 0.97 0.71 2fv7B1 VAL 19 HG23 0.03 0.01 -0.27 -0.04 0.95 0.68 2fv7B1 VAL 20 H 0.06 0.55 0.28 -0.55 8.24 8.57 2fv7B1 VAL 20 HA 0.05 0.20 1.09 -0.75 4.13 4.72 2fv7B1 VAL 20 HB 0.05 -0.07 0.06 -0.04 2.12 2.13 2fv7B1 VAL 20 HG13 0.05 0.02 -0.23 -0.04 0.97 0.77 2fv7B1 VAL 20 HG23 0.05 0.01 -0.20 -0.04 0.95 0.77 2fv7B1 VAL 21 H 0.05 0.73 0.28 -0.55 8.24 8.76 2fv7B1 VAL 21 HA 0.05 0.25 1.01 -0.75 4.13 4.69 2fv7B1 VAL 21 HB 0.05 0.01 0.16 -0.04 2.12 2.29 2fv7B1 VAL 21 HG13 0.04 -0.02 -0.13 -0.04 0.97 0.82 2fv7B1 VAL 21 HG23 0.02 0.01 -0.11 -0.04 0.95 0.83 2fv7B1 GLY 22 H 0.05 0.70 0.25 -0.55 8.43 8.88 2fv7B1 GLY 22 HA2 0.04 0.02 0.46 -0.51 4.01 4.02 2fv7B1 GLY 22 HA3 0.04 -0.08 0.30 -0.51 4.01 3.76 2fv7B1 SER 23 H 0.01 -0.06 0.13 -0.55 8.46 8.00 2fv7B1 SER 23 HA -0.02 0.24 0.59 -0.75 4.49 4.55 2fv7B1 SER 23 HB2 -0.02 0.09 -0.04 -0.04 3.95 3.94 2fv7B1 SER 23 HB3 0.00 0.19 -0.02 -0.04 3.93 4.06 2fv7B1 CYS 24 H -0.10 0.29 0.25 -0.55 8.50 8.39 2fv7B1 CYS 24 HA -0.34 0.23 0.87 -0.75 4.58 4.58 2fv7B1 CYS 24 HB2 -0.30 -0.00 0.13 -0.04 2.97 2.75 2fv7B1 CYS 24 HB3 -1.19 0.03 0.01 -0.04 2.97 1.77 2fv7B1 MET 25 H -0.03 0.65 0.01 -0.55 8.47 8.54 2fv7B1 MET 25 HA -0.00 0.34 0.76 -0.75 4.52 4.86 2fv7B1 MET 25 HB2 0.03 -0.17 -0.36 -0.04 2.15 1.61 2fv7B1 MET 25 HB3 0.01 0.05 -0.45 -0.04 2.03 1.60 2fv7B1 MET 25 HG2 -0.01 0.18 -0.34 -0.04 2.63 2.43 2fv7B1 MET 25 HG3 -0.01 -0.18 -0.38 -0.04 2.56 1.95 2fv7B1 MET 25 HE3 0.00 0.03 -0.12 -0.04 2.10 1.97 2fv7B1 THR 26 H 0.02 0.61 0.22 -0.55 8.28 8.57 2fv7B1 THR 26 HA -0.02 0.20 0.83 -0.75 4.39 4.64 2fv7B1 THR 26 HB -0.45 -0.04 0.15 -0.04 4.32 3.94 2fv7B1 THR 26 HG23 -0.72 0.03 -0.03 -0.04 1.22 0.45 2fv7B1 ASP 27 H -0.13 0.69 0.33 -0.55 8.40 8.73 2fv7B1 ASP 27 HA -0.10 0.15 0.81 -0.75 4.63 4.74 2fv7B1 ASP 27 HB2 -0.13 -0.08 0.12 -0.04 2.71 2.57 2fv7B1 ASP 27 HB3 -0.13 0.05 -0.05 -0.04 2.70 2.53 2fv7B1 LEU 28 H -0.13 0.79 0.36 -0.55 8.37 8.84 2fv7B1 LEU 28 HA -0.32 0.16 0.90 -0.75 4.35 4.34 2fv7B1 LEU 28 HB2 0.03 -0.07 0.24 -0.04 1.64 1.79 2fv7B1 LEU 28 HB3 0.26 0.03 0.07 -0.04 1.64 1.95 2fv7B1 LEU 28 HG -0.11 0.03 -0.27 -0.04 1.64 1.25 2fv7B1 LEU 28 HD13 0.16 -0.01 -0.04 -0.04 0.93 0.99 2fv7B1 LEU 28 HD23 -0.13 0.02 -0.11 -0.04 0.89 0.63 2fv7B1 VAL 29 H -0.92 0.81 0.34 -0.55 8.24 7.92 2fv7B1 VAL 29 HA -0.35 0.28 0.95 -0.75 4.13 4.26 2fv7B1 VAL 29 HB -1.81 -0.01 0.07 -0.04 2.12 0.33 2fv7B1 VAL 29 HG13 -0.39 -0.01 -0.24 -0.04 0.97 0.29 2fv7B1 VAL 29 HG23 -0.34 -0.01 -0.21 -0.04 0.95 0.34 2fv7B1 SER 30 H -0.18 0.69 0.47 -0.55 8.46 8.90 2fv7B1 SER 30 HA -0.09 0.25 1.13 -0.75 4.49 5.03 2fv7B1 SER 30 HB2 -0.03 -0.03 0.21 -0.04 3.95 4.06 2fv7B1 SER 30 HB3 -0.02 -0.01 0.04 -0.04 3.93 3.91 2fv7B1 LEU 31 H -0.16 0.71 0.38 -0.55 8.37 8.75 2fv7B1 LEU 31 HA -0.11 0.30 0.99 -0.75 4.35 4.77 2fv7B1 LEU 31 HB2 -0.41 -0.14 0.17 -0.04 1.64 1.21 2fv7B1 LEU 31 HB3 -0.06 0.09 0.04 -0.04 1.64 1.66 2fv7B1 LEU 31 HG 0.03 0.02 -0.14 -0.04 1.64 1.51 2fv7B1 LEU 31 HD13 0.28 0.00 -0.09 -0.04 0.93 1.09 2fv7B1 LEU 31 HD23 0.04 0.01 -0.21 -0.04 0.89 0.69 2fv7B1 THR 32 H -0.06 0.77 0.34 -0.55 8.28 8.78 2fv7B1 THR 32 HA -0.05 0.07 0.91 -0.75 4.39 4.56 2fv7B1 THR 32 HB 0.02 -0.01 0.09 -0.04 4.32 4.38 2fv7B1 THR 32 HG23 -0.04 -0.01 -0.30 -0.04 1.22 0.83 2fv7B1 SER 33 H 0.10 0.22 0.20 -0.55 8.46 8.43 2fv7B1 SER 33 HA 0.10 0.09 0.80 -0.75 4.49 4.73 2fv7B1 SER 33 HB2 0.05 0.02 0.07 -0.04 3.95 4.05 2fv7B1 SER 33 HB3 0.08 0.04 0.13 -0.04 3.93 4.14 2fv7B1 ARG 34 H 0.04 0.19 0.06 -0.55 8.46 8.20 2fv7B1 ARG 34 HA 0.02 0.11 0.78 -0.75 4.34 4.50 2fv7B1 ARG 34 HB2 0.02 0.07 -0.17 -0.04 1.90 1.78 2fv7B1 ARG 34 HB3 0.02 0.04 0.04 -0.04 1.80 1.86 2fv7B1 ARG 34 HG2 0.02 0.08 -0.34 -0.04 1.67 1.40 2fv7B1 ARG 34 HG3 0.03 -0.10 -0.11 -0.04 1.67 1.45 2fv7B1 ARG 34 HD2 0.02 0.04 -0.05 -0.04 3.22 3.19 2fv7B1 ARG 34 HD3 0.02 0.02 -0.05 -0.04 3.22 3.16 2fv7B1 LEU 35 H 0.01 0.09 0.05 -0.55 8.37 7.98 2fv7B1 LEU 35 HA -0.00 0.08 0.44 -0.75 4.35 4.12 2fv7B1 LEU 35 HB2 0.00 -0.02 0.00 -0.04 1.64 1.58 2fv7B1 LEU 35 HB3 -0.00 0.12 -0.03 -0.04 1.64 1.69 2fv7B1 LEU 35 HG 0.00 -0.11 -0.05 -0.04 1.64 1.43 2fv7B1 LEU 35 HD13 -0.00 -0.00 -0.25 -0.04 0.93 0.63 2fv7B1 LEU 35 HD23 -0.01 0.04 -0.20 -0.04 0.89 0.68 2fv7B1 PRO 36 HA 0.00 0.07 0.51 -0.51 4.44 4.51 2fv7B1 PRO 36 HB2 -0.01 0.20 -0.01 -0.04 2.28 2.42 2fv7B1 PRO 36 HB3 -0.01 -0.06 -0.01 -0.04 2.02 1.91 2fv7B1 PRO 36 HG2 -0.01 0.02 -0.02 -0.04 2.03 1.98 2fv7B1 PRO 36 HG3 -0.02 0.02 0.03 -0.04 2.03 2.02 2fv7B1 PRO 36 HD2 -0.01 0.05 0.14 -0.04 3.68 3.82 2fv7B1 PRO 36 HD3 -0.01 0.12 0.13 -0.04 3.65 3.85 2fv7B1 LYS 37 H -0.00 0.08 0.10 -0.55 8.42 8.04 2fv7B1 LYS 37 HA -0.00 0.16 0.74 -0.75 4.32 4.47 2fv7B1 LYS 37 HB2 0.00 -0.01 0.04 -0.04 1.87 1.86 2fv7B1 LYS 37 HB3 0.00 0.01 0.10 -0.04 1.79 1.86 2fv7B1 LYS 37 HG2 0.00 0.02 -0.02 -0.04 1.46 1.43 2fv7B1 LYS 37 HG3 0.00 0.01 -0.11 -0.04 1.46 1.33 2fv7B1 LYS 37 HD2 0.00 -0.01 -0.01 -0.04 1.69 1.63 2fv7B1 LYS 37 HD3 0.00 0.01 0.00 -0.04 1.68 1.66 2fv7B1 LYS 37 HE2 0.00 -0.00 -0.02 -0.04 2.99 2.93 2fv7B1 LYS 37 HE3 0.00 0.01 -0.04 -0.04 2.99 2.92 2fv7B1 THR 38 H -0.00 0.12 0.11 -0.55 8.28 7.96 2fv7B1 THR 38 HA -0.00 0.02 0.38 -0.75 4.39 4.04 2fv7B1 THR 38 HB -0.00 0.01 0.10 -0.04 4.32 4.39 2fv7B1 THR 38 HG23 -0.00 0.01 -0.10 -0.04 1.22 1.09 2fv7B1 GLY 39 H -0.01 0.12 0.16 -0.55 8.43 8.16 2fv7B1 GLY 39 HA2 -0.01 -0.01 0.34 -0.51 4.01 3.83 2fv7B1 GLY 39 HA3 -0.00 0.11 0.46 -0.51 4.01 4.07 2fv7B1 GLU 40 H -0.01 0.51 -0.36 -0.55 8.60 8.20 2fv7B1 GLU 40 HA -0.01 0.19 0.73 -0.75 4.29 4.45 2fv7B1 GLU 40 HB2 0.00 0.02 0.01 -0.04 2.09 2.08 2fv7B1 GLU 40 HB3 -0.00 0.05 -0.09 -0.04 1.99 1.91 2fv7B1 GLU 40 HG2 -0.00 -0.03 0.07 -0.04 2.34 2.34 2fv7B1 GLU 40 HG3 -0.00 -0.02 -0.37 -0.04 2.34 1.90 2fv7B1 THR 41 H -0.01 0.20 0.16 -0.55 8.28 8.08 2fv7B1 THR 41 HA -0.04 0.00 0.85 -0.75 4.39 4.44 2fv7B1 THR 41 HB -0.04 0.00 0.04 -0.04 4.32 4.28 2fv7B1 THR 41 HG23 -0.02 0.00 0.11 -0.04 1.22 1.28 2fv7B1 ILE 42 H -0.06 0.23 0.10 -0.55 8.25 7.97 2fv7B1 ILE 42 HA 0.01 0.22 0.90 -0.75 4.18 4.56 2fv7B1 ILE 42 HB 0.03 0.02 0.08 -0.04 1.89 1.98 2fv7B1 ILE 42 HG12 -0.02 -0.05 -0.06 -0.04 1.49 1.32 2fv7B1 ILE 42 HG13 -0.01 0.01 -0.36 -0.04 1.21 0.80 2fv7B1 ILE 42 HG23 0.01 0.01 -0.25 -0.04 0.93 0.66 2fv7B1 ILE 42 HD13 0.01 -0.03 -0.18 -0.04 0.88 0.63 2fv7B1 HIS 43 H 0.15 0.16 0.16 -0.55 8.41 8.33 2fv7B1 HIS 43 HA 0.00 0.12 0.85 -0.75 4.63 4.85 2fv7B1 HIS 43 HB2 0.02 -0.05 0.15 -0.04 3.26 3.35 2fv7B1 HIS 43 HB3 0.02 0.16 0.04 -0.04 3.20 3.38 2fv7B1 HIS 43 HD2 0.01 -0.02 -0.04 -0.04 6.97 6.87 2fv7B1 HIS 43 HE1 0.00 0.00 -0.02 -0.04 7.75 7.69 2fv7B1 GLY 44 H 0.05 0.12 0.14 -0.55 8.43 8.19 2fv7B1 GLY 44 HA2 0.01 0.05 0.92 -0.51 4.01 4.48 2fv7B1 GLY 44 HA3 -0.04 0.04 0.33 -0.51 4.01 3.84 2fv7B1 HIS 45 H -0.43 0.60 0.38 -0.55 8.41 8.41 2fv7B1 HIS 45 HA 0.06 0.24 1.06 -0.75 4.63 5.23 2fv7B1 HIS 45 HB2 0.04 0.01 0.09 -0.04 3.26 3.36 2fv7B1 HIS 45 HB3 0.04 -0.01 -0.03 -0.04 3.20 3.15 2fv7B1 HIS 45 HD2 0.05 0.00 -0.20 -0.04 6.97 6.78 2fv7B1 HIS 45 HE1 0.03 0.06 -0.32 -0.04 7.75 7.48 2fv7B1 LYS 46 H -0.22 0.24 0.31 -0.55 8.42 8.18 2fv7B1 LYS 46 HA 0.12 0.16 0.69 -0.75 4.32 4.54 2fv7B1 LYS 46 HB2 0.22 0.12 -0.15 -0.04 1.87 2.01 2fv7B1 LYS 46 HB3 0.16 -0.07 -0.01 -0.04 1.79 1.83 2fv7B1 LYS 46 HG2 0.33 -0.04 -0.20 -0.04 1.46 1.51 2fv7B1 LYS 46 HG3 0.18 0.02 0.11 -0.04 1.46 1.73 2fv7B1 LYS 46 HD2 0.11 0.03 0.01 -0.04 1.69 1.80 2fv7B1 LYS 46 HD3 0.12 -0.03 -0.05 -0.04 1.68 1.68 2fv7B1 LYS 46 HE2 0.07 0.03 0.01 -0.04 2.99 3.07 2fv7B1 LYS 46 HE3 0.00 0.00 -0.01 -0.04 2.99 2.94 2fv7B1 PHE 47 H 0.21 0.29 0.22 -0.55 8.34 8.50 2fv7B1 PHE 47 HA -0.16 0.39 1.04 -0.75 4.62 5.13 2fv7B1 PHE 47 HB2 -0.05 -0.03 0.01 -0.04 3.15 3.03 2fv7B1 PHE 47 HB3 -0.01 -0.02 0.09 -0.04 3.06 3.07 2fv7B1 PHE 47 HD2 -0.06 -0.02 -0.22 -0.04 7.28 6.95 2fv7B1 PHE 47 HE2 -0.06 -0.03 -0.17 -0.04 7.38 7.08 2fv7B1 PHE 47 HZ -0.05 -0.05 -0.06 -0.04 7.32 7.11 2fv7B1 PHE 48 H -1.23 0.63 0.36 -0.55 8.34 7.55 2fv7B1 PHE 48 HA -0.24 0.10 0.45 -0.75 4.62 4.18 2fv7B1 PHE 48 HB2 -0.17 0.04 0.14 -0.04 3.15 3.12 2fv7B1 PHE 48 HB3 -0.12 0.12 0.05 -0.04 3.06 3.07 2fv7B1 PHE 48 HD2 -0.16 0.04 -0.41 -0.04 7.28 6.71 2fv7B1 PHE 48 HE2 -0.11 -0.03 -0.18 -0.04 7.38 7.03 2fv7B1 PHE 48 HZ -0.09 -0.02 -0.14 -0.04 7.32 7.04 2fv7B1 ILE 49 H -0.04 0.21 0.21 -0.55 8.25 8.07 2fv7B1 ILE 49 HA -0.36 0.32 1.07 -0.75 4.18 4.46 2fv7B1 ILE 49 HB -0.16 -0.00 0.13 -0.04 1.89 1.82 2fv7B1 ILE 49 HG12 -0.06 0.03 -0.02 -0.04 1.49 1.40 2fv7B1 ILE 49 HG13 0.08 -0.05 -0.08 -0.04 1.21 1.13 2fv7B1 ILE 49 HG23 -0.41 -0.00 -0.07 -0.04 0.93 0.41 2fv7B1 ILE 49 HD13 0.08 -0.01 -0.02 -0.04 0.88 0.89 2fv7B1 GLY 50 H -0.27 0.56 0.38 -0.55 8.43 8.56 2fv7B1 GLY 50 HA2 -0.27 0.22 0.79 -0.51 4.01 4.24 2fv7B1 GLY 50 HA3 -0.11 0.01 0.31 -0.51 4.01 3.71 2fv7B1 PHE 51 H -0.10 0.24 0.17 -0.55 8.34 8.10 2fv7B1 PHE 51 HA -0.01 0.10 0.96 -0.75 4.62 4.92 2fv7B1 PHE 51 HB2 -0.18 0.02 0.18 -0.04 3.15 3.13 2fv7B1 PHE 51 HB3 -0.50 0.05 0.05 -0.04 3.06 2.62 2fv7B1 PHE 51 HD2 -0.36 0.00 0.01 -0.04 7.28 6.89 2fv7B1 PHE 51 HE2 -0.12 -0.01 -0.15 -0.04 7.38 7.06 2fv7B1 PHE 51 HZ -0.08 0.01 -0.09 -0.04 7.32 7.12 2fv7B1 GLY 52 H 0.31 0.75 0.32 -0.55 8.43 9.27 2fv7B1 GLY 52 HA2 0.13 0.18 0.79 -0.51 4.01 4.60 2fv7B1 GLY 52 HA3 0.08 -0.09 0.26 -0.51 4.01 3.75 2fv7B1 GLY 53 H 0.06 0.10 -0.01 -0.55 8.43 8.03 2fv7B1 GLY 53 HA2 0.02 -0.00 0.29 -0.51 4.01 3.81 2fv7B1 GLY 53 HA3 0.02 0.16 0.59 -0.51 4.01 4.27 2fv7B1 LYS 54 H 0.02 0.16 0.09 -0.55 8.42 8.13 2fv7B1 LYS 54 HA 0.05 0.06 0.26 -0.75 4.32 3.95 2fv7B1 LYS 54 HB2 -0.00 -0.04 0.12 -0.04 1.87 1.91 2fv7B1 LYS 54 HB3 -0.00 0.11 -0.01 -0.04 1.79 1.85 2fv7B1 LYS 54 HG2 0.01 -0.02 -0.02 -0.04 1.46 1.39 2fv7B1 LYS 54 HG3 0.01 -0.08 0.04 -0.04 1.46 1.38 2fv7B1 LYS 54 HD2 -0.03 0.11 -0.09 -0.04 1.69 1.63 2fv7B1 LYS 54 HD3 -0.05 0.05 -0.06 -0.04 1.68 1.58 2fv7B1 LYS 54 HE2 -0.02 -0.00 -0.10 -0.04 2.99 2.83 2fv7B1 LYS 54 HE3 -0.04 -0.05 -0.35 -0.04 2.99 2.50 2fv7B1 GLY 55 H 0.02 -0.04 -0.07 -0.55 8.43 7.79 2fv7B1 GLY 55 HA2 0.03 0.14 0.27 -0.51 4.01 3.94 2fv7B1 GLY 55 HA3 0.03 -0.05 0.19 -0.51 4.01 3.66 2fv7B1 ALA 56 H 0.04 0.44 -0.15 -0.55 8.40 8.18 2fv7B1 ALA 56 HA 0.10 0.06 0.26 -0.75 4.34 4.00 2fv7B1 ALA 56 HB3 0.19 0.04 0.03 -0.04 1.41 1.63 2fv7B1 ASN 57 H 0.13 0.56 -0.24 -0.55 8.53 8.43 2fv7B1 ASN 57 HA 0.27 0.06 0.27 -0.75 4.76 4.60 2fv7B1 ASN 57 HB2 0.14 0.01 0.03 -0.04 2.88 3.01 2fv7B1 ASN 57 HB3 0.35 -0.01 -0.14 -0.04 2.79 2.95 2fv7B1 ASN 57 HD21 0.09 -0.13 -0.11 -0.04 7.03 6.83 2fv7B1 ASN 57 HD22 0.12 -0.08 -0.13 -0.04 7.74 7.61 2fv7B1 GLN 58 H 0.07 0.51 -0.24 -0.55 8.47 8.26 2fv7B1 GLN 58 HA -0.04 0.14 0.48 -0.75 4.36 4.20 2fv7B1 GLN 58 HB2 0.03 0.11 0.09 -0.04 2.15 2.34 2fv7B1 GLN 58 HB3 0.01 -0.00 -0.09 -0.04 2.02 1.90 2fv7B1 GLN 58 HG2 0.00 0.01 0.07 -0.04 2.40 2.43 2fv7B1 GLN 58 HG3 0.02 -0.08 0.06 -0.04 2.39 2.36 2fv7B1 GLN 58 HE21 -0.04 -0.00 -0.10 -0.04 6.97 6.79 2fv7B1 GLN 58 HE22 0.00 -0.15 -0.08 -0.04 7.69 7.43 2fv7B1 CYS 59 H 0.06 0.48 -0.17 -0.55 8.50 8.32 2fv7B1 CYS 59 HA 0.04 0.03 0.32 -0.75 4.58 4.22 2fv7B1 CYS 59 HB2 0.06 0.04 0.01 -0.04 2.97 3.04 2fv7B1 CYS 59 HB3 0.07 0.07 0.02 -0.04 2.97 3.09 2fv7B1 VAL 60 H 0.09 0.57 -0.18 -0.55 8.24 8.18 2fv7B1 VAL 60 HA 0.03 0.07 0.37 -0.75 4.13 3.85 2fv7B1 VAL 60 HB 0.19 0.02 0.11 -0.04 2.12 2.40 2fv7B1 VAL 60 HG13 0.09 0.00 -0.14 -0.04 0.97 0.88 2fv7B1 VAL 60 HG23 0.06 0.01 -0.05 -0.04 0.95 0.93 2fv7B1 GLN 61 H -0.02 0.44 -0.19 -0.55 8.47 8.16 2fv7B1 GLN 61 HA -0.12 0.11 0.37 -0.75 4.36 3.97 2fv7B1 GLN 61 HB2 -0.68 -0.04 0.06 -0.04 2.15 1.45 2fv7B1 GLN 61 HB3 -0.23 -0.01 0.10 -0.04 2.02 1.84 2fv7B1 GLN 61 HG2 -0.27 0.12 0.06 -0.04 2.40 2.26 2fv7B1 GLN 61 HG3 -0.19 0.01 -0.32 -0.04 2.39 1.84 2fv7B1 GLN 61 HE21 -0.12 0.34 -0.06 -0.04 6.97 7.10 2fv7B1 GLN 61 HE22 -0.18 -0.10 0.02 -0.04 7.69 7.38 2fv7B1 ALA 62 H -0.04 0.41 -0.23 -0.55 8.40 7.98 2fv7B1 ALA 62 HA -0.08 0.06 0.37 -0.75 4.34 3.94 2fv7B1 ALA 62 HB3 0.06 0.02 0.06 -0.04 1.41 1.51 2fv7B1 ALA 63 H -0.01 0.56 -0.12 -0.55 8.40 8.28 2fv7B1 ALA 63 HA -0.00 0.19 0.50 -0.75 4.34 4.28 2fv7B1 ALA 63 HB3 0.01 0.03 0.07 -0.04 1.41 1.47 2fv7B1 ARG 64 H -0.11 0.47 -0.21 -0.55 8.46 8.06 2fv7B1 ARG 64 HA -0.04 0.06 0.49 -0.75 4.34 4.10 2fv7B1 ARG 64 HB2 -0.28 0.13 0.02 -0.04 1.90 1.73 2fv7B1 ARG 64 HB3 -0.68 -0.11 -0.05 -0.04 1.80 0.92 2fv7B1 ARG 64 HG2 -0.37 -0.07 -0.00 -0.04 1.67 1.19 2fv7B1 ARG 64 HG3 -0.18 0.19 0.06 -0.04 1.67 1.70 2fv7B1 ARG 64 HD2 -0.28 -0.00 -0.17 -0.04 3.22 2.73 2fv7B1 ARG 64 HD3 -1.30 -0.02 -0.14 -0.04 3.22 1.72 2fv7B1 LEU 65 H -0.24 0.33 -0.32 -0.55 8.37 7.60 2fv7B1 LEU 65 HA -0.28 -0.02 0.65 -0.75 4.35 3.94 2fv7B1 LEU 65 HB2 -0.73 0.10 0.12 -0.04 1.64 1.09 2fv7B1 LEU 65 HB3 -1.42 -0.05 0.05 -0.04 1.64 0.18 2fv7B1 LEU 65 HG -0.26 0.21 -0.01 -0.04 1.64 1.54 2fv7B1 LEU 65 HD13 -0.38 -0.03 -0.06 -0.04 0.93 0.41 2fv7B1 LEU 65 HD23 -0.06 -0.03 -0.10 -0.04 0.89 0.66 2fv7B1 GLY 66 H -0.19 0.28 -0.40 -0.55 8.43 7.57 2fv7B1 GLY 66 HA2 -0.10 0.03 0.22 -0.51 4.01 3.65 2fv7B1 GLY 66 HA3 -0.15 0.11 0.82 -0.51 4.01 4.28 2fv7B1 ALA 67 H -0.07 0.43 0.15 -0.55 8.40 8.37 2fv7B1 ALA 67 HA -0.12 0.05 0.41 -0.75 4.34 3.93 2fv7B1 ALA 67 HB3 0.28 -0.02 -0.12 -0.04 1.41 1.51 2fv7B1 MET 68 H 0.32 0.13 0.23 -0.55 8.47 8.61 2fv7B1 MET 68 HA 0.08 0.00 0.83 -0.75 4.52 4.67 2fv7B1 MET 68 HB2 0.16 0.00 0.37 -0.04 2.15 2.65 2fv7B1 MET 68 HB3 0.09 0.00 0.09 -0.04 2.03 2.16 2fv7B1 MET 68 HG2 0.07 0.00 0.09 -0.04 2.63 2.75 2fv7B1 MET 68 HG3 0.14 0.01 0.12 -0.04 2.56 2.79 2fv7B1 MET 68 HE3 0.11 -0.01 0.12 -0.04 2.10 2.27 2fv7B1 THR 69 H 0.07 0.35 0.23 -0.55 8.28 8.38 2fv7B1 THR 69 HA 0.08 0.32 1.04 -0.75 4.39 5.08 2fv7B1 THR 69 HB 0.06 -0.05 0.03 -0.04 4.32 4.33 2fv7B1 THR 69 HG23 0.08 0.06 -0.26 -0.04 1.22 1.06 2fv7B1 SER 70 H 0.07 0.53 0.34 -0.55 8.46 8.86 2fv7B1 SER 70 HA 0.06 0.13 0.70 -0.75 4.49 4.62 2fv7B1 SER 70 HB2 0.08 0.05 -0.08 -0.04 3.95 3.96 2fv7B1 SER 70 HB3 0.09 0.02 0.02 -0.04 3.93 4.03 2fv7B1 MET 71 H 0.06 0.56 0.12 -0.55 8.47 8.67 2fv7B1 MET 71 HA 0.06 0.20 0.84 -0.75 4.52 4.86 2fv7B1 MET 71 HB2 0.06 0.00 -0.06 -0.04 2.15 2.11 2fv7B1 MET 71 HB3 0.05 0.01 0.07 -0.04 2.03 2.12 2fv7B1 MET 71 HG2 0.05 -0.06 -0.20 -0.04 2.63 2.38 2fv7B1 MET 71 HG3 0.05 0.01 -0.46 -0.04 2.56 2.12 2fv7B1 MET 71 HE3 0.02 -0.04 -0.48 -0.04 2.10 1.56 2fv7B1 VAL 72 H 0.07 0.79 0.29 -0.55 8.24 8.84 2fv7B1 VAL 72 HA 0.15 0.30 0.75 -0.75 4.13 4.57 2fv7B1 VAL 72 HB 0.06 -0.08 0.20 -0.04 2.12 2.26 2fv7B1 VAL 72 HG13 0.13 -0.00 -0.07 -0.04 0.97 0.99 2fv7B1 VAL 72 HG23 0.04 0.02 -0.14 -0.04 0.95 0.83 2fv7B1 CYS 73 H 0.15 0.57 0.39 -0.55 8.50 9.07 2fv7B1 CYS 73 HA 0.09 0.11 0.70 -0.75 4.58 4.72 2fv7B1 CYS 73 HB2 0.00 -0.13 0.12 -0.04 2.97 2.93 2fv7B1 CYS 73 HB3 0.03 0.09 -0.37 -0.04 2.97 2.68 2fv7B1 LYS 74 H 0.05 0.22 0.20 -0.55 8.42 8.33 2fv7B1 LYS 74 HA 0.15 0.27 0.82 -0.75 4.32 4.81 2fv7B1 LYS 74 HB2 0.10 -0.02 -0.16 -0.04 1.87 1.74 2fv7B1 LYS 74 HB3 0.05 0.07 -0.01 -0.04 1.79 1.85 2fv7B1 LYS 74 HG2 0.06 -0.02 -0.24 -0.04 1.46 1.22 2fv7B1 LYS 74 HG3 0.12 -0.02 -0.22 -0.04 1.46 1.30 2fv7B1 LYS 74 HD2 0.00 -0.06 -0.46 -0.04 1.69 1.13 2fv7B1 LYS 74 HD3 0.02 -0.09 -0.17 -0.04 1.68 1.40 2fv7B1 LYS 74 HE2 -0.02 -0.01 -0.13 -0.04 2.99 2.79 2fv7B1 LYS 74 HE3 -0.11 -0.04 -0.10 -0.04 2.99 2.70 2fv7B1 VAL 75 H 0.09 0.69 0.22 -0.55 8.24 8.69 2fv7B1 VAL 75 HA 0.04 0.04 0.85 -0.75 4.13 4.31 2fv7B1 VAL 75 HB 0.10 -0.23 0.27 -0.04 2.12 2.22 2fv7B1 VAL 75 HG13 -0.02 0.01 -0.11 -0.04 0.97 0.81 2fv7B1 VAL 75 HG23 0.08 0.12 -0.02 -0.04 0.95 1.09 2fv7B1 GLY 76 H 0.09 -0.02 0.25 -0.55 8.43 8.21 2fv7B1 GLY 76 HA2 0.05 0.36 0.88 -0.51 4.01 4.79 2fv7B1 GLY 76 HA3 0.06 -0.09 0.41 -0.51 4.01 3.89 2fv7B1 LYS 77 H 0.04 0.65 0.11 -0.55 8.42 8.66 2fv7B1 LYS 77 HA 0.04 0.14 0.59 -0.75 4.32 4.34 2fv7B1 LYS 77 HB2 0.03 -0.08 -0.29 -0.04 1.87 1.50 2fv7B1 LYS 77 HB3 0.02 0.02 0.11 -0.04 1.79 1.90 2fv7B1 LYS 77 HG2 0.02 0.01 0.00 -0.04 1.46 1.46 2fv7B1 LYS 77 HG3 0.03 0.03 -0.04 -0.04 1.46 1.45 2fv7B1 LYS 77 HD2 0.02 -0.01 -0.01 -0.04 1.69 1.64 2fv7B1 LYS 77 HD3 0.02 0.05 -0.02 -0.04 1.68 1.69 2fv7B1 LYS 77 HE2 0.04 0.06 -0.09 -0.04 2.99 2.96 2fv7B1 LYS 77 HE3 0.03 -0.14 -0.21 -0.04 2.99 2.64 2fv7B1 ASP 78 H 0.06 0.41 -0.31 -0.55 8.40 8.01 2fv7B1 ASP 78 HA -0.01 0.28 0.64 -0.75 4.63 4.78 2fv7B1 ASP 78 HB2 -0.11 -0.05 0.19 -0.04 2.71 2.70 2fv7B1 ASP 78 HB3 -0.04 0.19 -0.02 -0.04 2.70 2.80 2fv7B1 SER 79 H -0.05 0.24 0.16 -0.55 8.46 8.26 2fv7B1 SER 79 HA 0.07 0.15 0.47 -0.75 4.49 4.43 2fv7B1 SER 79 HB2 0.08 0.08 0.08 -0.04 3.95 4.16 2fv7B1 SER 79 HB3 0.01 0.08 0.14 -0.04 3.93 4.11 2fv7B1 PHE 80 H 0.07 0.07 -0.11 -0.55 8.34 7.82 2fv7B1 PHE 80 HA 0.12 0.16 0.43 -0.75 4.62 4.58 2fv7B1 PHE 80 HB2 0.08 -0.13 0.09 -0.04 3.15 3.15 2fv7B1 PHE 80 HB3 0.13 0.06 -0.02 -0.04 3.06 3.18 2fv7B1 PHE 80 HD2 0.06 0.02 -0.04 -0.04 7.28 7.28 2fv7B1 PHE 80 HE2 0.05 0.04 -0.02 -0.04 7.38 7.41 2fv7B1 PHE 80 HZ 0.06 0.05 -0.02 -0.04 7.32 7.36 2fv7B1 GLY 81 H 0.20 0.05 -0.20 -0.55 8.43 7.94 2fv7B1 GLY 81 HA2 0.21 0.03 0.59 -0.51 4.01 4.33 2fv7B1 GLY 81 HA3 0.14 0.26 0.43 -0.51 4.01 4.32 2fv7B1 ASN 82 H 0.13 0.46 -0.01 -0.55 8.53 8.56 2fv7B1 ASN 82 HA 0.08 0.08 0.50 -0.75 4.76 4.66 2fv7B1 ASN 82 HB2 0.09 0.01 0.16 -0.04 2.88 3.10 2fv7B1 ASN 82 HB3 0.06 0.03 0.02 -0.04 2.79 2.85 2fv7B1 ASN 82 HD21 0.03 0.00 -0.11 -0.04 7.03 6.91 2fv7B1 ASN 82 HD22 0.04 -0.02 -0.07 -0.04 7.74 7.65 2fv7B1 ASP 83 H 0.18 0.56 -0.14 -0.55 8.40 8.45 2fv7B1 ASP 83 HA 0.11 0.08 0.47 -0.75 4.63 4.53 2fv7B1 ASP 83 HB2 0.31 0.03 0.13 -0.04 2.71 3.14 2fv7B1 ASP 83 HB3 0.35 -0.01 0.01 -0.04 2.70 3.01 2fv7B1 TYR 84 H 0.29 0.41 -0.18 -0.55 8.29 8.25 2fv7B1 TYR 84 HA -0.15 0.02 0.36 -0.75 4.56 4.03 2fv7B1 TYR 84 HB2 0.15 0.08 0.16 -0.04 3.06 3.40 2fv7B1 TYR 84 HB3 0.06 0.04 -0.00 -0.04 2.98 3.04 2fv7B1 TYR 84 HD2 0.10 0.02 -0.10 -0.04 7.15 7.13 2fv7B1 TYR 84 HE2 0.09 0.03 0.00 -0.04 6.85 6.92 2fv7B1 ILE 85 H 0.13 0.57 -0.16 -0.55 8.25 8.23 2fv7B1 ILE 85 HA 0.07 0.02 0.46 -0.75 4.18 3.98 2fv7B1 ILE 85 HB 0.05 0.10 0.16 -0.04 1.89 2.15 2fv7B1 ILE 85 HG12 0.04 0.00 0.00 -0.04 1.49 1.50 2fv7B1 ILE 85 HG13 0.09 0.03 0.05 -0.04 1.21 1.35 2fv7B1 ILE 85 HG23 0.00 -0.00 -0.10 -0.04 0.93 0.79 2fv7B1 ILE 85 HD13 0.04 -0.02 -0.09 -0.04 0.88 0.77 2fv7B1 GLU 86 H -0.01 0.43 -0.22 -0.55 8.60 8.25 2fv7B1 GLU 86 HA -0.04 0.02 0.47 -0.75 4.29 3.98 2fv7B1 GLU 86 HB2 -0.03 0.11 0.17 -0.04 2.09 2.30 2fv7B1 GLU 86 HB3 -0.03 -0.03 0.03 -0.04 1.99 1.92 2fv7B1 GLU 86 HG2 0.01 0.13 0.09 -0.04 2.34 2.53 2fv7B1 GLU 86 HG3 0.01 -0.05 0.01 -0.04 2.34 2.28 2fv7B1 ASN 87 H -0.35 0.49 -0.12 -0.55 8.53 8.01 2fv7B1 ASN 87 HA -0.40 0.03 0.49 -0.75 4.76 4.13 2fv7B1 ASN 87 HB2 -1.93 -0.02 0.09 -0.04 2.88 0.98 2fv7B1 ASN 87 HB3 -1.03 0.12 0.15 -0.04 2.79 1.99 2fv7B1 ASN 87 HD21 -0.35 -0.01 -0.08 -0.04 7.03 6.56 2fv7B1 ASN 87 HD22 -1.08 -0.03 -0.06 -0.04 7.74 6.53 2fv7B1 LEU 88 H -0.14 0.48 -0.21 -0.55 8.37 7.95 2fv7B1 LEU 88 HA -0.04 0.01 0.29 -0.75 4.35 3.86 2fv7B1 LEU 88 HB2 0.02 0.13 0.13 -0.04 1.64 1.88 2fv7B1 LEU 88 HB3 0.03 -0.01 -0.09 -0.04 1.64 1.53 2fv7B1 LEU 88 HG 0.17 0.17 0.05 -0.04 1.64 1.99 2fv7B1 LEU 88 HD13 0.11 -0.03 -0.09 -0.04 0.93 0.88 2fv7B1 LEU 88 HD23 0.16 -0.03 -0.09 -0.04 0.89 0.89 2fv7B1 LYS 89 H -0.04 0.53 -0.02 -0.55 8.42 8.33 2fv7B1 LYS 89 HA -0.02 0.09 0.45 -0.75 4.32 4.09 2fv7B1 LYS 89 HB2 -0.04 0.04 0.18 -0.04 1.87 2.01 2fv7B1 LYS 89 HB3 -0.02 -0.02 -0.00 -0.04 1.79 1.70 2fv7B1 LYS 89 HG2 -0.02 -0.03 0.04 -0.04 1.46 1.41 2fv7B1 LYS 89 HG3 -0.02 0.11 0.07 -0.04 1.46 1.58 2fv7B1 LYS 89 HD2 -0.02 -0.03 -0.07 -0.04 1.69 1.53 2fv7B1 LYS 89 HD3 -0.02 -0.01 -0.02 -0.04 1.68 1.60 2fv7B1 LYS 89 HE2 -0.02 -0.01 -0.02 -0.04 2.99 2.89 2fv7B1 LYS 89 HE3 -0.02 -0.01 -0.05 -0.04 2.99 2.87 2fv7B1 GLN 90 H -0.07 0.63 -0.15 -0.55 8.47 8.33 2fv7B1 GLN 90 HA -0.02 -0.01 0.42 -0.75 4.36 3.99 2fv7B1 GLN 90 HB2 -0.09 0.11 0.16 -0.04 2.15 2.28 2fv7B1 GLN 90 HB3 -0.03 -0.05 0.03 -0.04 2.02 1.94 2fv7B1 GLN 90 HG2 -0.03 -0.06 0.05 -0.04 2.40 2.32 2fv7B1 GLN 90 HG3 -0.05 0.16 0.09 -0.04 2.39 2.54 2fv7B1 GLN 90 HE21 0.01 -0.05 -0.02 -0.04 6.97 6.86 2fv7B1 GLN 90 HE22 -0.01 0.00 -0.00 -0.04 7.69 7.64 2fv7B1 ASN 91 H -0.04 0.34 -0.43 -0.55 8.53 7.85 2fv7B1 ASN 91 HA 0.04 0.11 0.62 -0.75 4.76 4.78 2fv7B1 ASN 91 HB2 -0.03 0.04 0.11 -0.04 2.88 2.96 2fv7B1 ASN 91 HB3 0.00 -0.04 0.11 -0.04 2.79 2.82 2fv7B1 ASN 91 HD21 -0.07 -0.12 -0.06 -0.04 7.03 6.74 2fv7B1 ASN 91 HD22 -0.12 0.33 -0.03 -0.04 7.74 7.88 2fv7B1 ASP 92 H -0.00 0.51 -0.49 -0.55 8.40 7.88 2fv7B1 ASP 92 HA 0.00 0.02 0.30 -0.75 4.63 4.20 2fv7B1 ASP 92 HB2 0.02 0.17 -0.00 -0.04 2.71 2.86 2fv7B1 ASP 92 HB3 0.01 -0.08 0.20 -0.04 2.70 2.78 2fv7B1 ILE 93 H 0.00 0.47 -0.14 -0.55 8.25 8.03 2fv7B1 ILE 93 HA 0.03 0.14 0.69 -0.75 4.18 4.28 2fv7B1 ILE 93 HB 0.02 -0.05 -0.10 -0.04 1.89 1.72 2fv7B1 ILE 93 HG12 0.03 0.01 -0.19 -0.04 1.49 1.30 2fv7B1 ILE 93 HG13 0.02 0.21 -0.36 -0.04 1.21 1.03 2fv7B1 ILE 93 HG23 0.04 0.00 -0.26 -0.04 0.93 0.67 2fv7B1 ILE 93 HD13 0.03 -0.05 -0.17 -0.04 0.88 0.65 2fv7B1 SER 94 H 0.03 0.57 0.23 -0.55 8.46 8.75 2fv7B1 SER 94 HA -0.00 0.07 0.55 -0.75 4.49 4.35 2fv7B1 SER 94 HB2 0.02 0.14 0.16 -0.04 3.95 4.23 2fv7B1 SER 94 HB3 0.04 -0.00 0.30 -0.04 3.93 4.23 2fv7B1 THR 95 H -0.04 0.20 0.16 -0.55 8.28 8.05 2fv7B1 THR 95 HA -0.02 0.19 0.79 -0.75 4.39 4.60 2fv7B1 THR 95 HB -0.03 -0.02 0.20 -0.04 4.32 4.43 2fv7B1 THR 95 HG23 0.00 0.08 -0.09 -0.04 1.22 1.17 2fv7B1 GLU 96 H -0.10 0.11 -0.13 -0.55 8.60 7.93 2fv7B1 GLU 96 HA -0.30 0.09 0.39 -0.75 4.29 3.71 2fv7B1 GLU 96 HB2 -0.19 -0.00 0.10 -0.04 2.09 1.95 2fv7B1 GLU 96 HB3 -0.36 0.00 -0.01 -0.04 1.99 1.58 2fv7B1 GLU 96 HG2 -1.18 0.03 -0.08 -0.04 2.34 1.07 2fv7B1 GLU 96 HG3 -0.37 0.00 0.06 -0.04 2.34 1.99 2fv7B1 PHE 97 H -0.07 0.09 -0.42 -0.55 8.34 7.38 2fv7B1 PHE 97 HA -0.50 0.21 0.74 -0.75 4.62 4.32 2fv7B1 PHE 97 HB2 -0.04 0.01 -0.06 -0.04 3.15 3.02 2fv7B1 PHE 97 HB3 -0.04 -0.03 0.13 -0.04 3.06 3.08 2fv7B1 PHE 97 HD2 -0.03 -0.02 -0.12 -0.04 7.28 7.08 2fv7B1 PHE 97 HE2 0.02 0.02 -0.10 -0.04 7.38 7.27 2fv7B1 PHE 97 HZ 0.01 0.02 0.01 -0.04 7.32 7.32 2fv7B1 THR 98 H -0.15 0.38 -0.33 -0.55 8.28 7.63 2fv7B1 THR 98 HA 0.01 0.04 0.86 -0.75 4.39 4.54 2fv7B1 THR 98 HB -0.04 0.10 0.22 -0.04 4.32 4.56 2fv7B1 THR 98 HG23 0.03 -0.03 -0.17 -0.04 1.22 1.01 2fv7B1 TYR 99 H 0.18 0.63 0.23 -0.55 8.29 8.77 2fv7B1 TYR 99 HA 0.03 0.14 0.55 -0.75 4.56 4.53 2fv7B1 TYR 99 HB2 0.04 -0.03 0.14 -0.04 3.06 3.18 2fv7B1 TYR 99 HB3 0.04 -0.03 0.04 -0.04 2.98 2.99 2fv7B1 TYR 99 HD2 0.06 0.08 0.05 -0.04 7.15 7.29 2fv7B1 TYR 99 HE2 0.11 0.02 -0.01 -0.04 6.85 6.93 2fv7B1 GLN 100 H 0.17 0.26 0.18 -0.55 8.47 8.53 2fv7B1 GLN 100 HA 0.09 0.19 0.65 -0.75 4.36 4.54 2fv7B1 GLN 100 HB2 0.06 0.03 0.02 -0.04 2.15 2.22 2fv7B1 GLN 100 HB3 0.06 -0.08 -0.22 -0.04 2.02 1.74 2fv7B1 GLN 100 HG2 0.07 -0.04 -0.20 -0.04 2.40 2.19 2fv7B1 GLN 100 HG3 0.05 0.11 -0.32 -0.04 2.39 2.19 2fv7B1 GLN 100 HE21 0.05 -0.03 -0.06 -0.04 6.97 6.89 2fv7B1 GLN 100 HE22 0.07 0.14 -0.00 -0.04 7.69 7.86 2fv7B1 THR 101 H 0.06 0.45 0.29 -0.55 8.28 8.54 2fv7B1 THR 101 HA 0.04 0.24 1.05 -0.75 4.39 4.98 2fv7B1 THR 101 HB 0.03 0.11 -0.08 -0.04 4.32 4.34 2fv7B1 THR 101 HG23 0.03 0.07 -0.01 -0.04 1.22 1.27 2fv7B1 LYS 102 H 0.02 0.25 0.18 -0.55 8.42 8.33 2fv7B1 LYS 102 HA 0.02 0.10 0.71 -0.75 4.32 4.40 2fv7B1 LYS 102 HB2 0.02 0.01 0.14 -0.04 1.87 1.99 2fv7B1 LYS 102 HB3 0.01 0.06 0.05 -0.04 1.79 1.87 2fv7B1 LYS 102 HG2 0.01 0.04 0.10 -0.04 1.46 1.57 2fv7B1 LYS 102 HG3 0.02 -0.04 0.03 -0.04 1.46 1.43 2fv7B1 LYS 102 HD2 0.02 0.01 0.03 -0.04 1.69 1.71 2fv7B1 LYS 102 HD3 0.01 0.01 0.03 -0.04 1.68 1.70 2fv7B1 LYS 102 HE2 0.01 0.02 0.02 -0.04 2.99 3.00 2fv7B1 LYS 102 HE3 0.01 0.00 0.03 -0.04 2.99 2.99 2fv7B1 ASP 103 H 0.02 -0.00 -0.23 -0.55 8.40 7.64 2fv7B1 ASP 103 HA 0.01 0.20 0.57 -0.75 4.63 4.65 2fv7B1 ASP 103 HB2 0.01 -0.03 0.01 -0.04 2.71 2.66 2fv7B1 ASP 103 HB3 0.01 0.04 0.04 -0.04 2.70 2.75 2fv7B1 ALA 104 H 0.02 0.23 -0.20 -0.55 8.40 7.90 2fv7B1 ALA 104 HA 0.02 0.15 0.51 -0.75 4.34 4.26 2fv7B1 ALA 104 HB3 0.02 -0.00 -0.21 -0.04 1.41 1.18 2fv7B1 ALA 105 H 0.03 0.16 0.08 -0.55 8.40 8.12 2fv7B1 ALA 105 HA 0.03 0.05 0.65 -0.75 4.34 4.32 2fv7B1 ALA 105 HB3 0.04 0.03 0.09 -0.04 1.41 1.52 2fv7B1 THR 106 H 0.11 0.02 0.20 -0.55 8.28 8.06 2fv7B1 THR 106 HA 0.08 -0.00 0.61 -0.75 4.39 4.33 2fv7B1 THR 106 HB 0.33 0.03 0.07 -0.04 4.32 4.71 2fv7B1 THR 106 HG23 0.14 0.11 -0.03 -0.04 1.22 1.40 2fv7B1 GLY 107 H 0.04 0.12 0.34 -0.55 8.43 8.39 2fv7B1 GLY 107 HA2 0.05 0.10 0.25 -0.51 4.01 3.90 2fv7B1 GLY 107 HA3 0.02 0.11 0.46 -0.51 4.01 4.10 2fv7B1 THR 108 H 0.04 0.63 0.38 -0.55 8.28 8.78 2fv7B1 THR 108 HA 0.01 0.18 1.02 -0.75 4.39 4.85 2fv7B1 THR 108 HB 0.05 0.02 0.03 -0.04 4.32 4.38 2fv7B1 THR 108 HG23 0.20 0.06 -0.13 -0.04 1.22 1.31 2fv7B1 ALA 109 H -0.03 0.75 0.23 -0.55 8.40 8.79 2fv7B1 ALA 109 HA -0.01 0.22 0.70 -0.75 4.34 4.49 2fv7B1 ALA 109 HB3 -0.02 -0.02 -0.04 -0.04 1.41 1.28 2fv7B1 SER 110 H -0.00 0.56 0.18 -0.55 8.46 8.65 2fv7B1 SER 110 HA -0.02 0.19 0.95 -0.75 4.49 4.86 2fv7B1 SER 110 HB2 0.00 -0.04 0.26 -0.04 3.95 4.13 2fv7B1 SER 110 HB3 0.01 0.06 0.03 -0.04 3.93 3.98 2fv7B1 ILE 111 H -0.09 0.75 0.36 -0.55 8.25 8.73 2fv7B1 ILE 111 HA -0.05 0.20 0.92 -0.75 4.18 4.50 2fv7B1 ILE 111 HB -0.15 -0.02 0.01 -0.04 1.89 1.69 2fv7B1 ILE 111 HG12 -0.05 -0.01 -0.23 -0.04 1.49 1.16 2fv7B1 ILE 111 HG13 -0.07 -0.02 -0.54 -0.04 1.21 0.54 2fv7B1 ILE 111 HG23 -0.07 -0.00 -0.21 -0.04 0.93 0.61 2fv7B1 ILE 111 HD13 -0.07 -0.02 -0.13 -0.04 0.88 0.61 2fv7B1 ILE 112 H -0.04 0.68 0.41 -0.55 8.25 8.75 2fv7B1 ILE 112 HA -0.07 0.27 0.99 -0.75 4.18 4.62 2fv7B1 ILE 112 HB -0.03 -0.06 0.20 -0.04 1.89 1.97 2fv7B1 ILE 112 HG12 -0.03 0.04 -0.02 -0.04 1.49 1.44 2fv7B1 ILE 112 HG13 -0.03 -0.03 -0.20 -0.04 1.21 0.91 2fv7B1 ILE 112 HG23 -0.03 0.00 -0.08 -0.04 0.93 0.78 2fv7B1 ILE 112 HD13 -0.02 -0.00 -0.03 -0.04 0.88 0.79 2fv7B1 VAL 113 H -0.06 0.68 0.32 -0.55 8.24 8.62 2fv7B1 VAL 113 HA -0.02 0.24 0.94 -0.75 4.13 4.54 2fv7B1 VAL 113 HB -0.01 -0.02 0.05 -0.04 2.12 2.09 2fv7B1 VAL 113 HG13 0.01 0.07 -0.16 -0.04 0.97 0.85 2fv7B1 VAL 113 HG23 -0.05 -0.01 -0.27 -0.04 0.95 0.59 2fv7B1 ASN 114 H 0.00 0.55 0.17 -0.55 8.53 8.71 2fv7B1 ASN 114 HA 0.03 0.38 0.68 -0.75 4.76 5.09 2fv7B1 ASN 114 HB2 0.03 0.19 -0.25 -0.04 2.88 2.80 2fv7B1 ASN 114 HB3 0.01 -0.04 -0.18 -0.04 2.79 2.54 2fv7B1 ASN 114 HD21 0.01 0.02 0.04 -0.04 7.03 7.06 2fv7B1 ASN 114 HD22 0.01 -0.05 0.08 -0.04 7.74 7.74 2fv7B1 ASN 115 H 0.05 0.34 0.21 -0.55 8.53 8.59 2fv7B1 ASN 115 HA 0.06 0.14 0.44 -0.75 4.76 4.64 2fv7B1 ASN 115 HB2 0.03 0.03 0.15 -0.04 2.88 3.05 2fv7B1 ASN 115 HB3 0.03 0.02 0.15 -0.04 2.79 2.95 2fv7B1 ASN 115 HD21 0.07 -0.06 0.06 -0.04 7.03 7.06 2fv7B1 ASN 115 HD22 0.04 0.02 0.13 -0.04 7.74 7.89 2fv7B1 GLU 116 H 0.02 -0.00 -0.28 -0.55 8.60 7.79 2fv7B1 GLU 116 HA 0.01 0.24 0.75 -0.75 4.29 4.53 2fv7B1 GLU 116 HB2 0.01 -0.12 0.01 -0.04 2.09 1.95 2fv7B1 GLU 116 HB3 0.01 0.06 0.14 -0.04 1.99 2.15 2fv7B1 GLU 116 HG2 0.02 -0.05 0.05 -0.04 2.34 2.31 2fv7B1 GLU 116 HG3 0.01 0.02 0.03 -0.04 2.34 2.36 2fv7B1 GLY 117 H 0.02 0.42 -0.32 -0.55 8.43 8.00 2fv7B1 GLY 117 HA2 0.02 0.06 0.24 -0.51 4.01 3.82 2fv7B1 GLY 117 HA3 0.01 0.14 0.57 -0.51 4.01 4.22 2fv7B1 GLN 118 H 0.01 -0.06 -0.27 -0.55 8.47 7.60 2fv7B1 GLN 118 HA -0.00 0.11 0.61 -0.75 4.36 4.33 2fv7B1 GLN 118 HB2 0.00 -0.12 0.06 -0.04 2.15 2.06 2fv7B1 GLN 118 HB3 0.00 0.08 -0.01 -0.04 2.02 2.05 2fv7B1 GLN 118 HG2 0.00 0.04 -0.01 -0.04 2.40 2.39 2fv7B1 GLN 118 HG3 0.00 0.06 -0.16 -0.04 2.39 2.25 2fv7B1 GLN 118 HE21 0.00 0.01 0.00 -0.04 6.97 6.95 2fv7B1 GLN 118 HE22 0.00 0.06 -0.02 -0.04 7.69 7.70 2fv7B1 ASN 119 H -0.01 0.16 0.22 -0.55 8.53 8.36 2fv7B1 ASN 119 HA -0.01 0.33 1.19 -0.75 4.76 5.51 2fv7B1 ASN 119 HB2 -0.02 0.02 0.05 -0.04 2.88 2.88 2fv7B1 ASN 119 HB3 -0.01 0.01 -0.18 -0.04 2.79 2.56 2fv7B1 ASN 119 HD21 -0.01 -0.06 -0.04 -0.04 7.03 6.87 2fv7B1 ASN 119 HD22 -0.01 0.02 -0.08 -0.04 7.74 7.62 2fv7B1 ILE 120 H -0.02 0.61 0.37 -0.55 8.25 8.66 2fv7B1 ILE 120 HA -0.01 0.11 0.69 -0.75 4.18 4.21 2fv7B1 ILE 120 HB -0.02 -0.02 0.18 -0.04 1.89 1.99 2fv7B1 ILE 120 HG12 -0.01 0.01 0.10 -0.04 1.49 1.55 2fv7B1 ILE 120 HG13 -0.01 0.05 -0.17 -0.04 1.21 1.04 2fv7B1 ILE 120 HG23 -0.01 -0.00 -0.15 -0.04 0.93 0.73 2fv7B1 ILE 120 HD13 -0.01 -0.01 -0.03 -0.04 0.88 0.80 2fv7B1 ILE 121 H -0.01 0.23 0.14 -0.55 8.25 8.05 2fv7B1 ILE 121 HA -0.02 0.39 1.06 -0.75 4.18 4.85 2fv7B1 ILE 121 HB -0.01 -0.02 0.04 -0.04 1.89 1.86 2fv7B1 ILE 121 HG12 -0.03 0.04 -0.17 -0.04 1.49 1.29 2fv7B1 ILE 121 HG13 -0.02 -0.10 -0.42 -0.04 1.21 0.63 2fv7B1 ILE 121 HG23 -0.02 -0.02 -0.27 -0.04 0.93 0.58 2fv7B1 ILE 121 HD13 -0.02 -0.00 -0.10 -0.04 0.88 0.72 2fv7B1 VAL 122 H -0.01 0.66 0.24 -0.55 8.24 8.58 2fv7B1 VAL 122 HA -0.00 0.16 0.94 -0.75 4.13 4.47 2fv7B1 VAL 122 HB 0.00 -0.03 0.18 -0.04 2.12 2.24 2fv7B1 VAL 122 HG13 0.01 -0.00 -0.15 -0.04 0.97 0.78 2fv7B1 VAL 122 HG23 -0.00 0.01 -0.10 -0.04 0.95 0.82 2fv7B1 ILE 123 H -0.00 0.22 0.09 -0.55 8.25 8.01 2fv7B1 ILE 123 HA 0.00 0.26 0.97 -0.75 4.18 4.66 2fv7B1 ILE 123 HB -0.00 0.01 0.13 -0.04 1.89 2.00 2fv7B1 ILE 123 HG12 -0.01 0.00 -0.05 -0.04 1.49 1.39 2fv7B1 ILE 123 HG13 -0.01 -0.02 -0.13 -0.04 1.21 1.01 2fv7B1 ILE 123 HG23 0.00 -0.01 -0.17 -0.04 0.93 0.71 2fv7B1 ILE 123 HD13 -0.01 -0.00 -0.04 -0.04 0.88 0.79 2fv7B1 VAL 124 H 0.02 0.66 0.31 -0.55 8.24 8.68 2fv7B1 VAL 124 HA 0.02 0.15 0.82 -0.75 4.13 4.36 2fv7B1 VAL 124 HB 0.04 -0.02 0.21 -0.04 2.12 2.30 2fv7B1 VAL 124 HG13 0.03 -0.02 0.01 -0.04 0.97 0.95 2fv7B1 VAL 124 HG23 0.02 0.03 -0.10 -0.04 0.95 0.86 2fv7B1 ALA 125 H 0.01 0.24 0.05 -0.55 8.40 8.16 2fv7B1 ALA 125 HA 0.01 0.05 0.38 -0.75 4.34 4.02 2fv7B1 ALA 125 HB3 0.01 0.03 0.05 -0.04 1.41 1.47 2fv7B1 GLY 126 H 0.02 0.05 -0.20 -0.55 8.43 7.75 2fv7B1 GLY 126 HA2 0.03 0.03 0.25 -0.51 4.01 3.81 2fv7B1 GLY 126 HA3 0.04 0.20 0.25 -0.51 4.01 3.99 2fv7B1 ALA 127 H 0.04 0.68 0.15 -0.55 8.40 8.73 2fv7B1 ALA 127 HA 0.02 0.01 0.26 -0.75 4.34 3.88 2fv7B1 ALA 127 HB3 0.04 0.02 -0.35 -0.04 1.41 1.08 2fv7B1 ASN 128 H 0.02 0.33 -0.11 -0.55 8.53 8.21 2fv7B1 ASN 128 HA 0.02 0.06 0.60 -0.75 4.76 4.68 2fv7B1 ASN 128 HB2 0.01 0.10 0.13 -0.04 2.88 3.08 2fv7B1 ASN 128 HB3 0.01 0.07 0.14 -0.04 2.79 2.97 2fv7B1 ASN 128 HD21 -0.02 0.18 0.15 -0.04 7.03 7.29 2fv7B1 ASN 128 HD22 0.00 0.17 0.28 -0.04 7.74 8.16 2fv7B1 LEU 129 H 0.02 0.47 -0.39 -0.55 8.37 7.92 2fv7B1 LEU 129 HA 0.02 -0.02 0.53 -0.75 4.35 4.12 2fv7B1 LEU 129 HB2 0.01 0.14 -0.00 -0.04 1.64 1.75 2fv7B1 LEU 129 HB3 0.01 -0.01 0.05 -0.04 1.64 1.65 2fv7B1 LEU 129 HG 0.01 -0.07 -0.10 -0.04 1.64 1.44 2fv7B1 LEU 129 HD13 0.01 0.00 -0.02 -0.04 0.93 0.88 2fv7B1 LEU 129 HD23 0.02 -0.00 -0.24 -0.04 0.89 0.62 2fv7B1 LEU 130 H 0.01 0.35 -0.45 -0.55 8.37 7.73 2fv7B1 LEU 130 HA -0.01 0.17 0.65 -0.75 4.35 4.41 2fv7B1 LEU 130 HB2 0.01 0.09 0.01 -0.04 1.64 1.70 2fv7B1 LEU 130 HB3 -0.01 -0.04 0.06 -0.04 1.64 1.61 2fv7B1 LEU 130 HG 0.01 -0.00 -0.17 -0.04 1.64 1.44 2fv7B1 LEU 130 HD13 0.01 -0.01 -0.16 -0.04 0.93 0.73 2fv7B1 LEU 130 HD23 0.00 0.03 -0.21 -0.04 0.89 0.67 2fv7B1 LEU 131 H 0.01 0.24 -0.30 -0.55 8.37 7.77 2fv7B1 LEU 131 HA -0.05 0.01 0.57 -0.75 4.35 4.13 2fv7B1 LEU 131 HB2 0.04 -0.03 0.07 -0.04 1.64 1.68 2fv7B1 LEU 131 HB3 0.02 0.02 0.12 -0.04 1.64 1.76 2fv7B1 LEU 131 HG 0.02 0.02 -0.24 -0.04 1.64 1.39 2fv7B1 LEU 131 HD13 0.09 -0.01 -0.16 -0.04 0.93 0.81 2fv7B1 LEU 131 HD23 0.06 -0.02 -0.13 -0.04 0.89 0.77 2fv7B1 ASN 132 H -0.10 0.07 0.18 -0.55 8.53 8.13 2fv7B1 ASN 132 HA -0.03 0.25 0.79 -0.75 4.76 5.02 2fv7B1 ASN 132 HB2 -0.04 -0.09 0.14 -0.04 2.88 2.86 2fv7B1 ASN 132 HB3 -0.04 0.19 -0.10 -0.04 2.79 2.80 2fv7B1 ASN 132 HD21 -0.09 0.01 0.03 -0.04 7.03 6.94 2fv7B1 ASN 132 HD22 -0.06 0.16 0.05 -0.04 7.74 7.84 2fv7B1 THR 133 H -0.03 0.20 0.13 -0.55 8.28 8.03 2fv7B1 THR 133 HA -0.03 0.14 0.36 -0.75 4.39 4.11 2fv7B1 THR 133 HB -0.03 0.08 0.04 -0.04 4.32 4.38 2fv7B1 THR 133 HG23 -0.02 0.02 -0.01 -0.04 1.22 1.16 2fv7B1 GLU 134 H -0.05 0.06 -0.13 -0.55 8.60 7.94 2fv7B1 GLU 134 HA -0.02 0.14 0.50 -0.75 4.29 4.15 2fv7B1 GLU 134 HB2 -0.05 -0.03 0.04 -0.04 2.09 2.00 2fv7B1 GLU 134 HB3 -0.03 0.09 0.01 -0.04 1.99 2.02 2fv7B1 GLU 134 HG2 -0.02 0.07 -0.00 -0.04 2.34 2.34 2fv7B1 GLU 134 HG3 -0.03 -0.10 0.04 -0.04 2.34 2.21 2fv7B1 ASP 135 H -0.12 0.00 -0.22 -0.55 8.40 7.52 2fv7B1 ASP 135 HA -0.23 0.10 0.46 -0.75 4.63 4.21 2fv7B1 ASP 135 HB2 -0.15 0.15 0.12 -0.04 2.71 2.79 2fv7B1 ASP 135 HB3 -0.38 0.09 -0.01 -0.04 2.70 2.36 2fv7B1 LEU 136 H -0.04 0.33 -0.23 -0.55 8.37 7.89 2fv7B1 LEU 136 HA -0.03 0.06 0.42 -0.75 4.35 4.05 2fv7B1 LEU 136 HB2 -0.03 0.09 0.12 -0.04 1.64 1.78 2fv7B1 LEU 136 HB3 -0.03 0.04 -0.14 -0.04 1.64 1.47 2fv7B1 LEU 136 HG -0.00 -0.01 -0.09 -0.04 1.64 1.50 2fv7B1 LEU 136 HD13 -0.01 0.02 -0.09 -0.04 0.93 0.81 2fv7B1 LEU 136 HD23 -0.00 0.00 -0.06 -0.04 0.89 0.78 2fv7B1 ARG 137 H -0.03 0.46 -0.03 -0.55 8.46 8.31 2fv7B1 ARG 137 HA -0.04 0.07 0.39 -0.75 4.34 4.01 2fv7B1 ARG 137 HB2 -0.01 0.02 0.08 -0.04 1.90 1.96 2fv7B1 ARG 137 HB3 -0.01 -0.00 0.07 -0.04 1.80 1.81 2fv7B1 ARG 137 HG2 -0.03 -0.01 0.04 -0.04 1.67 1.64 2fv7B1 ARG 137 HG3 -0.02 0.11 0.04 -0.04 1.67 1.76 2fv7B1 ARG 137 HD2 -0.02 -0.06 -0.05 -0.04 3.22 3.05 2fv7B1 ARG 137 HD3 -0.01 -0.01 -0.01 -0.04 3.22 3.15 2fv7B1 ALA 138 H 0.01 0.45 -0.30 -0.55 8.40 8.01 2fv7B1 ALA 138 HA 0.06 0.02 0.46 -0.75 4.34 4.13 2fv7B1 ALA 138 HB3 0.22 0.04 0.10 -0.04 1.41 1.74 2fv7B1 ALA 139 H -0.20 0.43 -0.59 -0.55 8.40 7.50 2fv7B1 ALA 139 HA -1.27 0.08 0.68 -0.75 4.34 3.07 2fv7B1 ALA 139 HB3 -0.62 0.02 0.07 -0.04 1.41 0.85 2fv7B1 ALA 140 H -0.12 0.54 -0.37 -0.55 8.40 7.91 2fv7B1 ALA 140 HA -0.08 0.02 0.25 -0.75 4.34 3.78 2fv7B1 ALA 140 HB3 -0.03 0.01 0.11 -0.04 1.41 1.45 2fv7B1 ASN 141 H -0.04 0.14 -0.30 -0.55 8.53 7.78 2fv7B1 ASN 141 HA -0.00 0.12 0.36 -0.75 4.76 4.48 2fv7B1 ASN 141 HB2 0.05 -0.01 0.02 -0.04 2.88 2.90 2fv7B1 ASN 141 HB3 0.03 0.05 -0.03 -0.04 2.79 2.79 2fv7B1 ASN 141 HD21 0.03 -0.01 -0.01 -0.04 7.03 7.00 2fv7B1 ASN 141 HD22 0.05 0.02 -0.00 -0.04 7.74 7.77 2fv7B1 VAL 142 H -0.04 0.15 -0.14 -0.55 8.24 7.66 2fv7B1 VAL 142 HA 0.04 0.10 0.55 -0.75 4.13 4.07 2fv7B1 VAL 142 HB -0.06 0.06 0.10 -0.04 2.12 2.19 2fv7B1 VAL 142 HG13 0.07 -0.01 -0.19 -0.04 0.97 0.81 2fv7B1 VAL 142 HG23 0.26 -0.02 -0.02 -0.04 0.95 1.13 2fv7B1 ILE 143 H -0.08 0.46 -0.16 -0.55 8.25 7.92 2fv7B1 ILE 143 HA -0.02 0.02 0.30 -0.75 4.18 3.72 2fv7B1 ILE 143 HB -0.06 0.08 0.00 -0.04 1.89 1.88 2fv7B1 ILE 143 HG12 -0.04 -0.03 -0.07 -0.04 1.49 1.30 2fv7B1 ILE 143 HG13 -0.12 0.06 -0.06 -0.04 1.21 1.05 2fv7B1 ILE 143 HG23 -0.02 0.00 -0.22 -0.04 0.93 0.64 2fv7B1 ILE 143 HD13 -0.06 -0.02 -0.11 -0.04 0.88 0.65 2fv7B1 SER 144 H -0.02 0.35 -0.21 -0.55 8.46 8.03 2fv7B1 SER 144 HA -0.01 0.12 0.42 -0.75 4.49 4.26 2fv7B1 SER 144 HB2 -0.01 0.01 0.09 -0.04 3.95 4.00 2fv7B1 SER 144 HB3 -0.02 -0.05 0.07 -0.04 3.93 3.89 2fv7B1 ARG 145 H -0.00 0.18 -0.40 -0.55 8.46 7.69 2fv7B1 ARG 145 HA -0.01 0.13 0.73 -0.75 4.34 4.44 2fv7B1 ARG 145 HB2 0.01 0.01 0.08 -0.04 1.90 1.96 2fv7B1 ARG 145 HB3 0.00 -0.06 0.12 -0.04 1.80 1.82 2fv7B1 ARG 145 HG2 0.00 -0.03 -0.00 -0.04 1.67 1.60 2fv7B1 ARG 145 HG3 0.00 0.07 0.01 -0.04 1.67 1.72 2fv7B1 ARG 145 HD2 0.02 -0.04 -0.00 -0.04 3.22 3.16 2fv7B1 ARG 145 HD3 0.01 -0.05 0.01 -0.04 3.22 3.15 2fv7B1 ALA 146 H -0.01 0.19 -0.37 -0.55 8.40 7.67 2fv7B1 ALA 146 HA -0.01 0.23 0.72 -0.75 4.34 4.52 2fv7B1 ALA 146 HB3 0.01 0.01 -0.02 -0.04 1.41 1.36 2fv7B1 LYS 147 H -0.04 0.48 0.42 -0.55 8.42 8.72 2fv7B1 LYS 147 HA -0.04 0.16 0.86 -0.75 4.32 4.55 2fv7B1 LYS 147 HB2 -0.11 -0.02 0.23 -0.04 1.87 1.92 2fv7B1 LYS 147 HB3 -0.08 -0.01 0.14 -0.04 1.79 1.79 2fv7B1 LYS 147 HG2 -0.14 -0.04 0.12 -0.04 1.46 1.36 2fv7B1 LYS 147 HG3 -0.19 0.11 0.15 -0.04 1.46 1.48 2fv7B1 LYS 147 HD2 -0.08 -0.04 0.07 -0.04 1.69 1.61 2fv7B1 LYS 147 HD3 -0.06 0.12 -0.12 -0.04 1.68 1.58 2fv7B1 LYS 147 HE2 -0.09 0.02 -0.02 -0.04 2.99 2.87 2fv7B1 LYS 147 HE3 -0.09 -0.06 0.03 -0.04 2.99 2.82 2fv7B1 VAL 148 H -0.00 0.45 0.35 -0.55 8.24 8.48 2fv7B1 VAL 148 HA 0.02 0.31 0.96 -0.75 4.13 4.66 2fv7B1 VAL 148 HB 0.04 -0.11 0.04 -0.04 2.12 2.05 2fv7B1 VAL 148 HG13 0.05 -0.03 -0.15 -0.04 0.97 0.80 2fv7B1 VAL 148 HG23 0.01 0.04 -0.25 -0.04 0.95 0.71 2fv7B1 MET 149 H 0.04 0.71 0.31 -0.55 8.47 8.97 2fv7B1 MET 149 HA 0.03 0.25 0.94 -0.75 4.52 4.99 2fv7B1 MET 149 HB2 0.02 0.05 -0.03 -0.04 2.15 2.14 2fv7B1 MET 149 HB3 0.03 0.14 0.02 -0.04 2.03 2.18 2fv7B1 MET 149 HG2 0.02 0.07 -0.15 -0.04 2.63 2.52 2fv7B1 MET 149 HG3 0.05 -0.12 -0.28 -0.04 2.56 2.17 2fv7B1 MET 149 HE3 0.00 0.01 -0.06 -0.04 2.10 2.02 2fv7B1 VAL 150 H 0.05 0.62 0.38 -0.55 8.24 8.74 2fv7B1 VAL 150 HA 0.08 0.39 1.20 -0.75 4.13 5.03 2fv7B1 VAL 150 HB 0.05 -0.11 0.07 -0.04 2.12 2.09 2fv7B1 VAL 150 HG13 0.04 -0.01 -0.12 -0.04 0.97 0.83 2fv7B1 VAL 150 HG23 0.05 0.02 -0.20 -0.04 0.95 0.79 2fv7B1 CYS 151 H 0.13 0.64 0.45 -0.55 8.50 9.18 2fv7B1 CYS 151 HA 0.10 0.27 0.97 -0.75 4.58 5.16 2fv7B1 CYS 151 HB2 0.31 0.01 0.06 -0.04 2.97 3.31 2fv7B1 CYS 151 HB3 0.26 0.01 0.12 -0.04 2.97 3.32 2fv7B1 GLN 152 H 0.10 0.18 0.27 -0.55 8.47 8.48 2fv7B1 GLN 152 HA -0.16 0.41 0.82 -0.75 4.36 4.67 2fv7B1 GLN 152 HB2 -0.01 -0.24 0.17 -0.04 2.15 2.03 2fv7B1 GLN 152 HB3 -0.09 0.14 0.36 -0.04 2.02 2.39 2fv7B1 GLN 152 HG2 -0.03 -0.11 -0.10 -0.04 2.40 2.11 2fv7B1 GLN 152 HG3 -0.05 0.24 -0.24 -0.04 2.39 2.29 2fv7B1 GLN 152 HE21 0.04 0.09 -0.28 -0.04 6.97 6.77 2fv7B1 GLN 152 HE22 0.02 0.12 -0.35 -0.04 7.69 7.44 2fv7B1 LEU 153 H -0.08 0.58 0.26 -0.55 8.37 8.58 2fv7B1 LEU 153 HA 0.03 0.19 0.93 -0.75 4.35 4.74 2fv7B1 LEU 153 HB2 -0.10 0.01 -0.21 -0.04 1.64 1.30 2fv7B1 LEU 153 HB3 -0.05 0.03 0.14 -0.04 1.64 1.71 2fv7B1 LEU 153 HG -0.00 -0.02 -0.33 -0.04 1.64 1.25 2fv7B1 LEU 153 HD13 -0.16 -0.02 -0.11 -0.04 0.93 0.59 2fv7B1 LEU 153 HD23 -0.27 0.01 0.01 -0.04 0.89 0.60 2fv7B1 GLU 154 H 0.01 0.04 -0.10 -0.55 8.60 8.00 2fv7B1 GLU 154 HA -0.00 0.27 0.93 -0.75 4.29 4.74 2fv7B1 GLU 154 HB2 0.00 -0.15 0.12 -0.04 2.09 2.03 2fv7B1 GLU 154 HB3 -0.00 -0.03 0.21 -0.04 1.99 2.13 2fv7B1 GLU 154 HG2 -0.01 0.14 0.06 -0.04 2.34 2.49 2fv7B1 GLU 154 HG3 -0.02 0.14 -0.02 -0.04 2.34 2.39 2fv7B1 ILE 155 H 0.03 0.15 -0.13 -0.55 8.25 7.75 2fv7B1 ILE 155 HA 0.02 0.19 0.49 -0.75 4.18 4.12 2fv7B1 ILE 155 HB 0.03 0.10 0.16 -0.04 1.89 2.14 2fv7B1 ILE 155 HG12 0.06 -0.14 -0.09 -0.04 1.49 1.28 2fv7B1 ILE 155 HG13 0.06 0.10 -0.32 -0.04 1.21 1.01 2fv7B1 ILE 155 HG23 0.03 -0.03 -0.20 -0.04 0.93 0.69 2fv7B1 ILE 155 HD13 0.05 0.02 -0.18 -0.04 0.88 0.72 2fv7B1 THR 156 H 0.03 0.27 0.13 -0.55 8.28 8.16 2fv7B1 THR 156 HA 0.04 0.15 0.48 -0.75 4.39 4.30 2fv7B1 THR 156 HB 0.02 -0.01 0.18 -0.04 4.32 4.47 2fv7B1 THR 156 HG23 0.03 -0.06 0.02 -0.04 1.22 1.16 2fv7B1 PRO 157 HA 0.22 0.10 0.40 -0.51 4.44 4.65 2fv7B1 PRO 157 HB2 0.17 0.01 0.07 -0.04 2.28 2.49 2fv7B1 PRO 157 HB3 0.31 0.05 0.10 -0.04 2.02 2.44 2fv7B1 PRO 157 HG2 0.08 0.06 0.11 -0.04 2.03 2.23 2fv7B1 PRO 157 HG3 0.06 0.10 0.13 -0.04 2.03 2.28 2fv7B1 PRO 157 HD2 0.06 0.05 0.23 -0.04 3.68 3.98 2fv7B1 PRO 157 HD3 0.05 0.22 0.27 -0.04 3.65 4.15 2fv7B1 ALA 158 H 0.06 0.14 -0.17 -0.55 8.40 7.89 2fv7B1 ALA 158 HA -0.02 0.09 0.37 -0.75 4.34 4.02 2fv7B1 ALA 158 HB3 0.00 0.02 0.03 -0.04 1.41 1.42 2fv7B1 THR 159 H 0.03 0.26 -0.34 -0.55 8.28 7.68 2fv7B1 THR 159 HA -0.00 0.03 0.45 -0.75 4.39 4.10 2fv7B1 THR 159 HB 0.03 0.08 0.03 -0.04 4.32 4.42 2fv7B1 THR 159 HG23 0.01 -0.01 -0.28 -0.04 1.22 0.90 2fv7B1 SER 160 H 0.09 0.38 -0.08 -0.55 8.46 8.30 2fv7B1 SER 160 HA 0.07 0.05 0.42 -0.75 4.49 4.28 2fv7B1 SER 160 HB2 0.28 0.06 0.15 -0.04 3.95 4.40 2fv7B1 SER 160 HB3 0.23 0.01 0.02 -0.04 3.93 4.15 2fv7B1 LEU 161 H -0.00 0.58 -0.15 -0.55 8.37 8.25 2fv7B1 LEU 161 HA -0.35 0.08 0.36 -0.75 4.35 3.68 2fv7B1 LEU 161 HB2 -0.48 0.03 0.03 -0.04 1.64 1.18 2fv7B1 LEU 161 HB3 -0.22 0.06 0.02 -0.04 1.64 1.46 2fv7B1 LEU 161 HG -0.35 0.04 -0.08 -0.04 1.64 1.21 2fv7B1 LEU 161 HD13 -1.29 -0.01 -0.18 -0.04 0.93 -0.60 2fv7B1 LEU 161 HD23 -0.30 -0.02 -0.07 -0.04 0.89 0.46 2fv7B1 GLU 162 H -0.06 0.35 -0.29 -0.55 8.60 8.05 2fv7B1 GLU 162 HA -0.07 0.05 0.48 -0.75 4.29 4.00 2fv7B1 GLU 162 HB2 -0.05 0.01 0.12 -0.04 2.09 2.12 2fv7B1 GLU 162 HB3 -0.03 0.07 0.16 -0.04 1.99 2.14 2fv7B1 GLU 162 HG2 -0.03 -0.09 0.01 -0.04 2.34 2.19 2fv7B1 GLU 162 HG3 -0.03 0.03 -0.19 -0.04 2.34 2.10 2fv7B1 ALA 163 H -0.02 0.49 -0.20 -0.55 8.40 8.13 2fv7B1 ALA 163 HA -0.02 0.01 0.42 -0.75 4.34 4.00 2fv7B1 ALA 163 HB3 0.01 0.02 0.05 -0.04 1.41 1.46 2fv7B1 LEU 164 H -0.04 0.43 -0.26 -0.55 8.37 7.95 2fv7B1 LEU 164 HA -0.01 0.06 0.37 -0.75 4.35 4.02 2fv7B1 LEU 164 HB2 -0.13 0.06 0.11 -0.04 1.64 1.64 2fv7B1 LEU 164 HB3 -0.07 0.10 -0.02 -0.04 1.64 1.62 2fv7B1 LEU 164 HG -0.03 0.13 0.01 -0.04 1.64 1.71 2fv7B1 LEU 164 HD13 -0.28 -0.03 -0.14 -0.04 0.93 0.44 2fv7B1 LEU 164 HD23 0.05 0.01 -0.11 -0.04 0.89 0.79 2fv7B1 THR 165 H -0.07 0.35 -0.23 -0.55 8.28 7.78 2fv7B1 THR 165 HA -0.05 0.08 0.44 -0.75 4.39 4.11 2fv7B1 THR 165 HB -0.05 0.03 0.12 -0.04 4.32 4.37 2fv7B1 THR 165 HG23 -0.04 -0.01 -0.05 -0.04 1.22 1.07 2fv7B1 MET 166 H -0.04 0.51 -0.13 -0.55 8.47 8.26 2fv7B1 MET 166 HA -0.03 0.00 0.36 -0.75 4.52 4.10 2fv7B1 MET 166 HB2 -0.03 0.09 0.09 -0.04 2.15 2.26 2fv7B1 MET 166 HB3 -0.03 -0.00 -0.05 -0.04 2.03 1.90 2fv7B1 MET 166 HG2 -0.03 -0.05 -0.00 -0.04 2.63 2.51 2fv7B1 MET 166 HG3 -0.03 0.13 0.06 -0.04 2.56 2.67 2fv7B1 MET 166 HE3 -0.03 -0.04 -0.13 -0.04 2.10 1.85 2fv7B1 ALA 167 H -0.02 0.46 -0.23 -0.55 8.40 8.07 2fv7B1 ALA 167 HA -0.01 0.08 0.29 -0.75 4.34 3.95 2fv7B1 ALA 167 HB3 0.00 0.02 -0.04 -0.04 1.41 1.35 2fv7B1 ARG 168 H -0.01 0.41 -0.24 -0.55 8.46 8.07 2fv7B1 ARG 168 HA -0.00 0.10 0.45 -0.75 4.34 4.13 2fv7B1 ARG 168 HB2 -0.01 0.16 0.18 -0.04 1.90 2.19 2fv7B1 ARG 168 HB3 -0.02 -0.00 0.19 -0.04 1.80 1.93 2fv7B1 ARG 168 HG2 -0.01 -0.03 0.03 -0.04 1.67 1.62 2fv7B1 ARG 168 HG3 -0.01 -0.06 -0.05 -0.04 1.67 1.52 2fv7B1 ARG 168 HD2 0.01 -0.05 0.03 -0.04 3.22 3.16 2fv7B1 ARG 168 HD3 0.01 0.05 0.08 -0.04 3.22 3.31 2fv7B1 ARG 169 H -0.02 0.57 -0.14 -0.55 8.46 8.31 2fv7B1 ARG 169 HA -0.01 0.02 0.50 -0.75 4.34 4.10 2fv7B1 ARG 169 HB2 -0.02 0.10 0.14 -0.04 1.90 2.09 2fv7B1 ARG 169 HB3 -0.01 -0.07 0.03 -0.04 1.80 1.70 2fv7B1 ARG 169 HG2 -0.02 -0.11 -0.01 -0.04 1.67 1.49 2fv7B1 ARG 169 HG3 -0.02 -0.04 0.04 -0.04 1.67 1.61 2fv7B1 ARG 169 HD2 -0.02 -0.04 -0.06 -0.04 3.22 3.06 2fv7B1 ARG 169 HD3 -0.03 0.05 -0.01 -0.04 3.22 3.20 2fv7B1 SER 170 H -0.01 0.33 -0.39 -0.55 8.46 7.84 2fv7B1 SER 170 HA -0.01 0.09 0.84 -0.75 4.49 4.65 2fv7B1 SER 170 HB2 -0.01 0.07 0.09 -0.04 3.95 4.06 2fv7B1 SER 170 HB3 -0.01 -0.01 0.22 -0.04 3.93 4.09 2fv7B1 GLY 171 H -0.01 0.28 -0.36 -0.55 8.43 7.80 2fv7B1 GLY 171 HA2 -0.00 -0.02 0.29 -0.51 4.01 3.77 2fv7B1 GLY 171 HA3 -0.01 -0.01 0.41 -0.51 4.01 3.90 2fv7B1 VAL 172 H -0.00 0.48 -0.13 -0.55 8.24 8.04 2fv7B1 VAL 172 HA -0.01 0.15 0.52 -0.75 4.13 4.05 2fv7B1 VAL 172 HB -0.00 -0.20 -0.02 -0.04 2.12 1.86 2fv7B1 VAL 172 HG13 0.00 -0.00 -0.56 -0.04 0.97 0.37 2fv7B1 VAL 172 HG23 -0.01 0.18 -0.05 -0.04 0.95 1.03 2fv7B1 LYS 173 H 0.00 0.53 0.22 -0.55 8.42 8.63 2fv7B1 LYS 173 HA 0.03 0.00 0.45 -0.75 4.32 4.04 2fv7B1 LYS 173 HB2 0.01 0.10 0.19 -0.04 1.87 2.13 2fv7B1 LYS 173 HB3 0.02 0.01 0.21 -0.04 1.79 1.99 2fv7B1 LYS 173 HG2 0.05 -0.09 -0.16 -0.04 1.46 1.22 2fv7B1 LYS 173 HG3 0.04 -0.05 0.07 -0.04 1.46 1.48 2fv7B1 LYS 173 HD2 0.03 0.04 -0.03 -0.04 1.69 1.68 2fv7B1 LYS 173 HD3 0.04 -0.09 -0.04 -0.04 1.68 1.55 2fv7B1 LYS 173 HE2 0.01 0.09 0.05 -0.04 2.99 3.11 2fv7B1 LYS 173 HE3 0.02 0.04 0.04 -0.04 2.99 3.04 2fv7B1 THR 174 H 0.05 0.11 0.27 -0.55 8.28 8.16 2fv7B1 THR 174 HA 0.06 0.28 1.11 -0.75 4.39 5.08 2fv7B1 THR 174 HB 0.08 -0.05 0.07 -0.04 4.32 4.38 2fv7B1 THR 174 HG23 0.03 0.08 -0.01 -0.04 1.22 1.27 2fv7B1 LEU 175 H 0.09 0.81 0.38 -0.55 8.37 9.10 2fv7B1 LEU 175 HA 0.11 0.24 1.02 -0.75 4.35 4.96 2fv7B1 LEU 175 HB2 0.07 0.03 -0.08 -0.04 1.64 1.61 2fv7B1 LEU 175 HB3 0.07 0.00 0.13 -0.04 1.64 1.80 2fv7B1 LEU 175 HG 0.04 -0.09 -0.16 -0.04 1.64 1.39 2fv7B1 LEU 175 HD13 0.07 0.03 -0.10 -0.04 0.93 0.88 2fv7B1 LEU 175 HD23 0.04 0.01 -0.11 -0.04 0.89 0.78 2fv7B1 PHE 176 H 0.18 0.73 0.37 -0.55 8.34 9.07 2fv7B1 PHE 176 HA -0.03 0.16 1.08 -0.75 4.62 5.07 2fv7B1 PHE 176 HB2 0.06 0.04 -0.10 -0.04 3.15 3.11 2fv7B1 PHE 176 HB3 0.04 0.05 0.09 -0.04 3.06 3.20 2fv7B1 PHE 176 HD2 -0.02 0.03 -0.19 -0.04 7.28 7.06 2fv7B1 PHE 176 HE2 -0.20 0.03 -0.27 -0.04 7.38 6.90 2fv7B1 PHE 176 HZ -0.72 -0.06 -0.19 -0.04 7.32 6.31 2fv7B1 ASN 177 H -0.41 0.67 0.30 -0.55 8.53 8.54 2fv7B1 ASN 177 HA -0.55 0.44 0.93 -0.75 4.76 4.83 2fv7B1 ASN 177 HB2 -0.16 0.04 0.01 -0.04 2.88 2.73 2fv7B1 ASN 177 HB3 -0.21 0.01 0.30 -0.04 2.79 2.86 2fv7B1 ASN 177 HD21 -0.15 -0.27 -0.07 -0.04 7.03 6.50 2fv7B1 ASN 177 HD22 -0.26 0.85 0.27 -0.04 7.74 8.57 2fv7B1 PRO 178 HA -0.71 0.06 0.28 -0.51 4.44 3.56 2fv7B1 PRO 178 HB2 -0.22 -0.04 0.11 -0.04 2.28 2.09 2fv7B1 PRO 178 HB3 -0.47 0.08 -0.03 -0.04 2.02 1.56 2fv7B1 PRO 178 HG2 -0.38 -0.10 -0.01 -0.04 2.03 1.49 2fv7B1 PRO 178 HG3 -1.00 0.11 -0.07 -0.04 2.03 1.03 2fv7B1 PRO 178 HD2 -0.72 0.28 -0.02 -0.04 3.68 3.18 2fv7B1 PRO 178 HD3 -1.57 0.23 -0.12 -0.04 3.65 2.16 2fv7B1 ALA 179 H -0.29 0.44 0.30 -0.55 8.40 8.30 2fv7B1 ALA 179 HA -0.12 -0.03 0.66 -0.75 4.34 4.09 2fv7B1 ALA 179 HB3 -0.13 -0.00 -0.08 -0.04 1.41 1.16 2fv7B1 PRO 180 HA -0.06 -0.04 0.41 -0.51 4.44 4.25 2fv7B1 PRO 180 HB2 -0.03 0.16 -0.03 -0.04 2.28 2.34 2fv7B1 PRO 180 HB3 -0.03 -0.04 0.11 -0.04 2.02 2.02 2fv7B1 PRO 180 HG2 -0.03 0.14 0.08 -0.04 2.03 2.19 2fv7B1 PRO 180 HG3 -0.02 -0.01 0.08 -0.04 2.03 2.05 2fv7B1 PRO 180 HD2 -0.03 0.27 0.33 -0.04 3.68 4.20 2fv7B1 PRO 180 HD3 -0.03 -0.04 0.01 -0.04 3.65 3.55 2fv7B1 ALA 181 H -0.04 -0.01 0.16 -0.55 8.40 7.97 2fv7B1 ALA 181 HA -0.07 0.17 0.36 -0.75 4.34 4.04 2fv7B1 ALA 181 HB3 -0.01 0.01 0.13 -0.04 1.41 1.50 2fv7B1 ILE 182 H -0.01 0.21 0.12 -0.55 8.25 8.02 2fv7B1 ILE 182 HA 0.01 0.13 0.79 -0.75 4.18 4.36 2fv7B1 ILE 182 HB 0.00 -0.02 0.02 -0.04 1.89 1.85 2fv7B1 ILE 182 HG12 -0.01 0.04 -0.13 -0.04 1.49 1.36 2fv7B1 ILE 182 HG13 -0.04 0.06 -0.08 -0.04 1.21 1.10 2fv7B1 ILE 182 HG23 0.03 -0.04 -0.10 -0.04 0.93 0.77 2fv7B1 ILE 182 HD13 -0.02 -0.00 -0.01 -0.04 0.88 0.81 2fv7B1 ALA 183 H 0.03 0.13 0.07 -0.55 8.40 8.07 2fv7B1 ALA 183 HA 0.05 0.25 0.24 -0.75 4.34 4.12 2fv7B1 ALA 183 HB3 0.03 -0.00 0.08 -0.04 1.41 1.47 2fv7B1 ASP 184 H 0.05 -0.02 -0.29 -0.55 8.40 7.59 2fv7B1 ASP 184 HA 0.08 0.31 0.78 -0.75 4.63 5.05 2fv7B1 ASP 184 HB2 0.05 -0.09 0.09 -0.04 2.71 2.72 2fv7B1 ASP 184 HB3 0.06 0.03 0.11 -0.04 2.70 2.86 2fv7B1 LEU 185 H 0.13 0.38 -0.34 -0.55 8.37 7.99 2fv7B1 LEU 185 HA 0.09 -0.11 0.32 -0.75 4.35 3.89 2fv7B1 LEU 185 HB2 0.07 0.12 0.10 -0.04 1.64 1.89 2fv7B1 LEU 185 HB3 0.18 0.07 0.02 -0.04 1.64 1.87 2fv7B1 LEU 185 HG -0.03 0.09 -0.11 -0.04 1.64 1.55 2fv7B1 LEU 185 HD13 -0.38 -0.05 0.02 -0.04 0.93 0.48 2fv7B1 LEU 185 HD23 -0.05 -0.00 -0.07 -0.04 0.89 0.72 2fv7B1 ASP 186 H 0.27 -0.00 0.17 -0.55 8.40 8.29 2fv7B1 ASP 186 HA 0.15 0.16 0.44 -0.75 4.63 4.62 2fv7B1 ASP 186 HB2 0.18 0.02 0.16 -0.04 2.71 3.03 2fv7B1 ASP 186 HB3 0.22 -0.09 0.11 -0.04 2.70 2.90 2fv7B1 PRO 187 HA 0.44 0.14 0.44 -0.51 4.44 4.96 2fv7B1 PRO 187 HB2 0.07 -0.02 0.03 -0.04 2.28 2.32 2fv7B1 PRO 187 HB3 0.09 0.12 0.11 -0.04 2.02 2.30 2fv7B1 PRO 187 HG2 0.06 0.02 0.09 -0.04 2.03 2.16 2fv7B1 PRO 187 HG3 0.10 0.11 0.11 -0.04 2.03 2.32 2fv7B1 PRO 187 HD2 0.08 0.01 0.22 -0.04 3.68 3.96 2fv7B1 PRO 187 HD3 0.13 0.24 0.20 -0.04 3.65 4.18 2fv7B1 GLN 188 H 0.02 0.04 -0.39 -0.55 8.47 7.59 2fv7B1 GLN 188 HA 0.00 0.15 0.31 -0.75 4.36 4.06 2fv7B1 GLN 188 HB2 -0.09 -0.04 0.03 -0.04 2.15 2.01 2fv7B1 GLN 188 HB3 -0.25 -0.00 -0.10 -0.04 2.02 1.62 2fv7B1 GLN 188 HG2 -0.10 0.05 -0.02 -0.04 2.40 2.28 2fv7B1 GLN 188 HG3 -0.05 0.04 -0.02 -0.04 2.39 2.33 2fv7B1 GLN 188 HE21 -0.07 -0.02 -0.04 -0.04 6.97 6.80 2fv7B1 GLN 188 HE22 -0.07 0.06 -0.05 -0.04 7.69 7.59 2fv7B1 PHE 189 H -0.02 0.33 -0.29 -0.55 8.34 7.81 2fv7B1 PHE 189 HA -0.26 0.03 0.33 -0.75 4.62 3.96 2fv7B1 PHE 189 HB2 -0.31 0.19 -0.02 -0.04 3.15 2.98 2fv7B1 PHE 189 HB3 -0.36 -0.01 -0.15 -0.04 3.06 2.49 2fv7B1 PHE 189 HD2 -0.61 0.12 -0.03 -0.04 7.28 6.72 2fv7B1 PHE 189 HE2 -0.16 -0.06 -0.08 -0.04 7.38 7.04 2fv7B1 PHE 189 HZ -0.06 -0.05 0.03 -0.04 7.32 7.20 2fv7B1 TYR 190 H 0.13 0.29 -0.33 -0.55 8.29 7.82 2fv7B1 TYR 190 HA 0.12 0.00 0.31 -0.75 4.56 4.24 2fv7B1 TYR 190 HB2 0.00 0.28 0.04 -0.04 3.06 3.34 2fv7B1 TYR 190 HB3 -0.09 -0.05 -0.29 -0.04 2.98 2.51 2fv7B1 TYR 190 HD2 -0.30 0.05 0.02 -0.04 7.15 6.88 2fv7B1 TYR 190 HE2 -0.05 0.02 -0.13 -0.04 6.85 6.65 2fv7B1 THR 191 H 0.14 0.21 -0.14 -0.55 8.28 7.95 2fv7B1 THR 191 HA 0.07 0.26 0.33 -0.75 4.39 4.30 2fv7B1 THR 191 HB 0.02 -0.02 0.08 -0.04 4.32 4.36 2fv7B1 THR 191 HG23 0.05 0.02 0.07 -0.04 1.22 1.32 2fv7B1 LEU 192 H 0.03 0.21 -0.55 -0.55 8.37 7.51 2fv7B1 LEU 192 HA 0.00 0.16 0.72 -0.75 4.35 4.48 2fv7B1 LEU 192 HB2 -0.10 0.02 -0.02 -0.04 1.64 1.50 2fv7B1 LEU 192 HB3 -0.06 -0.08 0.00 -0.04 1.64 1.47 2fv7B1 LEU 192 HG -0.08 0.05 -0.11 -0.04 1.64 1.46 2fv7B1 LEU 192 HD13 -0.19 -0.06 -0.12 -0.04 0.93 0.52 2fv7B1 LEU 192 HD23 -0.04 0.02 -0.10 -0.04 0.89 0.73 2fv7B1 SER 193 H 0.12 0.40 -0.43 -0.55 8.46 8.00 2fv7B1 SER 193 HA 0.14 0.05 0.77 -0.75 4.49 4.70 2fv7B1 SER 193 HB2 0.34 0.11 0.10 -0.04 3.95 4.46 2fv7B1 SER 193 HB3 0.38 -0.08 -0.26 -0.04 3.93 3.93 2fv7B1 ASP 194 H 0.11 0.22 0.28 -0.55 8.40 8.46 2fv7B1 ASP 194 HA 0.08 0.09 0.74 -0.75 4.63 4.79 2fv7B1 ASP 194 HB2 0.07 0.12 0.31 -0.04 2.71 3.18 2fv7B1 ASP 194 HB3 0.06 -0.02 0.10 -0.04 2.70 2.80 2fv7B1 VAL 195 H 0.13 0.62 0.33 -0.55 8.24 8.77 2fv7B1 VAL 195 HA 0.14 0.16 0.92 -0.75 4.13 4.60 2fv7B1 VAL 195 HB 0.10 -0.05 0.16 -0.04 2.12 2.29 2fv7B1 VAL 195 HG13 0.11 -0.02 -0.19 -0.04 0.97 0.83 2fv7B1 VAL 195 HG23 0.08 0.01 -0.15 -0.04 0.95 0.85 2fv7B1 PHE 196 H 0.28 0.73 0.23 -0.55 8.34 9.03 2fv7B1 PHE 196 HA 0.12 0.22 0.93 -0.75 4.62 5.13 2fv7B1 PHE 196 HB2 0.17 0.05 0.01 -0.04 3.15 3.34 2fv7B1 PHE 196 HB3 0.12 0.02 0.26 -0.04 3.06 3.43 2fv7B1 PHE 196 HD2 0.20 0.01 -0.14 -0.04 7.28 7.30 2fv7B1 PHE 196 HE2 0.07 -0.06 -0.17 -0.04 7.38 7.18 2fv7B1 PHE 196 HZ 0.07 -0.04 -0.09 -0.04 7.32 7.22 2fv7B1 CYS 197 H -0.26 0.72 0.33 -0.55 8.50 8.74 2fv7B1 CYS 197 HA 0.06 0.31 1.11 -0.75 4.58 5.31 2fv7B1 CYS 197 HB2 0.09 0.02 -0.22 -0.04 2.97 2.82 2fv7B1 CYS 197 HB3 -0.01 -0.02 0.02 -0.04 2.97 2.92 2fv7B1 CYS 198 H -0.01 0.65 0.37 -0.55 8.50 8.97 2fv7B1 CYS 198 HA -0.14 0.07 0.68 -0.75 4.58 4.44 2fv7B1 CYS 198 HB2 -0.10 -0.18 0.12 -0.04 2.97 2.77 2fv7B1 CYS 198 HB3 -0.24 0.11 -0.21 -0.04 2.97 2.60 2fv7B1 ASN 199 H -0.07 0.05 0.17 -0.55 8.53 8.14 2fv7B1 ASN 199 HA -0.07 0.29 0.99 -0.75 4.76 5.22 2fv7B1 ASN 199 HB2 -0.06 0.05 0.20 -0.04 2.88 3.03 2fv7B1 ASN 199 HB3 -0.07 0.03 0.05 -0.04 2.79 2.76 2fv7B1 ASN 199 HD21 -0.03 0.03 0.04 -0.04 7.03 7.02 2fv7B1 ASN 199 HD22 -0.04 0.04 0.04 -0.04 7.74 7.73 2fv7B1 GLU 200 H -0.04 0.30 0.22 -0.55 8.60 8.54 2fv7B1 GLU 200 HA -0.01 0.11 0.43 -0.75 4.29 4.06 2fv7B1 GLU 200 HB2 -0.02 -0.08 0.15 -0.04 2.09 2.09 2fv7B1 GLU 200 HB3 -0.02 0.18 0.05 -0.04 1.99 2.17 2fv7B1 SER 201 H -0.02 0.04 -0.10 -0.55 8.46 7.84 2fv7B1 SER 201 HA -0.01 0.17 0.50 -0.75 4.49 4.40 2fv7B1 SER 201 HB2 -0.02 -0.10 0.09 -0.04 3.95 3.88 2fv7B1 SER 201 HB3 -0.01 0.08 0.01 -0.04 3.93 3.97 2fv7B1 GLU 202 H -0.02 -0.00 -0.11 -0.55 8.60 7.92 2fv7B1 GLU 202 HA -0.01 0.07 0.57 -0.75 4.29 4.17 2fv7B1 GLU 202 HB2 -0.04 -0.06 0.16 -0.04 2.09 2.11 2fv7B1 GLU 202 HB3 -0.04 0.21 0.08 -0.04 1.99 2.20 2fv7B1 GLU 202 HG2 -0.07 0.06 0.19 -0.04 2.34 2.48 2fv7B1 GLU 202 HG3 -0.04 -0.08 0.09 -0.04 2.34 2.28 2fv7B1 ALA 203 H 0.02 0.48 -0.17 -0.55 8.40 8.18 2fv7B1 ALA 203 HA 0.09 0.07 0.38 -0.75 4.34 4.12 2fv7B1 ALA 203 HB3 0.04 0.03 -0.02 -0.04 1.41 1.41 2fv7B1 GLU 204 H 0.01 0.31 -0.29 -0.55 8.60 8.09 2fv7B1 GLU 204 HA 0.01 0.19 0.57 -0.75 4.29 4.31 2fv7B1 GLU 204 HB2 0.00 0.08 0.18 -0.04 2.09 2.32 2fv7B1 GLU 204 HB3 0.01 -0.01 -0.01 -0.04 1.99 1.94 2fv7B1 GLU 204 HG2 0.00 0.12 0.19 -0.04 2.34 2.61 2fv7B1 GLU 204 HG3 0.00 0.28 0.17 -0.04 2.34 2.75 2fv7B1 ILE 205 H 0.02 0.35 -0.15 -0.55 8.25 7.91 2fv7B1 ILE 205 HA 0.02 0.04 0.43 -0.75 4.18 3.92 2fv7B1 ILE 205 HB 0.02 0.06 0.15 -0.04 1.89 2.08 2fv7B1 ILE 205 HG12 0.01 -0.01 0.02 -0.04 1.49 1.46 2fv7B1 ILE 205 HG13 0.01 0.16 0.09 -0.04 1.21 1.43 2fv7B1 ILE 205 HG23 0.02 0.03 -0.37 -0.04 0.93 0.57 2fv7B1 ILE 205 HD13 -0.00 -0.04 -0.01 -0.04 0.88 0.79 2fv7B1 LEU 206 H 0.06 0.46 -0.13 -0.55 8.37 8.21 2fv7B1 LEU 206 HA 0.10 0.13 0.37 -0.75 4.35 4.20 2fv7B1 LEU 206 HB2 0.14 -0.01 0.08 -0.04 1.64 1.81 2fv7B1 LEU 206 HB3 0.22 0.02 -0.01 -0.04 1.64 1.83 2fv7B1 LEU 206 HG 0.10 0.06 0.02 -0.04 1.64 1.78 2fv7B1 LEU 206 HD13 0.30 -0.03 -0.12 -0.04 0.93 1.04 2fv7B1 LEU 206 HD23 0.16 0.00 -0.01 -0.04 0.89 1.01 2fv7B1 THR 207 H 0.04 0.28 -0.21 -0.55 8.28 7.85 2fv7B1 THR 207 HA 0.01 0.22 0.80 -0.75 4.39 4.66 2fv7B1 THR 207 HB -0.00 -0.03 0.07 -0.04 4.32 4.31 2fv7B1 THR 207 HG23 0.02 0.01 -0.01 -0.04 1.22 1.19 2fv7B1 GLY 208 H 0.02 0.50 -0.04 -0.55 8.43 8.36 2fv7B1 GLY 208 HA2 0.01 0.03 0.34 -0.51 4.01 3.88 2fv7B1 GLY 208 HA3 0.01 0.05 0.54 -0.51 4.01 4.11 2fv7B1 LEU 209 H 0.01 0.05 -0.23 -0.55 8.37 7.64 2fv7B1 LEU 209 HA -0.00 0.13 0.69 -0.75 4.35 4.41 2fv7B1 LEU 209 HB2 0.00 -0.04 -0.08 -0.04 1.64 1.48 2fv7B1 LEU 209 HB3 -0.00 0.01 -0.07 -0.04 1.64 1.53 2fv7B1 LEU 209 HG -0.00 0.12 -0.20 -0.04 1.64 1.52 2fv7B1 LEU 209 HD13 -0.01 -0.01 -0.15 -0.04 0.93 0.72 2fv7B1 LEU 209 HD23 -0.01 0.00 -0.04 -0.04 0.89 0.81 2fv7B1 THR 210 H -0.00 0.16 0.11 -0.55 8.28 8.00 2fv7B1 THR 210 HA -0.00 0.11 0.65 -0.75 4.39 4.39 2fv7B1 THR 210 HB -0.01 -0.02 0.12 -0.04 4.32 4.37 2fv7B1 THR 210 HG23 -0.01 -0.02 -0.17 -0.04 1.22 0.98 2fv7B1 VAL 211 H -0.01 0.24 0.00 -0.55 8.24 7.92 2fv7B1 VAL 211 HA -0.01 0.07 0.78 -0.75 4.13 4.21 2fv7B1 VAL 211 HB -0.01 0.06 0.15 -0.04 2.12 2.28 2fv7B1 VAL 211 HG13 -0.02 -0.03 -0.12 -0.04 0.97 0.76 2fv7B1 VAL 211 HG23 -0.00 0.05 -0.37 -0.04 0.95 0.59 2fv7B1 GLY 212 H -0.02 0.19 -0.04 -0.55 8.43 8.02 2fv7B1 GLY 212 HA2 -0.02 0.20 0.77 -0.51 4.01 4.45 2fv7B1 GLY 212 HA3 -0.02 0.06 0.29 -0.51 4.01 3.83 2fv7B1 SER 213 H -0.03 0.18 0.07 -0.55 8.46 8.13 2fv7B1 SER 213 HA -0.05 0.22 0.31 -0.75 4.49 4.21 2fv7B1 SER 213 HB2 -0.06 -0.00 0.21 -0.04 3.95 4.07 2fv7B1 SER 213 HB3 -0.03 0.26 0.00 -0.04 3.93 4.12 2fv7B1 ALA 214 H -0.14 0.26 0.13 -0.55 8.40 8.10 2fv7B1 ALA 214 HA -0.14 0.13 0.49 -0.75 4.34 4.07 2fv7B1 ALA 214 HB3 -0.47 0.06 0.03 -0.04 1.41 0.99 2fv7B1 ALA 215 H -0.08 0.10 -0.06 -0.55 8.40 7.81 2fv7B1 ALA 215 HA -0.04 0.17 0.49 -0.75 4.34 4.21 2fv7B1 ALA 215 HB3 -0.03 0.04 0.03 -0.04 1.41 1.41 2fv7B1 ASP 216 H -0.04 -0.01 -0.34 -0.55 8.40 7.45 2fv7B1 ASP 216 HA -0.02 0.16 0.50 -0.75 4.63 4.52 2fv7B1 ASP 216 HB2 -0.03 -0.12 0.15 -0.04 2.71 2.67 2fv7B1 ASP 216 HB3 -0.02 0.25 0.15 -0.04 2.70 3.04 2fv7B1 ALA 217 H -0.04 0.34 -0.21 -0.55 8.40 7.95 2fv7B1 ALA 217 HA -0.01 0.02 0.36 -0.75 4.34 3.96 2fv7B1 ALA 217 HB3 -0.03 0.04 0.01 -0.04 1.41 1.39 2fv7B1 GLY 218 H -0.02 0.38 -0.33 -0.55 8.43 7.91 2fv7B1 GLY 218 HA2 0.01 0.04 0.37 -0.51 4.01 3.92 2fv7B1 GLY 218 HA3 -0.00 0.09 0.23 -0.51 4.01 3.81 2fv7B1 GLU 219 H -0.01 0.34 -0.25 -0.55 8.60 8.14 2fv7B1 GLU 219 HA -0.01 0.07 0.50 -0.75 4.29 4.10 2fv7B1 GLU 219 HB2 -0.01 0.14 0.17 -0.04 2.09 2.34 2fv7B1 GLU 219 HB3 -0.01 -0.02 -0.01 -0.04 1.99 1.91 2fv7B1 GLU 219 HG2 -0.01 -0.01 0.05 -0.04 2.34 2.33 2fv7B1 GLU 219 HG3 -0.01 0.18 0.12 -0.04 2.34 2.59 2fv7B1 ALA 220 H -0.00 0.44 -0.16 -0.55 8.40 8.13 2fv7B1 ALA 220 HA -0.00 0.06 0.38 -0.75 4.34 4.02 2fv7B1 ALA 220 HB3 0.01 0.00 -0.03 -0.04 1.41 1.35 2fv7B1 ALA 221 H 0.01 0.57 -0.26 -0.55 8.40 8.17 2fv7B1 ALA 221 HA 0.03 -0.02 0.33 -0.75 4.34 3.92 2fv7B1 ALA 221 HB3 0.03 0.03 -0.04 -0.04 1.41 1.39 2fv7B1 LEU 222 H -0.00 0.41 -0.31 -0.55 8.37 7.91 2fv7B1 LEU 222 HA -0.01 0.07 0.38 -0.75 4.35 4.03 2fv7B1 LEU 222 HB2 -0.01 0.10 0.13 -0.04 1.64 1.82 2fv7B1 LEU 222 HB3 -0.02 0.07 0.08 -0.04 1.64 1.73 2fv7B1 LEU 222 HG -0.02 -0.04 -0.09 -0.04 1.64 1.46 2fv7B1 LEU 222 HD13 -0.01 0.02 0.02 -0.04 0.93 0.92 2fv7B1 LEU 222 HD23 -0.01 -0.01 -0.01 -0.04 0.89 0.81 2fv7B1 VAL 223 H -0.03 0.34 -0.20 -0.55 8.24 7.80 2fv7B1 VAL 223 HA -0.06 0.04 0.48 -0.75 4.13 3.83 2fv7B1 VAL 223 HB -0.04 0.12 0.15 -0.04 2.12 2.31 2fv7B1 VAL 223 HG13 -0.07 0.00 -0.09 -0.04 0.97 0.76 2fv7B1 VAL 223 HG23 -0.03 0.02 0.04 -0.04 0.95 0.94 2fv7B1 LEU 224 H -0.06 0.39 -0.19 -0.55 8.37 7.97 2fv7B1 LEU 224 HA -0.27 0.03 0.32 -0.75 4.35 3.67 2fv7B1 LEU 224 HB2 -0.05 0.12 0.07 -0.04 1.64 1.73 2fv7B1 LEU 224 HB3 -0.28 -0.05 -0.03 -0.04 1.64 1.25 2fv7B1 LEU 224 HG 0.01 0.22 0.02 -0.04 1.64 1.84 2fv7B1 LEU 224 HD13 0.20 -0.04 -0.12 -0.04 0.93 0.93 2fv7B1 LEU 224 HD23 0.08 -0.02 -0.09 -0.04 0.89 0.81 2fv7B1 LEU 225 H -0.06 0.53 -0.24 -0.55 8.37 8.05 2fv7B1 LEU 225 HA -0.05 0.03 0.38 -0.75 4.35 3.97 2fv7B1 LEU 225 HB2 -0.01 0.02 -0.02 -0.04 1.64 1.59 2fv7B1 LEU 225 HB3 -0.03 0.10 0.03 -0.04 1.64 1.70 2fv7B1 LEU 225 HG -0.01 0.03 -0.19 -0.04 1.64 1.44 2fv7B1 LEU 225 HD13 0.02 -0.03 -0.44 -0.04 0.93 0.43 2fv7B1 LEU 225 HD23 0.00 0.01 -0.17 -0.04 0.89 0.69 2fv7B1 LYS 226 H -0.08 0.48 -0.19 -0.55 8.42 8.08 2fv7B1 LYS 226 HA -0.05 0.05 0.50 -0.75 4.32 4.07 2fv7B1 LYS 226 HB2 -0.08 0.10 0.15 -0.04 1.87 2.00 2fv7B1 LYS 226 HB3 -0.06 -0.08 0.06 -0.04 1.79 1.67 2fv7B1 LYS 226 HG2 -0.04 0.13 0.06 -0.04 1.46 1.57 2fv7B1 LYS 226 HG3 -0.04 -0.09 -0.01 -0.04 1.46 1.28 2fv7B1 LYS 226 HD2 -0.03 -0.05 0.02 -0.04 1.69 1.59 2fv7B1 LYS 226 HD3 -0.03 0.02 0.03 -0.04 1.68 1.66 2fv7B1 LYS 226 HE2 -0.02 0.03 -0.02 -0.04 2.99 2.93 2fv7B1 LYS 226 HE3 -0.02 -0.04 -0.03 -0.04 2.99 2.86 2fv7B1 ARG 227 H -0.19 0.29 -0.41 -0.55 8.46 7.61 2fv7B1 ARG 227 HA -0.16 0.04 0.51 -0.75 4.34 3.97 2fv7B1 ARG 227 HB2 -0.61 0.18 0.09 -0.04 1.90 1.51 2fv7B1 ARG 227 HB3 -0.73 -0.10 0.10 -0.04 1.80 1.03 2fv7B1 ARG 227 HG2 -0.31 -0.06 0.02 -0.04 1.67 1.28 2fv7B1 ARG 227 HG3 -0.30 0.24 0.03 -0.04 1.67 1.60 2fv7B1 ARG 227 HD2 -0.88 -0.05 -0.05 -0.04 3.22 2.20 2fv7B1 ARG 227 HD3 -1.05 -0.05 -0.00 -0.04 3.22 2.07 2fv7B1 GLY 228 H -0.07 0.31 -0.51 -0.55 8.43 7.61 2fv7B1 GLY 228 HA2 -0.00 0.02 0.12 -0.51 4.01 3.63 2fv7B1 GLY 228 HA3 0.03 0.06 0.65 -0.51 4.01 4.24 2fv7B1 CYS 229 H -0.02 0.08 0.00 -0.55 8.50 8.01 2fv7B1 CYS 229 HA 0.10 0.35 0.53 -0.75 4.58 4.81 2fv7B1 CYS 229 HB2 0.00 -0.09 -0.22 -0.04 2.97 2.62 2fv7B1 CYS 229 HB3 0.12 0.03 -0.05 -0.04 2.97 3.03 2fv7B1 GLN 230 H 0.09 0.42 0.31 -0.55 8.47 8.74 2fv7B1 GLN 230 HA 0.04 0.06 0.75 -0.75 4.36 4.47 2fv7B1 GLN 230 HB2 0.07 0.26 0.44 -0.04 2.15 2.88 2fv7B1 GLN 230 HB3 0.05 -0.15 0.14 -0.04 2.02 2.01 2fv7B1 GLN 230 HG2 0.05 0.17 0.12 -0.04 2.40 2.71 2fv7B1 GLN 230 HG3 0.04 -0.06 0.10 -0.04 2.39 2.43 2fv7B1 GLN 230 HE21 0.02 -0.04 0.05 -0.04 6.97 6.96 2fv7B1 GLN 230 HE22 0.03 -0.06 0.09 -0.04 7.69 7.70 2fv7B1 VAL 231 H 0.10 0.44 0.26 -0.55 8.24 8.50 2fv7B1 VAL 231 HA 0.07 0.19 0.97 -0.75 4.13 4.60 2fv7B1 VAL 231 HB 0.10 0.01 0.27 -0.04 2.12 2.45 2fv7B1 VAL 231 HG13 0.09 -0.01 -0.12 -0.04 0.97 0.88 2fv7B1 VAL 231 HG23 0.06 -0.02 -0.05 -0.04 0.95 0.89 2fv7B1 VAL 232 H 0.08 0.71 0.27 -0.55 8.24 8.76 2fv7B1 VAL 232 HA 0.21 0.30 1.00 -0.75 4.13 4.88 2fv7B1 VAL 232 HB 0.06 -0.04 0.05 -0.04 2.12 2.15 2fv7B1 VAL 232 HG13 0.15 -0.02 -0.16 -0.04 0.97 0.89 2fv7B1 VAL 232 HG23 0.03 0.01 -0.29 -0.04 0.95 0.66 2fv7B1 ILE 233 H 0.17 0.73 0.36 -0.55 8.25 8.96 2fv7B1 ILE 233 HA 0.09 0.34 1.05 -0.75 4.18 4.91 2fv7B1 ILE 233 HB 0.15 -0.08 0.08 -0.04 1.89 1.99 2fv7B1 ILE 233 HG12 0.13 0.03 -0.13 -0.04 1.49 1.49 2fv7B1 ILE 233 HG13 0.13 -0.05 -0.43 -0.04 1.21 0.82 2fv7B1 ILE 233 HG23 0.15 -0.02 -0.21 -0.04 0.93 0.81 2fv7B1 ILE 233 HD13 0.18 -0.00 -0.16 -0.04 0.88 0.85 2fv7B1 ILE 234 H 0.04 0.60 0.26 -0.55 8.25 8.60 2fv7B1 ILE 234 HA 0.01 0.30 0.95 -0.75 4.18 4.68 2fv7B1 ILE 234 HB 0.01 -0.04 0.06 -0.04 1.89 1.89 2fv7B1 ILE 234 HG12 0.07 0.01 -0.13 -0.04 1.49 1.39 2fv7B1 ILE 234 HG13 0.07 0.02 -0.33 -0.04 1.21 0.94 2fv7B1 ILE 234 HG23 -0.01 -0.02 -0.32 -0.04 0.93 0.53 2fv7B1 ILE 234 HD13 0.03 0.03 -0.14 -0.04 0.88 0.77 2fv7B1 THR 235 H -0.10 0.63 0.34 -0.55 8.28 8.59 2fv7B1 THR 235 HA -0.21 0.24 0.85 -0.75 4.39 4.51 2fv7B1 THR 235 HB -0.31 0.00 0.09 -0.04 4.32 4.07 2fv7B1 THR 235 HG23 -0.71 0.04 -0.09 -0.04 1.22 0.42 2fv7B1 LEU 236 H -0.10 0.89 0.16 -0.55 8.37 8.77 2fv7B1 LEU 236 HA -0.05 0.08 0.76 -0.75 4.35 4.40 2fv7B1 LEU 236 HB2 0.01 0.07 -0.52 -0.04 1.64 1.16 2fv7B1 LEU 236 HB3 -0.02 -0.07 -0.08 -0.04 1.64 1.42 2fv7B1 LEU 236 HG -0.02 0.13 -0.43 -0.04 1.64 1.28 2fv7B1 LEU 236 HD13 -0.05 0.01 -0.28 -0.04 0.93 0.57 2fv7B1 LEU 236 HD23 -0.04 0.01 -0.30 -0.04 0.89 0.52 2fv7B1 GLY 237 H -0.07 0.08 -0.08 -0.55 8.43 7.81 2fv7B1 GLY 237 HA2 -0.04 0.05 0.32 -0.51 4.01 3.83 2fv7B1 GLY 237 HA3 -0.03 0.02 0.44 -0.51 4.01 3.94 2fv7B1 ALA 238 H -0.01 0.12 0.23 -0.55 8.40 8.19 2fv7B1 ALA 238 HA -0.01 0.14 0.34 -0.75 4.34 4.05 2fv7B1 ALA 238 HB3 -0.00 0.01 0.11 -0.04 1.41 1.50 2fv7B1 GLU 239 H 0.01 0.42 -0.29 -0.55 8.60 8.19 2fv7B1 GLU 239 HA 0.09 0.13 0.58 -0.75 4.29 4.33 2fv7B1 GLU 239 HB2 0.02 0.12 -0.00 -0.04 2.09 2.18 2fv7B1 GLU 239 HB3 0.10 -0.06 0.02 -0.04 1.99 2.01 2fv7B1 GLY 240 H 0.01 0.40 -0.53 -0.55 8.43 7.76 2fv7B1 GLY 240 HA2 -0.00 0.03 0.20 -0.51 4.01 3.73 2fv7B1 GLY 240 HA3 0.02 0.30 0.57 -0.51 4.01 4.38 2fv7B1 CYS 241 H 0.07 0.62 0.32 -0.55 8.50 8.96 2fv7B1 CYS 241 HA -0.02 0.04 0.54 -0.75 4.58 4.39 2fv7B1 CYS 241 HB2 -0.06 0.03 -0.02 -0.04 2.97 2.88 2fv7B1 CYS 241 HB3 -0.23 -0.01 -0.13 -0.04 2.97 2.56 2fv7B1 VAL 242 H 0.03 0.51 0.30 -0.55 8.24 8.53 2fv7B1 VAL 242 HA 0.10 0.31 0.97 -0.75 4.13 4.76 2fv7B1 VAL 242 HB 0.04 -0.07 -0.08 -0.04 2.12 1.97 2fv7B1 VAL 242 HG13 0.02 -0.01 -0.10 -0.04 0.97 0.84 2fv7B1 VAL 242 HG23 0.04 0.01 -0.26 -0.04 0.95 0.69 2fv7B1 VAL 243 H 0.06 0.50 0.30 -0.55 8.24 8.55 2fv7B1 VAL 243 HA 0.07 0.37 1.19 -0.75 4.13 5.00 2fv7B1 VAL 243 HB 0.08 -0.06 -0.14 -0.04 2.12 1.97 2fv7B1 VAL 243 HG13 0.05 0.02 -0.01 -0.04 0.97 0.99 2fv7B1 VAL 243 HG23 0.07 0.01 -0.13 -0.04 0.95 0.86 2fv7B1 LEU 244 H 0.06 0.64 0.38 -0.55 8.37 8.90 2fv7B1 LEU 244 HA 0.03 0.28 0.65 -0.75 4.35 4.57 2fv7B1 LEU 244 HB2 0.03 -0.08 -0.06 -0.04 1.64 1.50 2fv7B1 LEU 244 HB3 0.02 0.12 -0.04 -0.04 1.64 1.70 2fv7B1 LEU 244 HG 0.02 0.08 -0.29 -0.04 1.64 1.41 2fv7B1 LEU 244 HD13 0.03 -0.09 -0.42 -0.04 0.93 0.41 2fv7B1 LEU 244 HD23 0.01 0.04 -0.17 -0.04 0.89 0.73 2fv7B1 SER 245 H 0.03 0.45 -0.04 -0.55 8.46 8.36 2fv7B1 SER 245 HA 0.04 0.30 0.75 -0.75 4.49 4.82 2fv7B1 SER 245 HB2 0.03 0.07 0.25 -0.04 3.95 4.26 2fv7B1 SER 245 HB3 0.04 0.03 -0.03 -0.04 3.93 3.93 2fv7B1 GLN 246 H 0.03 0.55 0.30 -0.55 8.47 8.80 2fv7B1 GLN 246 HA 0.01 0.11 0.52 -0.75 4.36 4.24 2fv7B1 GLN 246 HB2 0.02 -0.07 0.18 -0.04 2.15 2.24 2fv7B1 GLN 246 HB3 0.01 -0.03 0.08 -0.04 2.02 2.04 2fv7B1 GLN 246 HG2 0.02 0.17 0.24 -0.04 2.40 2.80 2fv7B1 GLN 246 HG3 0.02 -0.02 0.11 -0.04 2.39 2.45 2fv7B1 GLN 246 HE21 -0.01 -0.00 -0.01 -0.04 6.97 6.91 2fv7B1 GLN 246 HE22 0.01 0.54 -0.06 -0.04 7.69 8.14 2fv7B1 THR 247 H 0.02 0.02 -0.09 -0.55 8.28 7.68 2fv7B1 THR 247 HA 0.01 0.16 0.57 -0.75 4.39 4.38 2fv7B1 THR 247 HB 0.01 0.01 0.05 -0.04 4.32 4.35 2fv7B1 THR 247 HG23 0.01 0.01 0.01 -0.04 1.22 1.22 2fv7B1 GLU 248 H 0.02 -0.00 -0.24 -0.55 8.60 7.83 2fv7B1 GLU 248 HA 0.01 0.20 0.76 -0.75 4.29 4.51 2fv7B1 PRO 249 HA 0.01 0.04 0.40 -0.51 4.44 4.38 2fv7B1 PRO 249 HB2 0.00 -0.05 0.03 -0.04 2.28 2.22 2fv7B1 PRO 249 HB3 0.01 0.14 0.09 -0.04 2.02 2.21 2fv7B1 PRO 249 HG2 0.00 -0.05 -0.05 -0.04 2.03 1.90 2fv7B1 PRO 249 HG3 0.00 0.08 0.00 -0.04 2.03 2.08 2fv7B1 PRO 249 HD2 0.01 0.04 0.04 -0.04 3.68 3.72 2fv7B1 PRO 249 HD3 0.01 0.27 -0.44 -0.04 3.65 3.44 2fv7B1 GLU 250 H 0.01 0.02 -0.44 -0.55 8.60 7.65 2fv7B1 GLU 250 HA 0.01 0.09 0.61 -0.75 4.29 4.25 2fv7B1 GLU 250 HB2 0.01 -0.03 0.05 -0.04 2.09 2.07 2fv7B1 GLU 250 HB3 0.01 -0.03 0.04 -0.04 1.99 1.98 2fv7B1 GLU 250 HG2 0.01 0.17 -0.16 -0.04 2.34 2.32 2fv7B1 GLU 250 HG3 0.01 -0.03 0.03 -0.04 2.34 2.31 2fv7B1 PRO 251 HA 0.03 0.26 0.38 -0.51 4.44 4.61 2fv7B1 PRO 251 HB2 0.02 -0.08 -0.03 -0.04 2.28 2.14 2fv7B1 PRO 251 HB3 0.02 -0.04 -0.00 -0.04 2.02 1.96 2fv7B1 PRO 251 HG2 0.01 -0.08 0.04 -0.04 2.03 1.96 2fv7B1 PRO 251 HG3 0.01 0.15 0.07 -0.04 2.03 2.22 2fv7B1 PRO 251 HD2 0.01 0.01 0.18 -0.04 3.68 3.84 2fv7B1 PRO 251 HD3 0.01 0.22 0.31 -0.04 3.65 4.15 2fv7B1 LYS 252 H 0.04 0.46 0.33 -0.55 8.42 8.70 2fv7B1 LYS 252 HA 0.05 0.09 0.83 -0.75 4.32 4.54 2fv7B1 LYS 252 HB2 0.03 0.01 0.07 -0.04 1.87 1.95 2fv7B1 LYS 252 HB3 0.03 0.10 -0.03 -0.04 1.79 1.85 2fv7B1 LYS 252 HG2 0.03 0.15 0.12 -0.04 1.46 1.72 2fv7B1 LYS 252 HG3 0.04 -0.08 0.00 -0.04 1.46 1.38 2fv7B1 LYS 252 HD2 0.02 -0.11 -0.03 -0.04 1.69 1.53 2fv7B1 LYS 252 HD3 0.01 0.01 -0.03 -0.04 1.68 1.64 2fv7B1 LYS 252 HE2 0.02 0.05 -0.02 -0.04 2.99 3.00 2fv7B1 LYS 252 HE3 0.02 0.05 -0.01 -0.04 2.99 3.02 2fv7B1 HIS 253 H 0.14 0.14 0.11 -0.55 8.41 8.25 2fv7B1 HIS 253 HA 0.01 0.14 0.80 -0.75 4.63 4.82 2fv7B1 HIS 253 HB2 0.00 -0.08 0.04 -0.04 3.26 3.18 2fv7B1 HIS 253 HB3 0.00 0.01 0.13 -0.04 3.20 3.30 2fv7B1 HIS 253 HD2 -0.00 0.11 -0.08 -0.04 6.97 6.96 2fv7B1 HIS 253 HE1 -0.00 -0.05 0.00 -0.04 7.75 7.66 2fv7B1 ILE 254 H 0.03 0.79 0.35 -0.55 8.25 8.86 2fv7B1 ILE 254 HA -0.12 0.17 0.88 -0.75 4.18 4.36 2fv7B1 ILE 254 HB 0.03 -0.06 0.10 -0.04 1.89 1.92 2fv7B1 ILE 254 HG12 -0.01 0.02 -0.07 -0.04 1.49 1.39 2fv7B1 ILE 254 HG13 0.01 -0.01 -0.55 -0.04 1.21 0.62 2fv7B1 ILE 254 HG23 -0.00 0.02 -0.12 -0.04 0.93 0.78 2fv7B1 ILE 254 HD13 0.04 -0.02 -0.08 -0.04 0.88 0.77 2fv7B1 PRO 255 HA -0.17 0.12 0.45 -0.51 4.44 4.33 2fv7B1 PRO 255 HB2 -0.07 0.06 -0.03 -0.04 2.28 2.19 2fv7B1 PRO 255 HB3 -0.10 0.00 0.09 -0.04 2.02 1.98 2fv7B1 PRO 255 HG2 -0.12 0.02 0.04 -0.04 2.03 1.93 2fv7B1 PRO 255 HG3 -0.34 -0.01 0.00 -0.04 2.03 1.64 2fv7B1 PRO 255 HD2 -0.12 0.09 0.16 -0.04 3.68 3.76 2fv7B1 PRO 255 HD3 -0.27 0.25 0.01 -0.04 3.65 3.59 2fv7B1 THR 256 H -0.02 0.14 -0.00 -0.55 8.28 7.86 2fv7B1 THR 256 HA 0.03 0.19 0.68 -0.75 4.39 4.53 2fv7B1 THR 256 HB 0.02 -0.05 -0.04 -0.04 4.32 4.22 2fv7B1 THR 256 HG23 0.00 0.01 -0.17 -0.04 1.22 1.02 2fv7B1 GLU 257 H -0.00 0.15 0.04 -0.55 8.60 8.24 2fv7B1 GLU 257 HA 0.01 0.06 0.53 -0.75 4.29 4.14 2fv7B1 LYS 258 H -0.00 0.13 0.15 -0.55 8.42 8.15 2fv7B1 LYS 258 HA -0.01 0.05 0.56 -0.75 4.32 4.16 2fv7B1 VAL 259 H -0.02 0.21 0.22 -0.55 8.24 8.10 2fv7B1 VAL 259 HA -0.02 0.13 0.76 -0.75 4.13 4.24 2fv7B1 VAL 259 HB -0.06 0.04 -0.40 -0.04 2.12 1.66 2fv7B1 VAL 259 HG13 -0.04 0.04 -0.23 -0.04 0.97 0.70 2fv7B1 VAL 259 HG23 -0.06 0.03 -0.06 -0.04 0.95 0.82 2fv7B1 LYS 260 H -0.02 0.16 0.10 -0.55 8.42 8.11 2fv7B1 LYS 260 HA -0.01 0.04 0.74 -0.75 4.32 4.34 2fv7B1 LYS 260 HB2 -0.01 0.01 0.14 -0.04 1.87 1.97 2fv7B1 LYS 260 HB3 -0.01 0.07 -0.03 -0.04 1.79 1.78 2fv7B1 LYS 260 HG2 -0.01 -0.00 0.00 -0.04 1.46 1.42 2fv7B1 LYS 260 HG3 -0.01 -0.02 -0.00 -0.04 1.46 1.39 2fv7B1 LYS 260 HD2 -0.01 0.01 0.01 -0.04 1.69 1.67 2fv7B1 LYS 260 HD3 -0.00 0.02 -0.01 -0.04 1.68 1.65 2fv7B1 LYS 260 HE2 -0.00 -0.01 -0.01 -0.04 2.99 2.92 2fv7B1 LYS 260 HE3 -0.00 0.00 -0.01 -0.04 2.99 2.94 2fv7B1 ALA 261 H -0.01 0.08 0.14 -0.55 8.40 8.07 2fv7B1 ALA 261 HA -0.01 0.17 0.33 -0.75 4.34 4.08 2fv7B1 ALA 261 HB3 -0.01 -0.03 0.01 -0.04 1.41 1.34 2fv7B1 VAL 262 H -0.01 0.74 0.39 -0.55 8.24 8.81 2fv7B1 VAL 262 HA -0.01 0.11 0.76 -0.75 4.13 4.24 2fv7B1 VAL 262 HB -0.01 0.05 -0.35 -0.04 2.12 1.77 2fv7B1 VAL 262 HG13 -0.01 -0.04 -0.23 -0.04 0.97 0.64 2fv7B1 VAL 262 HG23 -0.01 0.04 -0.06 -0.04 0.95 0.89 2fv7B1 ASP 263 H -0.00 0.61 0.05 -0.55 8.40 8.52 2fv7B1 ASP 263 HA 0.00 -0.02 0.52 -0.75 4.63 4.38 2fv7B1 ASP 263 HB2 -0.00 0.16 -0.08 -0.04 2.71 2.74 2fv7B1 ASP 263 HB3 -0.01 0.24 0.03 -0.04 2.70 2.92 2fv7B1 THR 264 H 0.00 0.14 0.09 -0.55 8.28 7.97 2fv7B1 THR 264 HA 0.02 0.26 0.60 -0.75 4.39 4.51 2fv7B1 THR 264 HB 0.00 -0.08 0.13 -0.04 4.32 4.33 2fv7B1 THR 264 HG23 -0.00 0.03 -0.01 -0.04 1.22 1.20 2fv7B1 THR 265 H 0.01 0.08 -0.21 -0.55 8.28 7.62 2fv7B1 THR 265 HA 0.02 -0.05 0.39 -0.75 4.39 3.99 2fv7B1 THR 265 HB 0.01 0.01 0.02 -0.04 4.32 4.32 2fv7B1 THR 265 HG23 0.01 -0.00 -0.12 -0.04 1.22 1.07 2fv7B1 GLY 266 H 0.04 0.06 0.22 -0.55 8.43 8.20 2fv7B1 GLY 266 HA2 0.11 -0.11 0.29 -0.51 4.01 3.78 2fv7B1 GLY 266 HA3 0.16 0.17 0.41 -0.51 4.01 4.24 2fv7B1 ALA 267 H 0.06 0.36 -0.06 -0.55 8.40 8.22 2fv7B1 ALA 267 HA 0.10 0.22 0.26 -0.75 4.34 4.16 2fv7B1 ALA 267 HB3 0.03 0.03 0.06 -0.04 1.41 1.49 2fv7B1 GLY 268 H 0.03 0.03 -0.06 -0.55 8.43 7.88 2fv7B1 GLY 268 HA2 0.03 0.15 0.42 -0.51 4.01 4.09 2fv7B1 GLY 268 HA3 0.00 0.00 0.23 -0.51 4.01 3.73 2fv7B1 ASP 269 H 0.05 -0.01 -0.37 -0.55 8.40 7.53 2fv7B1 ASP 269 HA 0.02 0.05 0.34 -0.75 4.63 4.28 2fv7B1 ASP 269 HB2 0.16 0.20 -0.03 -0.04 2.71 2.99 2fv7B1 ASP 269 HB3 0.07 0.03 -0.19 -0.04 2.70 2.57 2fv7B1 SER 270 H -0.07 0.39 -0.30 -0.55 8.46 7.94 2fv7B1 SER 270 HA -0.56 0.08 0.45 -0.75 4.49 3.71 2fv7B1 SER 270 HB2 -0.52 0.04 0.01 -0.04 3.95 3.44 2fv7B1 SER 270 HB3 -0.06 0.10 0.11 -0.04 3.93 4.03 2fv7B1 PHE 271 H 0.12 0.37 -0.20 -0.55 8.34 8.08 2fv7B1 PHE 271 HA -0.01 0.13 0.41 -0.75 4.62 4.39 2fv7B1 PHE 271 HB2 -0.02 0.05 0.08 -0.04 3.15 3.22 2fv7B1 PHE 271 HB3 -0.02 0.04 0.15 -0.04 3.06 3.19 2fv7B1 PHE 271 HD2 0.00 0.05 -0.30 -0.04 7.28 6.99 2fv7B1 PHE 271 HE2 0.02 0.04 -0.16 -0.04 7.38 7.24 2fv7B1 PHE 271 HZ 0.02 0.02 -0.13 -0.04 7.32 7.19 2fv7B1 VAL 272 H 0.13 0.58 -0.08 -0.55 8.24 8.32 2fv7B1 VAL 272 HA 0.04 0.04 0.32 -0.75 4.13 3.77 2fv7B1 VAL 272 HB 0.03 -0.01 0.06 -0.04 2.12 2.16 2fv7B1 VAL 272 HG13 0.02 0.00 -0.23 -0.04 0.97 0.72 2fv7B1 VAL 272 HG23 0.08 0.01 -0.08 -0.04 0.95 0.93 2fv7B1 GLY 273 H -0.06 0.59 -0.16 -0.55 8.43 8.25 2fv7B1 GLY 273 HA2 -0.01 -0.00 0.43 -0.51 4.01 3.92 2fv7B1 GLY 273 HA3 -0.08 0.12 0.34 -0.51 4.01 3.88 2fv7B1 ALA 274 H -0.10 0.55 -0.27 -0.55 8.40 8.03 2fv7B1 ALA 274 HA -0.06 0.06 0.42 -0.75 4.34 4.01 2fv7B1 ALA 274 HB3 -0.04 0.02 0.09 -0.04 1.41 1.44 2fv7B1 LEU 275 H -0.17 0.64 -0.07 -0.55 8.37 8.22 2fv7B1 LEU 275 HA 0.07 0.01 0.30 -0.75 4.35 3.97 2fv7B1 LEU 275 HB2 -0.36 0.02 0.04 -0.04 1.64 1.30 2fv7B1 LEU 275 HB3 -0.07 0.08 0.07 -0.04 1.64 1.67 2fv7B1 LEU 275 HG 0.02 0.01 -0.21 -0.04 1.64 1.43 2fv7B1 LEU 275 HD13 -0.02 -0.01 -0.12 -0.04 0.93 0.74 2fv7B1 LEU 275 HD23 0.05 -0.02 -0.14 -0.04 0.89 0.74 2fv7B1 ALA 276 H 0.03 0.57 -0.28 -0.55 8.40 8.17 2fv7B1 ALA 276 HA 0.06 -0.01 0.33 -0.75 4.34 3.97 2fv7B1 ALA 276 HB3 0.06 0.03 -0.00 -0.04 1.41 1.46 2fv7B1 PHE 277 H 0.17 0.49 -0.19 -0.55 8.34 8.26 2fv7B1 PHE 277 HA 0.15 -0.03 0.41 -0.75 4.62 4.39 2fv7B1 PHE 277 HB2 -0.08 -0.03 0.13 -0.04 3.15 3.13 2fv7B1 PHE 277 HB3 -0.23 0.20 0.19 -0.04 3.06 3.18 2fv7B1 PHE 277 HD2 -0.75 -0.02 -0.09 -0.04 7.28 6.38 2fv7B1 PHE 277 HE2 -0.48 0.02 -0.17 -0.04 7.38 6.72 2fv7B1 PHE 277 HZ 0.24 -0.00 -0.07 -0.04 7.32 7.44 2fv7B1 TYR 278 H 0.09 0.49 -0.17 -0.55 8.29 8.15 2fv7B1 TYR 278 HA -0.07 0.03 0.47 -0.75 4.56 4.23 2fv7B1 TYR 278 HB2 -0.02 0.03 0.05 -0.04 3.06 3.09 2fv7B1 TYR 278 HB3 -0.04 -0.03 -0.02 -0.04 2.98 2.85 2fv7B1 TYR 278 HD2 -0.27 -0.02 -0.11 -0.04 7.15 6.71 2fv7B1 TYR 278 HE2 -0.38 0.05 -0.08 -0.04 6.85 6.40 2fv7B1 LEU 279 H 0.10 0.62 -0.16 -0.55 8.37 8.38 2fv7B1 LEU 279 HA 0.06 0.04 0.44 -0.75 4.35 4.14 2fv7B1 LEU 279 HB2 0.06 0.09 0.11 -0.04 1.64 1.85 2fv7B1 LEU 279 HB3 0.04 -0.02 -0.05 -0.04 1.64 1.57 2fv7B1 LEU 279 HG 0.07 0.02 -0.06 -0.04 1.64 1.63 2fv7B1 LEU 279 HD13 0.05 -0.04 -0.21 -0.04 0.93 0.70 2fv7B1 LEU 279 HD23 0.05 -0.01 -0.05 -0.04 0.89 0.84 2fv7B1 ALA 280 H 0.03 0.45 -0.22 -0.55 8.40 8.12 2fv7B1 ALA 280 HA -0.10 0.12 0.48 -0.75 4.34 4.09 2fv7B1 ALA 280 HB3 -0.09 -0.03 0.00 -0.04 1.41 1.26 2fv7B1 TYR 281 H 0.00 0.44 -0.05 -0.55 8.29 8.13 2fv7B1 TYR 281 HA -0.17 0.17 0.85 -0.75 4.56 4.65 2fv7B1 TYR 281 HB2 -0.60 0.17 0.07 -0.04 3.06 2.65 2fv7B1 TYR 281 HB3 -0.39 -0.06 0.04 -0.04 2.98 2.53 2fv7B1 TYR 281 HD2 -0.17 0.07 0.04 -0.04 7.15 7.05 2fv7B1 TYR 281 HE2 0.04 -0.05 0.02 -0.04 6.85 6.82 2fv7B1 TYR 282 H 0.13 0.35 -0.19 -0.55 8.29 8.03 2fv7B1 TYR 282 HA 0.02 0.12 0.81 -0.75 4.56 4.76 2fv7B1 TYR 282 HB2 0.17 0.05 0.16 -0.04 3.06 3.40 2fv7B1 TYR 282 HB3 0.08 -0.11 0.12 -0.04 2.98 3.03 2fv7B1 TYR 282 HD2 -0.11 -0.03 -0.13 -0.04 7.15 6.83 2fv7B1 TYR 282 HE2 0.03 -0.02 -0.07 -0.04 6.85 6.76 2fv7B1 PRO 283 HA 0.04 0.13 0.36 -0.51 4.44 4.46 2fv7B1 PRO 283 HB2 -0.00 -0.04 0.02 -0.04 2.28 2.21 2fv7B1 PRO 283 HB3 -0.01 0.22 0.10 -0.04 2.02 2.29 2fv7B1 PRO 283 HG2 -0.03 -0.09 0.03 -0.04 2.03 1.90 2fv7B1 PRO 283 HG3 -0.05 0.11 -0.01 -0.04 2.03 2.04 2fv7B1 PRO 283 HD2 -0.06 0.11 -0.17 -0.04 3.68 3.52 2fv7B1 PRO 283 HD3 -0.06 0.17 -0.50 -0.04 3.65 3.22 2fv7B1 ASN 284 H 0.02 0.13 -0.21 -0.55 8.53 7.92 2fv7B1 ASN 284 HA 0.02 0.13 0.55 -0.75 4.76 4.70 2fv7B1 ASN 284 HB2 0.01 0.01 0.04 -0.04 2.88 2.90 2fv7B1 ASN 284 HB3 0.01 -0.04 0.15 -0.04 2.79 2.88 2fv7B1 ASN 284 HD21 -0.01 -0.00 -0.00 -0.04 7.03 6.98 2fv7B1 ASN 284 HD22 -0.00 -0.02 0.02 -0.04 7.74 7.69 2fv7B1 LEU 285 H 0.07 0.47 -0.63 -0.55 8.37 7.74 2fv7B1 LEU 285 HA 0.03 0.07 0.76 -0.75 4.35 4.46 2fv7B1 LEU 285 HB2 0.04 0.20 0.00 -0.04 1.64 1.85 2fv7B1 LEU 285 HB3 -0.03 -0.14 0.03 -0.04 1.64 1.45 2fv7B1 LEU 285 HG 0.24 -0.01 -0.10 -0.04 1.64 1.73 2fv7B1 LEU 285 HD13 -0.11 0.00 -0.05 -0.04 0.93 0.73 2fv7B1 LEU 285 HD23 0.06 -0.00 -0.02 -0.04 0.89 0.89 2fv7B1 SER 286 H -0.01 0.07 0.11 -0.55 8.46 8.08 2fv7B1 SER 286 HA 0.00 0.20 0.55 -0.75 4.49 4.49 2fv7B1 SER 286 HB2 -0.00 -0.01 0.10 -0.04 3.95 4.00 2fv7B1 SER 286 HB3 -0.01 0.11 0.10 -0.04 3.93 4.09 2fv7B1 LEU 287 H 0.01 0.20 0.16 -0.55 8.37 8.19 2fv7B1 LEU 287 HA -0.00 0.15 0.31 -0.75 4.35 4.05 2fv7B1 LEU 287 HB2 0.02 0.09 0.13 -0.04 1.64 1.84 2fv7B1 LEU 287 HB3 0.02 -0.03 0.04 -0.04 1.64 1.64 2fv7B1 LEU 287 HG 0.04 -0.06 -0.10 -0.04 1.64 1.48 2fv7B1 LEU 287 HD13 0.04 0.02 -0.04 -0.04 0.93 0.91 2fv7B1 LEU 287 HD23 0.05 0.01 -0.06 -0.04 0.89 0.85 2fv7B1 GLU 288 H -0.00 0.10 -0.17 -0.55 8.60 7.97 2fv7B1 GLU 288 HA 0.00 0.09 0.31 -0.75 4.29 3.94 2fv7B1 GLU 288 HB2 -0.02 -0.01 -0.02 -0.04 2.09 2.00 2fv7B1 GLU 288 HB3 -0.01 0.07 -0.00 -0.04 1.99 2.00 2fv7B1 ASP 289 H -0.05 0.11 -0.32 -0.55 8.40 7.59 2fv7B1 ASP 289 HA -0.10 0.06 0.51 -0.75 4.63 4.34 2fv7B1 ASP 289 HB2 -0.07 -0.08 0.09 -0.04 2.71 2.61 2fv7B1 ASP 289 HB3 -0.10 0.17 0.11 -0.04 2.70 2.84 2fv7B1 MET 290 H -0.12 0.53 -0.08 -0.55 8.47 8.26 2fv7B1 MET 290 HA -0.53 0.07 0.37 -0.75 4.52 3.68 2fv7B1 MET 290 HB2 -0.06 0.07 0.07 -0.04 2.15 2.19 2fv7B1 MET 290 HB3 -0.07 -0.05 -0.08 -0.04 2.03 1.80 2fv7B1 MET 290 HG2 -0.06 0.02 -0.09 -0.04 2.63 2.46 2fv7B1 MET 290 HG3 -0.06 0.10 -0.23 -0.04 2.56 2.33 2fv7B1 MET 290 HE3 0.06 0.07 -0.12 -0.04 2.10 2.07 2fv7B1 LEU 291 H -0.06 0.56 -0.28 -0.55 8.37 8.04 2fv7B1 LEU 291 HA -0.06 -0.01 0.41 -0.75 4.35 3.94 2fv7B1 LEU 291 HB2 0.03 0.10 0.04 -0.04 1.64 1.78 2fv7B1 LEU 291 HB3 0.15 -0.06 -0.09 -0.04 1.64 1.61 2fv7B1 LEU 291 HG 0.03 0.18 -0.05 -0.04 1.64 1.76 2fv7B1 LEU 291 HD13 0.09 -0.02 -0.17 -0.04 0.93 0.79 2fv7B1 LEU 291 HD23 0.19 -0.02 -0.12 -0.04 0.89 0.89 2fv7B1 ASN 292 H -0.06 0.53 -0.12 -0.55 8.53 8.34 2fv7B1 ASN 292 HA 0.01 0.06 0.55 -0.75 4.76 4.62 2fv7B1 ASN 292 HB2 -0.08 0.09 0.25 -0.04 2.88 3.10 2fv7B1 ASN 292 HB3 -0.07 -0.02 -0.05 -0.04 2.79 2.61 2fv7B1 ASN 292 HD21 -0.03 -0.05 -0.01 -0.04 7.03 6.90 2fv7B1 ASN 292 HD22 -0.05 0.01 -0.04 -0.04 7.74 7.62 2fv7B1 ARG 293 H -0.22 0.59 -0.21 -0.55 8.46 8.07 2fv7B1 ARG 293 HA -0.12 -0.00 0.42 -0.75 4.34 3.88 2fv7B1 ARG 293 HB2 -0.75 0.11 0.14 -0.04 1.90 1.35 2fv7B1 ARG 293 HB3 -0.46 0.01 0.02 -0.04 1.80 1.33 2fv7B1 ARG 293 HG2 -0.39 -0.00 0.05 -0.04 1.67 1.29 2fv7B1 ARG 293 HG3 -0.29 -0.11 -0.02 -0.04 1.67 1.20 2fv7B1 ARG 293 HD2 -0.31 -0.09 -0.06 -0.04 3.22 2.72 2fv7B1 ARG 293 HD3 -0.59 -0.00 -0.20 -0.04 3.22 2.38 2fv7B1 SER 294 H -0.14 0.52 -0.16 -0.55 8.46 8.13 2fv7B1 SER 294 HA -0.02 0.03 0.43 -0.75 4.49 4.17 2fv7B1 SER 294 HB2 -0.54 0.00 0.10 -0.04 3.95 3.47 2fv7B1 SER 294 HB3 -0.94 -0.04 0.05 -0.04 3.93 2.96 2fv7B1 ASN 295 H 0.13 0.79 -0.12 -0.55 8.53 8.78 2fv7B1 ASN 295 HA 0.33 -0.08 0.45 -0.75 4.76 4.71 2fv7B1 ASN 295 HB2 0.13 0.25 0.18 -0.04 2.88 3.40 2fv7B1 ASN 295 HB3 0.10 -0.12 -0.06 -0.04 2.79 2.67 2fv7B1 ASN 295 HD21 0.05 -0.04 -0.15 -0.04 7.03 6.86 2fv7B1 ASN 295 HD22 0.06 0.20 -0.23 -0.04 7.74 7.73 2fv7B1 PHE 296 H 0.19 0.46 -0.37 -0.55 8.34 8.06 2fv7B1 PHE 296 HA 0.01 -0.04 0.45 -0.75 4.62 4.29 2fv7B1 PHE 296 HB2 -0.03 0.07 0.09 -0.04 3.15 3.24 2fv7B1 PHE 296 HB3 -0.04 0.17 0.15 -0.04 3.06 3.30 2fv7B1 PHE 296 HD2 -0.02 0.02 -0.17 -0.04 7.28 7.07 2fv7B1 PHE 296 HE2 0.00 0.01 -0.04 -0.04 7.38 7.31 2fv7B1 PHE 296 HZ 0.01 -0.00 -0.02 -0.04 7.32 7.26 2fv7B1 ILE 297 H 0.21 0.63 0.01 -0.55 8.25 8.55 2fv7B1 ILE 297 HA 0.14 0.05 0.37 -0.75 4.18 3.99 2fv7B1 ILE 297 HB 0.05 0.04 0.11 -0.04 1.89 2.04 2fv7B1 ILE 297 HG12 0.15 0.14 0.11 -0.04 1.49 1.85 2fv7B1 ILE 297 HG13 0.09 -0.03 -0.02 -0.04 1.21 1.21 2fv7B1 ILE 297 HG23 -0.02 -0.01 -0.15 -0.04 0.93 0.71 2fv7B1 ILE 297 HD13 0.08 0.00 -0.05 -0.04 0.88 0.87 2fv7B1 ALA 298 H 0.08 0.58 -0.26 -0.55 8.40 8.25 2fv7B1 ALA 298 HA 0.03 -0.01 0.43 -0.75 4.34 4.04 2fv7B1 ALA 298 HB3 0.16 -0.00 0.03 -0.04 1.41 1.56 2fv7B1 ALA 299 H -0.03 0.52 -0.25 -0.55 8.40 8.09 2fv7B1 ALA 299 HA -0.05 -0.07 0.46 -0.75 4.34 3.92 2fv7B1 ALA 299 HB3 -0.17 0.04 0.14 -0.04 1.41 1.38 2fv7B1 VAL 300 H -0.15 0.38 -0.34 -0.55 8.24 7.58 2fv7B1 VAL 300 HA -0.12 0.04 0.63 -0.75 4.13 3.91 2fv7B1 VAL 300 HB -0.04 0.17 0.18 -0.04 2.12 2.38 2fv7B1 VAL 300 HG13 0.02 0.01 -0.08 -0.04 0.97 0.87 2fv7B1 VAL 300 HG23 -0.30 0.01 -0.01 -0.04 0.95 0.60 2fv7B1 SER 301 H 0.01 0.42 0.00 -0.55 8.46 8.35 2fv7B1 SER 301 HA 0.07 0.35 0.42 -0.75 4.49 4.58 2fv7B1 SER 301 HB2 0.29 -0.04 -0.17 -0.04 3.95 3.98 2fv7B1 SER 301 HB3 0.11 0.05 0.08 -0.04 3.93 4.13 2fv7B1 VAL 302 H 0.00 0.33 -0.40 -0.55 8.24 7.62 2fv7B1 VAL 302 HA 0.02 0.25 0.49 -0.75 4.13 4.14 2fv7B1 VAL 302 HB -0.00 -0.21 0.02 -0.04 2.12 1.88 2fv7B1 VAL 302 HG13 0.01 0.08 0.03 -0.04 0.97 1.05 2fv7B1 VAL 302 HG23 -0.02 0.03 -0.10 -0.04 0.95 0.82 2fv7B1 GLN 303 H -0.02 0.45 -0.53 -0.55 8.47 7.83 2fv7B1 GLN 303 HA -0.01 -0.04 0.74 -0.75 4.36 4.29 2fv7B1 GLN 303 HB2 -0.03 0.19 0.11 -0.04 2.15 2.38 2fv7B1 GLN 303 HB3 -0.02 -0.08 0.19 -0.04 2.02 2.07 2fv7B1 GLN 303 HG2 -0.03 0.11 -0.04 -0.04 2.40 2.41 2fv7B1 GLN 303 HG3 -0.05 0.19 0.01 -0.04 2.39 2.50 2fv7B1 GLN 303 HE21 -0.04 -0.05 0.02 -0.04 6.97 6.86 2fv7B1 GLN 303 HE22 -0.03 -0.01 0.06 -0.04 7.69 7.67 2fv7B1 ALA 304 H 0.00 0.49 -0.30 -0.55 8.40 8.05 2fv7B1 ALA 304 HA -0.01 0.09 0.78 -0.75 4.34 4.44 2fv7B1 ALA 304 HB3 -0.00 0.04 0.02 -0.04 1.41 1.42 2fv7B1 ALA 305 H -0.03 0.14 0.07 -0.55 8.40 8.03 2fv7B1 ALA 305 HA -0.02 0.10 0.64 -0.75 4.34 4.30 2fv7B1 ALA 305 HB3 -0.04 0.00 -0.01 -0.04 1.41 1.32 2fv7B1 GLY 306 H -0.03 0.07 0.10 -0.55 8.43 8.02 2fv7B1 GLY 306 HA2 -0.04 -0.02 0.20 -0.51 4.01 3.64 2fv7B1 GLY 306 HA3 -0.08 0.18 0.19 -0.51 4.01 3.79 2fv7B1 THR 307 H -0.07 0.17 -0.08 -0.55 8.28 7.76 2fv7B1 THR 307 HA -0.15 0.24 0.26 -0.75 4.39 3.98 2fv7B1 THR 307 HB -0.08 0.07 0.01 -0.04 4.32 4.27 2fv7B1 THR 307 HG23 -0.04 -0.02 -0.05 -0.04 1.22 1.07 2fv7B1 GLN 308 H -0.21 0.16 0.27 -0.55 8.47 8.13 2fv7B1 GLN 308 HA -0.98 0.07 0.38 -0.75 4.36 3.08 2fv7B1 GLN 308 HB2 -0.06 -0.02 0.17 -0.04 2.15 2.20 2fv7B1 GLN 308 HB3 -0.09 0.08 0.05 -0.04 2.02 2.02 2fv7B1 GLN 308 HG2 0.02 0.02 0.00 -0.04 2.40 2.40 2fv7B1 GLN 308 HG3 -0.04 -0.07 0.09 -0.04 2.39 2.33 2fv7B1 GLN 308 HE21 0.29 -0.04 -0.27 -0.04 6.97 6.90 2fv7B1 GLN 308 HE22 0.18 -0.12 -0.27 -0.04 7.69 7.44 2fv7B1 SER 309 H -0.15 0.32 -0.32 -0.55 8.46 7.76 2fv7B1 SER 309 HA -0.06 0.07 0.39 -0.75 4.49 4.14 2fv7B1 SER 309 HB2 -0.09 0.09 -0.03 -0.04 3.95 3.88 2fv7B1 SER 309 HB3 -0.05 -0.00 0.03 -0.04 3.93 3.86 2fv7B1 SER 310 H -0.24 0.41 -0.74 -0.55 8.46 7.34 2fv7B1 SER 310 HA -0.02 0.14 0.64 -0.75 4.49 4.50 2fv7B1 SER 310 HB2 0.01 0.12 -0.00 -0.04 3.95 4.03 2fv7B1 SER 310 HB3 -0.06 -0.15 -0.57 -0.04 3.93 3.12 2fv7B1 TYR 311 H -0.15 0.27 -0.32 -0.55 8.29 7.54 2fv7B1 TYR 311 HA -0.05 0.06 0.48 -0.75 4.56 4.29 2fv7B1 TYR 311 HB2 -0.12 0.07 0.05 -0.04 3.06 3.02 2fv7B1 TYR 311 HB3 -0.11 0.04 -0.06 -0.04 2.98 2.81 2fv7B1 TYR 311 HD2 -0.03 0.05 -0.20 -0.04 7.15 6.92 2fv7B1 TYR 311 HE2 0.01 -0.07 -0.13 -0.04 6.85 6.62 2fv7B1 PRO 312 HA 0.03 0.04 0.34 -0.51 4.44 4.34 2fv7B1 PRO 312 HB2 0.08 0.10 -0.13 -0.04 2.28 2.28 2fv7B1 PRO 312 HB3 0.06 0.03 -0.01 -0.04 2.02 2.07 2fv7B1 PRO 312 HG2 0.02 -0.00 -0.05 -0.04 2.03 1.96 2fv7B1 PRO 312 HG3 0.05 0.02 0.03 -0.04 2.03 2.08 2fv7B1 PRO 312 HD2 0.03 -0.03 0.16 -0.04 3.68 3.79 2fv7B1 PRO 312 HD3 0.07 0.29 0.21 -0.04 3.65 4.19 2fv7B1 TYR 313 H 0.20 0.05 0.11 -0.55 8.29 8.10 2fv7B1 TYR 313 HA -0.03 0.32 0.64 -0.75 4.56 4.73 2fv7B1 TYR 313 HB2 -0.01 -0.09 0.09 -0.04 3.06 3.01 2fv7B1 TYR 313 HB3 -0.04 -0.09 0.09 -0.04 2.98 2.89 2fv7B1 TYR 313 HD2 -0.02 0.02 0.07 -0.04 7.15 7.17 2fv7B1 TYR 313 HE2 -0.02 0.02 -0.01 -0.04 6.85 6.80 2fv7B1 LYS 314 H 0.01 0.70 0.28 -0.55 8.42 8.86 2fv7B1 LYS 314 HA -0.04 0.06 0.40 -0.75 4.32 3.99 2fv7B1 LYS 314 HB2 -0.32 0.20 0.12 -0.04 1.87 1.83 2fv7B1 LYS 314 HB3 -0.17 -0.10 0.10 -0.04 1.79 1.58 2fv7B1 LYS 314 HG2 -0.47 -0.07 -0.19 -0.04 1.46 0.69 2fv7B1 LYS 314 HG3 -1.53 -0.01 0.02 -0.04 1.46 -0.10 2fv7B1 LYS 314 HD2 -0.44 0.25 0.07 -0.04 1.69 1.53 2fv7B1 LYS 314 HD3 -0.25 -0.04 -0.04 -0.04 1.68 1.31 2fv7B1 LYS 314 HE2 -0.17 -0.01 0.00 -0.04 2.99 2.77 2fv7B1 LYS 314 HE3 -0.25 -0.06 -0.04 -0.04 2.99 2.60 2fv7B1 LYS 315 H 0.01 0.09 -0.18 -0.55 8.42 7.79 2fv7B1 LYS 315 HA -0.03 0.08 0.33 -0.75 4.32 3.94 2fv7B1 LYS 315 HB2 -0.03 -0.01 0.05 -0.04 1.87 1.84 2fv7B1 LYS 315 HB3 -0.05 0.00 0.07 -0.04 1.79 1.78 2fv7B1 LYS 315 HG2 0.01 -0.07 -0.04 -0.04 1.46 1.32 2fv7B1 LYS 315 HG3 0.00 0.06 -0.32 -0.04 1.46 1.17 2fv7B1 LYS 315 HD2 -0.10 -0.01 -0.06 -0.04 1.69 1.49 2fv7B1 LYS 315 HD3 -0.08 -0.01 -0.03 -0.04 1.68 1.52 2fv7B1 LYS 315 HE2 -0.21 0.02 0.00 -0.04 2.99 2.76 2fv7B1 LYS 315 HE3 -0.47 0.01 -0.00 -0.04 2.99 2.48 2fv7B1 ASP 316 H 0.10 0.25 -0.45 -0.55 8.40 7.75 2fv7B1 ASP 316 HA 0.06 0.13 0.69 -0.75 4.63 4.76 2fv7B1 ASP 316 HB2 0.13 -0.03 0.08 -0.04 2.71 2.85 2fv7B1 ASP 316 HB3 0.09 -0.01 0.15 -0.04 2.70 2.88 2fv7B1 LEU 317 H 0.13 0.47 -0.39 -0.55 8.37 8.03 2fv7B1 LEU 317 HA 0.18 0.13 0.87 -0.75 4.35 4.77 2fv7B1 LEU 317 HB2 0.38 0.11 0.01 -0.04 1.64 2.10 2fv7B1 LEU 317 HB3 0.21 -0.02 0.01 -0.04 1.64 1.80 2fv7B1 LEU 317 HG 0.16 0.03 -0.37 -0.04 1.64 1.42 2fv7B1 LEU 317 HD13 0.18 -0.02 -0.24 -0.04 0.93 0.82 2fv7B1 LEU 317 HD23 0.27 -0.01 -0.05 -0.04 0.89 1.05 2fv7B1 PRO 318 HA 0.05 0.04 0.47 -0.51 4.44 4.50 2fv7B1 PRO 318 HB2 -0.18 -0.06 -0.02 -0.04 2.28 1.98 2fv7B1 PRO 318 HB3 -0.05 0.00 0.09 -0.04 2.02 2.02 2fv7B1 PRO 318 HG2 -0.30 0.04 0.04 -0.04 2.03 1.77 2fv7B1 PRO 318 HG3 0.06 0.06 0.06 -0.04 2.03 2.17 2fv7B1 PRO 318 HD2 -0.01 0.10 0.15 -0.04 3.68 3.87 2fv7B1 PRO 318 HD3 0.22 0.20 0.19 -0.04 3.65 4.22 2fv7B1 LEU 319 H 0.06 0.14 0.20 -0.55 8.37 8.22 2fv7B1 LEU 319 HA 0.24 0.17 0.41 -0.75 4.35 4.43 2fv7B1 LEU 319 HB2 0.05 -0.03 0.06 -0.04 1.64 1.68 2fv7B1 LEU 319 HB3 0.09 0.03 0.09 -0.04 1.64 1.81 2fv7B1 LEU 319 HG 0.05 -0.04 0.14 -0.04 1.64 1.75 2fv7B1 LEU 319 HD13 0.03 -0.00 0.03 -0.04 0.93 0.95 2fv7B1 LEU 319 HD23 0.06 0.04 0.02 -0.04 0.89 0.98 2fv7B1 THR 320 H -0.02 -0.01 -0.31 -0.55 8.28 7.39 2fv7B1 THR 320 HA -0.03 0.13 0.33 -0.75 4.39 4.07 2fv7B1 THR 320 HB -0.13 -0.03 -0.03 -0.04 4.32 4.09 2fv7B1 THR 320 HG23 -0.12 0.01 -0.03 -0.04 1.22 1.04 2fv7B1 LEU 321 H -0.19 0.40 -0.57 -0.55 8.37 7.46 2fv7B1 LEU 321 HA -0.36 0.10 0.66 -0.75 4.35 3.99 2fv7B1 LEU 321 HB2 -0.93 0.15 -0.05 -0.04 1.64 0.77 2fv7B1 LEU 321 HB3 -0.57 -0.03 0.07 -0.04 1.64 1.06 2fv7B1 LEU 321 HG -0.45 -0.08 -0.09 -0.04 1.64 0.99 2fv7B1 LEU 321 HD13 -0.25 0.00 -0.03 -0.04 0.93 0.61 2fv7B1 LEU 321 HD23 -0.50 -0.01 -0.08 -0.04 0.89 0.26 2fv7B1 PHE 322 H 0.01 0.39 -0.31 -0.55 8.34 7.87 2fv7B1 PHE 322 HA 0.05 0.20 0.60 -0.75 4.62 4.71 2fv7B1 PHE 322 HB2 0.11 0.02 0.05 -0.04 3.15 3.29 2fv7B1 PHE 322 HB3 0.25 0.01 0.02 -0.04 3.06 3.30 2fv7B1 PHE 322 HD2 0.18 0.01 -0.07 -0.04 7.28 7.35 2fv7B1 PHE 322 HE2 -0.17 0.05 -0.09 -0.04 7.38 7.12 2fv7B1 PHE 322 HZ -0.09 -0.03 -0.06 -0.04 7.32 7.10