#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g72 h PRO 18 N 0.00 -0.14 0.00 0.00 0.11 -2.06 -1.33 132.00 128.58 2g72 h PRO 18 Ca 0.00 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.07 2g72 h PRO 18 Cb 0.00 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 2g72 h PRO 18 CO 0.00 -0.04 -0.23 0.78 -0.21 0.00 0.00 178.00 178.30 2g72 h GLY 19 N -0.21 0.00 0.46 -0.55 0.00 -2.03 -2.76 103.07 97.98 2g72 h GLY 19 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 2g72 h GLY 19 CO 0.02 0.00 -0.35 1.46 0.00 0.00 0.00 176.54 177.67 2g72 h GLN 20 N 0.00 0.19 0.00 4.80 4.20 -1.90 -3.03 115.11 119.37 2g72 h GLN 20 Ca -0.00 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.46 2g72 h GLN 20 Cb 0.49 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2g72 h GLN 20 CO 0.03 1.01 0.00 0.00 -0.67 0.00 0.00 178.83 179.21 2g72 h ALA 21 N 0.19 1.00 0.04 3.87 0.00 -1.22 -0.36 119.26 122.78 2g72 h ALA 21 Ca -0.05 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.69 2g72 h ALA 21 Cb 1.16 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.97 2g72 h ALA 21 CO 0.07 0.00 -0.69 0.00 0.00 0.00 0.00 179.25 178.63 2g72 h ALA 22 N 2.02 0.02 -0.02 0.00 0.00 -1.53 -2.53 119.26 117.22 2g72 h ALA 22 Ca 0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 2g72 h ALA 22 Cb 0.28 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2g72 h ALA 22 CO 0.00 0.37 0.00 0.28 0.00 0.00 0.00 179.25 179.91 2g72 h VAL 23 N -0.16 1.20 -0.92 0.00 2.07 -1.30 -2.44 116.25 114.69 2g72 h VAL 23 Ca -0.10 -0.59 0.24 0.00 0.82 0.00 0.00 66.70 67.07 2g72 h VAL 23 Cb 1.43 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 32.71 2g72 h VAL 23 CO 0.13 0.16 0.63 0.00 0.02 0.00 0.00 177.57 178.51 2g72 h ALA 24 N 0.76 2.49 -0.21 1.67 0.00 -1.16 0.14 119.26 122.96 2g72 h ALA 24 Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 2g72 h ALA 24 Cb 0.25 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.07 2g72 h ALA 24 CO 0.00 -0.78 -0.61 1.03 0.00 0.00 0.00 179.25 178.89 2g72 h SER 25 N 0.23 0.89 -0.57 0.00 0.87 -1.04 -3.17 113.55 110.76 2g72 h SER 25 Ca 0.47 -0.58 -0.10 0.00 -1.23 0.00 0.00 61.79 60.35 2g72 h SER 25 Cb 1.45 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 63.13 2g72 h SER 25 CO -0.12 1.32 -0.02 0.00 -0.53 0.00 0.00 176.83 177.48 2g72 h ALA 26 N 0.60 0.77 0.00 6.23 0.00 -0.34 -2.70 119.26 123.82 2g72 h ALA 26 Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2g72 h ALA 26 Cb 1.23 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2g72 h ALA 26 CO 0.13 0.63 0.00 0.66 0.00 0.00 0.00 179.25 180.67 2g72 n TYR 27 N -4.21 0.38 0.27 0.00 4.02 -0.43 -2.07 117.16 115.13 2g72 n TYR 27 Ca 0.02 0.17 0.16 0.00 -0.01 0.00 0.00 57.90 58.24 2g72 n TYR 27 Cb 0.35 -0.78 0.74 0.00 -0.02 0.00 0.00 39.34 39.64 2g72 n TYR 27 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2g72 h GLN 28 N 0.00 0.00 -0.01 -0.72 1.08 -1.45 -2.17 115.11 111.84 2g72 h GLN 28 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2g72 h GLN 28 Cb 0.16 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 2g72 h GLN 28 CO 0.00 0.07 -0.55 0.54 -0.95 0.00 0.00 178.83 177.94 2g72 n ARG 29 N -3.29 0.63 -1.60 1.46 1.74 -0.88 -4.96 116.66 109.76 2g72 n ARG 29 Ca -0.01 -0.47 -0.52 0.00 -0.77 0.00 0.00 57.85 56.08 2g72 n ARG 29 Cb 0.27 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.16 2g72 n ARG 29 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2g72 n PHE 30 N -0.78 1.96 -3.47 -1.55 7.35 -0.82 -3.80 117.46 116.36 2g72 n PHE 30 Ca 0.08 0.26 -0.43 0.00 -0.76 0.00 0.00 57.45 56.61 2g72 n PHE 30 Cb 0.38 -2.55 -0.10 0.00 0.35 0.00 0.00 39.48 37.56 2g72 n PHE 30 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 2g72 s GLU 31 N 4.81 3.00 0.18 -4.13 2.02 -0.66 -4.99 118.70 118.93 2g72 s GLU 31 Ca 1.01 -1.00 -0.15 0.00 0.02 0.00 0.00 54.97 54.85 2g72 s GLU 31 Cb -0.87 -3.97 0.16 0.00 0.10 0.00 0.00 34.13 29.56 2g72 s GLU 31 CO 0.55 -0.73 1.67 -1.35 0.02 0.00 0.00 175.26 175.42 2g72 h PRO 32 N 8.62 0.07 -0.96 0.39 0.11 -1.92 -1.03 132.00 137.27 2g72 h PRO 32 Ca -0.27 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.84 2g72 h PRO 32 Cb 1.12 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 2g72 h PRO 32 CO 0.72 0.04 0.63 0.00 -0.21 0.00 0.00 178.00 179.19 2g72 h ARG 33 N 0.07 1.27 -0.63 1.05 2.47 -1.97 0.26 114.38 116.90 2g72 h ARG 33 Ca 0.24 -0.08 -0.08 0.00 -1.26 0.00 0.00 59.98 58.80 2g72 h ARG 33 Cb 0.36 -0.29 -0.02 0.00 -1.65 0.00 0.00 29.97 28.37 2g72 h ARG 33 CO -0.43 0.85 0.10 0.00 0.56 0.00 0.00 179.97 181.05 2g72 h ALA 34 N 1.35 0.84 -0.19 0.04 0.00 -1.76 -1.06 119.26 118.48 2g72 h ALA 34 Ca 0.35 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2g72 h ALA 34 Cb -0.14 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 2g72 h ALA 34 CO -0.08 0.60 0.05 -0.92 0.00 0.00 0.00 179.25 178.90 2g72 h TYR 35 N 0.96 0.32 -0.33 0.00 3.20 -0.41 -0.90 116.97 119.81 2g72 h TYR 35 Ca 0.19 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 62.04 2g72 h TYR 35 Cb 0.44 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 2g72 h TYR 35 CO 0.03 0.42 0.18 -0.07 -1.64 0.00 0.00 178.16 177.09 2g72 h LEU 36 N 0.12 0.28 -0.46 2.82 3.38 -0.88 -2.00 115.31 118.57 2g72 h LEU 36 Ca 0.06 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2g72 h LEU 36 Cb 0.27 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2g72 h LEU 36 CO 0.00 0.21 0.25 -0.09 0.09 0.00 0.00 178.44 178.90 2g72 h ARG 37 N 0.37 0.63 -0.16 1.13 2.43 -1.10 0.48 114.38 118.16 2g72 h ARG 37 Ca 0.13 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 2g72 h ARG 37 Cb 0.02 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 2g72 h ARG 37 CO -0.08 0.50 -0.19 -0.91 -1.51 0.00 0.00 179.97 177.78 2g72 h ASN 38 N 0.60 0.25 0.00 -3.80 2.35 -0.94 -3.31 115.58 110.74 2g72 h ASN 38 Ca 0.16 -0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 55.74 2g72 h ASN 38 Cb 0.04 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 2g72 h ASN 38 CO -0.03 0.46 -1.41 0.59 -1.65 0.00 0.00 177.43 175.39 2g72 n ASN 39 N -4.22 3.49 -0.74 5.81 3.02 -0.77 -4.82 115.26 117.04 2g72 n ASN 39 Ca -0.01 -0.03 0.11 0.00 -0.03 0.00 0.00 54.58 54.63 2g72 n ASN 39 Cb 0.32 0.14 0.05 0.00 -0.61 0.00 0.00 39.78 39.68 2g72 n ASN 39 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2g72 n TYR 40 N -2.54 0.00 -3.41 3.10 4.02 0.17 -3.72 117.16 114.77 2g72 n TYR 40 Ca -0.12 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.58 2g72 n TYR 40 Cb 0.65 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.97 2g72 n TYR 40 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2g72 s ALA 41 N -2.15 4.17 0.92 -0.72 0.00 -1.11 -4.20 121.76 118.66 2g72 s ALA 41 Ca 0.23 -1.40 -0.10 0.00 0.00 0.00 0.00 51.96 50.69 2g72 s ALA 41 Cb 0.19 -1.74 0.15 0.00 0.00 0.00 0.00 23.12 21.71 2g72 s ALA 41 CO 0.41 -0.08 1.13 -1.25 0.00 0.00 0.00 175.76 175.97 2g72 s PRO 42 N -4.22 1.02 0.22 0.00 0.04 -1.26 -0.88 135.00 129.92 2g72 s PRO 42 Ca 0.45 1.42 0.02 0.00 0.04 0.00 0.00 61.00 62.93 2g72 s PRO 42 Cb -0.10 -1.74 0.21 0.00 0.04 0.00 0.00 34.50 32.92 2g72 s PRO 42 CO 0.32 -2.59 1.55 -1.00 0.04 0.00 0.00 177.00 175.32 2g72 h PRO 43 N -1.83 0.33 -0.30 0.56 0.13 -1.92 -3.43 132.00 125.54 2g72 h PRO 43 Ca -0.45 -0.22 0.02 0.00 -0.87 0.00 0.00 66.00 64.48 2g72 h PRO 43 Cb 1.27 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 2g72 h PRO 43 CO 0.44 0.82 0.20 0.00 -0.23 0.00 0.00 178.00 179.23 2g72 h ARG 44 N 0.25 0.30 -0.19 0.86 3.08 -1.80 -1.73 114.38 115.16 2g72 h ARG 44 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2g72 h ARG 44 Cb 1.10 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.08 2g72 h ARG 44 CO 0.10 0.20 0.00 0.41 -1.07 0.00 0.00 179.97 179.61 2g72 n GLY 45 N -1.51 0.06 3.59 0.04 0.00 -0.05 -3.91 105.19 103.41 2g72 n GLY 45 Ca 0.02 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 2g72 n GLY 45 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2g72 s ASP 46 N -1.26 6.40 0.00 1.61 3.68 -0.65 -4.53 116.67 121.93 2g72 s ASP 46 Ca 0.23 0.57 0.29 0.00 2.13 0.00 0.00 52.55 55.77 2g72 s ASP 46 Cb 0.12 -2.55 1.22 0.00 -1.45 0.00 0.00 42.92 40.27 2g72 s ASP 46 CO 0.18 -1.43 1.84 0.18 0.13 0.00 0.00 175.17 176.07 2g72 n LEU 47 N 8.61 1.20 0.09 -1.34 4.77 -1.26 -4.06 117.00 125.00 2g72 n LEU 47 Ca 0.14 -0.40 -0.06 0.00 -0.03 0.00 0.00 56.01 55.66 2g72 n LEU 47 Cb 0.49 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.55 2g72 n LEU 47 CO 0.71 0.20 0.25 0.00 -1.33 0.00 0.00 177.39 177.23 2g72 s ASN 49 N -6.78 6.73 0.63 0.00 2.47 -1.26 -4.91 114.94 111.83 2g72 s ASN 49 Ca -0.00 0.68 0.42 0.00 0.42 0.00 0.00 52.86 54.37 2g72 s ASN 49 Cb 0.11 -2.49 2.16 0.00 -1.45 0.00 0.00 41.25 39.58 2g72 s ASN 49 CO 0.80 -0.91 2.26 -0.65 -3.72 0.00 0.00 177.10 174.88 2g72 h PRO 50 N 8.48 0.00 -0.01 0.43 0.11 -1.93 -1.89 132.00 137.19 2g72 h PRO 50 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2g72 h PRO 50 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2g72 h PRO 50 CO 1.01 0.00 -0.11 0.09 -0.21 0.00 0.00 178.00 178.79 2g72 n ASN 51 N -3.04 1.23 -4.78 -2.05 3.02 -1.26 -4.50 115.26 103.87 2g72 n ASN 51 Ca -0.02 -1.20 -0.30 0.00 -0.03 0.00 0.00 54.58 53.03 2g72 n ASN 51 Cb 0.12 0.05 0.11 0.00 -0.61 0.00 0.00 39.78 39.45 2g72 n ASN 51 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2g72 s GLY 52 N -2.22 1.61 0.37 7.41 0.00 -0.71 -4.91 107.32 108.87 2g72 s GLY 52 Ca 0.32 -0.22 0.16 0.00 0.00 0.00 0.00 44.72 44.99 2g72 s GLY 52 CO 0.42 0.24 1.77 -0.24 0.00 0.00 0.00 173.10 175.29 2g72 h VAL 53 N -1.26 1.10 0.63 1.40 3.04 -1.89 -2.37 116.25 116.90 2g72 h VAL 53 Ca -0.48 -1.47 -0.03 0.00 -1.01 0.00 0.00 66.70 63.70 2g72 h VAL 53 Cb 1.28 1.84 0.01 0.00 -2.01 0.00 0.00 31.29 32.40 2g72 h VAL 53 CO 0.58 0.39 -0.30 1.23 -1.01 0.00 0.00 177.57 178.47 2g72 h GLY 54 N 1.58 -0.89 0.91 3.17 0.00 -1.86 0.57 103.07 106.55 2g72 h GLY 54 Ca -0.00 0.33 0.03 0.00 0.00 0.00 0.00 47.33 47.68 2g72 h GLY 54 CO 0.05 -0.32 0.60 -2.55 0.00 0.00 0.00 176.54 174.32 2g72 h PRO 55 N -1.04 1.15 -0.33 4.80 0.11 -1.82 -2.02 132.00 132.85 2g72 h PRO 55 Ca -0.09 -0.07 0.02 0.00 0.11 0.00 0.00 66.00 65.98 2g72 h PRO 55 Cb 0.70 -0.26 -0.03 0.00 0.11 0.00 0.00 31.00 31.52 2g72 h PRO 55 CO 0.14 0.76 0.17 2.35 -0.21 0.00 0.00 178.00 181.21 2g72 h TRP 56 N 1.19 0.31 -0.20 0.65 7.01 -1.31 -0.99 115.95 122.61 2g72 h TRP 56 Ca 0.36 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.35 2g72 h TRP 56 Cb -0.04 -0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 26.92 2g72 h TRP 56 CO -0.01 0.17 0.02 -0.22 -2.79 0.00 0.00 178.44 175.61 2g72 h LYS 57 N 0.35 0.34 -0.74 2.65 1.63 -0.57 -0.85 116.57 119.37 2g72 h LYS 57 Ca 0.14 -0.10 0.01 0.00 -0.85 0.00 0.00 60.65 59.85 2g72 h LYS 57 Cb 0.05 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.60 2g72 h LYS 57 CO -0.09 0.51 0.49 -0.07 -3.45 0.00 0.00 179.45 176.83 2g72 h LEU 58 N 0.12 0.84 -0.74 5.20 3.38 -1.27 -0.67 115.31 122.17 2g72 h LEU 58 Ca 0.06 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 2g72 h LEU 58 Cb 0.34 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2g72 h LEU 58 CO 0.01 0.60 -0.20 -0.09 0.09 0.00 0.00 178.44 178.85 2g72 h ARG 59 N 0.99 0.74 0.13 1.13 2.43 -1.03 -0.34 114.38 118.43 2g72 h ARG 59 Ca 0.27 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2g72 h ARG 59 Cb -0.09 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 2g72 h ARG 59 CO -0.06 0.89 -0.06 0.00 -1.51 0.00 0.00 179.97 179.22 2g72 h LEU 61 N -0.23 0.99 -0.13 0.00 3.38 -1.06 -2.32 115.31 115.92 2g72 h LEU 61 Ca -0.02 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 2g72 h LEU 61 Cb 0.19 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2g72 h LEU 61 CO 0.03 0.83 -0.10 0.00 0.09 0.00 0.00 178.44 179.29 2g72 h ALA 62 N 1.20 0.19 -0.95 1.53 0.00 -0.98 -2.79 119.26 117.46 2g72 h ALA 62 Ca 0.26 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2g72 h ALA 62 Cb 0.09 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 2g72 h ALA 62 CO -0.04 0.02 0.58 1.96 0.00 0.00 0.00 179.25 181.78 2g72 h GLN 63 N -0.06 1.29 -0.18 0.00 4.20 -1.28 0.47 115.11 119.54 2g72 h GLN 63 Ca 0.03 -0.11 0.02 0.00 0.06 0.00 0.00 58.65 58.64 2g72 h GLN 63 Cb 0.60 -0.27 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 2g72 h GLN 63 CO 0.03 0.90 0.06 1.15 -0.67 0.00 0.00 178.83 180.30 2g72 h THR 64 N 1.31 0.96 0.00 -0.54 2.02 -1.38 -2.76 112.91 112.52 2g72 h THR 64 Ca 0.34 -0.05 -0.13 0.00 0.77 0.00 0.00 66.41 67.34 2g72 h THR 64 Cb -0.06 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 2g72 h THR 64 CO -0.06 0.03 -0.60 -0.26 0.37 0.00 0.00 175.52 174.99 2g72 h PHE 65 N 0.15 0.00 0.00 3.16 -1.00 -1.19 -3.00 116.94 115.06 2g72 h PHE 65 Ca 0.08 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.86 2g72 h PHE 65 Cb 0.05 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.61 2g72 h PHE 65 CO -0.11 0.60 0.00 0.00 -1.61 0.00 0.00 178.31 177.19 2g72 h ALA 66 N 1.40 1.00 0.00 2.45 0.00 -0.62 -1.87 119.26 121.61 2g72 h ALA 66 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2g72 h ALA 66 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2g72 h ALA 66 CO 0.08 0.00 0.00 1.79 0.00 0.00 0.00 179.25 181.12 2g72 h THR 67 N 0.00 0.00 0.00 0.00 1.35 -1.43 -3.46 112.91 109.36 2g72 h THR 67 Ca 0.00 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 2g72 h THR 67 Cb 0.13 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.05 2g72 h THR 67 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2g72 n GLY 68 N 0.12 2.05 0.21 5.82 0.00 -0.71 -4.86 105.19 107.82 2g72 n GLY 68 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.99 2g72 n GLY 68 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2g72 h GLU 69 N 2.24 0.38 -4.30 1.61 4.39 -1.82 -3.40 114.58 113.70 2g72 h GLU 69 Ca 0.00 -0.18 -0.74 0.00 0.34 0.00 0.00 59.36 58.78 2g72 h GLU 69 Cb 0.00 -0.00 -0.25 0.00 -0.10 0.00 0.00 28.75 28.40 2g72 h GLU 69 CO 0.00 0.71 -0.35 0.08 -1.16 0.00 0.00 179.01 178.29 2g72 s VAL 70 N -4.23 4.91 0.27 3.13 1.01 -1.26 -5.03 120.40 119.20 2g72 s VAL 70 Ca -0.06 -1.28 -0.12 0.00 0.00 0.00 0.00 61.98 60.52 2g72 s VAL 70 Cb 0.13 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.50 2g72 s VAL 70 CO 0.79 -0.63 0.52 -0.94 0.00 0.00 0.00 175.10 174.84 2g72 s SER 71 N 2.67 0.03 0.00 3.32 1.04 -1.26 -4.94 113.70 114.56 2g72 s SER 71 Ca 0.04 -0.99 0.00 0.00 0.48 0.00 0.00 55.95 55.47 2g72 s SER 71 Cb -0.25 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.49 2g72 s SER 71 CO 0.04 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.66 2g72 n GLY 72 N -0.42 0.01 0.16 7.32 0.00 -1.23 -4.86 105.19 106.18 2g72 n GLY 72 Ca -0.02 -1.44 -0.21 0.00 0.00 0.00 0.00 46.02 44.36 2g72 n GLY 72 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2g72 n ARG 73 N 0.00 0.57 -4.57 1.61 0.63 -1.26 -4.35 116.66 109.28 2g72 n ARG 73 Ca 0.00 0.18 -0.30 0.00 -0.92 0.00 0.00 57.85 56.81 2g72 n ARG 73 Cb 0.00 -1.44 -0.13 0.00 0.45 0.00 0.00 32.46 31.34 2g72 n ARG 73 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 2g72 s THR 74 N -2.47 2.48 -0.01 5.15 -4.23 -1.26 -1.14 115.64 114.16 2g72 s THR 74 Ca -0.33 -1.47 -0.02 0.00 -1.18 0.00 0.00 61.69 58.68 2g72 s THR 74 Cb 0.10 -2.06 -0.00 0.00 1.34 0.00 0.00 72.50 71.88 2g72 s THR 74 CO 0.50 0.22 0.05 -0.22 -0.54 0.00 0.00 174.62 174.63 2g72 s LEU 75 N -1.72 1.86 -0.08 4.79 2.96 0.06 -2.02 118.68 124.53 2g72 s LEU 75 Ca 0.14 -0.05 0.04 0.00 -0.22 0.00 0.00 54.13 54.05 2g72 s LEU 75 Cb -0.10 0.22 0.00 0.00 0.50 0.00 0.00 46.19 46.81 2g72 s LEU 75 CO 0.06 -0.11 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.13 2g72 s ILE 76 N -0.42 1.82 -0.33 6.68 1.01 -0.97 -0.05 121.20 128.93 2g72 s ILE 76 Ca -0.05 -0.89 -0.11 0.00 0.00 0.00 0.00 60.65 59.60 2g72 s ILE 76 Cb -0.03 -1.57 -0.00 0.00 0.01 0.00 0.00 42.46 40.86 2g72 s ILE 76 CO 0.00 0.51 0.18 -0.62 0.00 0.00 0.00 174.94 175.01 2g72 s ASP 77 N 0.29 5.68 -0.32 3.58 2.15 0.65 -1.27 116.67 127.43 2g72 s ASP 77 Ca -0.14 -0.61 -0.22 0.00 0.43 0.00 0.00 52.55 52.00 2g72 s ASP 77 Cb -0.16 -2.03 -0.00 0.00 -0.30 0.00 0.00 42.92 40.42 2g72 s ASP 77 CO 0.06 -0.25 0.74 -0.63 -0.17 0.00 0.00 175.17 174.93 2g72 s ILE 78 N 1.62 4.83 -0.62 4.11 -1.09 0.77 -2.10 121.20 128.72 2g72 s ILE 78 Ca 0.04 1.02 -0.00 0.00 -2.23 0.00 0.00 60.65 59.48 2g72 s ILE 78 Cb -0.18 -4.11 -0.00 0.00 -1.58 0.00 0.00 42.46 36.59 2g72 s ILE 78 CO 0.07 -0.25 0.52 0.61 -1.23 0.00 0.00 174.94 174.65 2g72 n GLY 79 N 4.33 0.01 0.29 6.18 0.00 -1.19 -4.15 105.19 110.67 2g72 n GLY 79 Ca 0.02 -0.15 0.10 0.00 0.00 0.00 0.00 46.02 45.99 2g72 n GLY 79 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2g72 h SER 80 N -0.95 0.09 0.00 1.61 0.02 -0.03 -3.44 113.55 110.86 2g72 h SER 80 Ca -0.31 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2g72 h SER 80 Cb 1.18 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2g72 h SER 80 CO 0.26 0.06 0.00 0.61 -1.14 0.00 0.00 176.83 176.62 2g72 n GLY 81 N -1.55 2.10 1.95 -3.77 0.00 -1.25 -2.41 105.19 100.26 2g72 n GLY 81 Ca 0.01 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.39 2g72 n GLY 81 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2g72 n PRO 82 N 7.52 2.41 -4.42 1.61 -0.04 -1.26 -4.65 135.00 136.17 2g72 n PRO 82 Ca 0.00 -3.06 -0.27 0.00 -0.04 0.00 0.00 63.50 60.13 2g72 n PRO 82 Cb 0.00 -2.11 -0.12 0.00 -0.04 0.00 0.00 33.50 31.24 2g72 n PRO 82 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2g72 s THR 83 N -3.23 2.37 0.00 0.52 -4.23 -1.01 -4.81 115.64 105.25 2g72 s THR 83 Ca 0.54 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.04 2g72 s THR 83 Cb 0.46 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 72.16 2g72 s THR 83 CO 0.09 -0.11 0.08 1.33 -0.54 0.00 0.00 174.62 175.47 2g72 n VAL 84 N 0.28 0.00 -0.13 2.29 0.24 -1.26 -4.79 118.33 114.96 2g72 n VAL 84 Ca -0.13 -0.29 0.13 0.00 -2.04 0.00 0.00 64.34 62.02 2g72 n VAL 84 Cb 0.56 1.11 0.48 0.00 -1.47 0.00 0.00 33.84 34.53 2g72 n VAL 84 CO 0.00 0.00 0.00 0.10 -2.14 0.00 0.00 176.83 174.79 2g72 h TYR 85 N 0.00 0.50 0.00 6.34 -0.00 -1.97 0.74 116.97 122.57 2g72 h TYR 85 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.74 2g72 h TYR 85 Cb 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 36.73 36.63 2g72 h TYR 85 CO 0.00 0.22 0.00 0.00 -0.00 0.00 0.00 178.16 178.38 2g72 n GLN 86 N -4.48 0.06 -0.00 0.10 0.00 -1.26 -2.22 117.38 109.58 2g72 n GLN 86 Ca 0.12 0.48 0.04 0.00 0.00 0.00 0.00 57.00 57.64 2g72 n GLN 86 Cb 0.43 -1.66 0.04 0.00 0.00 0.00 0.00 30.24 29.05 2g72 n GLN 86 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2g72 n LEU 87 N -1.77 1.74 -0.24 2.61 4.77 0.25 -4.67 117.00 119.69 2g72 n LEU 87 Ca 0.01 -1.01 -0.04 0.00 -0.03 0.00 0.00 56.01 54.94 2g72 n LEU 87 Cb 0.07 -0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.23 2g72 n LEU 87 CO 0.07 0.34 1.14 -0.07 -1.33 0.00 0.00 177.39 177.55 2g72 h LEU 88 N 1.72 0.72 0.00 2.23 3.38 -1.42 -0.14 115.31 121.79 2g72 h LEU 88 Ca 0.00 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 2g72 h LEU 88 Cb 0.37 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2g72 h LEU 88 CO 0.00 0.50 -1.21 0.28 0.09 0.00 0.00 178.44 178.10 2g72 h SER 89 N 0.85 0.00 -0.17 -0.43 0.02 -1.86 -3.36 113.55 108.61 2g72 h SER 89 Ca 0.27 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 61.06 2g72 h SER 89 Cb -0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 2g72 h SER 89 CO -0.10 0.63 -0.49 0.00 -1.14 0.00 0.00 176.83 175.73 2g72 h ALA 90 N 1.37 0.62 -0.19 3.77 0.00 -1.76 -3.34 119.26 119.73 2g72 h ALA 90 Ca -0.13 -0.49 0.06 0.00 0.00 0.00 0.00 54.91 54.35 2g72 h ALA 90 Cb 1.59 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 2g72 h ALA 90 CO 0.06 0.68 0.31 0.00 0.00 0.00 0.00 179.25 180.30 2g72 n SER 92 N -3.45 1.06 -0.15 0.00 3.41 -1.25 -3.66 113.62 109.57 2g72 n SER 92 Ca 0.02 -1.57 0.02 0.00 -0.26 0.00 0.00 58.87 57.08 2g72 n SER 92 Cb 0.42 -0.06 0.01 0.00 -0.26 0.00 0.00 64.21 64.33 2g72 n SER 92 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2g72 n HIS 93 N -0.09 0.00 -3.64 7.33 8.25 -0.21 -4.98 115.22 121.88 2g72 n HIS 93 Ca 0.16 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.46 2g72 n HIS 93 Cb 0.24 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.20 2g72 n HIS 93 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2g72 s PHE 94 N -0.45 -0.27 0.22 4.41 0.40 -1.24 -3.47 117.98 117.58 2g72 s PHE 94 Ca 0.05 0.66 0.14 0.00 -0.60 0.00 0.00 56.93 57.18 2g72 s PHE 94 Cb 0.03 -0.21 0.51 0.00 0.51 0.00 0.00 43.02 43.87 2g72 s PHE 94 CO 0.06 -0.35 1.67 1.05 0.70 0.00 0.00 175.22 178.35 2g72 h GLU 95 N 8.33 0.00 -4.89 0.44 4.11 -1.65 -3.41 114.58 117.51 2g72 h GLU 95 Ca -0.14 0.00 -0.67 0.00 0.07 0.00 0.00 59.36 58.62 2g72 h GLU 95 Cb 1.12 0.00 -0.34 0.00 0.50 0.00 0.00 28.75 30.03 2g72 h GLU 95 CO 0.16 0.50 -0.78 0.34 0.07 0.00 0.00 179.01 179.31 2g72 s ASP 96 N -6.66 4.30 -0.06 3.06 2.15 -0.29 -4.60 116.67 114.57 2g72 s ASP 96 Ca -0.01 -1.11 0.06 0.00 0.43 0.00 0.00 52.55 51.92 2g72 s ASP 96 Cb 0.12 -1.60 -0.01 0.00 -0.30 0.00 0.00 42.92 41.12 2g72 s ASP 96 CO 0.73 -0.16 -0.24 -0.63 -0.17 0.00 0.00 175.17 174.70 2g72 s ILE 97 N 1.22 2.12 -0.15 4.11 1.01 0.16 -0.76 121.20 128.90 2g72 s ILE 97 Ca -0.04 -1.05 0.00 0.00 0.00 0.00 0.00 60.65 59.57 2g72 s ILE 97 Cb -0.18 -1.77 -0.01 0.00 0.01 0.00 0.00 42.46 40.52 2g72 s ILE 97 CO -0.05 0.57 -0.14 -0.89 0.00 0.00 0.00 174.94 174.42 2g72 s THR 98 N -0.19 2.77 0.11 2.92 2.01 0.93 -1.44 115.64 122.75 2g72 s THR 98 Ca -0.03 -0.74 0.03 0.00 0.31 0.00 0.00 61.69 61.27 2g72 s THR 98 Cb -0.13 -2.17 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 2g72 s THR 98 CO 0.03 0.51 0.12 -0.04 -0.69 0.00 0.00 174.62 174.56 2g72 s MET 99 N 0.71 2.96 0.07 4.92 -1.94 -0.43 -0.26 119.30 125.34 2g72 s MET 99 Ca -0.07 -0.73 -0.10 0.00 -1.71 0.00 0.00 55.69 53.09 2g72 s MET 99 Cb -0.15 -2.74 0.01 0.00 2.01 0.00 0.00 34.83 33.95 2g72 s MET 99 CO 0.02 0.54 0.22 0.95 -0.01 0.00 0.00 175.02 176.74 2g72 s THR 100 N -1.53 0.12 -0.19 2.05 -4.23 -0.89 -0.83 115.64 110.13 2g72 s THR 100 Ca 0.30 -1.00 -0.29 0.00 -1.18 0.00 0.00 61.69 59.52 2g72 s THR 100 Cb -0.11 -1.18 0.13 0.00 1.34 0.00 0.00 72.50 72.68 2g72 s THR 100 CO 0.23 -0.55 1.03 -0.62 -0.54 0.00 0.00 174.62 174.17 2g72 s ASP 101 N -2.58 -0.36 0.27 3.99 2.15 -0.69 0.58 116.67 120.03 2g72 s ASP 101 Ca 0.01 0.46 0.01 0.00 0.43 0.00 0.00 52.55 53.47 2g72 s ASP 101 Cb 0.03 0.39 0.37 0.00 -0.30 0.00 0.00 42.92 43.41 2g72 s ASP 101 CO -0.09 -0.28 1.70 0.15 -0.17 0.00 0.00 175.17 176.48 2g72 h PHE 102 N 2.86 0.58 -3.05 -5.34 3.57 -1.87 -3.17 116.94 110.51 2g72 h PHE 102 Ca -0.20 -0.13 -0.60 0.00 3.53 0.00 0.00 57.97 60.57 2g72 h PHE 102 Cb 1.17 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.72 2g72 h PHE 102 CO 0.29 0.73 -0.21 -0.51 -2.23 0.00 0.00 178.31 176.38 2g72 s LEU 103 N -8.66 4.43 0.12 0.59 1.43 -1.26 -4.78 118.68 110.55 2g72 s LEU 103 Ca -0.07 0.91 -0.12 0.00 -1.03 0.00 0.00 54.13 53.82 2g72 s LEU 103 Cb 0.14 -2.74 -0.07 0.00 0.03 0.00 0.00 46.19 43.55 2g72 s LEU 103 CO 0.80 0.27 1.43 -0.08 0.23 0.00 0.00 176.35 179.00 2g72 h GLU 104 N 4.34 0.86 -0.72 1.70 4.81 -2.00 -2.92 114.58 120.65 2g72 h GLU 104 Ca -0.51 -0.49 0.09 0.00 -0.13 0.00 0.00 59.36 58.32 2g72 h GLU 104 Cb 1.21 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 2g72 h GLU 104 CO 0.63 1.13 0.47 -0.39 -0.73 0.00 0.00 179.01 180.13 2g72 h VAL 105 N 0.65 0.95 -0.19 0.32 -1.51 -1.96 0.66 116.25 115.17 2g72 h VAL 105 Ca 0.04 -0.22 -0.13 0.00 -1.23 0.00 0.00 66.70 65.16 2g72 h VAL 105 Cb 1.02 0.25 0.00 0.00 -2.13 0.00 0.00 31.29 30.43 2g72 h VAL 105 CO 0.10 0.12 -0.37 0.78 -1.23 0.00 0.00 177.57 176.96 2g72 h ASN 106 N 0.64 0.65 -0.17 4.19 2.35 -1.88 -0.67 115.58 120.70 2g72 h ASN 106 Ca 0.33 -0.55 -0.00 0.00 -0.55 0.00 0.00 56.30 55.52 2g72 h ASN 106 Cb 0.43 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 2g72 h ASN 106 CO -0.11 1.08 0.10 0.03 -1.65 0.00 0.00 177.43 176.88 2g72 h ARG 107 N 0.25 0.25 -0.10 0.81 3.08 -1.17 0.72 114.38 118.24 2g72 h ARG 107 Ca 0.01 -0.02 -0.19 0.00 0.07 0.00 0.00 59.98 59.85 2g72 h ARG 107 Cb 0.97 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.98 2g72 h ARG 107 CO 0.08 0.20 -0.67 1.96 -1.07 0.00 0.00 179.97 180.47 2g72 h GLN 108 N 0.26 0.62 -0.76 0.04 4.20 -0.70 -1.96 115.11 116.81 2g72 h GLN 108 Ca 0.07 -0.54 0.00 0.00 0.06 0.00 0.00 58.65 58.24 2g72 h GLN 108 Cb 0.02 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.89 2g72 h GLN 108 CO -0.01 1.16 0.49 1.49 -0.67 0.00 0.00 178.83 181.29 2g72 h GLU 109 N 0.27 1.01 -0.64 1.46 4.57 -0.27 -1.08 114.58 119.91 2g72 h GLU 109 Ca -0.06 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.03 2g72 h GLU 109 Cb 1.32 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 29.66 2g72 h GLU 109 CO 0.14 0.69 0.34 -0.07 -1.18 0.00 0.00 179.01 178.92 2g72 h LEU 110 N 1.03 0.81 -1.08 1.64 3.38 -0.86 -2.55 115.31 117.67 2g72 h LEU 110 Ca 0.28 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.16 2g72 h LEU 110 Cb -0.09 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.41 2g72 h LEU 110 CO -0.06 0.68 0.62 1.23 0.09 0.00 0.00 178.44 181.00 2g72 h GLY 111 N 0.87 1.33 1.88 0.83 0.00 -0.63 0.12 103.07 107.47 2g72 h GLY 111 Ca 0.22 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 2g72 h GLY 111 CO -0.03 0.46 0.06 3.21 0.00 0.00 0.00 176.54 180.24 2g72 h ARG 112 N 1.25 0.16 0.14 4.80 3.08 -0.79 0.12 114.38 123.14 2g72 h ARG 112 Ca 0.35 -0.01 -0.34 0.00 0.07 0.00 0.00 59.98 60.05 2g72 h ARG 112 Cb -0.11 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 29.90 2g72 h ARG 112 CO -0.08 0.12 -1.77 2.35 -1.07 0.00 0.00 179.97 179.52 2g72 h TRP 113 N 0.17 0.55 -0.64 3.04 7.01 -1.20 0.68 115.95 125.56 2g72 h TRP 113 Ca 0.04 -0.40 0.00 0.00 2.11 0.00 0.00 58.89 60.64 2g72 h TRP 113 Cb 0.01 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.02 2g72 h TRP 113 CO 0.00 1.70 0.40 -0.07 -2.79 0.00 0.00 178.44 177.68 2g72 h LEU 114 N -0.02 0.76 -1.10 0.65 3.38 -0.55 -2.17 115.31 116.26 2g72 h LEU 114 Ca -0.37 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2g72 h LEU 114 Cb 1.99 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.55 2g72 h LEU 114 CO 0.11 0.57 0.00 0.00 0.09 0.00 0.00 178.44 179.21 2g72 n GLN 115 N -4.61 1.72 -3.81 1.13 1.13 0.39 -4.93 117.38 108.40 2g72 n GLN 115 Ca 0.05 -1.08 -0.27 0.00 -1.94 0.00 0.00 57.00 53.75 2g72 n GLN 115 Cb 0.04 -1.38 0.04 0.00 0.11 0.00 0.00 30.24 29.04 2g72 n GLN 115 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2g72 n GLU 116 N 0.31 -5.94 -1.91 -1.09 1.02 -0.82 -4.97 120.64 107.24 2g72 n GLU 116 Ca 0.16 0.65 -0.29 0.00 -0.02 0.00 0.00 57.16 57.66 2g72 n GLU 116 Cb 0.32 -5.53 0.12 0.00 -0.02 0.00 0.00 31.44 26.33 2g72 n GLU 116 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2g72 s GLU 117 N -6.44 1.50 0.40 3.49 2.02 0.23 -5.00 118.70 114.90 2g72 s GLU 117 Ca 0.54 -0.08 -0.25 0.00 0.02 0.00 0.00 54.97 55.20 2g72 s GLU 117 Cb -0.26 -1.92 -0.08 0.00 0.10 0.00 0.00 34.13 31.97 2g72 s GLU 117 CO 0.81 -1.89 1.16 -2.14 0.02 0.00 0.00 175.26 173.22 2g72 s PRO 118 N -5.69 4.04 0.00 0.39 0.02 -1.26 -3.23 135.00 129.28 2g72 s PRO 118 Ca 0.66 1.81 0.00 0.00 0.02 0.00 0.00 61.00 63.49 2g72 s PRO 118 Cb -0.08 -2.65 0.00 0.00 0.02 0.00 0.00 34.50 31.79 2g72 s PRO 118 CO 0.50 -0.32 0.00 0.41 -0.33 0.00 0.00 177.00 177.26 2g72 n GLY 119 N 0.60 0.80 3.74 0.52 0.00 -1.26 -5.01 105.19 104.58 2g72 n GLY 119 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2g72 n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g72 s ALA 120 N -3.15 2.46 0.43 4.61 0.00 -1.20 -4.96 121.76 119.95 2g72 s ALA 120 Ca 0.00 1.09 -0.24 0.00 0.00 0.00 0.00 51.96 52.81 2g72 s ALA 120 Cb 0.00 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.55 2g72 s ALA 120 CO 0.00 -1.36 1.17 0.12 0.00 0.00 0.00 175.76 175.69 2g72 s PHE 121 N -1.53 2.96 -0.55 0.00 5.36 -1.26 -4.96 117.98 118.00 2g72 s PHE 121 Ca 0.79 1.54 -0.21 0.00 -0.96 0.00 0.00 56.93 58.09 2g72 s PHE 121 Cb -0.33 -3.40 0.06 0.00 -0.34 0.00 0.00 43.02 39.01 2g72 s PHE 121 CO 0.36 -1.45 0.75 1.21 -1.46 0.00 0.00 175.22 174.64 2g72 s ASN 122 N -1.23 6.24 0.00 6.13 2.47 -1.26 -4.88 114.94 122.41 2g72 s ASN 122 Ca 0.60 -0.86 0.26 0.00 0.42 0.00 0.00 52.86 53.28 2g72 s ASN 122 Cb -0.30 -2.34 0.73 0.00 -1.45 0.00 0.00 41.25 37.88 2g72 s ASN 122 CO 0.37 -1.07 1.56 0.79 -3.72 0.00 0.00 177.10 175.03 2g72 n TRP 123 N 6.70 0.05 -0.34 0.43 7.02 -1.26 -4.63 117.44 125.40 2g72 n TRP 123 Ca -0.05 -0.02 0.19 0.00 -1.02 0.00 0.00 57.50 56.60 2g72 n TRP 123 Cb 0.45 0.00 0.40 0.00 -2.42 0.00 0.00 31.31 29.75 2g72 n TRP 123 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 2g72 h SER 124 N 3.17 0.65 -0.69 -0.99 4.64 -1.99 0.63 113.55 118.97 2g72 h SER 124 Ca 0.00 0.14 -0.03 0.00 -0.47 0.00 0.00 61.79 61.43 2g72 h SER 124 Cb 0.68 0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.78 2g72 h SER 124 CO 0.00 0.08 0.31 0.24 -0.87 0.00 0.00 176.83 176.58 2g72 h MET 125 N 0.55 1.03 -0.32 4.77 2.86 -2.00 -0.45 114.93 121.37 2g72 h MET 125 Ca 0.65 -0.16 -0.10 0.00 -2.06 0.00 0.00 59.70 58.04 2g72 h MET 125 Cb 1.29 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.76 2g72 h MET 125 CO -0.48 0.82 -0.19 1.88 1.06 0.00 0.00 176.91 180.00 2g72 h TYR 126 N 1.02 0.80 -0.50 -0.22 -1.99 -1.26 -1.03 116.97 113.79 2g72 h TYR 126 Ca 0.24 -0.21 0.02 0.00 2.00 0.00 0.00 58.73 60.78 2g72 h TYR 126 Cb 0.16 -0.18 -0.03 0.00 2.00 0.00 0.00 36.73 38.67 2g72 h TYR 126 CO 0.01 0.92 0.30 0.77 -0.00 0.00 0.00 178.16 180.17 2g72 h SER 127 N 0.45 0.50 -0.68 3.88 0.02 -1.01 0.22 113.55 116.92 2g72 h SER 127 Ca 0.07 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 2g72 h SER 127 Cb 0.73 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 2g72 h SER 127 CO 0.05 0.35 0.29 -0.61 -1.14 0.00 0.00 176.83 175.77 2g72 h GLN 128 N 0.61 1.01 -0.36 3.45 5.75 -0.99 -1.18 115.11 123.39 2g72 h GLN 128 Ca 0.20 -0.17 -0.12 0.00 -0.15 0.00 0.00 58.65 58.40 2g72 h GLN 128 Cb 0.00 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.37 2g72 h GLN 128 CO -0.08 0.83 -0.27 1.25 -2.65 0.00 0.00 178.83 177.91 2g72 h HIS 129 N 0.96 0.85 -0.72 3.99 2.76 -0.65 0.90 115.15 123.24 2g72 h HIS 129 Ca 0.23 -0.21 -0.03 0.00 -2.20 0.00 0.00 60.37 58.16 2g72 h HIS 129 Cb 0.19 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 28.92 2g72 h HIS 129 CO 0.01 0.93 0.34 0.00 -1.30 0.00 0.00 177.93 177.91 2g72 h ALA 130 N 1.06 0.93 -0.51 5.26 0.00 -0.67 0.63 119.26 125.96 2g72 h ALA 130 Ca 0.08 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2g72 h ALA 130 Cb 0.79 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2g72 h ALA 130 CO 0.06 0.50 0.14 0.00 0.00 0.00 0.00 179.25 179.96 2g72 h LEU 132 N 0.70 0.17 -0.20 0.00 5.85 -0.36 -2.01 115.31 119.46 2g72 h LEU 132 Ca 0.16 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 2g72 h LEU 132 Cb 0.30 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2g72 h LEU 132 CO -0.00 0.13 0.06 0.40 -0.34 0.00 0.00 178.44 178.68 2g72 h ILE 133 N 0.22 1.19 -0.54 4.05 2.04 -0.74 -3.09 117.51 120.65 2g72 h ILE 133 Ca 0.07 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.32 2g72 h ILE 133 Cb -0.00 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 2g72 h ILE 133 CO -0.04 0.19 0.34 -0.33 0.00 0.00 0.00 178.15 178.32 2g72 h GLU 134 N 0.14 0.71 -1.13 2.37 5.08 -0.89 -3.47 114.58 117.40 2g72 h GLU 134 Ca 0.06 -0.05 -0.26 0.00 -1.00 0.00 0.00 59.36 58.12 2g72 h GLU 134 Cb 0.24 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.27 2g72 h GLU 134 CO -0.00 0.48 -0.27 0.41 -1.00 0.00 0.00 179.01 178.63 2g72 n GLY 135 N -1.42 0.70 0.56 -3.84 0.00 -0.77 -4.90 105.19 95.52 2g72 n GLY 135 Ca 0.05 -0.40 0.13 0.00 0.00 0.00 0.00 46.02 45.79 2g72 n GLY 135 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2g72 n LYS 136 N -2.45 1.75 -1.12 1.61 5.02 -1.26 -4.91 118.16 116.80 2g72 n LYS 136 Ca -0.14 -1.11 -0.04 0.00 -2.02 0.00 0.00 58.31 55.00 2g72 n LYS 136 Cb 0.50 -1.45 -0.02 0.00 -0.02 0.00 0.00 35.03 34.05 2g72 n LYS 136 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2g72 n GLY 137 N 1.18 0.70 3.74 0.72 0.00 -1.26 -5.01 105.19 105.26 2g72 n GLY 137 Ca 0.18 -0.84 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 2g72 n GLY 137 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2g72 s GLU 138 N -2.29 4.61 0.46 1.61 2.12 -1.26 -5.04 118.70 118.90 2g72 s GLU 138 Ca 0.00 1.26 -0.20 0.00 0.36 0.00 0.00 54.97 56.38 2g72 s GLU 138 Cb 0.00 -3.36 -0.09 0.00 0.26 0.00 0.00 34.13 30.94 2g72 s GLU 138 CO 0.00 0.29 1.00 0.00 -0.54 0.00 0.00 175.26 176.01 2g72 h TRP 140 N 1.69 0.00 -0.51 0.00 5.08 -1.93 -2.46 115.95 117.83 2g72 h TRP 140 Ca -0.49 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 59.37 2g72 h TRP 140 Cb 1.20 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.35 2g72 h TRP 140 CO 0.59 0.12 -0.12 1.96 -1.28 0.00 0.00 178.44 179.71 2g72 h GLN 141 N 0.00 0.96 -0.23 0.12 7.50 -1.95 -1.72 115.11 119.78 2g72 h GLN 141 Ca -0.00 -0.35 -0.08 0.00 0.50 0.00 0.00 58.65 58.72 2g72 h GLN 141 Cb 0.29 -0.06 -0.01 0.00 0.05 0.00 0.00 27.48 27.74 2g72 h GLN 141 CO 0.02 1.02 -0.20 -0.44 -1.50 0.00 0.00 178.83 177.72 2g72 h ASP 142 N 0.85 0.41 0.09 1.46 3.32 -1.83 0.67 116.42 121.39 2g72 h ASP 142 Ca 0.13 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2g72 h ASP 142 Cb 0.67 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.11 2g72 h ASP 142 CO 0.05 0.62 -0.04 0.50 -1.72 0.00 0.00 179.24 178.65 2g72 h LYS 143 N 0.38 -0.11 -0.36 3.56 1.63 -1.35 -0.06 116.57 120.25 2g72 h LYS 143 Ca 0.06 0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.83 2g72 h LYS 143 Cb 0.57 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.20 2g72 h LYS 143 CO 0.04 0.14 0.05 0.93 -3.45 0.00 0.00 179.45 177.16 2g72 h GLU 144 N -0.36 0.55 0.04 1.90 5.08 -1.12 -1.10 114.58 119.56 2g72 h GLU 144 Ca -0.01 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2g72 h GLU 144 Cb 0.31 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2g72 h GLU 144 CO 0.02 0.54 -0.02 -0.09 -1.00 0.00 0.00 179.01 178.46 2g72 h ARG 145 N 0.53 -0.05 -0.71 2.33 2.43 -0.60 -0.98 114.38 117.33 2g72 h ARG 145 Ca 0.12 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.26 2g72 h ARG 145 Cb 0.27 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.80 2g72 h ARG 145 CO 0.00 0.04 0.31 0.37 -1.51 0.00 0.00 179.97 179.19 2g72 h GLN 146 N -0.13 1.02 -0.16 0.20 4.15 -0.62 -0.85 115.11 118.72 2g72 h GLN 146 Ca -0.01 -0.15 -0.02 0.00 0.77 0.00 0.00 58.65 59.24 2g72 h GLN 146 Cb 0.12 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 2g72 h GLN 146 CO 0.01 0.81 0.01 1.25 -1.93 0.00 0.00 178.83 178.98 2g72 h LEU 147 N 1.01 0.26 -1.34 -2.39 5.85 -0.95 -0.95 115.31 116.80 2g72 h LEU 147 Ca 0.24 -0.29 0.03 0.00 0.84 0.00 0.00 57.88 58.70 2g72 h LEU 147 Cb 0.15 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 2g72 h LEU 147 CO -0.03 0.48 0.47 0.03 -0.34 0.00 0.00 178.44 179.05 2g72 h ARG 148 N 0.03 0.84 -0.08 1.25 3.08 -0.98 -1.42 114.38 117.10 2g72 h ARG 148 Ca 0.05 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 2g72 h ARG 148 Cb 0.34 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 2g72 h ARG 148 CO 0.01 0.56 -0.07 0.00 -1.07 0.00 0.00 179.97 179.39 2g72 h ALA 149 N 1.59 0.12 0.00 0.04 0.00 -0.90 -3.27 119.26 116.83 2g72 h ALA 149 Ca 0.28 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2g72 h ALA 149 Cb 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2g72 h ALA 149 CO -0.08 -0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.10 2g72 h ARG 150 N -0.23 0.00 -6.24 0.00 3.08 -0.85 -3.40 114.38 106.75 2g72 h ARG 150 Ca 0.01 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.50 2g72 h ARG 150 Cb 0.58 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.54 2g72 h ARG 150 CO 0.02 0.00 1.26 0.08 -1.07 0.00 0.00 179.97 180.26 2g72 s VAL 151 N -3.50 3.80 0.22 2.04 1.01 -0.56 -0.67 120.40 122.74 2g72 s VAL 151 Ca 0.03 -0.13 0.05 0.00 0.00 0.00 0.00 61.98 61.94 2g72 s VAL 151 Cb 0.08 -4.96 -0.07 0.00 0.00 0.00 0.00 36.38 31.43 2g72 s VAL 151 CO 0.57 -1.87 1.51 0.11 0.00 0.00 0.00 175.10 175.42 2g72 h LYS 152 N 10.01 0.16 -3.19 2.72 1.79 -1.47 -3.48 116.57 123.11 2g72 h LYS 152 Ca -0.06 -0.13 -0.04 0.00 -2.18 0.00 0.00 60.65 58.24 2g72 h LYS 152 Cb 1.03 0.03 -0.13 0.00 -1.58 0.00 0.00 32.23 31.58 2g72 h LYS 152 CO 1.35 0.79 0.06 -0.98 -1.08 0.00 0.00 179.45 179.59 2g72 s ARG 153 N -3.54 1.16 -0.33 3.15 1.70 -1.24 -5.09 118.95 114.77 2g72 s ARG 153 Ca -0.03 -0.58 0.01 0.00 -0.47 0.00 0.00 55.73 54.66 2g72 s ARG 153 Cb 0.12 0.53 0.10 0.00 -0.57 0.00 0.00 34.95 35.12 2g72 s ARG 153 CO 0.80 -0.48 0.08 0.08 -1.08 0.00 0.00 175.30 174.70 2g72 s VAL 154 N -3.73 1.44 0.13 4.99 1.01 -1.26 -1.32 120.40 121.66 2g72 s VAL 154 Ca 0.02 -1.81 0.04 0.00 0.00 0.00 0.00 61.98 60.23 2g72 s VAL 154 Cb 0.00 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 2g72 s VAL 154 CO -0.12 -0.66 0.15 -0.76 0.00 0.00 0.00 175.10 173.71 2g72 s LEU 155 N 1.30 3.93 0.80 3.92 1.43 -0.01 -4.95 118.68 125.09 2g72 s LEU 155 Ca 0.11 -0.01 -0.11 0.00 -1.03 0.00 0.00 54.13 53.08 2g72 s LEU 155 Cb -0.18 -2.56 0.07 0.00 0.03 0.00 0.00 46.19 43.55 2g72 s LEU 155 CO -0.18 0.11 1.09 -2.16 0.23 0.00 0.00 176.35 175.44 2g72 s PRO 156 N -2.85 2.07 -0.00 1.29 0.04 -1.26 -1.71 135.00 132.59 2g72 s PRO 156 Ca 0.31 0.94 -0.28 0.00 0.04 0.00 0.00 61.00 62.01 2g72 s PRO 156 Cb -0.11 -1.89 0.10 0.00 0.04 0.00 0.00 34.50 32.63 2g72 s PRO 156 CO 0.24 -1.71 0.83 -1.50 0.04 0.00 0.00 177.00 174.90 2g72 s ILE 157 N -2.98 0.00 -0.28 0.56 2.07 -1.20 -4.72 121.20 114.65 2g72 s ILE 157 Ca 0.61 0.00 -0.00 0.00 -1.41 0.00 0.00 60.65 59.85 2g72 s ILE 157 Cb -0.16 -1.00 0.14 0.00 0.13 0.00 0.00 42.46 41.56 2g72 s ILE 157 CO 0.56 0.00 0.31 -0.62 -1.91 0.00 0.00 174.94 173.27 2g72 s ASP 158 N -2.20 1.47 0.13 4.50 -1.08 -0.90 -3.62 116.67 114.97 2g72 s ASP 158 Ca 0.02 -0.65 0.10 0.00 -0.52 0.00 0.00 52.55 51.49 2g72 s ASP 158 Cb -0.01 0.59 0.50 0.00 -1.46 0.00 0.00 42.92 42.54 2g72 s ASP 158 CO -0.06 -0.38 1.29 1.33 0.52 0.00 0.00 175.17 177.87 2g72 n VAL 159 N 5.32 1.56 0.46 1.11 0.24 -1.26 -1.42 118.33 124.33 2g72 n VAL 159 Ca -0.02 0.57 0.12 0.00 -2.04 0.00 0.00 64.34 62.97 2g72 n VAL 159 Cb 0.47 -1.55 0.26 0.00 -1.47 0.00 0.00 33.84 31.55 2g72 n VAL 159 CO 0.00 0.00 0.00 0.45 -2.14 0.00 0.00 176.83 175.14 2g72 h HIS 160 N 0.00 0.00 -3.62 6.34 3.86 -1.94 -3.40 115.15 116.38 2g72 h HIS 160 Ca 0.00 0.00 -0.51 0.00 -1.16 0.00 0.00 60.37 58.70 2g72 h HIS 160 Cb 0.02 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.47 2g72 h HIS 160 CO 0.00 0.00 0.12 -0.65 0.86 0.00 0.00 177.93 178.26 2g72 s GLN 161 N -3.17 4.21 0.43 2.45 -1.52 -0.51 -4.95 119.66 116.61 2g72 s GLN 161 Ca 0.08 0.85 0.13 0.00 -1.95 0.00 0.00 55.36 54.47 2g72 s GLN 161 Cb 0.10 -2.77 1.01 0.00 -0.22 0.00 0.00 33.01 31.13 2g72 s GLN 161 CO 0.66 0.33 1.96 -1.35 -0.25 0.00 0.00 175.29 176.64 2g72 h PRO 162 N 3.13 0.43 -3.37 2.91 0.11 -1.87 -2.98 132.00 130.36 2g72 h PRO 162 Ca -0.48 -0.03 -0.67 0.00 0.11 0.00 0.00 66.00 64.94 2g72 h PRO 162 Cb 1.19 -0.10 -0.38 0.00 0.11 0.00 0.00 31.00 31.82 2g72 h PRO 162 CO 0.65 0.28 -0.44 -0.65 -0.21 0.00 0.00 178.00 177.63 2g72 s GLN 163 N -5.42 2.48 0.30 1.05 -0.21 -1.26 -4.80 119.66 111.80 2g72 s GLN 163 Ca -0.08 -2.85 0.05 0.00 0.02 0.00 0.00 55.36 52.50 2g72 s GLN 163 Cb 0.20 -3.58 0.77 0.00 1.00 0.00 0.00 33.01 31.40 2g72 s GLN 163 CO 0.75 -1.19 1.69 -1.35 -2.12 0.00 0.00 175.29 173.07 2g72 h PRO 164 N 6.36 0.36 -0.00 2.91 0.11 -1.69 -0.33 132.00 139.72 2g72 h PRO 164 Ca 0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2g72 h PRO 164 Cb 0.87 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.90 2g72 h PRO 164 CO 0.73 0.24 -0.21 1.28 -0.21 0.00 0.00 178.00 179.83 2g72 n LEU 165 N -5.07 0.56 0.00 2.35 4.77 -1.26 -2.11 117.00 116.24 2g72 n LEU 165 Ca 0.23 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 2g72 n LEU 165 Cb 0.70 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2g72 n LEU 165 CO 0.12 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 2g72 n GLY 166 N 1.36 -0.79 3.29 -0.72 0.00 -0.13 -4.54 105.19 103.65 2g72 n GLY 166 Ca 0.11 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 43.97 2g72 n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g72 s ALA 167 N -1.86 2.93 0.00 4.61 0.00 -1.26 -4.62 121.76 121.55 2g72 s ALA 167 Ca 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.52 2g72 s ALA 167 Cb 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 23.12 21.16 2g72 s ALA 167 CO 0.00 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.31 2g72 n GLY 168 N 4.79 0.69 3.30 0.00 0.00 -1.26 -5.03 105.19 107.68 2g72 n GLY 168 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 2g72 n GLY 168 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2g72 n SER 169 N 0.00 -2.83 0.18 1.61 3.41 -1.26 -4.81 113.62 109.91 2g72 n SER 169 Ca 0.00 0.82 0.13 0.00 -0.26 0.00 0.00 58.87 59.56 2g72 n SER 169 Cb 0.00 -0.89 0.61 0.00 -0.26 0.00 0.00 64.21 63.68 2g72 n SER 169 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2g72 h PRO 170 N 0.34 0.00 -6.60 4.33 0.11 -1.95 -3.44 132.00 124.78 2g72 h PRO 170 Ca -0.37 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.22 2g72 h PRO 170 Cb 1.45 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.59 2g72 h PRO 170 CO 0.47 0.00 0.79 0.00 -0.21 0.00 0.00 178.00 179.05 2g72 s ALA 171 N -3.51 3.67 -0.43 -0.75 0.00 -1.26 -4.92 121.76 114.55 2g72 s ALA 171 Ca 0.01 1.25 -0.27 0.00 0.00 0.00 0.00 51.96 52.94 2g72 s ALA 171 Cb 0.08 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 2g72 s ALA 171 CO 0.33 -0.70 1.92 -2.14 0.00 0.00 0.00 175.76 175.18 2g72 s PRO 172 N 0.89 2.94 0.05 0.00 0.02 -1.26 -4.97 135.00 132.67 2g72 s PRO 172 Ca 0.66 1.20 0.06 0.00 0.02 0.00 0.00 61.00 62.94 2g72 s PRO 172 Cb -0.40 -4.32 -0.04 0.00 0.02 0.00 0.00 34.50 29.76 2g72 s PRO 172 CO 0.32 -2.34 -0.10 -0.51 -0.33 0.00 0.00 177.00 174.04 2g72 s LEU 173 N 8.36 3.00 0.64 -5.54 1.43 -1.26 -3.83 118.68 121.49 2g72 s LEU 173 Ca 0.79 -0.30 -0.10 0.00 -1.03 0.00 0.00 54.13 53.49 2g72 s LEU 173 Cb -0.19 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 2g72 s LEU 173 CO 0.29 0.24 1.03 -2.16 0.23 0.00 0.00 176.35 175.97 2g72 s PRO 174 N -1.73 3.28 0.36 1.29 0.04 -1.26 -5.14 135.00 131.83 2g72 s PRO 174 Ca 0.18 0.56 -0.12 0.00 0.04 0.00 0.00 61.00 61.66 2g72 s PRO 174 Cb -0.11 -2.09 -0.07 0.00 0.04 0.00 0.00 34.50 32.27 2g72 s PRO 174 CO 0.10 -0.73 0.74 0.00 0.04 0.00 0.00 177.00 177.15 2g72 s ALA 175 N -3.21 3.36 -0.32 8.56 0.00 -0.34 -4.73 121.76 125.08 2g72 s ALA 175 Ca 0.56 -0.13 0.26 0.00 0.00 0.00 0.00 51.96 52.65 2g72 s ALA 175 Cb -0.11 -2.70 0.61 0.00 0.00 0.00 0.00 23.12 20.92 2g72 s ALA 175 CO 0.52 0.14 1.71 -0.44 0.00 0.00 0.00 175.76 177.69 2g72 h ASP 176 N 1.68 0.00 -4.81 0.00 3.45 -1.74 -0.92 116.42 114.09 2g72 h ASP 176 Ca -0.47 0.00 0.01 0.00 0.43 0.00 0.00 57.03 56.99 2g72 h ASP 176 Cb 1.18 0.00 -0.16 0.00 -0.56 0.00 0.00 39.33 39.79 2g72 h ASP 176 CO 0.65 0.00 0.31 0.00 -1.57 0.00 0.00 179.24 178.62 2g72 s ALA 177 N -3.32 -1.74 0.11 3.45 0.00 -1.18 -2.88 121.76 116.19 2g72 s ALA 177 Ca 0.06 1.00 0.06 0.00 0.00 0.00 0.00 51.96 53.08 2g72 s ALA 177 Cb 0.06 0.30 -0.04 0.00 0.00 0.00 0.00 23.12 23.45 2g72 s ALA 177 CO 0.63 -0.57 -0.15 -0.51 0.00 0.00 0.00 175.76 175.16 2g72 s LEU 178 N -1.99 2.37 -0.02 0.00 1.43 0.55 -2.28 118.68 118.73 2g72 s LEU 178 Ca -0.02 -0.76 0.01 0.00 -1.03 0.00 0.00 54.13 52.33 2g72 s LEU 178 Cb -0.01 -0.60 0.01 0.00 0.03 0.00 0.00 46.19 45.62 2g72 s LEU 178 CO -0.03 -0.10 -0.05 -0.69 0.23 0.00 0.00 176.35 175.71 2g72 s VAL 179 N -1.85 0.49 -0.14 -1.59 1.01 -0.39 -1.49 120.40 116.44 2g72 s VAL 179 Ca 0.07 -0.18 -0.05 0.00 0.00 0.00 0.00 61.98 61.82 2g72 s VAL 179 Cb -0.07 -0.47 0.07 0.00 0.00 0.00 0.00 36.38 35.91 2g72 s VAL 179 CO 0.03 0.18 0.30 -0.55 0.00 0.00 0.00 175.10 175.05 2g72 s SER 180 N 0.39 0.17 -0.16 3.32 0.15 -0.46 -0.16 113.70 116.94 2g72 s SER 180 Ca -0.05 0.67 0.01 0.00 0.70 0.00 0.00 55.95 57.28 2g72 s SER 180 Cb -0.09 0.80 0.02 0.00 -1.71 0.00 0.00 66.02 65.05 2g72 s SER 180 CO -0.00 -0.23 -0.17 0.00 1.20 0.00 0.00 173.24 174.04 2g72 s ALA 181 N 2.34 2.07 -1.55 5.45 0.00 -1.26 0.19 121.76 129.00 2g72 s ALA 181 Ca -0.00 -1.05 -0.02 0.00 0.00 0.00 0.00 51.96 50.89 2g72 s ALA 181 Cb -0.12 -1.11 0.01 0.00 0.00 0.00 0.00 23.12 21.90 2g72 s ALA 181 CO -0.09 -0.36 0.23 1.19 0.00 0.00 0.00 175.76 176.72 2g72 n PHE 182 N 4.70 -1.45 -0.01 0.00 3.01 0.16 -4.91 117.46 118.96 2g72 n PHE 182 Ca -0.19 0.20 -0.01 0.00 1.01 0.00 0.00 57.45 58.47 2g72 n PHE 182 Cb 0.50 -3.86 -0.00 0.00 -0.01 0.00 0.00 39.48 36.10 2g72 n PHE 182 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2g72 h LEU 184 N -0.12 -1.75 -1.76 0.00 3.38 -1.92 0.65 115.31 113.79 2g72 h LEU 184 Ca 0.00 0.27 -0.02 0.00 0.09 0.00 0.00 57.88 58.22 2g72 h LEU 184 Cb 0.12 0.77 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 2g72 h LEU 184 CO 0.00 -0.33 -0.11 1.05 0.09 0.00 0.00 178.44 179.14 2g72 h GLU 185 N -0.21 0.00 -0.00 1.13 9.09 -1.90 -2.16 114.58 120.52 2g72 h GLU 185 Ca 0.16 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.57 2g72 h GLU 185 Cb 0.54 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.64 2g72 h GLU 185 CO -0.74 0.11 -0.18 0.00 0.05 0.00 0.00 179.01 178.25 2g72 n ALA 186 N -2.21 2.88 -0.33 1.06 0.00 0.15 -1.47 120.51 120.58 2g72 n ALA 186 Ca -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2g72 n ALA 186 Cb 0.28 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.44 2g72 n ALA 186 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2g72 n VAL 187 N -1.03 0.28 -4.13 0.00 0.24 -0.75 -4.76 118.33 108.18 2g72 n VAL 187 Ca 0.12 -0.48 -0.35 0.00 -2.04 0.00 0.00 64.34 61.60 2g72 n VAL 187 Cb 0.30 1.05 -0.12 0.00 -1.47 0.00 0.00 33.84 33.60 2g72 n VAL 187 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2g72 s SER 188 N -0.28 4.86 0.54 -1.34 0.01 -0.85 -4.97 113.70 111.67 2g72 s SER 188 Ca 0.00 -0.18 0.33 0.00 1.31 0.00 0.00 55.95 57.41 2g72 s SER 188 Cb 0.00 -1.82 1.42 0.00 0.21 0.00 0.00 66.02 65.83 2g72 s SER 188 CO 0.00 0.09 2.01 1.55 0.41 0.00 0.00 173.24 177.30 2g72 h PRO 189 N 7.30 0.00 -2.90 12.44 0.13 -1.89 -3.25 132.00 143.84 2g72 h PRO 189 Ca -0.35 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.84 2g72 h PRO 189 Cb 1.18 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.27 2g72 h PRO 189 CO 0.62 0.05 0.29 0.16 -0.23 0.00 0.00 178.00 178.89 2g72 s ASP 190 N -5.77 -0.16 0.16 1.44 1.47 -1.26 -4.77 116.67 107.78 2g72 s ASP 190 Ca -0.00 -0.74 -0.17 0.00 1.18 0.00 0.00 52.55 52.82 2g72 s ASP 190 Cb 0.10 0.72 0.09 0.00 -0.34 0.00 0.00 42.92 43.50 2g72 s ASP 190 CO 0.55 -1.37 1.68 0.25 0.68 0.00 0.00 175.17 176.96 2g72 h LEU 191 N 2.00 -0.26 -0.44 2.11 7.12 -1.94 -0.93 115.31 122.96 2g72 h LEU 191 Ca -0.24 0.10 0.08 0.00 0.13 0.00 0.00 57.88 57.96 2g72 h LEU 191 Cb 1.25 0.20 -0.07 0.00 -0.53 0.00 0.00 40.66 41.51 2g72 h LEU 191 CO 0.29 -0.09 0.03 0.00 -0.13 0.00 0.00 178.44 178.54 2g72 h ALA 192 N 1.36 0.44 -0.27 1.25 0.00 -1.99 0.11 119.26 120.15 2g72 h ALA 192 Ca 0.19 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 2g72 h ALA 192 Cb 0.28 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2g72 h ALA 192 CO -0.36 -0.37 -0.01 1.03 0.00 0.00 0.00 179.25 179.54 2g72 h SER 193 N 0.14 0.38 -0.20 0.00 0.87 -1.81 -1.87 113.55 111.07 2g72 h SER 193 Ca 0.22 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 2g72 h SER 193 Cb 0.31 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2g72 h SER 193 CO -0.34 0.45 0.09 0.15 -0.53 0.00 0.00 176.83 176.65 2g72 h PHE 194 N 0.40 0.29 -0.39 2.24 3.57 0.41 -0.88 116.94 122.57 2g72 h PHE 194 Ca 0.09 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.60 2g72 h PHE 194 Cb 0.28 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 2g72 h PHE 194 CO 0.01 0.30 0.22 0.37 -2.23 0.00 0.00 178.31 176.98 2g72 h GLN 195 N 0.19 0.43 -0.20 1.11 5.75 -0.41 -1.29 115.11 120.69 2g72 h GLN 195 Ca 0.07 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.54 2g72 h GLN 195 Cb 0.13 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.57 2g72 h GLN 195 CO -0.01 0.28 0.10 0.00 -2.65 0.00 0.00 178.83 176.56 2g72 h ARG 196 N 0.44 0.28 -0.76 1.69 3.08 -1.16 -0.41 114.38 117.55 2g72 h ARG 196 Ca 0.16 -0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.25 2g72 h ARG 196 Cb 0.03 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 29.98 2g72 h ARG 196 CO -0.09 0.29 0.50 0.00 -1.07 0.00 0.00 179.97 179.59 2g72 h ALA 197 N 0.98 1.70 -0.38 0.04 0.00 -0.92 0.37 119.26 121.05 2g72 h ALA 197 Ca 0.07 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2g72 h ALA 197 Cb 0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2g72 h ALA 197 CO -0.01 0.17 -0.18 1.25 0.00 0.00 0.00 179.25 180.49 2g72 h LEU 198 N 0.77 0.81 -0.35 0.00 5.85 -0.75 -1.65 115.31 120.00 2g72 h LEU 198 Ca 0.33 -0.40 0.01 0.00 0.84 0.00 0.00 57.88 58.66 2g72 h LEU 198 Cb 0.30 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 2g72 h LEU 198 CO -0.12 1.03 0.22 0.44 -0.34 0.00 0.00 178.44 179.68 2g72 h ASP 199 N 0.59 0.37 0.17 1.25 3.32 0.64 -0.32 116.42 122.44 2g72 h ASP 199 Ca 0.09 -0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.15 2g72 h ASP 199 Cb 0.72 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.16 2g72 h ASP 199 CO 0.05 0.26 -0.31 0.45 -1.72 0.00 0.00 179.24 177.97 2g72 h HIS 200 N 0.44 -0.86 0.00 4.55 3.86 -0.14 -2.42 115.15 120.59 2g72 h HIS 200 Ca 0.13 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.30 2g72 h HIS 200 Cb -0.02 0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.79 2g72 h HIS 200 CO -0.06 -0.43 -0.27 -0.84 0.86 0.00 0.00 177.93 177.19 2g72 h ILE 201 N -0.57 0.84 0.00 2.45 3.07 -1.13 -2.59 117.51 119.57 2g72 h ILE 201 Ca 0.02 -1.08 -0.01 0.00 1.55 0.00 0.00 64.86 65.33 2g72 h ILE 201 Cb 0.58 1.66 -0.00 0.00 -0.27 0.00 0.00 36.82 38.78 2g72 h ILE 201 CO -0.15 0.27 -0.04 0.74 -1.05 0.00 0.00 178.15 177.91 2g72 h THR 202 N 0.00 0.68 0.00 0.16 2.02 -0.55 -0.53 112.91 114.70 2g72 h THR 202 Ca -0.00 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.01 2g72 h THR 202 Cb 0.63 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.15 2g72 h THR 202 CO 0.04 0.04 0.00 0.71 0.37 0.00 0.00 175.52 176.68 2g72 h THR 203 N 0.00 0.00 -0.00 3.16 1.35 -1.31 -1.43 112.91 114.67 2g72 h THR 203 Ca -0.00 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 2g72 h THR 203 Cb 0.10 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 67.75 2g72 h THR 203 CO 0.01 0.00 -0.04 0.18 -0.25 0.00 0.00 175.52 175.42 2g72 n LEU 204 N -2.99 0.06 -4.79 3.87 4.77 -0.21 -4.83 117.00 112.87 2g72 n LEU 204 Ca -0.01 0.38 -0.36 0.00 -0.03 0.00 0.00 56.01 55.99 2g72 n LEU 204 Cb 0.20 -0.40 -0.07 0.00 -2.33 0.00 0.00 43.42 40.81 2g72 n LEU 204 CO 0.23 0.01 -0.22 -0.22 -1.33 0.00 0.00 177.39 175.87 2g72 s LEU 205 N -2.84 4.09 0.28 2.23 2.96 -0.54 -1.20 118.68 123.65 2g72 s LEU 205 Ca 0.19 0.33 -0.29 0.00 -0.22 0.00 0.00 54.13 54.13 2g72 s LEU 205 Cb 0.19 -1.99 -0.10 0.00 0.50 0.00 0.00 46.19 44.80 2g72 s LEU 205 CO 0.52 0.37 1.21 -0.60 -1.32 0.00 0.00 176.35 176.53 2g72 s ARG 206 N -0.80 4.49 0.36 1.98 3.52 -0.35 -4.84 118.95 123.31 2g72 s ARG 206 Ca 0.13 1.99 -0.26 0.00 -0.13 0.00 0.00 55.73 57.46 2g72 s ARG 206 Cb -0.12 -3.15 -0.12 0.00 -1.56 0.00 0.00 34.95 30.00 2g72 s ARG 206 CO 0.03 -0.02 1.09 -2.30 -0.81 0.00 0.00 175.30 173.29 2g72 n PRO 207 N 1.37 1.56 -0.32 5.12 -0.02 -1.26 0.52 135.00 141.97 2g72 n PRO 207 Ca 0.01 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2g72 n PRO 207 Cb 0.43 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 2g72 n PRO 207 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2g72 n GLY 208 N 1.08 2.17 3.59 -1.23 0.00 0.46 -5.00 105.19 106.26 2g72 n GLY 208 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2g72 n GLY 208 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2g72 s GLY 209 N -2.00 1.55 0.10 -0.02 0.00 0.18 -4.62 107.32 102.51 2g72 s GLY 209 Ca 0.00 -0.57 0.09 0.00 0.00 0.00 0.00 44.72 44.24 2g72 s GLY 209 CO 0.00 0.18 -0.22 0.30 0.00 0.00 0.00 173.10 173.36 2g72 s HIS 210 N -2.86 2.44 -0.09 1.90 3.76 -1.14 -1.11 115.29 118.20 2g72 s HIS 210 Ca 0.68 -0.32 0.01 0.00 -0.15 0.00 0.00 55.06 55.28 2g72 s HIS 210 Cb -0.16 -1.35 0.02 0.00 1.11 0.00 0.00 32.58 32.20 2g72 s HIS 210 CO 0.58 0.31 -0.08 -1.17 -0.85 0.00 0.00 174.74 173.53 2g72 s LEU 211 N -1.85 1.31 -0.40 0.89 2.96 0.15 -0.33 118.68 121.40 2g72 s LEU 211 Ca 0.15 -0.26 -0.06 0.00 -0.22 0.00 0.00 54.13 53.73 2g72 s LEU 211 Cb -0.10 -0.76 0.09 0.00 0.50 0.00 0.00 46.19 45.91 2g72 s LEU 211 CO 0.07 -0.07 0.21 -0.76 -1.32 0.00 0.00 176.35 174.48 2g72 s LEU 212 N 1.30 5.04 -0.17 -0.68 1.43 -0.55 0.11 118.68 125.15 2g72 s LEU 212 Ca -0.03 -1.64 -0.06 0.00 -1.03 0.00 0.00 54.13 51.37 2g72 s LEU 212 Cb -0.14 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.14 2g72 s LEU 212 CO -0.03 -0.51 0.01 -0.22 0.23 0.00 0.00 176.35 175.83 2g72 s LEU 213 N 1.32 3.52 -0.01 1.79 2.96 0.79 -1.36 118.68 127.69 2g72 s LEU 213 Ca 0.03 -0.04 0.05 0.00 -0.22 0.00 0.00 54.13 53.96 2g72 s LEU 213 Cb -0.23 -1.87 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 2g72 s LEU 213 CO -0.00 0.16 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.40 2g72 s ILE 214 N 0.42 1.29 0.19 6.68 1.01 0.13 0.47 121.20 131.40 2g72 s ILE 214 Ca -0.00 -0.73 -0.22 0.00 0.00 0.00 0.00 60.65 59.70 2g72 s ILE 214 Cb -0.13 -1.08 0.08 0.00 0.01 0.00 0.00 42.46 41.33 2g72 s ILE 214 CO 0.02 0.34 1.04 -0.83 0.00 0.00 0.00 174.94 175.51 2g72 s GLY 215 N -0.44 0.15 0.06 6.18 0.00 -0.78 0.38 107.32 112.87 2g72 s GLY 215 Ca 0.06 -0.40 -0.24 0.00 0.00 0.00 0.00 44.72 44.14 2g72 s GLY 215 CO -0.00 2.71 0.74 0.00 0.00 0.00 0.00 173.10 176.54 2g72 s ALA 216 N -2.07 3.40 -0.20 3.20 0.00 -1.26 -0.81 121.76 124.02 2g72 s ALA 216 Ca 0.23 0.26 -0.09 0.00 0.00 0.00 0.00 51.96 52.36 2g72 s ALA 216 Cb -0.03 -2.95 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 2g72 s ALA 216 CO 0.06 0.13 0.10 -0.51 0.00 0.00 0.00 175.76 175.54 2g72 s LEU 217 N -0.30 3.99 -1.47 0.00 1.43 0.50 -4.51 118.68 118.32 2g72 s LEU 217 Ca 0.37 0.13 -0.10 0.00 -1.03 0.00 0.00 54.13 53.49 2g72 s LEU 217 Cb -0.21 -2.03 0.06 0.00 0.03 0.00 0.00 46.19 44.04 2g72 s LEU 217 CO 0.23 0.15 0.92 -0.62 0.23 0.00 0.00 176.35 177.25 2g72 n GLU 218 N 3.72 -5.43 -4.05 1.70 -0.58 0.22 -2.21 120.64 114.01 2g72 n GLU 218 Ca -0.16 0.61 -0.33 0.00 -0.42 0.00 0.00 57.16 56.85 2g72 n GLU 218 Cb 0.52 -5.41 -0.07 0.00 -0.57 0.00 0.00 31.44 25.91 2g72 n GLU 218 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 2g72 s GLU 219 N -6.46 3.18 0.00 3.49 2.12 -1.26 -4.23 118.70 115.53 2g72 s GLU 219 Ca 0.50 -0.41 0.00 0.00 0.36 0.00 0.00 54.97 55.42 2g72 s GLU 219 Cb -0.25 -2.94 0.00 0.00 0.26 0.00 0.00 34.13 31.20 2g72 s GLU 219 CO 0.82 0.67 0.09 -1.13 -0.54 0.00 0.00 175.26 175.18 2g72 n SER 220 N 1.25 0.19 -3.53 -1.70 3.41 -1.26 -2.28 113.62 109.71 2g72 n SER 220 Ca -0.13 -0.52 -0.09 0.00 -0.26 0.00 0.00 58.87 57.86 2g72 n SER 220 Cb 0.53 0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 64.89 2g72 n SER 220 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 2g72 s TRP 221 N -0.45 -0.37 0.05 7.33 1.48 -1.26 -2.00 118.94 123.73 2g72 s TRP 221 Ca 0.00 0.38 -0.25 0.00 -1.06 0.00 0.00 56.10 55.17 2g72 s TRP 221 Cb 0.00 0.51 0.06 0.00 -1.16 0.00 0.00 33.47 32.88 2g72 s TRP 221 CO 0.00 -0.48 0.59 1.52 -4.06 0.00 0.00 176.95 174.51 2g72 s TYR 222 N -2.43 -0.52 0.17 1.66 -0.85 -0.85 -2.97 117.35 111.56 2g72 s TYR 222 Ca 0.02 0.62 0.06 0.00 -0.52 0.00 0.00 57.07 57.25 2g72 s TYR 222 Cb -0.01 0.42 -0.04 0.00 0.38 0.00 0.00 41.96 42.71 2g72 s TYR 222 CO -0.05 -0.69 0.07 -0.51 -1.52 0.00 0.00 175.55 172.85 2g72 s LEU 223 N -1.96 3.56 -0.45 -3.49 1.43 -0.15 -1.05 118.68 116.57 2g72 s LEU 223 Ca -0.05 -0.26 0.07 0.00 -1.03 0.00 0.00 54.13 52.85 2g72 s LEU 223 Cb -0.01 -2.19 0.23 0.00 0.03 0.00 0.00 46.19 44.25 2g72 s LEU 223 CO -0.01 0.08 0.68 0.00 0.23 0.00 0.00 176.35 177.33 2g72 n ALA 224 N -0.22 0.30 0.00 4.21 0.00 -0.48 -4.77 120.51 119.55 2g72 n ALA 224 Ca -0.09 -2.22 0.00 0.00 0.00 0.00 0.00 53.44 51.13 2g72 n ALA 224 Cb 0.55 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.88 2g72 n ALA 224 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g72 n GLY 225 N 1.87 0.84 0.08 0.00 0.00 -1.26 -1.65 105.19 105.06 2g72 n GLY 225 Ca 0.17 -0.67 0.13 0.00 0.00 0.00 0.00 46.02 45.64 2g72 n GLY 225 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2g72 n GLU 226 N 11.35 0.18 -2.91 1.61 -0.58 -1.26 -4.80 120.64 124.23 2g72 n GLU 226 Ca 0.00 0.17 -0.38 0.00 -0.42 0.00 0.00 57.16 56.54 2g72 n GLU 226 Cb 0.00 -1.72 -0.06 0.00 -0.57 0.00 0.00 31.44 29.08 2g72 n GLU 226 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2g72 s ALA 227 N -3.09 3.33 -0.15 0.62 0.00 -1.15 -5.01 121.76 116.32 2g72 s ALA 227 Ca 0.11 0.40 -0.01 0.00 0.00 0.00 0.00 51.96 52.46 2g72 s ALA 227 Cb 0.14 -3.03 0.04 0.00 0.00 0.00 0.00 23.12 20.26 2g72 s ALA 227 CO 0.56 0.25 -0.05 0.50 0.00 0.00 0.00 175.76 177.02 2g72 s ARG 228 N -1.76 1.34 0.05 0.00 3.00 -1.26 -1.38 118.95 118.95 2g72 s ARG 228 Ca 0.44 -0.39 0.05 0.00 -1.00 0.00 0.00 55.73 54.82 2g72 s ARG 228 Cb -0.20 -1.82 -0.04 0.00 0.00 0.00 0.00 34.95 32.89 2g72 s ARG 228 CO 0.24 -0.39 -0.06 -0.51 0.00 0.00 0.00 175.30 174.58 2g72 s LEU 229 N 1.69 3.20 0.30 -0.88 2.01 -0.22 -4.96 118.68 119.83 2g72 s LEU 229 Ca 0.02 -0.21 -0.11 0.00 0.01 0.00 0.00 54.13 53.84 2g72 s LEU 229 Cb -0.14 -1.91 -0.07 0.00 0.01 0.00 0.00 46.19 44.08 2g72 s LEU 229 CO -0.08 0.23 0.65 -0.89 1.01 0.00 0.00 176.35 177.28 2g72 s THR 230 N -1.12 4.84 0.03 5.49 2.01 -1.26 -2.01 115.64 123.63 2g72 s THR 230 Ca 0.20 0.57 0.01 0.00 0.31 0.00 0.00 61.69 62.78 2g72 s THR 230 Cb -0.11 -3.66 -0.02 0.00 0.01 0.00 0.00 72.50 68.72 2g72 s THR 230 CO 0.11 -0.24 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.06 2g72 s VAL 231 N -2.03 0.29 -0.22 3.82 1.01 -0.85 -4.65 120.40 117.77 2g72 s VAL 231 Ca 0.50 -1.10 -0.17 0.00 0.00 0.00 0.00 61.98 61.20 2g72 s VAL 231 Cb -0.11 -0.57 -0.03 0.00 0.00 0.00 0.00 36.38 35.68 2g72 s VAL 231 CO 0.24 -0.53 0.48 0.54 0.00 0.00 0.00 175.10 175.83 2g72 s VAL 232 N -1.77 5.12 -0.44 2.92 0.11 -0.54 -4.31 120.40 121.48 2g72 s VAL 232 Ca -0.10 0.84 -0.28 0.00 -2.93 0.00 0.00 61.98 59.50 2g72 s VAL 232 Cb -0.08 -3.80 0.01 0.00 -1.53 0.00 0.00 36.38 30.98 2g72 s VAL 232 CO -0.02 0.16 1.47 -2.84 -3.33 0.00 0.00 175.10 170.55 2g72 s PRO 233 N 1.80 3.46 0.21 1.54 0.02 -0.96 -4.59 135.00 136.48 2g72 s PRO 233 Ca 0.21 0.88 0.09 0.00 0.02 0.00 0.00 61.00 62.21 2g72 s PRO 233 Cb -0.15 -4.07 -0.04 0.00 0.02 0.00 0.00 34.50 30.25 2g72 s PRO 233 CO 0.09 -1.71 -0.07 0.14 -0.33 0.00 0.00 177.00 175.12 2g72 s VAL 234 N 5.83 3.27 0.34 3.83 -7.23 -1.26 -4.74 120.40 120.44 2g72 s VAL 234 Ca 0.62 -1.75 0.08 0.00 -1.81 0.00 0.00 61.98 59.12 2g72 s VAL 234 Cb -0.14 -2.66 -0.03 0.00 0.56 0.00 0.00 36.38 34.11 2g72 s VAL 234 CO 0.31 -0.20 0.23 -0.94 -0.31 0.00 0.00 175.10 174.19 2g72 s SER 235 N -3.10 5.00 0.20 4.85 1.04 -1.26 -0.61 113.70 119.82 2g72 s SER 235 Ca 0.27 -0.64 -0.10 0.00 0.48 0.00 0.00 55.95 55.96 2g72 s SER 235 Cb -0.08 -0.84 0.22 0.00 0.10 0.00 0.00 66.02 65.43 2g72 s SER 235 CO 0.17 -0.35 1.79 -0.08 0.98 0.00 0.00 173.24 175.74 2g72 h GLU 236 N 1.37 0.56 0.01 4.02 4.81 -1.99 -0.63 114.58 122.73 2g72 h GLU 236 Ca -0.44 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2g72 h GLU 236 Cb 1.25 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 2g72 h GLU 236 CO 0.61 0.37 -0.09 1.49 -0.73 0.00 0.00 179.01 180.65 2g72 h GLU 237 N 0.57 -0.16 -0.95 1.92 4.81 -1.99 0.15 114.58 118.93 2g72 h GLU 237 Ca 0.28 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.57 2g72 h GLU 237 Cb 0.22 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.58 2g72 h GLU 237 CO -0.20 -0.11 0.62 0.93 -0.73 0.00 0.00 179.01 179.52 2g72 h GLU 238 N -0.17 1.14 -0.13 1.92 5.08 -1.84 0.38 114.58 120.96 2g72 h GLU 238 Ca 0.03 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 2g72 h GLU 238 Cb 0.21 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.19 2g72 h GLU 238 CO -0.09 0.76 -0.00 0.28 -1.00 0.00 0.00 179.01 178.96 2g72 h VAL 239 N 1.18 1.25 -0.00 3.13 2.07 -0.59 -0.16 116.25 123.12 2g72 h VAL 239 Ca 0.39 -0.82 0.03 0.00 0.82 0.00 0.00 66.70 67.12 2g72 h VAL 239 Cb 0.05 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 2g72 h VAL 239 CO -0.14 0.24 -0.26 -0.09 0.02 0.00 0.00 177.57 177.34 2g72 h ARG 240 N -0.04 -0.39 -0.31 1.57 2.43 -0.08 -0.20 114.38 117.35 2g72 h ARG 240 Ca 0.04 0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.27 2g72 h ARG 240 Cb 0.37 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.97 2g72 h ARG 240 CO 0.01 -0.26 0.10 0.93 -1.51 0.00 0.00 179.97 179.24 2g72 h GLU 241 N -0.40 0.22 -1.00 0.20 5.08 -0.90 -1.17 114.58 116.61 2g72 h GLU 241 Ca 0.06 -0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.49 2g72 h GLU 241 Cb 0.49 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.61 2g72 h GLU 241 CO -0.23 0.15 0.64 0.00 -1.00 0.00 0.00 179.01 178.57 2g72 h ALA 242 N 1.20 1.44 -0.49 3.43 0.00 -0.54 0.11 119.26 124.41 2g72 h ALA 242 Ca 0.14 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2g72 h ALA 242 Cb 0.12 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2g72 h ALA 242 CO -0.15 0.38 0.19 -0.07 0.00 0.00 0.00 179.25 179.60 2g72 h LEU 243 N 1.12 0.68 -0.21 0.00 3.38 -0.07 -2.28 115.31 117.93 2g72 h LEU 243 Ca 0.45 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 2g72 h LEU 243 Cb 0.26 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2g72 h LEU 243 CO -0.20 0.67 0.12 0.58 0.09 0.00 0.00 178.44 179.69 2g72 h VAL 244 N 0.65 1.10 0.00 1.22 2.07 -0.10 -1.90 116.25 119.29 2g72 h VAL 244 Ca 0.16 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.42 2g72 h VAL 244 Cb 0.20 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 2g72 h VAL 244 CO -0.01 0.10 0.00 0.03 0.02 0.00 0.00 177.57 177.70 2g72 h ARG 245 N 0.23 0.00 -0.68 1.57 3.08 -0.59 -0.94 114.38 117.05 2g72 h ARG 245 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2g72 h ARG 245 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2g72 h ARG 245 CO -0.01 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.32 2g72 n SER 246 N -2.43 4.04 -0.04 7.04 7.64 -0.76 -4.94 113.62 124.18 2g72 n SER 246 Ca -0.02 -2.10 0.00 0.00 1.01 0.00 0.00 58.87 57.76 2g72 n SER 246 Cb 0.04 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.76 2g72 n SER 246 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2g72 n GLY 247 N 1.44 0.99 3.56 0.23 0.00 -0.36 -4.99 105.19 106.05 2g72 n GLY 247 Ca 0.24 -0.54 -0.25 0.00 0.00 0.00 0.00 46.02 45.47 2g72 n GLY 247 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2g72 s TYR 248 N -2.07 2.53 -0.23 1.61 2.02 -0.94 -1.82 117.35 118.46 2g72 s TYR 248 Ca 0.00 -0.26 0.00 0.00 -0.37 0.00 0.00 57.07 56.44 2g72 s TYR 248 Cb 0.00 -1.16 0.03 0.00 -0.40 0.00 0.00 41.96 40.43 2g72 s TYR 248 CO 0.00 0.61 -0.12 0.21 -1.57 0.00 0.00 175.55 174.68 2g72 s LYS 249 N -3.31 2.81 -0.45 -0.62 2.20 0.56 -4.28 119.74 116.66 2g72 s LYS 249 Ca 0.28 -0.98 -0.28 0.00 -0.36 0.00 0.00 55.97 54.64 2g72 s LYS 249 Cb -0.07 -2.82 -0.01 0.00 -1.51 0.00 0.00 37.83 33.42 2g72 s LYS 249 CO 0.16 -0.35 1.64 0.08 -0.36 0.00 0.00 175.35 176.52 2g72 s VAL 250 N 1.28 3.62 -0.07 4.02 1.01 -1.26 -0.62 120.40 128.38 2g72 s VAL 250 Ca 0.00 0.58 0.13 0.00 0.00 0.00 0.00 61.98 62.69 2g72 s VAL 250 Cb -0.16 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 2g72 s VAL 250 CO -0.07 -0.73 1.34 0.03 0.00 0.00 0.00 175.10 175.67 2g72 h ARG 251 N 12.38 0.00 -1.78 2.72 2.47 -0.74 -3.47 114.38 125.96 2g72 h ARG 251 Ca -0.29 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.44 2g72 h ARG 251 Cb 1.14 0.00 -0.23 0.00 -1.65 0.00 0.00 29.97 29.23 2g72 h ARG 251 CO 1.11 0.65 0.33 0.34 0.56 0.00 0.00 179.97 182.95 2g72 s ASP 252 N -6.49 -0.56 -0.14 7.04 2.15 -0.84 -4.97 116.67 112.86 2g72 s ASP 252 Ca 0.02 0.93 -0.06 0.00 0.43 0.00 0.00 52.55 53.87 2g72 s ASP 252 Cb 0.08 0.89 0.06 0.00 -0.30 0.00 0.00 42.92 43.65 2g72 s ASP 252 CO 0.77 -0.30 0.31 -0.22 -0.17 0.00 0.00 175.17 175.56 2g72 s LEU 253 N -0.22 -0.08 0.06 -1.34 2.96 -1.26 -0.18 118.68 118.62 2g72 s LEU 253 Ca -0.01 0.68 0.03 0.00 -0.22 0.00 0.00 54.13 54.61 2g72 s LEU 253 Cb -0.03 0.92 -0.03 0.00 0.50 0.00 0.00 46.19 47.55 2g72 s LEU 253 CO 0.00 -0.21 -0.10 -0.13 -1.32 0.00 0.00 176.35 174.60 2g72 s ARG 254 N 1.88 0.64 -0.00 1.98 0.52 -0.00 -4.98 118.95 118.99 2g72 s ARG 254 Ca -0.05 -0.86 0.06 0.00 -0.52 0.00 0.00 55.73 54.37 2g72 s ARG 254 Cb -0.11 -0.46 -0.02 0.00 0.52 0.00 0.00 34.95 34.88 2g72 s ARG 254 CO -0.10 0.09 -0.20 0.99 0.02 0.00 0.00 175.30 176.10 2g72 s THR 255 N -1.48 1.60 -0.12 0.02 2.01 -1.26 -0.78 115.64 115.63 2g72 s THR 255 Ca -0.06 -0.93 0.03 0.00 0.31 0.00 0.00 61.69 61.04 2g72 s THR 255 Cb -0.09 -1.34 0.01 0.00 0.01 0.00 0.00 72.50 71.09 2g72 s THR 255 CO 0.01 0.40 -0.22 -0.47 -0.69 0.00 0.00 174.62 173.65 2g72 s TYR 256 N -0.54 2.54 -0.14 4.92 5.04 0.59 -4.97 117.35 124.80 2g72 s TYR 256 Ca 0.08 -1.21 -0.19 0.00 -2.44 0.00 0.00 57.07 53.31 2g72 s TYR 256 Cb -0.08 -1.73 -0.04 0.00 0.35 0.00 0.00 41.96 40.46 2g72 s TYR 256 CO -0.00 -0.54 0.50 0.42 -1.34 0.00 0.00 175.55 174.59 2g72 s ILE 257 N 0.70 5.16 -0.18 3.14 1.01 -1.26 -0.12 121.20 129.64 2g72 s ILE 257 Ca -0.10 0.98 -0.29 0.00 0.00 0.00 0.00 60.65 61.24 2g72 s ILE 257 Cb -0.16 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 2g72 s ILE 257 CO 0.01 0.28 1.70 -0.32 0.00 0.00 0.00 174.94 176.61 2g72 s MET 258 N 0.88 3.80 0.87 2.79 1.75 -0.51 -4.95 119.30 123.94 2g72 s MET 258 Ca 0.26 1.82 -0.11 0.00 -1.25 0.00 0.00 55.69 56.40 2g72 s MET 258 Cb -0.15 -4.07 0.11 0.00 2.84 0.00 0.00 34.83 33.56 2g72 s MET 258 CO 0.10 -1.29 1.09 -1.25 -0.65 0.00 0.00 175.02 173.03 2g72 s PRO 259 N 4.73 1.46 0.24 4.11 0.04 -1.26 -4.87 135.00 139.45 2g72 s PRO 259 Ca 0.75 0.86 -0.05 0.00 0.04 0.00 0.00 61.00 62.60 2g72 s PRO 259 Cb -0.28 -1.83 0.39 0.00 0.04 0.00 0.00 34.50 32.82 2g72 s PRO 259 CO 0.31 -2.11 1.79 0.00 0.04 0.00 0.00 177.00 177.02 2g72 h ALA 260 N -1.46 1.10 0.00 8.56 0.00 -1.95 -1.71 119.26 123.81 2g72 h ALA 260 Ca -0.48 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2g72 h ALA 260 Cb 1.27 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2g72 h ALA 260 CO 0.54 0.01 0.00 -2.39 0.00 0.00 0.00 179.25 177.41 2g72 n HIS 261 N -4.82 0.71 0.06 0.00 1.44 -1.26 -1.45 115.22 109.90 2g72 n HIS 261 Ca 0.13 0.30 0.10 0.00 -2.01 0.00 0.00 57.72 56.24 2g72 n HIS 261 Cb 0.30 -0.99 0.21 0.00 0.12 0.00 0.00 29.99 29.63 2g72 n HIS 261 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2g72 n LEU 262 N -2.17 3.34 -4.36 2.39 4.77 -0.66 -4.77 117.00 115.54 2g72 n LEU 262 Ca 0.01 -1.67 -0.45 0.00 -0.03 0.00 0.00 56.01 53.87 2g72 n LEU 262 Cb 0.17 -0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 40.94 2g72 n LEU 262 CO 0.16 0.77 0.42 -1.10 -1.33 0.00 0.00 177.39 176.30 2g72 s GLN 263 N -1.22 3.16 0.00 3.23 -0.21 -0.53 -4.94 119.66 119.15 2g72 s GLN 263 Ca 0.36 -1.57 0.00 0.00 0.02 0.00 0.00 55.36 54.16 2g72 s GLN 263 Cb 0.20 -4.35 0.00 0.00 1.00 0.00 0.00 33.01 29.86 2g72 s GLN 263 CO 0.27 -1.50 0.00 0.25 -2.12 0.00 0.00 175.29 172.20 2g72 n THR 264 N 5.29 0.00 1.02 -0.19 -2.24 -1.26 -5.01 114.28 111.88 2g72 n THR 264 Ca -0.04 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.84 2g72 n THR 264 Cb 0.43 -0.70 0.32 0.00 -2.10 0.00 0.00 70.33 68.28 2g72 n THR 264 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g72 n GLY 265 N 5.00 0.59 0.03 3.38 0.00 -1.26 -4.18 105.19 108.75 2g72 n GLY 265 Ca 0.00 -0.47 0.14 0.00 0.00 0.00 0.00 46.02 45.69 2g72 n GLY 265 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2g72 n VAL 266 N 0.55 0.16 -3.86 1.61 0.24 -1.26 -4.89 118.33 110.88 2g72 n VAL 266 Ca 0.16 -0.08 0.01 0.00 -2.04 0.00 0.00 64.34 62.39 2g72 n VAL 266 Cb 0.37 -0.47 0.01 0.00 -1.47 0.00 0.00 33.84 32.28 2g72 n VAL 266 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2g72 n ASP 267 N -1.71 -0.47 -1.53 -1.34 5.68 -1.26 -0.97 116.55 114.95 2g72 n ASP 267 Ca 0.06 -1.13 -0.03 0.00 -0.50 0.00 0.00 54.79 53.20 2g72 n ASP 267 Cb 0.37 0.74 0.09 0.00 -1.14 0.00 0.00 41.12 41.18 2g72 n ASP 267 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2g72 n ASP 268 N -0.55 2.29 -4.77 -1.12 3.85 -1.16 -4.73 116.55 110.36 2g72 n ASP 268 Ca 0.01 -3.09 -0.40 0.00 -0.71 0.00 0.00 54.79 50.60 2g72 n ASP 268 Cb 0.21 -0.42 -0.01 0.00 -1.35 0.00 0.00 41.12 39.56 2g72 n ASP 268 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2g72 s VAL 269 N -2.87 2.46 -0.11 2.12 0.11 -1.26 -4.58 120.40 116.27 2g72 s VAL 269 Ca 0.38 0.44 0.17 0.00 -2.93 0.00 0.00 61.98 60.04 2g72 s VAL 269 Cb 0.38 -3.27 -0.24 0.00 -1.53 0.00 0.00 36.38 31.71 2g72 s VAL 269 CO -0.06 0.09 0.20 0.29 -3.33 0.00 0.00 175.10 172.29 2g72 n LYS 270 N 0.39 0.93 -3.86 1.54 4.76 -0.94 -4.88 118.16 116.10 2g72 n LYS 270 Ca 0.02 -0.08 -0.03 0.00 -2.87 0.00 0.00 58.31 55.35 2g72 n LYS 270 Cb 0.42 -1.44 0.01 0.00 -1.84 0.00 0.00 35.03 32.18 2g72 n LYS 270 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2g72 s GLY 271 N -4.71 0.06 -0.02 0.72 0.00 -1.17 -1.43 107.32 100.78 2g72 s GLY 271 Ca -0.08 -0.27 0.03 0.00 0.00 0.00 0.00 44.72 44.41 2g72 s GLY 271 CO 0.73 2.03 -0.11 0.14 0.00 0.00 0.00 173.10 175.88 2g72 s VAL 272 N -2.32 0.95 0.20 1.40 1.01 0.83 -0.37 120.40 122.09 2g72 s VAL 272 Ca 0.20 -0.47 0.09 0.00 0.00 0.00 0.00 61.98 61.80 2g72 s VAL 272 Cb -0.02 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 2g72 s VAL 272 CO 0.05 0.28 -0.05 0.72 0.00 0.00 0.00 175.10 176.10 2g72 s PHE 273 N 0.04 2.69 -0.08 5.22 -0.12 0.01 -0.30 117.98 125.44 2g72 s PHE 273 Ca -0.01 -0.20 -0.00 0.00 -0.05 0.00 0.00 56.93 56.66 2g72 s PHE 273 Cb -0.08 -1.28 0.02 0.00 -0.63 0.00 0.00 43.02 41.06 2g72 s PHE 273 CO 0.01 0.54 -0.05 0.12 -0.05 0.00 0.00 175.22 175.79 2g72 s PHE 274 N -1.87 1.03 -0.14 3.49 5.36 0.04 -1.86 117.98 124.03 2g72 s PHE 274 Ca 0.27 -0.40 0.02 0.00 -0.96 0.00 0.00 56.93 55.85 2g72 s PHE 274 Cb -0.08 -0.94 0.02 0.00 -0.34 0.00 0.00 43.02 41.67 2g72 s PHE 274 CO 0.17 -0.36 -0.18 0.00 -1.46 0.00 0.00 175.22 173.39 2g72 s ALA 275 N 1.55 2.00 -0.37 11.12 0.00 0.18 -0.82 121.76 135.41 2g72 s ALA 275 Ca -0.00 -0.96 -0.10 0.00 0.00 0.00 0.00 51.96 50.90 2g72 s ALA 275 Cb -0.13 -0.99 0.03 0.00 0.00 0.00 0.00 23.12 22.03 2g72 s ALA 275 CO -0.04 -0.17 0.19 -0.46 0.00 0.00 0.00 175.76 175.27 2g72 s TRP 276 N 1.10 3.25 0.06 0.00 -0.00 0.75 -0.15 118.94 123.95 2g72 s TRP 276 Ca -0.02 -1.07 0.08 0.00 -0.00 0.00 0.00 56.10 55.09 2g72 s TRP 276 Cb -0.14 -2.42 -0.03 0.00 -0.00 0.00 0.00 33.47 30.88 2g72 s TRP 276 CO -0.06 -0.67 -0.23 0.00 -0.00 0.00 0.00 176.95 176.00 2g72 s ALA 277 N 1.52 1.94 -0.15 5.86 0.00 0.12 0.05 121.76 131.09 2g72 s ALA 277 Ca 0.01 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 50.79 2g72 s ALA 277 Cb -0.19 -0.36 -0.00 0.00 0.00 0.00 0.00 23.12 22.57 2g72 s ALA 277 CO 0.06 0.43 -0.16 -1.14 0.00 0.00 0.00 175.76 174.96 2g72 s GLN 278 N -1.42 3.22 -0.39 0.00 0.74 0.21 0.34 119.66 122.36 2g72 s GLN 278 Ca 0.09 -0.75 -0.28 0.00 0.05 0.00 0.00 55.36 54.46 2g72 s GLN 278 Cb -0.09 -2.61 -0.01 0.00 1.10 0.00 0.00 33.01 31.40 2g72 s GLN 278 CO 0.03 0.04 1.66 0.21 -0.55 0.00 0.00 175.29 176.67 2g72 s LYS 279 N 0.77 3.37 0.00 1.67 2.20 -0.27 -0.32 119.74 127.15 2g72 s LYS 279 Ca -0.06 1.17 0.18 0.00 -0.36 0.00 0.00 55.97 56.90 2g72 s LYS 279 Cb -0.15 -4.15 0.15 0.00 -1.51 0.00 0.00 37.83 32.16 2g72 s LYS 279 CO 0.01 -1.82 1.08 1.55 -0.36 0.00 0.00 175.35 175.81