#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g24 s ASP 10 N 0.00 6.47 -0.33 6.12 3.68 -1.26 -5.01 116.67 126.34 3g24 s ASP 10 Ca 0.00 -1.83 -0.23 0.00 2.13 0.00 0.00 52.55 52.61 3g24 s ASP 10 Cb 0.00 -2.35 0.00 0.00 -1.45 0.00 0.00 42.92 39.12 3g24 s ASP 10 CO 0.00 -1.06 0.80 -0.69 0.13 0.00 0.00 175.17 174.34 3g24 s VAL 11 N 2.53 4.76 0.17 1.11 1.01 -1.26 -5.00 120.40 123.72 3g24 s VAL 11 Ca 0.24 1.07 -0.33 0.00 0.00 0.00 0.00 61.98 62.96 3g24 s VAL 11 Cb -0.12 -4.18 -0.13 0.00 0.00 0.00 0.00 36.38 31.94 3g24 s VAL 11 CO -0.03 -0.34 1.63 0.80 0.00 0.00 0.00 175.10 177.17 3g24 n MET 12 N 6.32 2.35 -1.39 2.72 1.56 -1.26 -1.40 117.12 126.02 3g24 n MET 12 Ca 0.04 0.85 -0.14 0.00 -0.27 0.00 0.00 57.70 58.18 3g24 n MET 12 Cb 0.48 -2.64 -0.06 0.00 2.15 0.00 0.00 33.22 33.15 3g24 n MET 12 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 3g24 n ASN 13 N 3.64 -5.44 -2.35 6.12 5.03 -1.26 -2.37 115.26 118.62 3g24 n ASN 13 Ca 0.17 0.34 -0.12 0.00 0.87 0.00 0.00 54.58 55.84 3g24 n ASN 13 Cb 0.31 -4.28 -0.01 0.00 -1.02 0.00 0.00 39.78 34.78 3g24 n ASN 13 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3g24 n ARG 14 N -1.30 -2.15 -4.05 3.52 1.74 -0.50 -4.93 116.66 108.99 3g24 n ARG 14 Ca -0.14 0.60 -0.30 0.00 -0.77 0.00 0.00 57.85 57.25 3g24 n ARG 14 Cb 0.60 -5.17 -0.17 0.00 -1.02 0.00 0.00 32.46 26.71 3g24 n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3g24 s LEU 15 N -5.45 1.64 -0.19 0.55 2.96 -1.00 -1.10 118.68 116.09 3g24 s LEU 15 Ca 0.00 -0.46 -0.05 0.00 -0.22 0.00 0.00 54.13 53.40 3g24 s LEU 15 Cb 0.00 -1.14 -0.02 0.00 0.50 0.00 0.00 46.19 45.53 3g24 s LEU 15 CO 0.00 -0.05 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.33 3g24 s ILE 16 N 1.46 3.87 -0.19 6.68 1.01 0.16 -4.65 121.20 129.53 3g24 s ILE 16 Ca 0.04 -0.34 -0.25 0.00 0.00 0.00 0.00 60.65 60.10 3g24 s ILE 16 Cb -0.13 -2.74 -0.01 0.00 0.01 0.00 0.00 42.46 39.59 3g24 s ILE 16 CO -0.10 0.44 0.82 -0.22 0.00 0.00 0.00 174.94 175.88 3g24 s LEU 17 N 0.92 4.14 -0.65 2.97 2.96 -1.08 -1.08 118.68 126.87 3g24 s LEU 17 Ca 0.01 1.11 -0.20 0.00 -0.22 0.00 0.00 54.13 54.82 3g24 s LEU 17 Cb -0.14 -3.20 0.10 0.00 0.50 0.00 0.00 46.19 43.44 3g24 s LEU 17 CO 0.02 -0.43 0.83 0.00 -1.32 0.00 0.00 176.35 175.45 3g24 s ALA 18 N 2.35 3.31 -1.07 5.97 0.00 -0.06 -0.26 121.76 132.01 3g24 s ALA 18 Ca 0.37 -2.15 -0.18 0.00 0.00 0.00 0.00 51.96 49.99 3g24 s ALA 18 Cb -0.16 -3.69 0.12 0.00 0.00 0.00 0.00 23.12 19.39 3g24 s ALA 18 CO 0.11 -2.55 1.36 1.41 0.00 0.00 0.00 175.76 176.08 3g24 s MET 19 N 3.14 3.78 -0.22 0.00 1.75 -0.42 -4.38 119.30 122.95 3g24 s MET 19 Ca 0.17 -1.88 0.15 0.00 -1.25 0.00 0.00 55.69 52.88 3g24 s MET 19 Cb -0.20 -5.13 0.73 0.00 2.84 0.00 0.00 34.83 33.07 3g24 s MET 19 CO 0.06 -1.93 1.65 -0.25 -0.65 0.00 0.00 175.02 173.90 3g24 n ASP 20 N 7.04 5.16 -4.78 1.11 8.00 -1.26 -4.41 116.55 127.42 3g24 n ASP 20 Ca 0.32 -2.96 -0.33 0.00 0.71 0.00 0.00 54.79 52.54 3g24 n ASP 20 Cb 0.47 -0.64 0.05 0.00 -0.02 0.00 0.00 41.12 40.98 3g24 n ASP 20 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3g24 s LEU 21 N -2.78 3.37 -0.08 0.64 1.43 -1.26 -4.64 118.68 115.35 3g24 s LEU 21 Ca 0.51 1.94 0.13 0.00 -1.03 0.00 0.00 54.13 55.68 3g24 s LEU 21 Cb 0.39 -4.54 0.37 0.00 0.03 0.00 0.00 46.19 42.44 3g24 s LEU 21 CO 0.14 -1.59 1.29 0.23 0.23 0.00 0.00 176.35 176.65 3g24 n MET 22 N -2.48 2.79 -4.73 1.70 2.81 -1.26 -3.92 117.12 112.02 3g24 n MET 22 Ca 0.10 -2.36 -0.31 0.00 -1.81 0.00 0.00 57.70 53.32 3g24 n MET 22 Cb 0.52 -1.50 -0.17 0.00 -0.71 0.00 0.00 33.22 31.37 3g24 n MET 22 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3g24 s ASN 23 N -1.52 2.87 0.17 7.83 3.84 -1.26 -4.73 114.94 122.13 3g24 s ASN 23 Ca 0.29 -0.53 -0.15 0.00 0.21 0.00 0.00 52.86 52.68 3g24 s ASN 23 Cb 0.21 -1.31 0.11 0.00 -0.55 0.00 0.00 41.25 39.71 3g24 s ASN 23 CO 0.10 0.08 1.72 -0.09 -2.79 0.00 0.00 177.10 176.12 3g24 h ARG 24 N 7.20 0.18 -0.28 0.43 2.43 -1.94 0.99 114.38 123.38 3g24 h ARG 24 Ca -0.29 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 58.89 3g24 h ARG 24 Cb 1.20 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.68 3g24 h ARG 24 CO 0.52 0.12 0.13 -0.44 -1.51 0.00 0.00 179.97 178.79 3g24 h ASP 25 N 0.18 0.19 -0.41 -3.80 3.32 -1.99 -0.86 116.42 113.06 3g24 h ASP 25 Ca 0.20 0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.16 3g24 h ASP 25 Cb 0.25 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 3g24 h ASP 25 CO -0.27 0.15 -0.15 0.44 -1.72 0.00 0.00 179.24 177.68 3g24 h ASP 26 N 0.28 0.84 -0.48 6.45 3.32 -1.93 -1.33 116.42 123.58 3g24 h ASP 26 Ca 0.12 -0.39 0.00 0.00 0.02 0.00 0.00 57.03 56.79 3g24 h ASP 26 Cb 0.05 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 3g24 h ASP 26 CO -0.09 1.04 0.32 0.00 -1.72 0.00 0.00 179.24 178.79 3g24 h ALA 27 N 0.83 0.61 -0.34 3.45 0.00 -0.59 -0.08 119.26 123.14 3g24 h ALA 27 Ca 0.10 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 3g24 h ALA 27 Cb 0.70 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3g24 h ALA 27 CO 0.05 0.05 -0.39 -0.07 0.00 0.00 0.00 179.25 178.89 3g24 h LEU 28 N 0.65 0.87 -0.00 0.00 3.38 -1.13 -2.05 115.31 117.03 3g24 h LEU 28 Ca 0.18 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 3g24 h LEU 28 Cb -0.08 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.43 3g24 h LEU 28 CO -0.04 1.16 -0.00 -0.09 0.09 0.00 0.00 178.44 179.56 3g24 h ARG 29 N 0.67 0.01 -0.52 1.13 2.43 -0.98 -1.21 114.38 115.91 3g24 h ARG 29 Ca 0.05 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 3g24 h ARG 29 Cb 0.96 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.49 3g24 h ARG 29 CO 0.09 0.34 0.19 0.28 -1.51 0.00 0.00 179.97 179.36 3g24 h VAL 30 N -0.33 1.22 -0.80 0.20 2.07 -1.07 -0.99 116.25 116.55 3g24 h VAL 30 Ca 0.00 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 3g24 h VAL 30 Cb 0.34 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 3g24 h VAL 30 CO 0.00 0.26 0.42 0.74 0.02 0.00 0.00 177.57 179.01 3g24 h THR 31 N 0.70 1.24 -0.42 2.57 2.02 -1.38 -2.04 112.91 115.59 3g24 h THR 31 Ca 0.17 -0.63 -0.06 0.00 0.77 0.00 0.00 66.41 66.67 3g24 h THR 31 Cb 0.22 0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 3g24 h THR 31 CO -0.01 0.28 0.03 1.23 0.37 0.00 0.00 175.52 177.42 3g24 h GLY 32 N 1.16 0.71 2.00 2.16 0.00 -0.68 -0.67 103.07 107.75 3g24 h GLY 32 Ca 0.28 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 3g24 h GLY 32 CO -0.04 0.40 -0.08 0.83 0.00 0.00 0.00 176.54 177.65 3g24 h GLU 33 N 0.63 0.00 -0.16 4.80 5.08 -0.47 -3.05 114.58 121.41 3g24 h GLU 33 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3g24 h GLU 33 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 3g24 h GLU 33 CO 0.01 0.08 0.00 1.33 -1.00 0.00 0.00 179.01 179.43 3g24 n VAL 34 N -3.22 0.65 -0.02 3.13 0.24 -0.96 -4.49 118.33 113.66 3g24 n VAL 34 Ca 0.00 -0.82 0.19 0.00 -2.04 0.00 0.00 64.34 61.67 3g24 n VAL 34 Cb 0.34 0.73 0.66 0.00 -1.47 0.00 0.00 33.84 34.10 3g24 n VAL 34 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 3g24 h ARG 35 N 1.44 0.06 0.00 7.34 0.11 -1.01 -0.12 114.38 122.20 3g24 h ARG 35 Ca 0.00 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3g24 h ARG 35 Cb 0.54 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.61 3g24 h ARG 35 CO 0.00 0.04 0.00 1.05 0.10 0.00 0.00 179.97 181.16 3g24 h GLU 36 N 0.07 0.00 0.00 0.08 4.11 -1.84 -3.10 114.58 113.90 3g24 h GLU 36 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.69 3g24 h GLU 36 Cb 0.95 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.20 3g24 h GLU 36 CO -0.02 0.00 -1.53 0.66 0.07 0.00 0.00 179.01 178.19 3g24 n TYR 37 N -2.68 0.04 -4.27 2.06 4.01 -0.07 -5.01 117.16 111.24 3g24 n TYR 37 Ca 0.01 0.01 -0.15 0.00 -0.16 0.00 0.00 57.90 57.62 3g24 n TYR 37 Cb 0.28 -0.32 -0.10 0.00 -0.31 0.00 0.00 39.34 38.88 3g24 n TYR 37 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 3g24 s ILE 38 N -3.30 0.57 0.00 -0.72 -4.36 -1.16 -4.55 121.20 107.68 3g24 s ILE 38 Ca -0.01 -1.99 0.00 0.00 -0.26 0.00 0.00 60.65 58.39 3g24 s ILE 38 Cb 0.15 -2.37 0.00 0.00 1.25 0.00 0.00 42.46 41.49 3g24 s ILE 38 CO 0.88 -0.24 0.53 -0.90 0.24 0.00 0.00 174.94 175.46 3g24 n ASP 39 N -0.34 0.00 -3.67 4.36 5.75 -1.26 -4.81 116.55 116.59 3g24 n ASP 39 Ca -0.03 -1.27 -0.21 0.00 -0.01 0.00 0.00 54.79 53.27 3g24 n ASP 39 Cb 0.65 -0.05 -0.18 0.00 -1.03 0.00 0.00 41.12 40.51 3g24 n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3g24 s THR 40 N 0.00 -0.09 -0.06 2.12 2.01 -1.26 -0.94 115.64 117.42 3g24 s THR 40 Ca 0.00 0.34 0.06 0.00 0.31 0.00 0.00 61.69 62.40 3g24 s THR 40 Cb 0.00 -0.22 -0.01 0.00 0.01 0.00 0.00 72.50 72.28 3g24 s THR 40 CO 0.00 0.12 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.12 3g24 s VAL 41 N 2.16 2.01 -0.26 3.82 1.01 -0.25 -2.62 120.40 126.27 3g24 s VAL 41 Ca 0.05 -1.04 -0.09 0.00 0.00 0.00 0.00 61.98 60.90 3g24 s VAL 41 Cb -0.13 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 3g24 s VAL 41 CO -0.04 0.56 0.11 -0.75 0.00 0.00 0.00 175.10 174.98 3g24 s LYS 42 N -0.15 3.74 -0.13 2.72 2.20 0.65 -1.39 119.74 127.38 3g24 s LYS 42 Ca -0.04 -0.43 -0.02 0.00 -0.36 0.00 0.00 55.97 55.12 3g24 s LYS 42 Cb -0.14 -3.44 -0.03 0.00 -1.51 0.00 0.00 37.83 32.72 3g24 s LYS 42 CO 0.04 -0.19 -0.06 0.42 -0.36 0.00 0.00 175.35 175.19 3g24 s ILE 43 N 1.66 3.71 0.00 5.43 -1.09 0.18 -1.30 121.20 129.79 3g24 s ILE 43 Ca 0.07 -0.43 0.00 0.00 -2.23 0.00 0.00 60.65 58.05 3g24 s ILE 43 Cb -0.15 -2.60 0.00 0.00 -1.58 0.00 0.00 42.46 38.13 3g24 s ILE 43 CO 0.06 0.52 0.00 0.61 -1.23 0.00 0.00 174.94 174.90 3g24 n GLY 44 N 3.29 4.67 0.19 6.18 0.00 -1.26 -0.61 105.19 117.65 3g24 n GLY 44 Ca -0.18 -2.17 0.04 0.00 0.00 0.00 0.00 46.02 43.71 3g24 n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3g24 h TYR 45 N 0.76 0.00 -0.50 1.61 0.05 -1.97 -2.27 116.97 114.65 3g24 h TYR 45 Ca 0.00 0.00 0.07 0.00 0.05 0.00 0.00 58.73 58.85 3g24 h TYR 45 Cb 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.68 3g24 h TYR 45 CO 0.00 0.35 0.15 -1.35 -1.05 0.00 0.00 178.16 176.26 3g24 h PRO 46 N 0.00 0.30 0.07 4.88 0.11 -1.92 0.11 132.00 135.55 3g24 h PRO 46 Ca -0.00 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.95 3g24 h PRO 46 Cb 0.65 -0.07 0.01 0.00 0.11 0.00 0.00 31.00 31.71 3g24 h PRO 46 CO 0.05 0.20 -0.58 1.25 -0.21 0.00 0.00 178.00 178.71 3g24 h LEU 47 N 0.31 0.38 -0.83 2.35 5.85 -1.66 -3.18 115.31 118.52 3g24 h LEU 47 Ca 0.24 -0.89 -0.02 0.00 0.84 0.00 0.00 57.88 58.05 3g24 h LEU 47 Cb 0.29 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 3g24 h LEU 47 CO -0.27 1.24 0.43 0.58 -0.34 0.00 0.00 178.44 180.08 3g24 h VAL 48 N -0.42 1.25 0.00 1.05 2.07 -1.29 0.80 116.25 119.71 3g24 h VAL 48 Ca -0.09 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.78 3g24 h VAL 48 Cb 1.39 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 3g24 h VAL 48 CO 0.11 0.29 0.00 -0.07 0.02 0.00 0.00 177.57 177.92 3g24 h LEU 49 N 1.16 0.00 0.02 2.57 3.38 -0.92 0.29 115.31 121.80 3g24 h LEU 49 Ca 0.29 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.92 3g24 h LEU 49 Cb 0.06 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.76 3g24 h LEU 49 CO -0.04 0.00 -2.09 -1.20 0.09 0.00 0.00 178.44 175.20 3g24 n SER 50 N -2.41 0.85 -0.00 -0.43 7.64 -0.87 -4.66 113.62 113.74 3g24 n SER 50 Ca 0.04 0.17 0.01 0.00 1.01 0.00 0.00 58.87 60.09 3g24 n SER 50 Cb 0.35 0.18 -0.01 0.00 -1.01 0.00 0.00 64.21 63.72 3g24 n SER 50 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3g24 n GLU 51 N -3.02 3.91 0.00 1.43 -0.58 0.22 -5.00 120.64 117.60 3g24 n GLU 51 Ca -0.28 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.45 3g24 n GLU 51 Cb 1.08 -0.75 0.00 0.00 -0.57 0.00 0.00 31.44 31.21 3g24 n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g24 n GLY 52 N 1.61 2.28 0.16 0.62 0.00 1.00 -4.72 105.19 106.14 3g24 n GLY 52 Ca 0.00 -1.90 0.13 0.00 0.00 0.00 0.00 46.02 44.25 3g24 n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3g24 h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.94 -2.76 114.93 114.70 3g24 h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g24 h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3g24 h MET 53 CO 0.00 0.00 0.00 -0.25 1.06 0.00 0.00 176.91 177.72 3g24 n ASP 54 N -2.36 0.27 0.23 1.22 8.00 -1.26 -2.35 116.55 120.30 3g24 n ASP 54 Ca 0.01 0.58 0.09 0.00 0.71 0.00 0.00 54.79 56.18 3g24 n ASP 54 Cb 0.20 -0.63 0.57 0.00 -0.02 0.00 0.00 41.12 41.25 3g24 n ASP 54 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 3g24 h ILE 55 N 0.00 0.82 -0.18 0.53 6.09 -1.77 -2.55 117.51 120.45 3g24 h ILE 55 Ca 0.00 -0.80 -0.02 0.00 -1.37 0.00 0.00 64.86 62.67 3g24 h ILE 55 Cb 0.23 1.48 -0.01 0.00 0.47 0.00 0.00 36.82 38.99 3g24 h ILE 55 CO 0.00 0.20 0.02 0.40 -3.07 0.00 0.00 178.15 175.70 3g24 h ILE 56 N 0.00 1.24 -0.57 2.19 2.04 -1.72 -1.27 117.51 119.41 3g24 h ILE 56 Ca -0.00 -0.78 -0.04 0.00 1.00 0.00 0.00 64.86 65.04 3g24 h ILE 56 Cb 0.46 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 3g24 h ILE 56 CO 0.03 0.23 0.20 0.00 0.00 0.00 0.00 178.15 178.61 3g24 h ALA 57 N 0.80 1.28 -0.74 1.87 0.00 -1.61 -2.12 119.26 118.75 3g24 h ALA 57 Ca 0.05 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3g24 h ALA 57 Cb 0.34 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3g24 h ALA 57 CO 0.01 0.52 0.34 1.49 0.00 0.00 0.00 179.25 181.60 3g24 h GLU 58 N 0.83 1.09 -0.65 0.00 4.57 -1.18 0.11 114.58 119.34 3g24 h GLU 58 Ca 0.19 -0.17 -0.07 0.00 -1.18 0.00 0.00 59.36 58.12 3g24 h GLU 58 Cb 0.20 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.58 3g24 h GLU 58 CO -0.01 0.86 0.12 0.74 -1.18 0.00 0.00 179.01 179.54 3g24 h PHE 59 N 1.05 1.14 -0.19 0.92 -1.00 -0.70 -1.01 116.94 117.16 3g24 h PHE 59 Ca 0.25 -0.15 -0.11 0.00 2.81 0.00 0.00 57.97 60.77 3g24 h PHE 59 Cb 0.15 -0.31 -0.01 0.00 3.61 0.00 0.00 35.95 39.39 3g24 h PHE 59 CO 0.01 0.96 -0.36 0.00 -1.61 0.00 0.00 178.31 177.31 3g24 h ARG 60 N 0.99 0.40 -0.38 1.51 3.08 -1.04 0.16 114.38 119.10 3g24 h ARG 60 Ca 0.20 -0.18 -0.15 0.00 0.07 0.00 0.00 59.98 59.92 3g24 h ARG 60 Cb 0.42 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 3g24 h ARG 60 CO 0.01 0.70 -0.35 -0.22 -1.07 0.00 0.00 179.97 179.04 3g24 h LYS 61 N 0.34 0.92 0.12 0.04 3.64 -0.67 -1.83 116.57 119.14 3g24 h LYS 61 Ca 0.04 -0.47 -0.32 0.00 -1.27 0.00 0.00 60.65 58.62 3g24 h LYS 61 Cb 0.79 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.61 3g24 h LYS 61 CO 0.06 1.13 -1.66 0.00 -2.27 0.00 0.00 179.45 176.71 3g24 h ARG 62 N 0.74 0.26 0.00 1.90 3.08 -1.05 -3.41 114.38 115.89 3g24 h ARG 62 Ca 0.06 -0.44 0.00 0.00 0.07 0.00 0.00 59.98 59.67 3g24 h ARG 62 Cb 0.95 0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.16 3g24 h ARG 62 CO 0.09 1.11 -0.90 1.19 -1.07 0.00 0.00 179.97 180.39 3g24 n PHE 63 N -3.45 0.00 -3.64 3.04 3.72 0.54 -5.01 117.46 112.66 3g24 n PHE 63 Ca -0.20 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 56.99 3g24 n PHE 63 Cb 1.05 -0.10 0.05 0.00 -0.94 0.00 0.00 39.48 39.54 3g24 n PHE 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3g24 n GLY 64 N 1.66 -0.32 3.73 1.37 0.00 -0.69 -4.98 105.19 105.96 3g24 n GLY 64 Ca -0.00 0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 3g24 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g24 s ARG 66 N -3.80 4.57 -0.13 0.00 3.52 -0.11 -4.75 118.95 118.25 3g24 s ARG 66 Ca 0.35 1.40 0.01 0.00 -0.13 0.00 0.00 55.73 57.37 3g24 s ARG 66 Cb -0.05 -2.86 0.02 0.00 -1.56 0.00 0.00 34.95 30.50 3g24 s ARG 66 CO 0.22 0.26 -0.17 0.42 -0.81 0.00 0.00 175.30 175.22 3g24 s ILE 67 N -1.54 1.70 -0.20 4.11 -1.09 -1.26 -1.08 121.20 121.84 3g24 s ILE 67 Ca 0.50 -0.75 -0.05 0.00 -2.23 0.00 0.00 60.65 58.12 3g24 s ILE 67 Cb -0.21 -1.55 -0.02 0.00 -1.58 0.00 0.00 42.46 39.10 3g24 s ILE 67 CO 0.26 0.48 -0.01 -0.63 -1.23 0.00 0.00 174.94 173.81 3g24 s ILE 68 N 1.11 3.83 -0.49 2.92 1.01 -0.48 -0.30 121.20 128.79 3g24 s ILE 68 Ca -0.02 -0.35 -0.21 0.00 0.00 0.00 0.00 60.65 60.06 3g24 s ILE 68 Cb -0.14 -2.73 0.04 0.00 0.01 0.00 0.00 42.46 39.63 3g24 s ILE 68 CO -0.05 0.43 0.73 0.00 0.00 0.00 0.00 174.94 176.04 3g24 s ALA 69 N 1.08 3.31 -1.20 9.38 0.00 0.13 -0.65 121.76 133.81 3g24 s ALA 69 Ca 0.02 -1.36 -0.15 0.00 0.00 0.00 0.00 51.96 50.47 3g24 s ALA 69 Cb -0.14 -3.45 0.15 0.00 0.00 0.00 0.00 23.12 19.68 3g24 s ALA 69 CO 0.01 -2.02 1.45 1.21 0.00 0.00 0.00 175.76 176.41 3g24 s ASN 70 N 2.45 7.01 0.00 0.00 3.84 0.22 -1.45 114.94 126.99 3g24 s ASN 70 Ca 0.23 -2.84 0.20 0.00 0.21 0.00 0.00 52.86 50.66 3g24 s ASN 70 Cb -0.15 -2.42 0.30 0.00 -0.55 0.00 0.00 41.25 38.43 3g24 s ASN 70 CO 0.17 -0.83 1.26 0.49 -2.79 0.00 0.00 177.10 175.40 3g24 n PHE 71 N 6.07 0.29 -4.29 0.43 3.72 -1.26 -4.09 117.46 118.34 3g24 n PHE 71 Ca 0.37 -0.17 -0.34 0.00 -0.05 0.00 0.00 57.45 57.27 3g24 n PHE 71 Cb 0.44 -0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.90 3g24 n PHE 71 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3g24 n LYS 72 N 1.23 -1.63 -1.69 -1.08 4.76 -0.98 -4.69 118.16 114.08 3g24 n LYS 72 Ca 0.15 0.20 -0.56 0.00 -2.87 0.00 0.00 58.31 55.24 3g24 n LYS 72 Cb 0.53 -4.23 -0.07 0.00 -1.84 0.00 0.00 35.03 29.42 3g24 n LYS 72 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3g24 n VAL 73 N -4.40 0.30 -2.68 -0.18 0.31 -0.92 -4.44 118.33 106.32 3g24 n VAL 73 Ca -0.16 -0.05 -0.08 0.00 -0.01 0.00 0.00 64.34 64.03 3g24 n VAL 73 Cb 0.61 -1.26 0.07 0.00 -0.91 0.00 0.00 33.84 32.34 3g24 n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g24 n ALA 74 N 5.17 2.59 -4.01 3.52 0.00 -1.26 -0.98 120.51 125.55 3g24 n ALA 74 Ca 0.25 -2.41 -0.07 0.00 0.00 0.00 0.00 53.44 51.21 3g24 n ALA 74 Cb 0.16 -0.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.64 3g24 n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3g24 n ASP 75 N -0.30 2.05 -4.81 0.00 -0.08 -1.26 -4.97 116.55 107.18 3g24 n ASP 75 Ca 0.04 -1.46 -0.31 0.00 -1.51 0.00 0.00 54.79 51.55 3g24 n ASP 75 Cb 0.83 0.05 0.07 0.00 2.34 0.00 0.00 41.12 44.41 3g24 n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3g24 s ILE 76 N -1.18 3.66 0.20 5.18 -4.36 -1.26 -4.71 121.20 118.73 3g24 s ILE 76 Ca 0.02 0.54 -0.18 0.00 -0.26 0.00 0.00 60.65 60.77 3g24 s ILE 76 Cb -0.00 -3.25 0.17 0.00 1.25 0.00 0.00 42.46 40.63 3g24 s ILE 76 CO 0.01 -0.71 1.60 -0.65 0.24 0.00 0.00 174.94 175.43 3g24 h PRO 77 N -0.89 -0.11 -0.57 0.37 0.11 -1.87 0.61 132.00 129.65 3g24 h PRO 77 Ca -0.45 0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.76 3g24 h PRO 77 Cb 1.23 0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.30 3g24 h PRO 77 CO 0.57 -0.07 0.20 1.49 -0.21 0.00 0.00 178.00 179.98 3g24 h GLU 78 N -0.12 0.37 -0.12 1.05 4.57 -1.95 -0.97 114.58 117.41 3g24 h GLU 78 Ca 0.26 -0.02 -0.21 0.00 -1.18 0.00 0.00 59.36 58.21 3g24 h GLU 78 Cb 0.54 -0.08 0.01 0.00 -0.16 0.00 0.00 28.75 29.05 3g24 h GLU 78 CO -0.68 0.24 -0.77 1.15 -1.18 0.00 0.00 179.01 177.77 3g24 h THR 79 N 0.38 1.31 -0.97 0.32 2.02 -1.78 -3.09 112.91 111.10 3g24 h THR 79 Ca 0.28 -2.05 0.04 0.00 0.77 0.00 0.00 66.41 65.46 3g24 h THR 79 Cb 0.34 2.05 -0.06 0.00 -1.74 0.00 0.00 68.15 68.74 3g24 h THR 79 CO -0.29 0.64 0.64 0.78 0.37 0.00 0.00 175.52 177.65 3g24 h ASN 80 N 0.44 1.05 -0.36 4.18 4.21 -0.39 -0.72 115.58 123.99 3g24 h ASN 80 Ca -0.05 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.46 3g24 h ASN 80 Cb 1.38 -0.24 -0.02 0.00 -1.12 0.00 0.00 38.32 38.33 3g24 h ASN 80 CO 0.15 0.71 0.24 -0.08 -1.29 0.00 0.00 177.43 177.15 3g24 h GLU 81 N 1.21 0.47 -0.67 0.81 4.81 -1.14 -1.29 114.58 118.78 3g24 h GLU 81 Ca 0.39 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.55 3g24 h GLU 81 Cb 0.04 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 3g24 h GLU 81 CO -0.13 0.31 0.25 0.87 -0.73 0.00 0.00 179.01 179.58 3g24 h LYS 82 N 0.48 1.01 -0.42 1.92 1.57 -1.29 -1.58 116.57 118.26 3g24 h LYS 82 Ca 0.13 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 3g24 h LYS 82 Cb -0.05 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.08 3g24 h LYS 82 CO -0.03 0.86 0.23 0.82 -0.57 0.00 0.00 179.45 180.76 3g24 h ILE 83 N 0.95 1.15 -0.63 1.86 2.04 -0.87 -1.32 117.51 120.69 3g24 h ILE 83 Ca 0.22 -0.40 -0.04 0.00 1.00 0.00 0.00 64.86 65.65 3g24 h ILE 83 Cb 0.24 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 3g24 h ILE 83 CO -0.01 0.16 0.24 0.00 0.00 0.00 0.00 178.15 178.54 3g24 h ARG 85 N 0.89 0.42 -0.53 0.00 3.08 -1.01 -0.34 114.38 116.89 3g24 h ARG 85 Ca 0.21 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.16 3g24 h ARG 85 Cb 0.23 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3g24 h ARG 85 CO -0.01 0.36 0.13 0.00 -1.07 0.00 0.00 179.97 179.37 3g24 h ALA 86 N 1.04 1.25 -0.23 0.04 0.00 -1.10 -0.81 119.26 119.44 3g24 h ALA 86 Ca 0.10 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3g24 h ALA 86 Cb 0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3g24 h ALA 86 CO -0.02 0.53 -0.14 1.15 0.00 0.00 0.00 179.25 180.76 3g24 h THR 87 N 0.77 1.31 0.00 0.00 2.02 -0.86 -2.69 112.91 113.46 3g24 h THR 87 Ca 0.17 -1.25 -0.11 0.00 0.77 0.00 0.00 66.41 65.99 3g24 h THR 87 Cb 0.28 1.62 -0.02 0.00 -1.74 0.00 0.00 68.15 68.29 3g24 h THR 87 CO -0.00 0.39 -0.54 -0.26 0.37 0.00 0.00 175.52 175.47 3g24 h PHE 88 N 0.22 0.00 -0.31 3.16 0.04 -0.96 -2.64 116.94 116.45 3g24 h PHE 88 Ca 0.05 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.79 3g24 h PHE 88 Cb 0.66 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.79 3g24 h PHE 88 CO 0.07 0.54 0.06 0.87 -0.60 0.00 0.00 178.31 179.25 3g24 h LYS 89 N 0.00 0.45 0.00 1.51 6.56 -1.06 -1.16 116.57 122.86 3g24 h LYS 89 Ca -0.01 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.51 3g24 h LYS 89 Cb 1.07 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 32.65 3g24 h LYS 89 CO 0.07 0.43 0.00 0.00 -2.06 0.00 0.00 179.45 177.89 3g24 n ALA 90 N -2.48 2.22 0.00 3.86 0.00 -1.01 -4.89 120.51 118.20 3g24 n ALA 90 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.34 3g24 n ALA 90 Cb 0.18 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.24 3g24 n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g24 n GLY 91 N 0.83 0.96 3.77 0.00 0.00 -0.44 -3.84 105.19 106.48 3g24 n GLY 91 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 3g24 n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g24 s ALA 92 N -2.00 3.22 -0.12 4.61 0.00 -1.14 -4.82 121.76 121.51 3g24 s ALA 92 Ca 0.00 1.04 0.16 0.00 0.00 0.00 0.00 51.96 53.17 3g24 s ALA 92 Cb 0.00 -3.41 -0.13 0.00 0.00 0.00 0.00 23.12 19.58 3g24 s ALA 92 CO 0.00 -0.58 0.85 -0.44 0.00 0.00 0.00 175.76 175.59 3g24 h ASP 93 N 2.77 0.00 -5.15 0.00 3.32 -1.02 -3.43 116.42 112.92 3g24 h ASP 93 Ca -0.49 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.50 3g24 h ASP 93 Cb 1.24 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.67 3g24 h ASP 93 CO 0.63 0.61 -0.14 0.00 -1.72 0.00 0.00 179.24 178.61 3g24 s ALA 94 N -2.90 -0.55 0.00 3.45 0.00 -1.09 -2.35 121.76 118.32 3g24 s ALA 94 Ca -0.03 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.48 3g24 s ALA 94 Cb 0.09 0.79 -0.01 0.00 0.00 0.00 0.00 23.12 23.99 3g24 s ALA 94 CO 0.81 -0.70 -0.02 -1.50 0.00 0.00 0.00 175.76 174.35 3g24 s ILE 95 N -3.89 0.12 -0.17 0.00 2.07 -0.74 -0.69 121.20 117.89 3g24 s ILE 95 Ca 0.10 -0.25 -0.15 0.00 -1.41 0.00 0.00 60.65 58.94 3g24 s ILE 95 Cb 0.01 -0.14 -0.04 0.00 0.13 0.00 0.00 42.46 42.42 3g24 s ILE 95 CO -0.04 -0.08 0.36 -0.63 -1.91 0.00 0.00 174.94 172.63 3g24 s ILE 96 N -0.34 5.25 -0.03 2.00 1.01 -0.53 -1.07 121.20 127.50 3g24 s ILE 96 Ca -0.03 0.66 0.06 0.00 0.00 0.00 0.00 60.65 61.34 3g24 s ILE 96 Cb -0.03 -3.69 -0.01 0.00 0.01 0.00 0.00 42.46 38.74 3g24 s ILE 96 CO -0.00 0.33 -0.21 -0.69 0.00 0.00 0.00 174.94 174.36 3g24 s VAL 97 N 0.83 1.68 0.35 2.92 1.01 0.13 -2.16 120.40 125.16 3g24 s VAL 97 Ca 0.19 -0.90 -0.26 0.00 0.00 0.00 0.00 61.98 61.01 3g24 s VAL 97 Cb -0.14 -1.41 -0.09 0.00 0.00 0.00 0.00 36.38 34.74 3g24 s VAL 97 CO 0.06 0.48 1.06 -1.00 0.00 0.00 0.00 175.10 175.70 3g24 s HIS 98 N -0.37 3.42 -0.14 5.22 3.76 -0.15 -0.85 115.29 126.17 3g24 s HIS 98 Ca 0.05 1.68 0.22 0.00 -0.15 0.00 0.00 55.06 56.86 3g24 s HIS 98 Cb -0.09 -3.18 -0.19 0.00 1.11 0.00 0.00 32.58 30.23 3g24 s HIS 98 CO 0.00 -0.54 0.72 0.41 -0.85 0.00 0.00 174.74 174.48 3g24 n GLY 99 N 0.71 -1.19 0.38 -2.22 0.00 -1.14 -4.43 105.19 97.29 3g24 n GLY 99 Ca 0.02 -0.40 0.14 0.00 0.00 0.00 0.00 46.02 45.77 3g24 n GLY 99 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3g24 h PHE 100 N 0.00 0.75 0.00 1.61 3.57 -1.93 -1.57 116.94 119.36 3g24 h PHE 100 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3g24 h PHE 100 Cb 0.99 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.49 3g24 h PHE 100 CO 0.00 0.26 0.00 -2.30 -2.23 0.00 0.00 178.31 174.04 3g24 n PRO 101 N -4.55 0.33 0.00 6.41 -0.02 -1.26 -4.97 135.00 130.93 3g24 n PRO 101 Ca 0.18 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 3g24 n PRO 101 Cb 0.52 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 3g24 n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g24 n GLY 102 N -0.15 1.97 0.28 -1.23 0.00 -0.59 -4.64 105.19 100.83 3g24 n GLY 102 Ca 0.09 -2.01 -0.06 0.00 0.00 0.00 0.00 46.02 44.04 3g24 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g24 h ALA 103 N 0.00 0.88 -0.76 4.61 0.00 -1.93 -2.79 119.26 119.27 3g24 h ALA 103 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3g24 h ALA 103 Cb 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 3g24 h ALA 103 CO 0.00 0.38 0.36 0.38 0.00 0.00 0.00 179.25 180.37 3g24 h ASP 104 N 0.94 0.99 -0.20 0.00 2.03 -1.99 0.06 116.42 118.25 3g24 h ASP 104 Ca 0.24 -0.12 -0.09 0.00 -0.73 0.00 0.00 57.03 56.34 3g24 h ASP 104 Cb 0.01 -0.25 -0.02 0.00 -0.83 0.00 0.00 39.33 38.24 3g24 h ASP 104 CO -0.04 0.84 -0.17 0.28 -1.03 0.00 0.00 179.24 179.12 3g24 h SER 105 N 1.08 0.61 -0.20 4.15 0.02 -1.79 -1.64 113.55 115.78 3g24 h SER 105 Ca 0.26 -0.19 -0.13 0.00 -0.84 0.00 0.00 61.79 60.90 3g24 h SER 105 Cb 0.12 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.49 3g24 h SER 105 CO -0.03 0.80 -0.36 0.58 -1.14 0.00 0.00 176.83 176.67 3g24 h VAL 106 N 0.56 1.33 -0.78 2.27 2.07 -1.17 -3.13 116.25 117.40 3g24 h VAL 106 Ca 0.09 -1.59 0.04 0.00 0.82 0.00 0.00 66.70 66.06 3g24 h VAL 106 Cb 0.61 1.85 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 3g24 h VAL 106 CO 0.04 0.49 0.51 -0.09 0.02 0.00 0.00 177.57 178.54 3g24 h ARG 107 N 0.28 0.91 -0.87 1.57 9.65 -0.80 -1.13 114.38 123.98 3g24 h ARG 107 Ca 0.01 -0.05 0.06 0.00 -1.10 0.00 0.00 59.98 58.89 3g24 h ARG 107 Cb 0.96 -0.21 -0.06 0.00 -1.39 0.00 0.00 29.97 29.27 3g24 h ARG 107 CO 0.08 0.60 0.55 0.00 2.80 0.00 0.00 179.97 184.00 3g24 h ALA 108 N 1.55 1.19 -0.32 2.80 0.00 -1.25 -0.73 119.26 122.50 3g24 h ALA 108 Ca 0.31 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.05 3g24 h ALA 108 Cb 0.07 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 3g24 h ALA 108 CO -0.09 0.31 -0.41 0.00 0.00 0.00 0.00 179.25 179.06 3g24 h LEU 110 N 0.62 1.06 -0.22 0.00 3.38 -0.68 -1.51 115.31 117.97 3g24 h LEU 110 Ca 0.04 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3g24 h LEU 110 Cb 1.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 3g24 h LEU 110 CO 0.10 0.78 0.13 0.78 0.09 0.00 0.00 178.44 180.32 3g24 h ASN 111 N 1.24 0.26 -0.51 -0.43 2.35 -1.09 -1.19 115.58 116.22 3g24 h ASN 111 Ca 0.33 -0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 55.91 3g24 h ASN 111 Cb -0.11 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 3g24 h ASN 111 CO -0.07 0.25 -0.11 0.58 -1.65 0.00 0.00 177.43 176.43 3g24 h VAL 112 N 0.26 1.27 -0.50 2.81 2.07 -1.43 -2.09 116.25 118.63 3g24 h VAL 112 Ca 0.08 -1.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.34 3g24 h VAL 112 Cb 0.04 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 3g24 h VAL 112 CO -0.01 0.44 0.31 0.00 0.02 0.00 0.00 177.57 178.33 3g24 h ALA 113 N 0.98 0.64 -0.87 1.67 0.00 -1.11 -1.17 119.26 119.40 3g24 h ALA 113 Ca 0.14 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3g24 h ALA 113 Cb 0.66 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 3g24 h ALA 113 CO 0.05 0.12 0.45 1.49 0.00 0.00 0.00 179.25 181.36 3g24 h GLU 114 N 0.67 1.22 -0.07 0.00 4.81 -1.06 0.29 114.58 120.44 3g24 h GLU 114 Ca 0.18 -0.16 -0.10 0.00 -0.13 0.00 0.00 59.36 59.16 3g24 h GLU 114 Cb -0.03 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.11 3g24 h GLU 114 CO -0.04 0.91 -0.40 1.49 -0.73 0.00 0.00 179.01 180.25 3g24 h GLU 115 N 1.22 0.16 -0.44 1.92 4.81 -0.88 -3.14 114.58 118.22 3g24 h GLU 115 Ca 0.30 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 3g24 h GLU 115 Cb 0.06 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3g24 h GLU 115 CO -0.04 0.54 0.00 -1.33 -0.73 0.00 0.00 179.01 177.44 3g24 n MET 116 N -4.04 2.55 -2.93 1.92 2.81 -0.49 -4.99 117.12 111.96 3g24 n MET 116 Ca -0.02 -2.20 -0.12 0.00 -1.81 0.00 0.00 57.70 53.56 3g24 n MET 116 Cb 0.46 -1.40 0.06 0.00 -0.71 0.00 0.00 33.22 31.63 3g24 n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g24 n GLY 117 N 1.04 -0.29 3.46 3.03 0.00 -0.20 -5.05 105.19 107.18 3g24 n GLY 117 Ca 0.16 0.08 -0.24 0.00 0.00 0.00 0.00 46.02 46.02 3g24 n GLY 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g24 s ARG 118 N -4.62 1.90 0.09 1.61 1.81 0.86 -5.03 118.95 115.58 3g24 s ARG 118 Ca 0.12 -2.15 0.10 0.00 -1.72 0.00 0.00 55.73 52.08 3g24 s ARG 118 Cb -0.02 -0.34 -0.04 0.00 -0.45 0.00 0.00 34.95 34.11 3g24 s ARG 118 CO 0.52 -0.54 -0.26 -1.21 -0.68 0.00 0.00 175.30 173.13 3g24 s GLU 119 N -3.63 1.60 -0.13 3.54 0.41 -0.99 -4.40 118.70 115.10 3g24 s GLU 119 Ca 0.28 -1.24 -0.01 0.00 -0.41 0.00 0.00 54.97 53.58 3g24 s GLU 119 Cb 0.02 -1.96 -0.02 0.00 -1.78 0.00 0.00 34.13 30.39 3g24 s GLU 119 CO 0.18 0.48 -0.09 0.08 -0.49 0.00 0.00 175.26 175.42 3g24 s VAL 120 N -0.97 3.47 -0.22 2.63 1.01 -1.26 -1.80 120.40 123.27 3g24 s VAL 120 Ca 0.14 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 3g24 s VAL 120 Cb -0.10 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 3g24 s VAL 120 CO 0.05 0.52 0.01 -0.36 0.00 0.00 0.00 175.10 175.32 3g24 s PHE 121 N 0.23 3.04 -0.28 5.22 0.08 -0.23 -4.09 117.98 121.95 3g24 s PHE 121 Ca -0.06 -0.51 -0.18 0.00 0.12 0.00 0.00 56.93 56.30 3g24 s PHE 121 Cb -0.15 -2.13 -0.02 0.00 -0.57 0.00 0.00 43.02 40.16 3g24 s PHE 121 CO 0.04 -0.31 0.52 -1.17 -0.10 0.00 0.00 175.22 174.20 3g24 s LEU 122 N 1.22 4.10 -0.30 -0.37 2.96 0.06 -0.69 118.68 125.64 3g24 s LEU 122 Ca 0.03 0.44 -0.26 0.00 -0.22 0.00 0.00 54.13 54.13 3g24 s LEU 122 Cb -0.15 -2.66 0.01 0.00 0.50 0.00 0.00 46.19 43.89 3g24 s LEU 122 CO 0.01 -0.33 0.90 -0.22 -1.32 0.00 0.00 176.35 175.40 3g24 s LEU 123 N 2.35 4.04 -0.26 -0.68 2.96 -0.03 -0.86 118.68 126.20 3g24 s LEU 123 Ca 0.21 0.85 -0.13 0.00 -0.22 0.00 0.00 54.13 54.84 3g24 s LEU 123 Cb -0.16 -3.26 -0.14 0.00 0.50 0.00 0.00 46.19 43.13 3g24 s LEU 123 CO 0.10 -0.70 -0.23 0.35 -1.32 0.00 0.00 176.35 174.54 3g24 n THR 124 N 5.62 1.53 -3.96 3.68 -2.24 -0.91 -2.89 114.28 115.12 3g24 n THR 124 Ca 0.07 -0.36 -0.16 0.00 -2.27 0.00 0.00 64.05 61.33 3g24 n THR 124 Cb 0.48 -1.85 -0.16 0.00 -2.10 0.00 0.00 70.33 66.71 3g24 n THR 124 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3g24 s GLU 125 N -2.49 0.28 0.51 -0.78 2.12 -1.25 -4.42 118.70 112.67 3g24 s GLU 125 Ca -0.36 0.02 -0.06 0.00 0.36 0.00 0.00 54.97 54.92 3g24 s GLU 125 Cb 0.13 -0.40 -0.03 0.00 0.26 0.00 0.00 34.13 34.08 3g24 s GLU 125 CO 0.53 -0.07 0.83 -1.64 -0.54 0.00 0.00 175.26 174.36 3g24 s MET 126 N 0.68 3.51 0.03 4.30 -1.94 -1.26 -3.31 119.30 121.31 3g24 s MET 126 Ca -0.07 0.27 0.25 0.00 -1.71 0.00 0.00 55.69 54.43 3g24 s MET 126 Cb -0.10 -2.33 0.43 0.00 2.01 0.00 0.00 34.83 34.85 3g24 s MET 126 CO -0.01 -0.29 1.36 -1.13 -0.01 0.00 0.00 175.02 174.94 3g24 n SER 127 N -2.35 0.55 -4.88 3.03 3.41 -1.26 -4.72 113.62 107.39 3g24 n SER 127 Ca 0.02 -0.18 -0.30 0.00 -0.26 0.00 0.00 58.87 58.15 3g24 n SER 127 Cb 0.55 0.28 0.01 0.00 -0.26 0.00 0.00 64.21 64.79 3g24 n SER 127 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 3g24 s HIS 128 N -3.05 3.57 0.26 7.33 -3.43 -1.26 -4.72 115.29 113.99 3g24 s HIS 128 Ca 0.09 1.10 -0.01 0.00 -0.80 0.00 0.00 55.06 55.44 3g24 s HIS 128 Cb 0.16 -2.62 0.54 0.00 -1.43 0.00 0.00 32.58 29.24 3g24 s HIS 128 CO 0.71 -0.61 1.74 -1.35 -2.00 0.00 0.00 174.74 173.24 3g24 h PRO 129 N -0.17 0.51 0.00 -0.38 0.11 -2.00 -1.48 132.00 128.59 3g24 h PRO 129 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3g24 h PRO 129 Cb 1.20 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3g24 h PRO 129 CO 0.62 0.34 0.07 0.78 -0.21 0.00 0.00 178.00 179.59 3g24 h GLY 130 N 0.52 0.00 2.00 -0.55 0.00 -1.97 -1.80 103.07 101.28 3g24 h GLY 130 Ca 0.46 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 3g24 h GLY 130 CO -0.41 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 176.12 3g24 h ALA 131 N 1.87 1.25 0.00 3.60 0.00 -1.56 -2.12 119.26 122.30 3g24 h ALA 131 Ca 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3g24 h ALA 131 Cb 0.13 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3g24 h ALA 131 CO 0.00 0.02 -0.21 0.93 0.00 0.00 0.00 179.25 180.00 3g24 h GLU 132 N 0.00 0.00 -0.01 0.00 5.08 -1.51 0.09 114.58 118.23 3g24 h GLU 132 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3g24 h GLU 132 Cb 0.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 3g24 h GLU 132 CO 0.00 0.21 0.00 0.52 -1.00 0.00 0.00 179.01 178.74 3g24 h MET 133 N 0.00 0.01 0.00 2.33 2.86 -1.59 -3.42 114.93 115.13 3g24 h MET 133 Ca -0.00 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3g24 h MET 133 Cb 0.64 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.30 3g24 h MET 133 CO 0.03 0.29 -0.48 1.19 1.06 0.00 0.00 176.91 179.00 3g24 n PHE 134 N -4.95 0.00 -0.04 -0.22 3.72 -1.25 -4.88 117.46 109.84 3g24 n PHE 134 Ca -0.08 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.21 3g24 n PHE 134 Cb 0.16 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.64 3g24 n PHE 134 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 3g24 h ILE 135 N 0.00 1.22 -0.73 4.37 2.04 -1.80 -3.26 117.51 119.36 3g24 h ILE 135 Ca 0.00 -0.70 0.11 0.00 1.00 0.00 0.00 64.86 65.27 3g24 h ILE 135 Cb 0.48 1.41 -0.08 0.00 -0.74 0.00 0.00 36.82 37.89 3g24 h ILE 135 CO 0.00 0.21 0.33 -0.61 0.00 0.00 0.00 178.15 178.08 3g24 h GLN 136 N 0.02 0.52 0.00 2.37 4.15 -1.22 0.41 115.11 121.36 3g24 h GLN 136 Ca 0.04 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.43 3g24 h GLN 136 Cb 0.30 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.87 3g24 h GLN 136 CO 0.00 0.35 0.00 0.78 -1.93 0.00 0.00 178.83 178.03 3g24 h GLY 137 N 0.54 0.00 -0.26 2.39 0.00 -1.82 -2.59 103.07 101.32 3g24 h GLY 137 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 3g24 h GLY 137 CO -0.32 0.00 -0.47 0.00 0.00 0.00 0.00 176.54 175.74 3g24 n ALA 138 N -2.06 3.42 -0.16 3.60 0.00 -0.51 -4.73 120.51 120.07 3g24 n ALA 138 Ca -0.01 -0.42 -0.02 0.00 0.00 0.00 0.00 53.44 52.99 3g24 n ALA 138 Cb 0.19 -0.48 0.07 0.00 0.00 0.00 0.00 19.45 19.23 3g24 n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g24 h ALA 139 N 2.07 0.54 -0.69 0.00 0.00 -0.54 0.68 119.26 121.32 3g24 h ALA 139 Ca 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3g24 h ALA 139 Cb 0.37 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3g24 h ALA 139 CO 0.00 -0.35 0.29 -0.44 0.00 0.00 0.00 179.25 178.76 3g24 h ASP 140 N 0.18 0.93 -0.27 0.00 5.19 -1.85 -0.78 116.42 119.82 3g24 h ASP 140 Ca 0.26 -0.16 -0.11 0.00 -0.62 0.00 0.00 57.03 56.40 3g24 h ASP 140 Cb 0.37 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.63 3g24 h ASP 140 CO -0.38 0.83 -0.22 -0.08 -3.12 0.00 0.00 179.24 176.28 3g24 h GLU 141 N 0.97 0.74 -0.80 3.56 4.81 -1.75 -0.94 114.58 121.17 3g24 h GLU 141 Ca 0.23 -0.29 -0.04 0.00 -0.13 0.00 0.00 59.36 59.12 3g24 h GLU 141 Cb 0.18 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 3g24 h GLU 141 CO -0.02 0.90 0.33 0.82 -0.73 0.00 0.00 179.01 180.31 3g24 h ILE 142 N 0.65 1.26 -0.45 2.32 2.04 -0.50 0.11 117.51 122.95 3g24 h ILE 142 Ca 0.09 -0.81 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 3g24 h ILE 142 Cb 0.72 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 3g24 h ILE 142 CO 0.06 0.33 0.09 0.00 0.00 0.00 0.00 178.15 178.63 3g24 h ALA 143 N 1.19 0.59 -0.47 1.87 0.00 -0.74 -0.93 119.26 120.78 3g24 h ALA 143 Ca 0.27 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3g24 h ALA 143 Cb 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3g24 h ALA 143 CO -0.02 0.29 0.14 0.00 0.00 0.00 0.00 179.25 179.65 3g24 h ARG 144 N 0.59 0.70 -0.67 0.00 3.08 -0.81 -1.21 114.38 116.07 3g24 h ARG 144 Ca 0.14 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 3g24 h ARG 144 Cb 0.34 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 3g24 h ARG 144 CO 0.00 0.62 0.30 1.98 -1.07 0.00 0.00 179.97 181.81 3g24 h MET 145 N 0.69 0.98 -0.46 0.04 4.05 -0.54 -0.35 114.93 119.34 3g24 h MET 145 Ca 0.16 -0.16 0.01 0.00 -0.28 0.00 0.00 59.70 59.44 3g24 h MET 145 Cb 0.22 -0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 30.82 3g24 h MET 145 CO -0.01 0.79 0.29 0.78 0.23 0.00 0.00 176.91 178.99 3g24 h GLY 146 N 0.93 0.64 0.96 1.39 0.00 -0.21 -0.31 103.07 106.48 3g24 h GLY 146 Ca 0.23 -0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.35 3g24 h GLY 146 CO -0.03 0.21 0.26 -2.08 0.00 0.00 0.00 176.54 174.90 3g24 h VAL 147 N 0.58 1.08 -0.38 4.60 2.07 -0.72 0.64 116.25 124.12 3g24 h VAL 147 Ca 0.17 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 3g24 h VAL 147 Cb -0.03 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 3g24 h VAL 147 CO -0.06 0.10 0.16 0.44 0.02 0.00 0.00 177.57 178.23 3g24 h ASP 148 N 0.53 0.48 0.61 0.57 3.32 -0.59 -2.07 116.42 119.26 3g24 h ASP 148 Ca 0.16 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3g24 h ASP 148 Cb -0.03 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.40 3g24 h ASP 148 CO -0.05 0.43 -0.10 0.18 -1.72 0.00 0.00 179.24 177.97 3g24 n LEU 149 N -4.39 0.23 0.00 1.55 4.77 -0.17 -4.92 117.00 114.07 3g24 n LEU 149 Ca 0.02 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 3g24 n LEU 149 Cb 0.13 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 3g24 n LEU 149 CO 0.37 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 3g24 n GLY 150 N 1.37 0.58 3.75 -0.72 0.00 -0.61 -5.03 105.19 104.54 3g24 n GLY 150 Ca 0.11 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 3g24 n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g24 s VAL 151 N -2.00 2.84 -0.25 1.61 1.01 0.12 -4.93 120.40 118.80 3g24 s VAL 151 Ca 0.00 0.75 0.04 0.00 0.00 0.00 0.00 61.98 62.77 3g24 s VAL 151 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 3g24 s VAL 151 CO 0.00 0.14 0.25 0.29 0.00 0.00 0.00 175.10 175.78 3g24 n LYS 152 N 1.83 4.66 -5.03 2.72 5.02 -1.26 -4.60 118.16 121.50 3g24 n LYS 152 Ca 0.04 -0.13 -0.29 0.00 -2.02 0.00 0.00 58.31 55.91 3g24 n LYS 152 Cb 0.42 -0.75 -0.17 0.00 -0.02 0.00 0.00 35.03 34.50 3g24 n LYS 152 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3g24 s ASN 153 N -1.20 2.63 0.12 4.39 0.01 -1.26 -0.03 114.94 119.60 3g24 s ASN 153 Ca 0.02 -0.45 0.02 0.00 -0.71 0.00 0.00 52.86 51.74 3g24 s ASN 153 Cb 0.03 -0.99 -0.04 0.00 0.41 0.00 0.00 41.25 40.66 3g24 s ASN 153 CO 0.14 0.15 -0.05 -0.31 -1.51 0.00 0.00 177.10 175.53 3g24 s TYR 154 N 0.22 0.99 -0.08 2.20 2.02 0.65 -0.76 117.35 122.58 3g24 s TYR 154 Ca -0.11 -0.94 0.02 0.00 -0.37 0.00 0.00 57.07 55.66 3g24 s TYR 154 Cb -0.15 -0.57 0.02 0.00 -0.40 0.00 0.00 41.96 40.86 3g24 s TYR 154 CO 0.05 -0.16 -0.12 0.08 -1.57 0.00 0.00 175.55 173.83 3g24 s VAL 155 N -3.63 1.21 0.12 0.71 1.01 -0.04 -1.37 120.40 118.42 3g24 s VAL 155 Ca 0.15 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.66 3g24 s VAL 155 Cb 0.05 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 3g24 s VAL 155 CO -0.02 0.38 -0.05 -0.83 0.00 0.00 0.00 175.10 174.58 3g24 s GLY 156 N 0.90 0.91 -0.12 4.51 0.00 -0.92 -2.14 107.32 110.46 3g24 s GLY 156 Ca -0.10 -1.43 -0.29 0.00 0.00 0.00 0.00 44.72 42.90 3g24 s GLY 156 CO 0.01 -1.48 1.18 2.56 0.00 0.00 0.00 173.10 175.37 3g24 s PRO 157 N -3.86 4.30 0.33 2.90 0.04 -1.21 -3.65 135.00 133.86 3g24 s PRO 157 Ca 0.16 1.60 0.13 0.00 0.04 0.00 0.00 61.00 62.92 3g24 s PRO 157 Cb 0.05 -3.64 0.58 0.00 0.04 0.00 0.00 34.50 31.53 3g24 s PRO 157 CO -0.02 -0.55 1.73 1.03 0.04 0.00 0.00 177.00 179.23 3g24 h SER 158 N 7.70 0.00 0.60 6.66 0.87 -1.60 -2.99 113.55 124.78 3g24 h SER 158 Ca -0.29 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 3g24 h SER 158 Cb 1.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 3g24 h SER 158 CO 0.92 0.47 0.00 0.35 -0.53 0.00 0.00 176.83 178.05 3g24 n THR 159 N -3.92 0.93 -3.43 2.23 -2.24 -1.26 -3.87 114.28 102.72 3g24 n THR 159 Ca -0.01 0.24 -0.26 0.00 -2.27 0.00 0.00 64.05 61.74 3g24 n THR 159 Cb 0.50 -1.08 -0.09 0.00 -2.10 0.00 0.00 70.33 67.55 3g24 n THR 159 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3g24 n ARG 160 N -1.85 0.73 -0.16 -0.78 1.74 -1.13 -4.96 116.66 110.24 3g24 n ARG 160 Ca 0.03 -3.50 0.25 0.00 -0.77 0.00 0.00 57.85 53.86 3g24 n ARG 160 Cb 0.20 -1.70 0.67 0.00 -1.02 0.00 0.00 32.46 30.61 3g24 n ARG 160 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3g24 h PRO 161 N 5.11 0.08 -0.15 5.56 0.13 -1.73 0.15 132.00 141.16 3g24 h PRO 161 Ca 0.20 -0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 65.20 3g24 h PRO 161 Cb 0.86 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 3g24 h PRO 161 CO 0.48 0.06 -0.45 1.05 -0.23 0.00 0.00 178.00 178.90 3g24 h GLU 162 N 0.09 0.36 -0.03 0.86 9.09 -1.94 0.66 114.58 123.67 3g24 h GLU 162 Ca 0.40 -0.19 -0.24 0.00 0.05 0.00 0.00 59.36 59.38 3g24 h GLU 162 Cb 1.47 0.01 0.01 0.00 -1.65 0.00 0.00 28.75 28.59 3g24 h GLU 162 CO -0.04 0.74 -0.95 0.00 0.05 0.00 0.00 179.01 178.81 3g24 h ARG 163 N 0.29 0.59 -0.64 1.06 2.47 -1.13 -1.91 114.38 115.11 3g24 h ARG 163 Ca 0.02 -0.60 -0.06 0.00 -1.26 0.00 0.00 59.98 58.08 3g24 h ARG 163 Cb 0.91 0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 29.37 3g24 h ARG 163 CO 0.08 1.21 0.17 1.25 0.56 0.00 0.00 179.97 183.24 3g24 h LEU 164 N 0.35 0.96 -0.60 3.04 5.85 -0.87 -0.76 115.31 123.29 3g24 h LEU 164 Ca -0.09 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.37 3g24 h LEU 164 Cb 1.59 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 42.34 3g24 h LEU 164 CO 0.18 0.93 0.26 -1.28 -0.34 0.00 0.00 178.44 178.19 3g24 h SER 165 N 0.94 0.81 -0.84 1.25 0.87 -0.84 -1.25 113.55 114.49 3g24 h SER 165 Ca 0.20 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.59 3g24 h SER 165 Cb 0.34 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.05 3g24 h SER 165 CO -0.00 0.74 0.45 -0.09 -0.53 0.00 0.00 176.83 177.40 3g24 h ARG 166 N 0.82 1.17 -0.53 2.24 9.65 -0.91 -0.55 114.38 126.28 3g24 h ARG 166 Ca 0.20 -0.14 -0.01 0.00 -1.10 0.00 0.00 59.98 58.93 3g24 h ARG 166 Cb 0.17 -0.23 -0.03 0.00 -1.39 0.00 0.00 29.97 28.50 3g24 h ARG 166 CO -0.02 0.87 0.30 1.25 2.80 0.00 0.00 179.97 185.17 3g24 h LEU 167 N 1.17 0.65 -0.90 3.80 5.85 -0.72 -1.39 115.31 123.76 3g24 h LEU 167 Ca 0.29 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.94 3g24 h LEU 167 Cb 0.04 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.87 3g24 h LEU 167 CO -0.05 0.53 0.58 -0.09 -0.34 0.00 0.00 178.44 179.08 3g24 h ARG 168 N 0.71 1.19 -0.54 1.25 9.65 -0.74 -1.47 114.38 124.43 3g24 h ARG 168 Ca 0.19 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 3g24 h ARG 168 Cb 0.02 -0.26 -0.03 0.00 -1.39 0.00 0.00 29.97 28.31 3g24 h ARG 168 CO -0.03 0.80 0.34 0.93 2.80 0.00 0.00 179.97 184.81 3g24 h GLU 169 N 1.22 0.73 -0.27 0.20 5.08 -0.46 -0.31 114.58 120.77 3g24 h GLU 169 Ca 0.33 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.59 3g24 h GLU 169 Cb -0.12 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 3g24 h GLU 169 CO -0.07 0.51 0.02 0.82 -1.00 0.00 0.00 179.01 179.29 3g24 h ILE 170 N 0.73 1.24 0.00 3.13 2.04 -0.78 -3.23 117.51 120.64 3g24 h ILE 170 Ca 0.20 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.21 3g24 h ILE 170 Cb -0.04 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 3g24 h ILE 170 CO -0.04 0.27 -0.10 0.16 0.00 0.00 0.00 178.15 178.44 3g24 h ILE 171 N 0.25 0.00 0.00 -0.67 3.07 -1.21 -3.48 117.51 115.46 3g24 h ILE 171 Ca 0.08 -0.87 0.00 0.00 1.55 0.00 0.00 64.86 65.62 3g24 h ILE 171 Cb 0.37 1.82 0.00 0.00 -0.27 0.00 0.00 36.82 38.74 3g24 h ILE 171 CO 0.01 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.72 3g24 n GLY 172 N 1.16 -0.87 0.20 0.16 0.00 -0.13 -4.23 105.19 101.47 3g24 n GLY 172 Ca 0.04 -1.65 0.06 0.00 0.00 0.00 0.00 46.02 44.47 3g24 n GLY 172 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3g24 h GLN 173 N 0.00 0.00 -0.06 1.61 1.08 -1.92 -3.17 115.11 112.65 3g24 h GLN 173 Ca 0.00 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.06 3g24 h GLN 173 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 3g24 h GLN 173 CO 0.00 0.34 -0.58 -0.44 -0.95 0.00 0.00 178.83 177.20 3g24 h ASP 174 N 0.00 0.21 -4.22 1.46 5.19 -1.97 -3.45 116.42 113.63 3g24 h ASP 174 Ca -0.00 -0.11 -0.52 0.00 -0.62 0.00 0.00 57.03 55.78 3g24 h ASP 174 Cb 0.77 -0.06 0.13 0.00 0.18 0.00 0.00 39.33 40.35 3g24 h ASP 174 CO 0.04 0.74 0.35 -0.44 -3.12 0.00 0.00 179.24 176.82 3g24 s SER 175 N -6.89 4.62 -0.17 6.45 0.01 -1.20 -5.02 113.70 111.50 3g24 s SER 175 Ca -0.03 2.06 -0.08 0.00 1.31 0.00 0.00 55.95 59.20 3g24 s SER 175 Cb 0.12 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 3g24 s SER 175 CO 0.79 -1.96 0.10 0.12 0.41 0.00 0.00 173.24 172.70 3g24 s PHE 176 N -2.40 3.39 -0.07 2.43 5.36 0.95 -4.98 117.98 122.65 3g24 s PHE 176 Ca 0.67 0.29 0.01 0.00 -0.96 0.00 0.00 56.93 56.94 3g24 s PHE 176 Cb -0.22 -2.07 0.02 0.00 -0.34 0.00 0.00 43.02 40.41 3g24 s PHE 176 CO 0.46 0.35 -0.08 -1.17 -1.46 0.00 0.00 175.22 173.33 3g24 s LEU 177 N 0.01 1.34 0.18 6.12 2.96 -1.26 -0.26 118.68 127.77 3g24 s LEU 177 Ca 0.08 -0.24 0.10 0.00 -0.22 0.00 0.00 54.13 53.85 3g24 s LEU 177 Cb -0.12 -0.70 -0.04 0.00 0.50 0.00 0.00 46.19 45.83 3g24 s LEU 177 CO 0.00 -0.05 -0.16 0.27 -1.32 0.00 0.00 176.35 175.09 3g24 s ILE 178 N 1.14 2.85 -0.06 6.68 -4.36 -0.47 0.05 121.20 127.03 3g24 s ILE 178 Ca -0.06 -1.77 -0.03 0.00 -0.26 0.00 0.00 60.65 58.53 3g24 s ILE 178 Cb -0.14 -2.39 0.04 0.00 1.25 0.00 0.00 42.46 41.22 3g24 s ILE 178 CO -0.01 -0.09 0.12 -0.55 0.24 0.00 0.00 174.94 174.65 3g24 s SER 179 N -2.69 0.74 0.51 4.36 0.15 -0.72 -2.15 113.70 113.89 3g24 s SER 179 Ca 0.23 0.22 0.04 0.00 0.70 0.00 0.00 55.95 57.14 3g24 s SER 179 Cb -0.09 0.10 0.03 0.00 -1.71 0.00 0.00 66.02 64.35 3g24 s SER 179 CO 0.13 -0.23 0.71 -2.16 1.20 0.00 0.00 173.24 172.89 3g24 s PRO 180 N 2.04 2.62 0.00 5.44 0.04 -1.24 -0.89 135.00 143.01 3g24 s PRO 180 Ca 0.02 -0.96 0.00 0.00 0.04 0.00 0.00 61.00 60.09 3g24 s PRO 180 Cb -0.12 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.84 3g24 s PRO 180 CO -0.05 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 176.82 3g24 n GLY 181 N -2.18 1.02 3.71 0.56 0.00 -1.26 -1.63 105.19 105.40 3g24 n GLY 181 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 3g24 n GLY 181 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g24 s VAL 182 N -2.00 5.03 0.00 1.61 1.01 -1.26 -0.34 120.40 124.45 3g24 s VAL 182 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 61.98 63.48 3g24 s VAL 182 Cb 0.00 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.31 3g24 s VAL 182 CO 0.00 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.94 3g24 n GLY 183 N 3.11 1.31 0.27 4.51 0.00 -0.39 -4.49 105.19 109.51 3g24 n GLY 183 Ca -0.00 -0.57 0.05 0.00 0.00 0.00 0.00 46.02 45.49 3g24 n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g24 h ALA 184 N 0.00 0.99 0.00 4.61 0.00 -1.90 0.18 119.26 123.14 3g24 h ALA 184 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3g24 h ALA 184 Cb 0.00 0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3g24 h ALA 184 CO 0.00 -0.29 0.00 1.04 0.00 0.00 0.00 179.25 180.00 3g24 n GLN 185 N -5.10 0.39 0.00 0.00 6.02 -1.26 -4.91 117.38 112.52 3g24 n GLN 185 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 3g24 n GLN 185 Cb 0.44 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.20 3g24 n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g24 n GLY 186 N 1.27 1.04 3.77 1.08 0.00 0.05 -4.94 105.19 107.47 3g24 n GLY 186 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 3g24 n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g24 s GLY 187 N -2.08 2.68 -0.19 -0.02 0.00 0.53 -4.74 107.32 103.51 3g24 s GLY 187 Ca 0.00 0.86 -0.12 0.00 0.00 0.00 0.00 44.72 45.46 3g24 s GLY 187 CO 0.00 1.25 0.20 -0.35 0.00 0.00 0.00 173.10 174.20 3g24 s ASP 188 N -1.63 6.30 0.11 1.64 2.15 -1.26 -1.26 116.67 122.72 3g24 s ASP 188 Ca 0.69 0.34 -0.33 0.00 0.43 0.00 0.00 52.55 53.69 3g24 s ASP 188 Cb -0.25 -2.13 -0.12 0.00 -0.30 0.00 0.00 42.92 40.12 3g24 s ASP 188 CO 0.29 0.14 1.57 -0.65 -0.17 0.00 0.00 175.17 176.35 3g24 h PRO 189 N 6.73 -0.66 -0.45 4.34 0.11 -1.96 -1.63 132.00 138.48 3g24 h PRO 189 Ca -0.41 0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.75 3g24 h PRO 189 Cb 1.16 0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.40 3g24 h PRO 189 CO 0.75 -0.44 0.28 0.78 -0.21 0.00 0.00 178.00 179.16 3g24 h GLY 190 N -0.69 0.65 1.13 -0.55 0.00 -1.94 -2.36 103.07 99.32 3g24 h GLY 190 Ca 0.01 -0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.03 3g24 h GLY 190 CO -0.28 0.25 0.26 0.83 0.00 0.00 0.00 176.54 177.60 3g24 h GLU 191 N 0.60 1.09 -0.62 4.80 4.39 -1.97 -2.61 114.58 120.26 3g24 h GLU 191 Ca 0.16 -0.21 -0.05 0.00 0.34 0.00 0.00 59.36 59.61 3g24 h GLU 191 Cb -0.03 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.42 3g24 h GLU 191 CO -0.03 0.91 0.20 1.15 -1.16 0.00 0.00 179.01 180.08 3g24 h THR 192 N 1.06 1.23 0.00 1.13 2.02 -1.09 -2.21 112.91 115.05 3g24 h THR 192 Ca 0.24 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.62 3g24 h THR 192 Cb 0.25 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 3g24 h THR 192 CO -0.01 0.31 0.00 0.18 0.37 0.00 0.00 175.52 176.37 3g24 n LEU 193 N -4.28 0.00 0.17 2.58 4.77 -0.91 -0.92 117.00 118.41 3g24 n LEU 193 Ca 0.05 0.06 0.03 0.00 -0.03 0.00 0.00 56.01 56.12 3g24 n LEU 193 Cb 0.21 -0.06 0.28 0.00 -2.33 0.00 0.00 43.42 41.52 3g24 n LEU 193 CO 0.40 -0.02 0.62 0.03 -1.33 0.00 0.00 177.39 177.09 3g24 h ARG 194 N 0.00 0.00 0.00 3.23 3.08 -1.33 -3.37 114.38 115.99 3g24 h ARG 194 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 3g24 h ARG 194 Cb 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 3g24 h ARG 194 CO 0.00 0.46 -1.18 1.19 -1.07 0.00 0.00 179.97 179.37 3g24 n PHE 195 N -3.63 0.00 -3.40 3.04 3.72 -0.86 -5.05 117.46 111.28 3g24 n PHE 195 Ca -0.01 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.08 3g24 n PHE 195 Cb 0.54 -0.12 -0.05 0.00 -0.94 0.00 0.00 39.48 38.91 3g24 n PHE 195 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3g24 s ALA 196 N -2.06 3.56 0.16 4.37 0.00 -0.10 -4.90 121.76 122.78 3g24 s ALA 196 Ca -0.03 -0.27 0.01 0.00 0.00 0.00 0.00 51.96 51.67 3g24 s ALA 196 Cb 0.01 -2.44 -0.03 0.00 0.00 0.00 0.00 23.12 20.65 3g24 s ALA 196 CO 0.08 0.49 1.36 -0.44 0.00 0.00 0.00 175.76 177.25 3g24 h ASP 197 N 2.50 0.29 -4.88 0.00 3.32 -0.70 -3.40 116.42 113.55 3g24 h ASP 197 Ca -0.47 -0.24 -0.13 0.00 0.02 0.00 0.00 57.03 56.21 3g24 h ASP 197 Cb 1.17 -0.09 -0.21 0.00 0.22 0.00 0.00 39.33 40.42 3g24 h ASP 197 CO 0.69 1.05 -0.38 0.00 -1.72 0.00 0.00 179.24 178.88 3g24 s ALA 198 N -3.19 -0.58 0.02 3.45 0.00 -1.15 -4.77 121.76 115.54 3g24 s ALA 198 Ca -0.03 0.17 -0.00 0.00 0.00 0.00 0.00 51.96 52.10 3g24 s ALA 198 Cb 0.10 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 3g24 s ALA 198 CO 0.83 -0.23 0.12 0.96 0.00 0.00 0.00 175.76 177.44 3g24 s ILE 199 N -1.22 4.91 -0.19 0.00 -4.36 -0.26 -1.76 121.20 118.32 3g24 s ILE 199 Ca -0.13 -0.43 -0.08 0.00 -0.26 0.00 0.00 60.65 59.76 3g24 s ILE 199 Cb -0.06 -3.30 -0.04 0.00 1.25 0.00 0.00 42.46 40.31 3g24 s ILE 199 CO 0.03 0.27 0.07 -0.63 0.24 0.00 0.00 174.94 174.92 3g24 s ILE 200 N -1.30 4.80 -0.07 8.37 1.01 -0.07 -0.67 121.20 133.28 3g24 s ILE 200 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.89 3g24 s ILE 200 Cb -0.12 -3.17 0.02 0.00 0.01 0.00 0.00 42.46 39.20 3g24 s ILE 200 CO 0.18 0.45 -0.05 -0.69 0.00 0.00 0.00 174.94 174.83 3g24 s VAL 201 N 0.49 0.65 0.00 2.92 1.01 -0.24 -3.99 120.40 121.24 3g24 s VAL 201 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 61.89 3g24 s VAL 201 Cb -0.13 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.56 3g24 s VAL 201 CO 0.01 0.28 0.00 0.61 0.00 0.00 0.00 175.10 175.99 3g24 n GLY 202 N 4.48 0.35 0.35 4.51 0.00 -1.26 -0.88 105.19 112.73 3g24 n GLY 202 Ca -0.18 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.01 3g24 n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3g24 h ARG 203 N 0.00 0.62 -0.13 1.61 3.08 -1.92 0.11 114.38 117.75 3g24 h ARG 203 Ca 0.00 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.05 3g24 h ARG 203 Cb 0.00 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 3g24 h ARG 203 CO 0.00 0.41 0.23 0.77 -1.07 0.00 0.00 179.97 180.32 3g24 h SER 204 N 0.64 0.00 0.00 7.04 0.02 -1.90 -0.93 113.55 118.42 3g24 h SER 204 Ca 0.62 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.56 3g24 h SER 204 Cb 1.12 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.66 3g24 h SER 204 CO -0.44 0.00 -0.85 -0.38 -1.14 0.00 0.00 176.83 174.01 3g24 n ILE 205 N -3.42 1.44 0.40 3.27 5.41 -0.08 -4.30 119.36 122.08 3g24 n ILE 205 Ca 0.01 0.17 0.09 0.00 1.00 0.00 0.00 62.75 64.02 3g24 n ILE 205 Cb 0.33 -2.18 0.38 0.00 -0.71 0.00 0.00 39.64 37.46 3g24 n ILE 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3g24 n TYR 206 N -4.26 0.39 0.63 1.39 0.18 -0.56 -2.06 117.16 112.88 3g24 n TYR 206 Ca -0.12 0.16 0.07 0.00 1.88 0.00 0.00 57.90 59.89 3g24 n TYR 206 Cb 0.43 -0.76 0.04 0.00 -0.38 0.00 0.00 39.34 38.67 3g24 n TYR 206 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3g24 n LEU 207 N -1.86 1.98 -4.77 -3.48 4.77 -0.36 -5.00 117.00 108.28 3g24 n LEU 207 Ca 0.02 -0.92 -0.35 0.00 -0.03 0.00 0.00 56.01 54.73 3g24 n LEU 207 Cb 0.18 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3g24 n LEU 207 CO 0.15 0.37 0.79 0.00 -1.33 0.00 0.00 177.39 177.37 3g24 s ALA 208 N -1.42 2.72 0.23 -1.18 0.00 -0.87 -4.92 121.76 116.32 3g24 s ALA 208 Ca 0.15 0.85 -0.06 0.00 0.00 0.00 0.00 51.96 52.91 3g24 s ALA 208 Cb 0.12 -3.37 0.34 0.00 0.00 0.00 0.00 23.12 20.21 3g24 s ALA 208 CO 0.25 -0.79 1.81 -0.44 0.00 0.00 0.00 175.76 176.59 3g24 h ASP 209 N 1.28 0.63 -3.52 0.00 3.32 -1.94 -3.30 116.42 112.89 3g24 h ASP 209 Ca -0.50 0.04 -0.61 0.00 0.02 0.00 0.00 57.03 55.98 3g24 h ASP 209 Cb 1.26 -0.08 -0.40 0.00 0.22 0.00 0.00 39.33 40.33 3g24 h ASP 209 CO 0.57 0.38 -0.73 0.20 -1.72 0.00 0.00 179.24 177.94 3g24 s ASN 210 N -5.61 3.79 0.28 6.45 0.01 -1.26 -5.01 114.94 113.60 3g24 s ASN 210 Ca -0.13 -2.49 0.03 0.00 -0.71 0.00 0.00 52.86 49.56 3g24 s ASN 210 Cb 0.18 -1.07 0.67 0.00 0.41 0.00 0.00 41.25 41.44 3g24 s ASN 210 CO 0.77 -0.29 1.73 -0.65 -1.51 0.00 0.00 177.10 177.15 3g24 h PRO 211 N 6.95 0.50 -0.63 -0.60 0.11 -1.74 -1.51 132.00 135.08 3g24 h PRO 211 Ca -0.03 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 3g24 h PRO 211 Cb 0.94 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.91 3g24 h PRO 211 CO 0.49 0.33 0.38 0.00 -0.21 0.00 0.00 178.00 178.99 3g24 h ALA 212 N 1.65 0.80 -0.26 -0.75 0.00 -1.89 -0.38 119.26 118.44 3g24 h ALA 212 Ca 0.53 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 55.26 3g24 h ALA 212 Cb 0.92 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3g24 h ALA 212 CO -0.46 0.29 -0.29 0.00 0.00 0.00 0.00 179.25 178.79 3g24 h ALA 213 N 1.19 1.02 -0.09 0.00 0.00 -1.69 -0.71 119.26 118.98 3g24 h ALA 213 Ca 0.23 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3g24 h ALA 213 Cb -0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3g24 h ALA 213 CO -0.04 0.59 0.02 0.00 0.00 0.00 0.00 179.25 179.82 3g24 h ALA 214 N 1.24 0.11 -0.33 0.00 0.00 -0.80 0.31 119.26 119.79 3g24 h ALA 214 Ca 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3g24 h ALA 214 Cb 0.73 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3g24 h ALA 214 CO 0.06 -0.26 0.17 0.00 0.00 0.00 0.00 179.25 179.22 3g24 h ALA 215 N 0.81 0.42 -0.67 0.00 0.00 -0.95 -1.72 119.26 117.15 3g24 h ALA 215 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3g24 h ALA 215 Cb 0.25 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3g24 h ALA 215 CO 0.00 -0.05 0.43 0.00 0.00 0.00 0.00 179.25 179.64 3g24 h ALA 216 N 1.04 1.51 -0.31 0.00 0.00 -1.03 -1.77 119.26 118.69 3g24 h ALA 216 Ca 0.11 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3g24 h ALA 216 Cb 0.07 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3g24 h ALA 216 CO -0.02 0.45 -0.02 0.78 0.00 0.00 0.00 179.25 180.44 3g24 h GLY 217 N 0.92 0.62 0.97 0.00 0.00 -0.47 -1.05 103.07 104.06 3g24 h GLY 217 Ca 0.24 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 3g24 h GLY 217 CO -0.05 0.43 0.22 -2.22 0.00 0.00 0.00 176.54 174.92 3g24 h ILE 218 N 0.36 1.14 -0.85 2.60 2.04 -0.97 -1.92 117.51 119.91 3g24 h ILE 218 Ca 0.09 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 3g24 h ILE 218 Cb 0.48 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.20 3g24 h ILE 218 CO 0.02 0.14 0.45 0.40 0.00 0.00 0.00 178.15 179.16 3g24 h ILE 219 N 0.49 1.25 -0.58 -0.67 2.04 -1.26 -1.99 117.51 116.79 3g24 h ILE 219 Ca 0.13 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 3g24 h ILE 219 Cb 0.04 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.21 3g24 h ILE 219 CO -0.02 0.29 0.25 -0.08 0.00 0.00 0.00 178.15 178.58 3g24 h GLU 220 N 1.20 0.82 0.00 2.37 4.57 -0.83 -0.95 114.58 121.76 3g24 h GLU 220 Ca 0.30 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 3g24 h GLU 220 Cb 0.06 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.49 3g24 h GLU 220 CO -0.04 0.66 0.00 0.66 -1.18 0.00 0.00 179.01 179.11 3g24 h SER 221 N 0.82 0.00 0.00 1.04 4.64 -0.59 -2.88 113.55 116.58 3g24 h SER 221 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3g24 h SER 221 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3g24 h SER 221 CO -0.02 0.00 -0.01 2.30 -0.87 0.00 0.00 176.83 178.23 3g24 n ILE 222 N -2.67 1.65 -0.32 0.95 -5.35 -0.81 -4.78 119.36 108.03 3g24 n ILE 222 Ca 0.01 -1.93 0.17 0.00 -0.27 0.00 0.00 62.75 60.73 3g24 n ILE 222 Cb 0.27 -0.05 0.36 0.00 -1.74 0.00 0.00 39.64 38.48 3g24 n ILE 222 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3g24 h LYS 223 N 0.00 0.33 0.00 6.28 3.64 -0.97 0.34 116.57 126.19 3g24 h LYS 223 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3g24 h LYS 223 Cb 0.88 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 3g24 h LYS 223 CO 0.00 0.22 0.00 -0.40 -2.27 0.00 0.00 179.45 177.00 3g24 n ASP 224 N -5.08 0.00 -0.89 4.20 3.85 -1.26 -5.10 116.55 112.27 3g24 n ASP 224 Ca 0.25 0.15 0.12 0.00 -0.71 0.00 0.00 54.79 54.60 3g24 n ASP 224 Cb 0.77 -0.35 0.16 0.00 -1.35 0.00 0.00 41.12 40.35 3g24 n ASP 224 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37