#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ggk n SER 28 N 0.00 -0.55 -0.42 -2.24 2.88 -1.26 -5.06 113.62 106.96 1ggk n SER 28 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 1ggk n SER 28 Cb 0.00 -0.27 0.02 0.00 -0.75 0.00 0.00 64.21 63.20 1ggk n SER 28 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1ggk n LEU 29 N -0.28 1.77 -4.79 2.46 4.77 -1.26 -5.02 117.00 114.66 1ggk n LEU 29 Ca 0.00 -0.83 -0.34 0.00 -0.03 0.00 0.00 56.01 54.82 1ggk n LEU 29 Cb 0.14 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1ggk n LEU 29 CO 0.00 0.33 0.74 0.00 -1.33 0.00 0.00 177.39 177.14 1ggk s ALA 30 N -1.70 2.70 0.33 -1.18 0.00 -1.26 -4.99 121.76 115.67 1ggk s ALA 30 Ca 0.14 0.62 -0.28 0.00 0.00 0.00 0.00 51.96 52.44 1ggk s ALA 30 Cb 0.13 -3.30 -0.10 0.00 0.00 0.00 0.00 23.12 19.85 1ggk s ALA 30 CO 0.34 -0.77 1.25 -1.25 0.00 0.00 0.00 175.76 175.33 1ggk s PRO 31 N -3.61 4.37 -0.21 0.00 0.04 -1.26 -4.98 135.00 129.35 1ggk s PRO 31 Ca 0.68 2.09 -0.26 0.00 0.04 0.00 0.00 61.00 63.55 1ggk s PRO 31 Cb -0.20 -3.04 -0.00 0.00 0.04 0.00 0.00 34.50 31.29 1ggk s PRO 31 CO 0.30 -0.13 0.88 -2.00 0.04 0.00 0.00 177.00 176.10 1ggk s GLU 32 N -1.79 4.24 0.00 4.56 2.56 -1.26 -2.17 118.70 124.85 1ggk s GLU 32 Ca 0.49 1.07 0.00 0.00 0.00 0.00 0.00 54.97 56.54 1ggk s GLU 32 Cb -0.37 -3.62 0.00 0.00 2.00 0.00 0.00 34.13 32.14 1ggk s GLU 32 CO 0.49 -0.48 0.00 -0.40 -0.56 0.00 0.00 175.26 174.31 1ggk n ASP 33 N 5.80 0.00 -4.05 -1.70 5.75 -1.26 -4.91 116.55 116.19 1ggk n ASP 33 Ca 0.07 0.00 -0.33 0.00 -0.01 0.00 0.00 54.79 54.52 1ggk n ASP 33 Cb 0.48 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 1ggk n ASP 33 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ggk n GLY 34 N 0.00 -0.46 0.69 6.12 0.00 -0.92 -4.87 105.19 105.74 1ggk n GLY 34 Ca 0.00 0.17 0.05 0.00 0.00 0.00 0.00 46.02 46.23 1ggk n GLY 34 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ggk n SER 35 N -2.77 1.95 -0.13 1.61 3.41 -1.26 -3.70 113.62 112.74 1ggk n SER 35 Ca 0.04 -2.08 0.14 0.00 -0.26 0.00 0.00 58.87 56.71 1ggk n SER 35 Cb 0.52 -0.29 0.59 0.00 -0.26 0.00 0.00 64.21 64.77 1ggk n SER 35 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ggk n HIS 36 N 0.38 0.00 -4.20 7.33 1.44 -1.26 -4.81 115.22 114.10 1ggk n HIS 36 Ca 0.11 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.63 1ggk n HIS 36 Cb 0.35 -0.17 -0.16 0.00 0.12 0.00 0.00 29.99 30.13 1ggk n HIS 36 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 1ggk s ARG 37 N -2.46 0.76 0.47 -1.40 6.06 -1.24 -5.04 118.95 116.10 1ggk s ARG 37 Ca 0.29 -0.15 -0.20 0.00 -2.50 0.00 0.00 55.73 53.17 1ggk s ARG 37 Cb 0.20 -0.76 -0.09 0.00 0.06 0.00 0.00 34.95 34.36 1ggk s ARG 37 CO 0.48 -0.01 1.01 -1.25 -2.50 0.00 0.00 175.30 173.02 1ggk s PRO 38 N 0.61 3.93 0.47 5.12 0.04 -1.26 -5.02 135.00 138.90 1ggk s PRO 38 Ca -0.08 1.26 -0.24 0.00 0.04 0.00 0.00 61.00 61.98 1ggk s PRO 38 Cb -0.11 -2.12 -0.08 0.00 0.04 0.00 0.00 34.50 32.23 1ggk s PRO 38 CO 0.00 -0.31 1.31 0.00 0.04 0.00 0.00 177.00 178.05 1ggk n ALA 39 N -0.91 1.48 -1.86 8.56 0.00 -1.26 -4.90 120.51 121.61 1ggk n ALA 39 Ca 0.08 0.21 -0.40 0.00 0.00 0.00 0.00 53.44 53.33 1ggk n ALA 39 Cb 0.53 -2.31 -0.01 0.00 0.00 0.00 0.00 19.45 17.66 1ggk n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ggk n ALA 40 N -0.52 6.81 -3.26 0.00 0.00 -1.26 -4.86 120.51 117.41 1ggk n ALA 40 Ca 0.08 -3.97 -0.13 0.00 0.00 0.00 0.00 53.44 49.41 1ggk n ALA 40 Cb 0.42 -2.96 -0.05 0.00 0.00 0.00 0.00 19.45 16.86 1ggk n ALA 40 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1ggk s GLU 41 N -0.10 1.03 0.18 0.00 -1.05 -1.23 -4.81 118.70 112.72 1ggk s GLU 41 Ca 0.56 -0.31 -0.33 0.00 -0.15 0.00 0.00 54.97 54.75 1ggk s GLU 41 Cb 0.17 0.47 -0.15 0.00 -0.44 0.00 0.00 34.13 34.18 1ggk s GLU 41 CO -0.08 -0.38 1.27 -2.30 0.95 0.00 0.00 175.26 174.72 1ggk n PRO 42 N 0.32 1.44 -3.77 -4.83 -0.02 -1.26 -4.99 135.00 121.89 1ggk n PRO 42 Ca -0.18 0.51 -0.13 0.00 -2.02 0.00 0.00 63.50 61.68 1ggk n PRO 42 Cb 0.61 -2.08 -0.11 0.00 -0.02 0.00 0.00 33.50 31.90 1ggk n PRO 42 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ggk s THR 43 N -0.03 0.01 0.77 3.45 -4.23 -1.12 -4.96 115.64 109.53 1ggk s THR 43 Ca 0.73 -0.06 -0.14 0.00 -1.18 0.00 0.00 61.69 61.04 1ggk s THR 43 Cb -0.80 -0.45 0.06 0.00 1.34 0.00 0.00 72.50 72.65 1ggk s THR 43 CO 0.50 -0.03 1.22 -2.16 -0.54 0.00 0.00 174.62 173.61 1ggk s PRO 44 N -0.01 1.85 0.12 3.99 0.04 -1.26 -3.74 135.00 136.00 1ggk s PRO 44 Ca -0.02 1.81 -0.33 0.00 0.04 0.00 0.00 61.00 62.50 1ggk s PRO 44 Cb -0.03 -1.79 -0.13 0.00 0.04 0.00 0.00 34.50 32.59 1ggk s PRO 44 CO 0.01 -2.07 1.68 -2.30 0.04 0.00 0.00 177.00 174.36 1ggk n PRO 45 N -2.99 2.32 0.00 0.56 -0.02 -1.26 -1.38 135.00 132.23 1ggk n PRO 45 Ca 0.14 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 1ggk n PRO 45 Cb 0.50 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1ggk n PRO 45 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ggk n GLY 46 N 3.75 2.45 0.06 -1.23 0.00 -1.26 -4.92 105.19 104.03 1ggk n GLY 46 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 1ggk n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ggk h ALA 47 N 0.00 -0.03 -2.12 4.61 0.00 -1.56 -3.45 119.26 116.70 1ggk h ALA 47 Ca 0.00 -0.10 -0.44 0.00 0.00 0.00 0.00 54.91 54.37 1ggk h ALA 47 Cb 0.00 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 17.66 1ggk h ALA 47 CO 0.00 -0.42 -0.66 -0.65 0.00 0.00 0.00 179.25 177.51 1ggk s GLN 48 N -5.45 1.46 0.34 0.00 -0.21 -1.26 -5.09 119.66 109.45 1ggk s GLN 48 Ca -0.14 -1.74 -0.29 0.00 0.02 0.00 0.00 55.36 53.21 1ggk s GLN 48 Cb 0.04 -0.92 -0.10 0.00 1.00 0.00 0.00 33.01 33.03 1ggk s GLN 48 CO 0.66 -0.03 1.33 -2.14 -2.12 0.00 0.00 175.29 172.99 1ggk s PRO 49 N -3.79 4.32 0.71 2.91 0.02 -1.26 -5.01 135.00 132.90 1ggk s PRO 49 Ca 0.29 2.26 -0.11 0.00 0.02 0.00 0.00 61.00 63.47 1ggk s PRO 49 Cb 0.05 -3.06 0.01 0.00 0.02 0.00 0.00 34.50 31.52 1ggk s PRO 49 CO 0.11 -0.23 1.06 0.95 -0.33 0.00 0.00 177.00 178.56 1ggk s THR 50 N -1.13 3.94 0.22 0.99 -4.23 -1.26 -4.61 115.64 109.56 1ggk s THR 50 Ca 0.49 0.63 -0.13 0.00 -1.18 0.00 0.00 61.69 61.50 1ggk s THR 50 Cb -0.41 -3.36 0.00 0.00 1.34 0.00 0.00 72.50 70.07 1ggk s THR 50 CO 0.54 -0.82 0.46 0.00 -0.54 0.00 0.00 174.62 174.26 1ggk s ALA 51 N -3.05 -0.36 0.30 3.99 0.00 -1.26 -5.01 121.76 116.37 1ggk s ALA 51 Ca 0.58 -0.74 -0.28 0.00 0.00 0.00 0.00 51.96 51.52 1ggk s ALA 51 Cb -0.14 0.99 -0.14 0.00 0.00 0.00 0.00 23.12 23.83 1ggk s ALA 51 CO 0.55 -0.81 1.08 -2.30 0.00 0.00 0.00 175.76 174.27 1ggk n PRO 52 N -0.35 1.51 -0.34 0.00 -0.02 -1.26 -4.75 135.00 129.80 1ggk n PRO 52 Ca -0.04 0.53 0.15 0.00 -2.02 0.00 0.00 63.50 62.12 1ggk n PRO 52 Cb 0.62 -1.95 0.34 0.00 -0.02 0.00 0.00 33.50 32.49 1ggk n PRO 52 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1ggk h GLY 53 N 2.18 1.77 1.91 -1.23 0.00 -1.31 -2.30 103.07 104.09 1ggk h GLY 53 Ca -0.41 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 46.63 1ggk h GLY 53 CO 0.62 -0.19 0.00 -1.14 0.00 0.00 0.00 176.54 175.82 1ggk n SER 54 N -4.89 0.00 -0.08 0.19 3.41 -1.26 -1.57 113.62 109.42 1ggk n SER 54 Ca 0.24 0.37 -0.08 0.00 -0.26 0.00 0.00 58.87 59.15 1ggk n SER 54 Cb 0.66 -0.45 -0.16 0.00 -0.26 0.00 0.00 64.21 64.00 1ggk n SER 54 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ggk n LEU 55 N -1.45 0.09 0.07 1.04 4.77 -0.90 -3.55 117.00 117.07 1ggk n LEU 55 Ca 0.07 0.04 -0.22 0.00 -0.03 0.00 0.00 56.01 55.87 1ggk n LEU 55 Cb 0.27 0.42 -0.15 0.00 -2.33 0.00 0.00 43.42 41.64 1ggk n LEU 55 CO 0.22 0.44 -0.23 0.50 -1.33 0.00 0.00 177.39 176.99 1ggk h LYS 56 N 0.00 0.37 -2.12 3.23 1.63 -1.31 -3.41 116.57 114.96 1ggk h LYS 56 Ca -0.48 -0.63 -0.57 0.00 -0.85 0.00 0.00 60.65 58.12 1ggk h LYS 56 Cb 2.11 0.23 -0.40 0.00 -0.60 0.00 0.00 32.23 33.58 1ggk h LYS 56 CO 0.03 1.30 -0.96 0.00 -3.45 0.00 0.00 179.45 176.37 1ggk n ALA 57 N -2.79 2.87 0.30 5.00 0.00 -0.61 -3.52 120.51 121.77 1ggk n ALA 57 Ca -0.19 -3.71 0.18 0.00 0.00 0.00 0.00 53.44 49.72 1ggk n ALA 57 Cb 0.96 -0.83 0.94 0.00 0.00 0.00 0.00 19.45 20.51 1ggk n ALA 57 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ggk h PRO 58 N 4.26 0.00 -0.15 0.00 0.13 -1.73 -1.13 132.00 133.37 1ggk h PRO 58 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1ggk h PRO 58 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1ggk h PRO 58 CO 0.54 0.04 0.00 -0.25 -0.23 0.00 0.00 178.00 178.10 1ggk n ASP 59 N -3.39 2.29 -4.54 1.44 8.00 -1.26 -4.79 116.55 114.31 1ggk n ASP 59 Ca -0.02 -1.78 -0.43 0.00 0.71 0.00 0.00 54.79 53.27 1ggk n ASP 59 Cb 0.16 -0.09 -0.07 0.00 -0.02 0.00 0.00 41.12 41.10 1ggk n ASP 59 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ggk s THR 60 N -1.81 4.82 0.28 -3.53 2.01 -0.43 -5.03 115.64 111.94 1ggk s THR 60 Ca 0.34 0.31 0.09 0.00 0.31 0.00 0.00 61.69 62.75 1ggk s THR 60 Cb 0.20 -4.18 -0.05 0.00 0.01 0.00 0.00 72.50 68.48 1ggk s THR 60 CO 0.30 -0.52 -0.12 -0.13 -0.69 0.00 0.00 174.62 173.46 1ggk s ARG 61 N 2.85 1.59 0.24 4.92 3.00 -1.26 -5.04 118.95 125.25 1ggk s ARG 61 Ca 0.24 -1.77 -0.22 0.00 0.00 0.00 0.00 55.73 53.99 1ggk s ARG 61 Cb -0.14 -1.42 0.04 0.00 0.00 0.00 0.00 34.95 33.43 1ggk s ARG 61 CO 0.18 0.17 0.83 0.54 0.00 0.00 0.00 175.30 177.02 1ggk s ASN 62 N -3.46 -0.18 0.28 0.23 2.20 -1.26 -5.00 114.94 107.75 1ggk s ASN 62 Ca 0.29 -0.61 -0.03 0.00 -0.94 0.00 0.00 52.86 51.56 1ggk s ASN 62 Cb 0.00 0.65 0.39 0.00 -2.00 0.00 0.00 41.25 40.29 1ggk s ASN 62 CO 0.12 -1.22 1.94 -0.08 -2.94 0.00 0.00 177.10 174.93 1ggk h GLU 63 N 2.00 1.13 0.27 3.55 4.81 -1.97 -1.52 114.58 122.85 1ggk h GLU 63 Ca -0.23 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 58.91 1ggk h GLU 63 Cb 1.24 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 30.37 1ggk h GLU 63 CO 0.27 0.77 -0.13 -0.22 -0.73 0.00 0.00 179.01 178.97 1ggk h LYS 64 N 1.16 -0.34 -0.54 1.92 1.63 -1.96 -2.11 116.57 116.32 1ggk h LYS 64 Ca 0.31 0.02 0.10 0.00 -0.85 0.00 0.00 60.65 60.23 1ggk h LYS 64 Cb -0.10 0.08 -0.08 0.00 -0.60 0.00 0.00 32.23 31.53 1ggk h LYS 64 CO -0.06 -0.05 0.07 -0.07 -3.45 0.00 0.00 179.45 175.89 1ggk h LEU 65 N -0.65 -0.08 -1.09 5.20 3.38 -1.92 -1.69 115.31 118.46 1ggk h LEU 65 Ca -0.04 0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.07 1ggk h LEU 65 Cb 0.46 0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.33 1ggk h LEU 65 CO 0.06 -0.02 0.62 0.78 0.09 0.00 0.00 178.44 179.97 1ggk h ASN 66 N 0.20 1.05 0.86 -0.43 2.35 -1.30 -2.12 115.58 116.19 1ggk h ASN 66 Ca 0.28 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.01 1ggk h ASN 66 Cb 0.41 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1ggk h ASN 66 CO -0.40 0.74 0.00 -1.54 -1.65 0.00 0.00 177.43 174.58 1ggk n SER 67 N -4.42 0.35 -0.02 5.81 3.41 -0.67 -2.47 113.62 115.62 1ggk n SER 67 Ca 0.12 0.56 0.13 0.00 -0.26 0.00 0.00 58.87 59.42 1ggk n SER 67 Cb 0.06 -0.65 0.52 0.00 -0.26 0.00 0.00 64.21 63.88 1ggk n SER 67 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ggk n LEU 68 N -1.86 0.22 0.22 1.04 4.77 -0.80 -4.14 117.00 116.45 1ggk n LEU 68 Ca 0.04 0.27 0.16 0.00 -0.03 0.00 0.00 56.01 56.46 1ggk n LEU 68 Cb 0.27 -0.37 0.83 0.00 -2.33 0.00 0.00 43.42 41.83 1ggk n LEU 68 CO 0.21 0.05 1.14 -0.08 -1.33 0.00 0.00 177.39 177.38 1ggk h GLU 69 N 0.09 0.00 0.00 3.23 4.57 -1.55 -0.20 114.58 120.71 1ggk h GLU 69 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1ggk h GLU 69 Cb 0.47 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1ggk h GLU 69 CO 0.00 0.00 0.00 0.38 -1.18 0.00 0.00 179.01 178.21 1ggk h ASP 70 N 0.00 0.00 -0.00 1.04 -0.00 -1.83 -3.07 116.42 112.56 1ggk h ASP 70 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.10 1ggk h ASP 70 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.71 1ggk h ASP 70 CO -0.00 0.00 -0.44 1.33 -0.00 0.00 0.00 179.24 180.13 1ggk n VAL 71 N -2.85 0.00 -2.29 4.15 0.24 -0.10 -5.01 118.33 112.48 1ggk n VAL 71 Ca 0.00 -0.28 -0.38 0.00 -2.04 0.00 0.00 64.34 61.64 1ggk n VAL 71 Cb 0.25 1.04 -0.02 0.00 -1.47 0.00 0.00 33.84 33.64 1ggk n VAL 71 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1ggk s ARG 72 N -1.88 3.99 -0.03 7.34 0.52 -1.14 -5.05 118.95 122.70 1ggk s ARG 72 Ca 0.06 1.82 0.03 0.00 -0.52 0.00 0.00 55.73 57.11 1ggk s ARG 72 Cb 0.09 -2.61 0.00 0.00 0.52 0.00 0.00 34.95 32.95 1ggk s ARG 72 CO 0.40 -0.37 -0.10 0.21 0.02 0.00 0.00 175.30 175.47 1ggk s LYS 73 N -2.40 1.13 0.00 3.54 2.20 -1.26 -5.04 119.74 117.91 1ggk s LYS 73 Ca 0.59 -0.34 0.00 0.00 -0.36 0.00 0.00 55.97 55.86 1ggk s LYS 73 Cb -0.30 -1.02 0.00 0.00 -1.51 0.00 0.00 37.83 35.00 1ggk s LYS 73 CO 0.37 0.11 0.00 0.41 -0.36 0.00 0.00 175.35 175.88 1ggk n GLY 74 N 3.38 1.34 0.00 5.54 0.00 -1.26 -5.08 105.19 109.11 1ggk n GLY 74 Ca -0.19 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1ggk n GLY 74 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ggk n SER 75 N 0.00 0.00 -4.72 1.61 3.41 -1.26 -5.10 113.62 107.57 1ggk n SER 75 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1ggk n SER 75 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1ggk n SER 75 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ggk n GLU 76 N -0.66 2.71 -1.13 4.33 1.02 -1.26 -2.67 120.64 122.97 1ggk n GLU 76 Ca 0.00 0.97 -0.05 0.00 -0.02 0.00 0.00 57.16 58.07 1ggk n GLU 76 Cb 0.00 -2.80 -0.02 0.00 -0.02 0.00 0.00 31.44 28.60 1ggk n GLU 76 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1ggk n ASN 77 N 3.61 -4.19 -4.74 1.62 3.02 -1.26 -5.03 115.26 108.29 1ggk n ASN 77 Ca 0.15 0.11 -0.28 0.00 -0.03 0.00 0.00 54.58 54.54 1ggk n ASN 77 Cb 0.35 -2.10 -0.07 0.00 -0.61 0.00 0.00 39.78 37.35 1ggk n ASN 77 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1ggk s TYR 78 N -1.96 3.05 0.41 3.10 2.02 -1.09 -5.12 117.35 117.76 1ggk s TYR 78 Ca 0.00 -0.03 -0.23 0.00 -0.37 0.00 0.00 57.07 56.44 1ggk s TYR 78 Cb 0.00 -1.50 -0.10 0.00 -0.40 0.00 0.00 41.96 39.96 1ggk s TYR 78 CO 0.00 0.51 0.99 0.00 -1.57 0.00 0.00 175.55 175.48 1ggk s ALA 79 N -1.60 3.06 -0.15 3.71 0.00 -1.26 -5.02 121.76 120.50 1ggk s ALA 79 Ca 0.29 0.54 -0.29 0.00 0.00 0.00 0.00 51.96 52.50 1ggk s ALA 79 Cb -0.11 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 1ggk s ALA 79 CO 0.21 -0.03 1.19 -1.17 0.00 0.00 0.00 175.76 175.97 1ggk s LEU 80 N -2.84 4.19 0.29 0.00 2.96 -1.26 -5.03 118.68 116.99 1ggk s LEU 80 Ca 0.59 1.65 0.02 0.00 -0.22 0.00 0.00 54.13 56.17 1ggk s LEU 80 Cb -0.16 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.94 1ggk s LEU 80 CO 0.20 -0.69 0.09 0.42 -1.32 0.00 0.00 176.35 175.06 1ggk s THR 81 N 3.11 0.70 1.12 3.68 -4.23 -1.26 -1.92 115.64 116.83 1ggk s THR 81 Ca 0.53 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.85 1ggk s THR 81 Cb -0.21 -2.65 0.26 0.00 1.34 0.00 0.00 72.50 71.24 1ggk s THR 81 CO 0.15 0.00 1.21 0.42 -0.54 0.00 0.00 174.62 175.86 1ggk s THR 82 N -3.59 1.75 -0.53 3.99 -4.23 0.27 -4.87 115.64 108.43 1ggk s THR 82 Ca 0.37 0.00 0.24 0.00 -1.18 0.00 0.00 61.69 61.12 1ggk s THR 82 Cb 0.08 -2.71 0.26 0.00 1.34 0.00 0.00 72.50 71.46 1ggk s THR 82 CO 0.15 0.00 1.73 0.59 -0.54 0.00 0.00 174.62 176.54 1ggk n ASN 83 N -4.38 0.70 -0.68 3.99 3.02 -1.26 -1.83 115.26 114.82 1ggk n ASN 83 Ca 0.15 0.65 0.13 0.00 -0.03 0.00 0.00 54.58 55.48 1ggk n ASN 83 Cb 0.59 -0.81 0.36 0.00 -0.61 0.00 0.00 39.78 39.32 1ggk n ASN 83 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ggk n GLN 84 N -2.25 1.93 -0.69 3.52 1.13 -1.26 -4.96 117.38 114.80 1ggk n GLN 84 Ca 0.03 -1.36 0.00 0.00 -1.94 0.00 0.00 57.00 53.73 1ggk n GLN 84 Cb 0.27 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.15 1ggk n GLN 84 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ggk n GLY 85 N 1.24 0.62 3.73 1.08 0.00 -0.76 -5.05 105.19 106.05 1ggk n GLY 85 Ca 0.17 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 45.11 1ggk n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ggk s VAL 86 N -2.00 5.24 0.39 1.61 1.01 -1.26 -4.79 120.40 120.59 1ggk s VAL 86 Ca 0.00 0.76 -0.27 0.00 0.00 0.00 0.00 61.98 62.47 1ggk s VAL 86 Cb 0.00 -3.73 -0.09 0.00 0.00 0.00 0.00 36.38 32.56 1ggk s VAL 86 CO 0.00 0.36 1.28 -0.13 0.00 0.00 0.00 175.10 176.61 1ggk s ARG 87 N 0.52 4.08 -0.21 2.72 0.52 -1.26 -0.56 118.95 124.75 1ggk s ARG 87 Ca 0.21 2.12 -0.07 0.00 -0.52 0.00 0.00 55.73 57.47 1ggk s ARG 87 Cb -0.14 -2.82 -0.03 0.00 0.52 0.00 0.00 34.95 32.47 1ggk s ARG 87 CO 0.07 -0.39 0.05 0.42 0.02 0.00 0.00 175.30 175.48 1ggk s ILE 88 N -1.25 4.44 -0.01 1.52 1.01 -0.81 -4.90 121.20 121.19 1ggk s ILE 88 Ca 0.55 -0.14 -0.16 0.00 0.00 0.00 0.00 60.65 60.89 1ggk s ILE 88 Cb -0.37 -3.03 -0.33 0.00 0.01 0.00 0.00 42.46 38.73 1ggk s ILE 88 CO 0.48 0.40 0.87 0.00 0.00 0.00 0.00 174.94 176.70 1ggk h ALA 89 N 7.47 -0.06 -3.42 9.38 0.00 -1.95 -3.45 119.26 127.23 1ggk h ALA 89 Ca -0.36 -0.90 -0.56 0.00 0.00 0.00 0.00 54.91 53.08 1ggk h ALA 89 Cb 1.18 0.25 -0.39 0.00 0.00 0.00 0.00 17.79 18.82 1ggk h ALA 89 CO 0.63 0.71 -0.77 0.34 0.00 0.00 0.00 179.25 180.15 1ggk s ASP 90 N -7.37 3.31 -0.26 0.00 3.68 -1.26 -4.99 116.67 109.78 1ggk s ASP 90 Ca -0.12 -0.98 0.13 0.00 2.13 0.00 0.00 52.55 53.71 1ggk s ASP 90 Cb 0.04 -0.84 0.77 0.00 -1.45 0.00 0.00 42.92 41.44 1ggk s ASP 90 CO 0.89 -0.28 1.74 -0.67 0.13 0.00 0.00 175.17 176.98 1ggk n ASP 91 N 4.89 5.26 -0.00 -0.34 4.64 -1.26 -4.28 116.55 125.46 1ggk n ASP 91 Ca -0.10 -3.05 0.05 0.00 -1.38 0.00 0.00 54.79 50.31 1ggk n ASP 91 Cb 0.46 -0.69 -0.07 0.00 -1.04 0.00 0.00 41.12 39.78 1ggk n ASP 91 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1ggk n GLN 92 N 0.24 2.50 -4.04 -0.67 1.13 -1.26 -5.05 117.38 110.23 1ggk n GLN 92 Ca 0.31 -0.03 -0.10 0.00 -1.94 0.00 0.00 57.00 55.25 1ggk n GLN 92 Cb 1.23 -1.09 -0.11 0.00 0.11 0.00 0.00 30.24 30.39 1ggk n GLN 92 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1ggk s ASN 93 N -2.40 0.52 0.49 1.08 0.01 -1.26 -5.15 114.94 108.23 1ggk s ASN 93 Ca 0.02 -0.68 -0.04 0.00 -0.71 0.00 0.00 52.86 51.45 1ggk s ASN 93 Cb 0.08 0.11 -0.02 0.00 0.41 0.00 0.00 41.25 41.83 1ggk s ASN 93 CO 0.45 -0.37 0.77 -0.44 -1.51 0.00 0.00 177.10 176.00 1ggk s SER 94 N -1.99 6.02 -0.20 -1.22 0.01 -1.26 -4.98 113.70 110.07 1ggk s SER 94 Ca -0.06 0.71 -0.25 0.00 1.31 0.00 0.00 55.95 57.65 1ggk s SER 94 Cb -0.04 -1.96 -0.01 0.00 0.21 0.00 0.00 66.02 64.22 1ggk s SER 94 CO -0.03 -0.69 0.83 -0.22 0.41 0.00 0.00 173.24 173.54 1ggk s LEU 95 N -4.73 4.13 0.25 2.44 2.96 -1.26 -5.03 118.68 117.44 1ggk s LEU 95 Ca 0.48 1.11 0.05 0.00 -0.22 0.00 0.00 54.13 55.55 1ggk s LEU 95 Cb -0.10 -3.21 -0.05 0.00 0.50 0.00 0.00 46.19 43.32 1ggk s LEU 95 CO 0.43 -0.46 -0.03 0.00 -1.32 0.00 0.00 176.35 174.97 1ggk s ARG 96 N 2.48 1.43 -1.00 1.98 1.70 -1.26 -0.68 118.95 123.60 1ggk s ARG 96 Ca 0.37 -1.72 -0.16 0.00 -0.47 0.00 0.00 55.73 53.74 1ggk s ARG 96 Cb -0.16 -0.86 0.16 0.00 -0.57 0.00 0.00 34.95 33.52 1ggk s ARG 96 CO 0.10 -0.03 1.16 0.00 -1.08 0.00 0.00 175.30 175.45 1ggk s ALA 97 N -3.23 3.69 0.00 7.88 0.00 -0.90 -4.82 121.76 124.37 1ggk s ALA 97 Ca 0.29 -3.05 0.00 0.00 0.00 0.00 0.00 51.96 49.20 1ggk s ALA 97 Cb 0.05 -3.98 0.00 0.00 0.00 0.00 0.00 23.12 19.19 1ggk s ALA 97 CO 0.10 -2.80 0.00 0.41 0.00 0.00 0.00 175.76 173.47 1ggk n GLY 98 N 4.80 2.38 0.03 0.00 0.00 -1.26 -3.76 105.19 107.39 1ggk n GLY 98 Ca 0.26 -1.69 0.07 0.00 0.00 0.00 0.00 46.02 44.66 1ggk n GLY 98 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ggk n SER 99 N 0.00 0.16 -0.28 1.61 3.41 -1.26 -1.31 113.62 115.95 1ggk n SER 99 Ca 0.00 0.55 0.09 0.00 -0.26 0.00 0.00 58.87 59.25 1ggk n SER 99 Cb 0.00 -0.58 0.17 0.00 -0.26 0.00 0.00 64.21 63.54 1ggk n SER 99 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ggk n ARG 100 N -1.69 1.53 -2.79 4.33 1.74 -1.26 -5.07 116.66 113.45 1ggk n ARG 100 Ca 0.02 -2.74 -0.22 0.00 -0.77 0.00 0.00 57.85 54.14 1ggk n ARG 100 Cb 0.14 -1.57 0.10 0.00 -1.02 0.00 0.00 32.46 30.11 1ggk n ARG 100 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1ggk s GLY 101 N -2.82 1.72 0.60 -0.13 0.00 -0.42 -5.06 107.32 101.21 1ggk s GLY 101 Ca 0.34 -2.02 -0.17 0.00 0.00 0.00 0.00 44.72 42.87 1ggk s GLY 101 CO 0.02 -1.44 1.09 2.56 0.00 0.00 0.00 173.10 175.33 1ggk s PRO 102 N -5.01 3.17 0.12 2.90 0.04 -1.26 -4.60 135.00 130.35 1ggk s PRO 102 Ca 0.66 1.38 -0.30 0.00 0.04 0.00 0.00 61.00 62.79 1ggk s PRO 102 Cb -0.04 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.43 1ggk s PRO 102 CO 0.43 -0.96 1.12 0.99 0.04 0.00 0.00 177.00 178.62 1ggk s THR 103 N -2.21 4.04 0.20 1.26 2.01 -1.26 -2.12 115.64 117.56 1ggk s THR 103 Ca 0.67 1.62 -0.14 0.00 0.31 0.00 0.00 61.69 64.15 1ggk s THR 103 Cb -0.20 -4.04 -0.07 0.00 0.01 0.00 0.00 72.50 68.20 1ggk s THR 103 CO 0.35 0.21 0.60 -0.76 -0.69 0.00 0.00 174.62 174.33 1ggk s LEU 104 N 0.26 4.27 0.46 4.42 1.43 0.14 -4.96 118.68 124.69 1ggk s LEU 104 Ca 0.53 1.12 0.24 0.00 -1.03 0.00 0.00 54.13 54.99 1ggk s LEU 104 Cb -0.28 -3.51 1.06 0.00 0.03 0.00 0.00 46.19 43.49 1ggk s LEU 104 CO 0.32 0.02 1.90 0.25 0.23 0.00 0.00 176.35 179.07 1ggk h LEU 105 N 3.16 0.00 0.00 1.79 5.85 -1.96 -3.10 115.31 121.05 1ggk h LEU 105 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1ggk h LEU 105 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1ggk h LEU 105 CO 0.66 0.22 0.00 -1.84 -0.34 0.00 0.00 178.44 177.14 1ggk n GLU 106 N -3.53 0.60 -2.36 1.25 0.28 -1.26 -4.58 120.64 111.03 1ggk n GLU 106 Ca -0.01 0.03 -0.36 0.00 -0.16 0.00 0.00 57.16 56.66 1ggk n GLU 106 Cb 0.37 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.71 1ggk n GLU 106 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1ggk s ASP 107 N -2.24 6.03 0.57 -1.84 3.68 -1.17 -4.78 116.67 116.91 1ggk s ASP 107 Ca 0.31 -1.63 0.35 0.00 2.13 0.00 0.00 52.55 53.71 1ggk s ASP 107 Cb 0.17 -2.57 1.52 0.00 -1.45 0.00 0.00 42.92 40.59 1ggk s ASP 107 CO 0.32 -1.97 2.04 2.19 0.13 0.00 0.00 175.17 177.88 1ggk h PHE 108 N 9.42 0.00 -0.04 -5.34 -0.00 -1.92 -2.89 116.94 116.17 1ggk h PHE 108 Ca 0.26 0.00 -0.06 0.00 -0.00 0.00 0.00 57.97 58.17 1ggk h PHE 108 Cb 0.95 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.91 1ggk h PHE 108 CO 1.30 0.00 -0.20 0.82 -0.00 0.00 0.00 178.31 180.23 1ggk h ILE 109 N 0.00 1.47 -0.40 0.88 2.04 -1.98 -2.16 117.51 117.36 1ggk h ILE 109 Ca 0.00 -1.66 0.01 0.00 1.00 0.00 0.00 64.86 64.21 1ggk h ILE 109 Cb 0.43 2.44 -0.02 0.00 -0.74 0.00 0.00 36.82 38.93 1ggk h ILE 109 CO 0.00 0.46 0.25 0.25 0.00 0.00 0.00 178.15 179.11 1ggk h LEU 110 N -0.36 0.42 -0.83 1.44 5.85 -1.93 -2.57 115.31 117.34 1ggk h LEU 110 Ca -0.01 -0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.59 1ggk h LEU 110 Cb 0.85 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 1ggk h LEU 110 CO 0.04 0.30 -0.33 0.03 -0.34 0.00 0.00 178.44 178.15 1ggk h ARG 111 N 0.51 0.49 0.06 1.25 3.08 -1.49 -1.01 114.38 117.28 1ggk h ARG 111 Ca 0.15 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1ggk h ARG 111 Cb -0.03 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1ggk h ARG 111 CO -0.05 0.76 -0.03 1.49 -1.07 0.00 0.00 179.97 181.07 1ggk h GLU 112 N 0.42 -0.08 -0.13 0.04 4.81 -1.39 0.11 114.58 118.36 1ggk h GLU 112 Ca 0.05 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1ggk h GLU 112 Cb 0.78 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.13 1ggk h GLU 112 CO 0.06 0.17 -0.16 -0.22 -0.73 0.00 0.00 179.01 178.13 1ggk h LYS 113 N -0.32 -0.19 -0.27 1.92 3.64 -1.21 -1.38 116.57 118.76 1ggk h LYS 113 Ca -0.01 0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 1ggk h LYS 113 Cb 0.29 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1ggk h LYS 113 CO 0.01 -0.13 -0.38 0.82 -2.27 0.00 0.00 179.45 177.50 1ggk h ILE 114 N -0.20 1.29 -0.35 2.00 1.08 -1.19 -2.99 117.51 117.15 1ggk h ILE 114 Ca 0.09 -1.54 -0.01 0.00 -0.39 0.00 0.00 64.86 63.02 1ggk h ILE 114 Cb 0.33 1.50 -0.02 0.00 -3.07 0.00 0.00 36.82 35.57 1ggk h ILE 114 CO -0.25 0.49 0.20 0.74 -0.69 0.00 0.00 178.15 178.65 1ggk h THR 115 N 0.51 1.13 -0.19 -0.27 2.02 -0.21 0.72 112.91 116.63 1ggk h THR 115 Ca 0.05 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 1ggk h THR 115 Cb 0.89 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 1ggk h THR 115 CO 0.08 0.14 0.10 -0.74 0.37 0.00 0.00 175.52 175.46 1ggk h HIS 116 N 0.45 0.27 -0.47 3.16 -0.00 -1.30 -2.78 115.15 114.48 1ggk h HIS 116 Ca 0.13 -0.01 0.09 0.00 -0.00 0.00 0.00 60.37 60.58 1ggk h HIS 116 Cb 0.04 -0.08 -0.10 0.00 -0.00 0.00 0.00 27.41 27.27 1ggk h HIS 116 CO -0.03 0.26 -0.23 0.35 -0.00 0.00 0.00 177.93 178.29 1ggk h PHE 117 N 0.19 -0.58 0.00 5.26 3.57 -1.37 -2.46 116.94 121.56 1ggk h PHE 117 Ca 0.07 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 1ggk h PHE 117 Cb 0.09 0.32 -0.00 0.00 2.79 0.00 0.00 35.95 39.15 1ggk h PHE 117 CO -0.03 -0.31 -0.02 -0.44 -2.23 0.00 0.00 178.31 175.28 1ggk h ASP 118 N -0.13 0.00 -0.23 0.41 3.45 -0.63 -2.98 116.42 116.32 1ggk h ASP 118 Ca 0.22 0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.59 1ggk h ASP 118 Cb 0.47 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 39.18 1ggk h ASP 118 CO -0.55 0.02 -0.13 1.41 -1.57 0.00 0.00 179.24 178.42 1ggk n HIS 119 N -3.32 0.72 -0.26 4.55 8.25 -0.94 -4.80 115.22 119.42 1ggk n HIS 119 Ca -0.02 -1.38 -0.07 0.00 -0.26 0.00 0.00 57.72 55.99 1ggk n HIS 119 Cb 0.12 -0.37 0.05 0.00 1.12 0.00 0.00 29.99 30.91 1ggk n HIS 119 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1ggk h GLU 120 N 1.02 1.11 -6.97 -0.41 5.08 -1.36 -3.45 114.58 109.60 1ggk h GLU 120 Ca 0.11 -0.22 -0.46 0.00 -1.00 0.00 0.00 59.36 57.79 1ggk h GLU 120 Cb 1.42 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1ggk h GLU 120 CO 0.24 0.93 0.36 1.03 -1.00 0.00 0.00 179.01 180.57 1ggk s ARG 121 N -5.48 4.36 0.18 2.33 1.81 -1.26 -5.09 118.95 115.80 1ggk s ARG 121 Ca -0.12 1.29 0.10 0.00 -1.72 0.00 0.00 55.73 55.27 1ggk s ARG 121 Cb 0.15 -2.52 -0.04 0.00 -0.45 0.00 0.00 34.95 32.09 1ggk s ARG 121 CO 0.83 0.07 -0.20 0.96 -0.68 0.00 0.00 175.30 176.28 1ggk s ILE 122 N -1.83 2.02 0.53 1.52 -4.36 -1.26 -5.12 121.20 112.71 1ggk s ILE 122 Ca 0.56 -1.97 -0.21 0.00 -0.26 0.00 0.00 60.65 58.78 1ggk s ILE 122 Cb -0.16 -1.95 -0.07 0.00 1.25 0.00 0.00 42.46 41.53 1ggk s ILE 122 CO 0.21 -0.24 0.97 -2.65 0.24 0.00 0.00 174.94 173.46 1ggk n PRO 123 N 0.27 1.09 -2.28 0.37 -0.02 -1.26 -5.01 135.00 128.16 1ggk n PRO 123 Ca -0.13 0.41 -0.26 0.00 -2.02 0.00 0.00 63.50 61.50 1ggk n PRO 123 Cb 0.57 -2.12 0.05 0.00 -0.02 0.00 0.00 33.50 31.97 1ggk n PRO 123 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1ggk s GLU 124 N -2.46 2.58 0.34 -0.52 -1.05 -1.26 -4.92 118.70 111.42 1ggk s GLU 124 Ca 0.70 -0.10 -0.28 0.00 -0.15 0.00 0.00 54.97 55.14 1ggk s GLU 124 Cb -0.46 -2.21 -0.12 0.00 -0.44 0.00 0.00 34.13 30.89 1ggk s GLU 124 CO 0.51 -0.97 1.36 0.54 0.95 0.00 0.00 175.26 177.65 1ggk n ARG 125 N -2.76 2.28 -0.04 -4.83 1.74 -1.26 -4.91 116.66 106.88 1ggk n ARG 125 Ca 0.06 0.80 -0.01 0.00 -0.77 0.00 0.00 57.85 57.94 1ggk n ARG 125 Cb 0.59 -2.43 0.27 0.00 -1.02 0.00 0.00 32.46 29.86 1ggk n ARG 125 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1ggk h ILE 126 N 2.71 1.20 -3.83 0.55 6.09 -1.99 -3.35 117.51 118.90 1ggk h ILE 126 Ca -0.47 -0.78 -0.35 0.00 -1.37 0.00 0.00 64.86 61.89 1ggk h ILE 126 Cb 1.27 0.86 -0.20 0.00 0.47 0.00 0.00 36.82 39.23 1ggk h ILE 126 CO 0.64 0.28 -0.75 0.68 -3.07 0.00 0.00 178.15 175.93 1ggk s VAL 127 N -5.04 0.95 -1.09 2.19 -7.23 -1.26 -4.83 120.40 104.09 1ggk s VAL 127 Ca -0.08 -1.44 0.00 0.00 -1.81 0.00 0.00 61.98 58.65 1ggk s VAL 127 Cb 0.15 -1.15 0.00 0.00 0.56 0.00 0.00 36.38 35.95 1ggk s VAL 127 CO 0.77 -0.42 0.00 1.41 -0.31 0.00 0.00 175.10 176.56 1ggk n HIS 128 N 0.94 -0.43 -0.31 2.82 8.25 -0.67 -4.93 115.22 120.90 1ggk n HIS 128 Ca -0.19 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.34 1ggk n HIS 128 Cb 0.56 -2.58 0.22 0.00 1.12 0.00 0.00 29.99 29.30 1ggk n HIS 128 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ggk h ALA 129 N 0.43 1.33 -2.31 -1.41 0.00 -1.73 -3.41 119.26 112.16 1ggk h ALA 129 Ca -0.27 0.06 -0.60 0.00 0.00 0.00 0.00 54.91 54.09 1ggk h ALA 129 Cb 1.10 -0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.70 1ggk h ALA 129 CO 0.34 0.03 0.42 0.50 0.00 0.00 0.00 179.25 180.55 1ggk s ARG 130 N -5.98 4.15 0.09 0.00 6.06 -1.25 -4.30 118.95 117.72 1ggk s ARG 130 Ca -0.12 0.85 -0.26 0.00 -2.50 0.00 0.00 55.73 53.71 1ggk s ARG 130 Cb 0.21 -3.65 0.07 0.00 0.06 0.00 0.00 34.95 31.64 1ggk s ARG 130 CO 0.79 -0.52 0.65 0.20 -2.50 0.00 0.00 175.30 173.92 1ggk s GLY 131 N 1.38 -0.59 -0.03 8.12 0.00 -1.26 -2.18 107.32 112.77 1ggk s GLY 131 Ca 0.33 0.76 0.03 0.00 0.00 0.00 0.00 44.72 45.84 1ggk s GLY 131 CO 0.08 0.38 -0.11 -0.56 0.00 0.00 0.00 173.10 172.89 1ggk s SER 132 N -2.33 1.39 0.14 1.64 0.01 0.35 -4.95 113.70 109.96 1ggk s SER 132 Ca -0.02 -0.22 0.03 0.00 1.31 0.00 0.00 55.95 57.06 1ggk s SER 132 Cb -0.01 -0.37 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 1ggk s SER 132 CO -0.07 0.08 -0.07 0.00 0.41 0.00 0.00 173.24 173.60 1ggk s ALA 133 N 0.15 1.31 0.15 1.44 0.00 -1.26 0.20 121.76 123.75 1ggk s ALA 133 Ca -0.03 -1.48 -0.20 0.00 0.00 0.00 0.00 51.96 50.25 1ggk s ALA 133 Cb -0.09 0.19 0.05 0.00 0.00 0.00 0.00 23.12 23.28 1ggk s ALA 133 CO 0.01 -0.19 0.53 0.00 0.00 0.00 0.00 175.76 176.11 1ggk s ALA 134 N -3.48 -1.31 0.17 0.00 0.00 -0.58 -4.55 121.76 112.00 1ggk s ALA 134 Ca 0.17 0.23 -0.06 0.00 0.00 0.00 0.00 51.96 52.30 1ggk s ALA 134 Cb 0.04 0.82 -0.06 0.00 0.00 0.00 0.00 23.12 23.92 1ggk s ALA 134 CO -0.00 -0.74 0.42 -1.01 0.00 0.00 0.00 175.76 174.43 1ggk s HIS 135 N -3.78 3.46 0.00 0.00 3.76 -0.63 -0.65 115.29 117.45 1ggk s HIS 135 Ca 0.03 0.63 0.00 0.00 -0.15 0.00 0.00 55.06 55.57 1ggk s HIS 135 Cb -0.00 -2.07 0.00 0.00 1.11 0.00 0.00 32.58 31.62 1ggk s HIS 135 CO -0.11 0.39 0.00 0.41 -0.85 0.00 0.00 174.74 174.57 1ggk n GLY 136 N -0.01 2.31 3.35 -2.22 0.00 -0.80 -1.83 105.19 105.99 1ggk n GLY 136 Ca -0.02 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.43 1ggk n GLY 136 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ggk s TYR 137 N -1.34 -0.32 0.13 1.61 -0.85 -0.50 -1.05 117.35 115.02 1ggk s TYR 137 Ca 0.00 0.33 0.11 0.00 -0.52 0.00 0.00 57.07 56.99 1ggk s TYR 137 Cb 0.00 0.26 -0.04 0.00 0.38 0.00 0.00 41.96 42.56 1ggk s TYR 137 CO 0.00 -0.59 -0.26 0.12 -1.52 0.00 0.00 175.55 173.30 1ggk s PHE 138 N -2.39 2.22 -0.16 -3.49 5.36 0.23 -1.41 117.98 118.35 1ggk s PHE 138 Ca -0.06 -0.39 -0.07 0.00 -0.96 0.00 0.00 56.93 55.46 1ggk s PHE 138 Cb -0.01 -1.20 0.06 0.00 -0.34 0.00 0.00 43.02 41.53 1ggk s PHE 138 CO -0.02 0.32 0.35 -1.14 -1.46 0.00 0.00 175.22 173.28 1ggk s GLN 139 N -2.06 0.29 0.60 10.12 0.74 -0.82 -1.25 119.66 127.29 1ggk s GLN 139 Ca 0.13 0.78 -0.18 0.00 0.05 0.00 0.00 55.36 56.14 1ggk s GLN 139 Cb -0.10 0.04 -0.03 0.00 1.10 0.00 0.00 33.01 34.01 1ggk s GLN 139 CO 0.06 -0.20 1.19 -1.25 -0.55 0.00 0.00 175.29 174.53 1ggk s PRO 140 N 1.84 2.97 0.16 1.67 0.04 -1.26 -1.78 135.00 138.64 1ggk s PRO 140 Ca -0.06 1.77 0.13 0.00 0.04 0.00 0.00 61.00 62.88 1ggk s PRO 140 Cb -0.10 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.42 1ggk s PRO 140 CO -0.11 -1.19 1.21 1.88 0.04 0.00 0.00 177.00 178.83 1ggk h TYR 141 N 0.82 0.00 -3.10 0.56 0.99 -1.40 -3.42 116.97 111.41 1ggk h TYR 141 Ca -0.50 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.21 1ggk h TYR 141 Cb 1.29 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 39.00 1ggk h TYR 141 CO 0.48 0.70 0.22 -1.59 -0.00 0.00 0.00 178.16 177.97 1ggk s LYS 142 N -2.85 2.10 0.32 4.88 -2.85 -1.26 -4.83 119.74 115.24 1ggk s LYS 142 Ca 0.01 -1.36 -0.27 0.00 -1.00 0.00 0.00 55.97 53.35 1ggk s LYS 142 Cb 0.09 0.61 -0.09 0.00 -2.06 0.00 0.00 37.83 36.37 1ggk s LYS 142 CO 0.79 -0.97 1.04 0.45 0.10 0.00 0.00 175.35 176.76 1ggk s SER 143 N -3.05 7.18 -0.17 0.03 0.15 -1.26 -4.49 113.70 112.08 1ggk s SER 143 Ca 0.16 2.10 0.16 0.00 0.70 0.00 0.00 55.95 59.07 1ggk s SER 143 Cb -0.05 -2.61 0.38 0.00 -1.71 0.00 0.00 66.02 62.04 1ggk s SER 143 CO 0.11 -0.20 1.25 0.18 1.20 0.00 0.00 173.24 175.78 1ggk n LEU 144 N 0.77 2.88 0.21 3.45 4.77 -0.77 -4.76 117.00 123.55 1ggk n LEU 144 Ca 0.01 -3.35 0.17 0.00 -0.03 0.00 0.00 56.01 52.82 1ggk n LEU 144 Cb 0.47 -0.49 0.85 0.00 -2.33 0.00 0.00 43.42 41.91 1ggk n LEU 144 CO 0.50 0.93 1.15 0.28 -1.33 0.00 0.00 177.39 178.91 1ggk h SER 145 N 0.64 0.00 -0.38 -1.43 0.02 -1.78 -1.51 113.55 109.11 1ggk h SER 145 Ca 0.02 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1ggk h SER 145 Cb 1.14 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.67 1ggk h SER 145 CO 0.08 0.00 0.24 0.44 -1.14 0.00 0.00 176.83 176.45 1ggk h ASP 146 N 0.00 0.42 0.00 3.07 3.45 -1.98 -3.33 116.42 118.05 1ggk h ASP 146 Ca 0.08 -0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.51 1ggk h ASP 146 Cb 0.50 -0.10 -0.00 0.00 -0.56 0.00 0.00 39.33 39.16 1ggk h ASP 146 CO -0.00 0.30 -2.03 2.30 -1.57 0.00 0.00 179.24 178.24 1ggk n ILE 147 N -4.84 0.09 -3.78 0.35 -5.35 -0.65 -4.82 119.36 100.37 1ggk n ILE 147 Ca 0.00 -0.52 -0.13 0.00 -0.27 0.00 0.00 62.75 61.83 1ggk n ILE 147 Cb 0.03 -0.03 -0.09 0.00 -1.74 0.00 0.00 39.64 37.81 1ggk n ILE 147 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1ggk s THR 148 N -3.45 0.07 -0.91 7.28 -1.32 -0.73 -3.65 115.64 112.93 1ggk s THR 148 Ca -0.08 -0.57 0.16 0.00 -1.21 0.00 0.00 61.69 59.99 1ggk s THR 148 Cb 0.13 -0.65 0.55 0.00 -1.51 0.00 0.00 72.50 71.02 1ggk s THR 148 CO 0.90 -0.31 1.47 2.29 -2.21 0.00 0.00 174.62 176.76 1ggk n LYS 149 N 1.16 3.26 -1.70 7.08 2.85 -0.82 -3.92 118.16 126.05 1ggk n LYS 149 Ca -0.21 -2.62 -0.42 0.00 -1.05 0.00 0.00 58.31 54.01 1ggk n LYS 149 Cb 0.57 -1.68 -0.03 0.00 -0.65 0.00 0.00 35.03 33.24 1ggk n LYS 149 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ggk s ALA 150 N -1.76 3.58 0.32 0.58 0.00 -1.23 -4.69 121.76 118.57 1ggk s ALA 150 Ca 0.41 1.29 0.06 0.00 0.00 0.00 0.00 51.96 53.72 1ggk s ALA 150 Cb 0.27 -3.84 0.72 0.00 0.00 0.00 0.00 23.12 20.27 1ggk s ALA 150 CO 0.19 -1.56 1.83 0.22 0.00 0.00 0.00 175.76 176.45 1ggk h ASP 151 N 10.52 0.77 0.75 0.00 3.58 -1.93 -2.64 116.42 127.46 1ggk h ASP 151 Ca -0.49 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.02 1ggk h ASP 151 Cb 1.23 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.19 1ggk h ASP 151 CO 0.94 0.36 0.00 2.19 -2.88 0.00 0.00 179.24 179.86 1ggk h PHE 152 N 0.80 0.00 -0.55 0.28 -5.15 -1.96 -2.61 116.94 107.76 1ggk h PHE 152 Ca 0.50 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.27 1ggk h PHE 152 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.88 1ggk h PHE 152 CO -0.00 0.00 0.00 1.28 -2.00 0.00 0.00 178.31 177.59 1ggk n LEU 153 N -2.60 4.06 0.03 2.10 4.77 -1.00 -4.66 117.00 119.71 1ggk n LEU 153 Ca 0.01 -2.32 0.11 0.00 -0.03 0.00 0.00 56.01 53.79 1ggk n LEU 153 Cb 0.24 -0.47 0.07 0.00 -2.33 0.00 0.00 43.42 40.92 1ggk n LEU 153 CO 0.22 0.81 0.11 -1.54 -1.33 0.00 0.00 177.39 175.66 1ggk n SER 154 N 0.89 0.63 -3.73 -1.43 3.41 -0.98 -1.85 113.62 110.56 1ggk n SER 154 Ca 0.22 -0.18 -0.12 0.00 -0.26 0.00 0.00 58.87 58.53 1ggk n SER 154 Cb 0.73 0.62 -0.12 0.00 -0.26 0.00 0.00 64.21 65.18 1ggk n SER 154 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ggk s ASP 155 N -3.85 -0.37 0.23 4.04 3.68 -1.26 -4.45 116.67 114.69 1ggk s ASP 155 Ca 0.05 0.68 0.18 0.00 2.13 0.00 0.00 52.55 55.59 1ggk s ASP 155 Cb 0.15 0.61 0.89 0.00 -1.45 0.00 0.00 42.92 43.11 1ggk s ASP 155 CO 0.78 -0.16 1.55 -0.81 0.13 0.00 0.00 175.17 176.66 1ggk n PRO 156 N 3.82 0.12 -0.02 4.34 -0.04 -1.26 -1.24 135.00 140.71 1ggk n PRO 156 Ca -0.21 0.53 0.12 0.00 -0.04 0.00 0.00 63.50 63.91 1ggk n PRO 156 Cb 0.55 -1.83 0.17 0.00 -0.04 0.00 0.00 33.50 32.36 1ggk n PRO 156 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ggk n ASN 157 N -2.07 2.83 -4.63 3.54 3.02 -1.26 -4.60 115.26 112.08 1ggk n ASN 157 Ca 0.00 -1.93 -0.42 0.00 -0.03 0.00 0.00 54.58 52.20 1ggk n ASN 157 Cb 0.09 -0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.20 1ggk n ASN 157 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1ggk s LYS 158 N -1.94 4.06 -0.20 3.52 2.20 -0.38 -5.02 119.74 121.98 1ggk s LYS 158 Ca 0.31 0.91 -0.14 0.00 -0.36 0.00 0.00 55.97 56.69 1ggk s LYS 158 Cb 0.20 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.76 1ggk s LYS 158 CO 0.31 -0.76 0.30 0.42 -0.36 0.00 0.00 175.35 175.26 1ggk s ILE 159 N 3.28 5.28 -0.19 5.43 -1.09 -1.26 -4.36 121.20 128.29 1ggk s ILE 159 Ca 0.40 0.52 -0.01 0.00 -2.23 0.00 0.00 60.65 59.32 1ggk s ILE 159 Cb -0.13 -3.64 -0.00 0.00 -1.58 0.00 0.00 42.46 37.11 1ggk s ILE 159 CO 0.13 0.32 -0.11 -0.89 -1.23 0.00 0.00 174.94 173.16 1ggk s THR 160 N 0.95 2.90 0.35 2.92 2.01 -0.38 -4.97 115.64 119.42 1ggk s THR 160 Ca 0.15 -0.67 -0.27 0.00 0.31 0.00 0.00 61.69 61.21 1ggk s THR 160 Cb -0.14 -2.27 -0.09 0.00 0.01 0.00 0.00 72.50 70.01 1ggk s THR 160 CO 0.05 0.48 1.21 -2.84 -0.69 0.00 0.00 174.62 172.84 1ggk s PRO 161 N 1.15 4.28 0.21 4.92 0.02 -1.26 -0.60 135.00 143.72 1ggk s PRO 161 Ca 0.01 1.98 0.08 0.00 0.02 0.00 0.00 61.00 63.09 1ggk s PRO 161 Cb -0.14 -2.93 -0.05 0.00 0.02 0.00 0.00 34.50 31.40 1ggk s PRO 161 CO -0.04 -0.17 -0.14 0.14 -0.33 0.00 0.00 177.00 176.47 1ggk s VAL 162 N -1.25 1.72 -0.09 3.83 -7.23 -0.21 -1.95 120.40 115.21 1ggk s VAL 162 Ca 0.51 -2.21 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 1ggk s VAL 162 Cb -0.35 -2.06 0.02 0.00 0.56 0.00 0.00 36.38 34.56 1ggk s VAL 162 CO 0.45 -0.59 -0.07 0.12 -0.31 0.00 0.00 175.10 174.70 1ggk s PHE 163 N -2.98 1.29 0.02 2.82 5.36 -0.98 -1.90 117.98 121.60 1ggk s PHE 163 Ca 0.23 -0.56 0.09 0.00 -0.96 0.00 0.00 56.93 55.72 1ggk s PHE 163 Cb -0.00 -1.08 -0.02 0.00 -0.34 0.00 0.00 43.02 41.57 1ggk s PHE 163 CO 0.07 -0.41 -0.26 0.08 -1.46 0.00 0.00 175.22 173.24 1ggk s VAL 164 N 1.45 2.09 -0.08 3.12 1.01 0.18 -1.73 120.40 126.44 1ggk s VAL 164 Ca -0.01 -1.27 0.02 0.00 0.00 0.00 0.00 61.98 60.73 1ggk s VAL 164 Cb -0.13 -1.77 0.01 0.00 0.00 0.00 0.00 36.38 34.49 1ggk s VAL 164 CO -0.05 0.45 -0.13 -0.60 0.00 0.00 0.00 175.10 174.78 1ggk s ARG 165 N -0.97 1.89 0.07 2.72 3.52 -0.55 -1.53 118.95 124.11 1ggk s ARG 165 Ca 0.11 -0.46 0.03 0.00 -0.13 0.00 0.00 55.73 55.27 1ggk s ARG 165 Cb -0.10 -1.58 -0.04 0.00 -1.56 0.00 0.00 34.95 31.67 1ggk s ARG 165 CO 0.01 0.00 0.07 -0.06 -0.81 0.00 0.00 175.30 174.51 1ggk s PHE 166 N 0.78 3.18 0.27 5.12 0.40 0.13 -1.96 117.98 125.90 1ggk s PHE 166 Ca -0.12 0.08 -0.21 0.00 -0.60 0.00 0.00 56.93 56.08 1ggk s PHE 166 Cb -0.16 -1.63 0.03 0.00 0.51 0.00 0.00 43.02 41.78 1ggk s PHE 166 CO 0.02 0.52 0.78 -1.54 0.70 0.00 0.00 175.22 175.70 1ggk s SER 167 N -2.33 -0.20 0.38 1.36 1.04 -0.99 -0.50 113.70 112.46 1ggk s SER 167 Ca 0.29 -0.66 0.01 0.00 0.48 0.00 0.00 55.95 56.07 1ggk s SER 167 Cb -0.12 0.70 0.04 0.00 0.10 0.00 0.00 66.02 66.75 1ggk s SER 167 CO 0.21 -1.32 0.32 0.35 0.98 0.00 0.00 173.24 173.78 1ggk n THR 168 N -0.48 0.00 0.00 2.02 -2.24 -0.93 0.54 114.28 113.20 1ggk n THR 168 Ca -0.05 -0.60 -0.03 0.00 -2.27 0.00 0.00 64.05 61.10 1ggk n THR 168 Cb 0.59 -1.05 -0.01 0.00 -2.10 0.00 0.00 70.33 67.76 1ggk n THR 168 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1ggk n VAL 169 N -1.71 0.93 -0.04 2.28 0.31 -1.24 -3.81 118.33 115.05 1ggk n VAL 169 Ca 0.06 0.20 -0.14 0.00 -0.01 0.00 0.00 64.34 64.44 1ggk n VAL 169 Cb 0.21 -1.68 -0.11 0.00 -0.91 0.00 0.00 33.84 31.34 1ggk n VAL 169 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 1ggk h GLN 170 N -0.20 0.05 -7.25 5.55 -0.00 -1.96 -1.78 115.11 109.52 1ggk h GLN 170 Ca -0.05 -0.05 -0.52 0.00 -0.00 0.00 0.00 58.65 58.03 1ggk h GLN 170 Cb 0.54 0.01 0.15 0.00 0.00 0.00 0.00 27.48 28.19 1ggk h GLN 170 CO -0.03 0.76 0.31 0.20 0.00 0.00 0.00 178.83 180.07 1ggk s GLY 171 N -3.68 1.89 1.14 2.39 0.00 -1.26 -4.77 107.32 103.02 1ggk s GLY 171 Ca -0.17 0.55 -0.18 0.00 0.00 0.00 0.00 44.72 44.92 1ggk s GLY 171 CO 0.70 0.93 1.15 -0.32 0.00 0.00 0.00 173.10 175.56 1ggk s GLY 172 N -2.75 1.62 0.57 0.20 0.00 -1.26 -4.02 107.32 101.67 1ggk s GLY 172 Ca 0.67 -0.97 0.34 0.00 0.00 0.00 0.00 44.72 44.76 1ggk s GLY 172 CO 0.52 -0.12 2.13 0.00 0.00 0.00 0.00 173.10 175.63 1ggk h ALA 173 N -2.36 1.11 -0.64 3.20 0.00 -1.95 -2.14 119.26 116.49 1ggk h ALA 173 Ca -0.45 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1ggk h ALA 173 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ggk h ALA 173 CO 0.36 0.07 0.00 0.41 0.00 0.00 0.00 179.25 180.09 1ggk n GLY 174 N -0.56 2.68 3.79 0.00 0.00 -1.26 -4.67 105.19 105.18 1ggk n GLY 174 Ca -0.01 -0.77 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 1ggk n GLY 174 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ggk s SER 175 N -1.00 2.55 0.36 1.61 1.04 -0.80 -5.05 113.70 112.40 1ggk s SER 175 Ca 0.46 0.55 -0.06 0.00 0.48 0.00 0.00 55.95 57.38 1ggk s SER 175 Cb 0.26 -0.78 -0.05 0.00 0.10 0.00 0.00 66.02 65.55 1ggk s SER 175 CO 0.27 -3.11 0.65 0.00 0.98 0.00 0.00 173.24 172.04 1ggk s ALA 176 N -3.47 3.52 0.01 5.32 0.00 -1.26 -4.93 121.76 120.94 1ggk s ALA 176 Ca 0.70 -0.47 -0.21 0.00 0.00 0.00 0.00 51.96 51.98 1ggk s ALA 176 Cb -0.08 -2.45 -0.20 0.00 0.00 0.00 0.00 23.12 20.40 1ggk s ALA 176 CO 0.54 0.06 1.18 -0.44 0.00 0.00 0.00 175.76 177.10 1ggk h ASP 177 N 1.27 0.41 -0.80 0.00 3.45 -0.73 -3.38 116.42 116.64 1ggk h ASP 177 Ca -0.48 -0.66 -0.53 0.00 0.43 0.00 0.00 57.03 55.80 1ggk h ASP 177 Cb 1.19 -0.12 -0.22 0.00 -0.56 0.00 0.00 39.33 39.62 1ggk h ASP 177 CO 0.64 1.00 0.68 0.35 -1.57 0.00 0.00 179.24 180.34 1ggk n THR 178 N -4.41 3.27 -1.39 0.35 -2.24 -1.26 -4.89 114.28 103.70 1ggk n THR 178 Ca -0.08 -2.42 -0.30 0.00 -2.27 0.00 0.00 64.05 58.97 1ggk n THR 178 Cb 0.51 -1.25 0.22 0.00 -2.10 0.00 0.00 70.33 67.71 1ggk n THR 178 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1ggk s VAL 179 N -3.71 1.75 -0.29 2.28 -7.23 -1.26 -4.42 120.40 107.51 1ggk s VAL 179 Ca 0.50 0.00 -0.16 0.00 -1.81 0.00 0.00 61.98 60.51 1ggk s VAL 179 Cb 0.39 -2.68 -0.03 0.00 0.56 0.00 0.00 36.38 34.63 1ggk s VAL 179 CO -0.02 0.00 0.43 -0.60 -0.31 0.00 0.00 175.10 174.60 1ggk s ARG 180 N -5.58 3.91 -0.19 4.82 3.52 -1.26 -4.51 118.95 119.65 1ggk s ARG 180 Ca 0.72 0.02 -0.36 0.00 -0.13 0.00 0.00 55.73 55.98 1ggk s ARG 180 Cb -0.08 -3.70 0.15 0.00 -1.56 0.00 0.00 34.95 29.77 1ggk s ARG 180 CO 0.55 -0.39 1.40 0.34 -0.81 0.00 0.00 175.30 176.39 1ggk s ASP 181 N 1.65 -0.01 0.68 -2.12 3.68 -0.46 -4.69 116.67 115.40 1ggk s ASP 181 Ca 0.17 -0.01 -0.13 0.00 2.13 0.00 0.00 52.55 54.71 1ggk s ASP 181 Cb -0.16 0.02 0.01 0.00 -1.45 0.00 0.00 42.92 41.34 1ggk s ASP 181 CO 0.11 -0.04 1.09 -0.63 0.13 0.00 0.00 175.17 175.83 1ggk s ILE 182 N -2.06 3.50 0.01 4.11 -1.09 -1.26 -4.60 121.20 119.81 1ggk s ILE 182 Ca 0.13 0.60 0.06 0.00 -2.23 0.00 0.00 60.65 59.22 1ggk s ILE 182 Cb 0.03 -3.15 -0.03 0.00 -1.58 0.00 0.00 42.46 37.73 1ggk s ILE 182 CO -0.04 -0.52 -0.18 -0.13 -1.23 0.00 0.00 174.94 172.83 1ggk s ARG 183 N -4.46 2.18 0.20 2.79 1.81 -1.26 -3.72 118.95 116.49 1ggk s ARG 183 Ca 0.63 -0.91 -0.02 0.00 -1.72 0.00 0.00 55.73 53.71 1ggk s ARG 183 Cb -0.18 -2.21 -0.05 0.00 -0.45 0.00 0.00 34.95 32.07 1ggk s ARG 183 CO 0.47 0.56 0.41 0.20 -0.68 0.00 0.00 175.30 176.26 1ggk s GLY 184 N -1.14 1.92 -0.34 -3.53 0.00 0.19 -1.29 107.32 103.13 1ggk s GLY 184 Ca 0.13 -0.72 0.01 0.00 0.00 0.00 0.00 44.72 44.14 1ggk s GLY 184 CO 0.03 -0.66 0.28 -0.12 0.00 0.00 0.00 173.10 172.63 1ggk s PHE 185 N -1.84 0.06 -0.17 1.90 2.19 -0.38 -2.35 117.98 117.39 1ggk s PHE 185 Ca 0.40 -0.96 -0.04 0.00 0.33 0.00 0.00 56.93 56.66 1ggk s PHE 185 Cb -0.11 -0.63 -0.03 0.00 -1.31 0.00 0.00 43.02 40.94 1ggk s PHE 185 CO 0.28 -0.90 -0.02 0.00 1.83 0.00 0.00 175.22 176.41 1ggk s ALA 186 N 1.57 3.04 -0.11 11.12 0.00 -0.83 -0.14 121.76 136.41 1ggk s ALA 186 Ca 0.15 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.26 1ggk s ALA 186 Cb -0.17 -1.64 0.02 0.00 0.00 0.00 0.00 23.12 21.33 1ggk s ALA 186 CO -0.12 0.12 -0.10 0.99 0.00 0.00 0.00 175.76 176.66 1ggk s THR 187 N 0.52 1.15 -0.40 0.00 2.01 -0.25 -1.48 115.64 117.19 1ggk s THR 187 Ca -0.02 -0.39 -0.16 0.00 0.31 0.00 0.00 61.69 61.42 1ggk s THR 187 Cb -0.14 -1.12 0.01 0.00 0.01 0.00 0.00 72.50 71.26 1ggk s THR 187 CO 0.02 0.38 0.40 -0.75 -0.69 0.00 0.00 174.62 173.99 1ggk s LYS 188 N 1.45 3.23 -0.30 4.92 2.20 -0.71 0.18 119.74 130.71 1ggk s LYS 188 Ca 0.01 -0.68 -0.14 0.00 -0.36 0.00 0.00 55.97 54.80 1ggk s LYS 188 Cb -0.13 -3.92 -0.03 0.00 -1.51 0.00 0.00 37.83 32.24 1ggk s LYS 188 CO -0.06 -0.74 0.32 -0.06 -0.36 0.00 0.00 175.35 174.44 1ggk s PHE 189 N 2.05 3.23 -1.16 4.03 0.40 0.13 -2.33 117.98 124.33 1ggk s PHE 189 Ca 0.11 0.18 -0.16 0.00 -0.60 0.00 0.00 56.93 56.46 1ggk s PHE 189 Cb -0.17 -2.55 0.14 0.00 0.51 0.00 0.00 43.02 40.95 1ggk s PHE 189 CO 0.13 -0.28 1.42 0.71 0.70 0.00 0.00 175.22 177.89 1ggk s TYR 190 N 1.96 3.28 0.60 0.36 2.02 -0.82 -1.66 117.35 123.10 1ggk s TYR 190 Ca 0.12 -1.86 -0.03 0.00 -0.37 0.00 0.00 57.07 54.92 1ggk s TYR 190 Cb -0.16 -4.39 0.03 0.00 -0.40 0.00 0.00 41.96 37.05 1ggk s TYR 190 CO 0.11 -1.50 0.87 0.95 -1.57 0.00 0.00 175.55 174.42 1ggk s THR 191 N 2.32 2.86 -0.36 -0.71 -4.23 -1.08 -4.29 115.64 110.16 1ggk s THR 191 Ca 0.42 -0.38 0.27 0.00 -1.18 0.00 0.00 61.69 60.83 1ggk s THR 191 Cb -0.02 -3.14 0.31 0.00 1.34 0.00 0.00 72.50 70.99 1ggk s THR 191 CO -0.01 -0.13 1.79 -0.33 -0.54 0.00 0.00 174.62 175.40 1ggk h GLU 192 N -0.18 0.00 -0.14 3.99 5.08 -1.96 -3.05 114.58 118.32 1ggk h GLU 192 Ca -0.44 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 57.86 1ggk h GLU 192 Cb 1.29 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.51 1ggk h GLU 192 CO 0.57 0.00 -0.20 0.39 -1.00 0.00 0.00 179.01 178.77 1ggk n GLU 193 N -2.64 1.76 0.00 2.33 1.02 -1.26 -4.83 120.64 117.02 1ggk n GLU 193 Ca 0.03 -3.06 0.00 0.00 -0.02 0.00 0.00 57.16 54.11 1ggk n GLU 193 Cb 0.35 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1ggk n GLU 193 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ggk n GLY 194 N -1.12 3.10 3.75 0.62 0.00 -1.15 -4.77 105.19 105.61 1ggk n GLY 194 Ca 0.23 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 1ggk n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ggk s ILE 195 N -2.55 3.16 -0.15 -0.61 -1.09 -1.26 -2.62 121.20 116.08 1ggk s ILE 195 Ca 0.00 1.02 0.00 0.00 -2.23 0.00 0.00 60.65 59.44 1ggk s ILE 195 Cb 0.00 -3.65 0.02 0.00 -1.58 0.00 0.00 42.46 37.25 1ggk s ILE 195 CO 0.00 0.18 -0.15 0.12 -1.23 0.00 0.00 174.94 173.87 1ggk s PHE 196 N -0.29 2.21 -0.24 3.97 5.36 -0.66 -4.22 117.98 124.10 1ggk s PHE 196 Ca 0.53 -1.25 -0.08 0.00 -0.96 0.00 0.00 56.93 55.18 1ggk s PHE 196 Cb -0.36 -1.62 -0.03 0.00 -0.34 0.00 0.00 43.02 40.67 1ggk s PHE 196 CO 0.41 -0.68 0.08 -0.51 -1.46 0.00 0.00 175.22 173.06 1ggk s ASP 197 N 1.47 5.27 -0.44 6.13 -0.00 -0.54 0.18 116.67 128.75 1ggk s ASP 197 Ca 0.05 -0.15 -0.09 0.00 -0.00 0.00 0.00 52.55 52.36 1ggk s ASP 197 Cb -0.13 -1.94 0.10 0.00 -0.00 0.00 0.00 42.92 40.95 1ggk s ASP 197 CO -0.11 -0.01 0.29 -0.22 -0.00 0.00 0.00 175.17 175.12 1ggk s LEU 198 N 1.46 5.38 -0.80 1.23 2.96 0.13 -4.51 118.68 124.54 1ggk s LEU 198 Ca 0.06 -1.71 -0.16 0.00 -0.22 0.00 0.00 54.13 52.10 1ggk s LEU 198 Cb -0.15 -1.98 0.18 0.00 0.50 0.00 0.00 46.19 44.74 1ggk s LEU 198 CO 0.04 -0.60 0.81 -0.69 -1.32 0.00 0.00 176.35 174.58 1ggk s VAL 199 N 1.38 5.32 0.00 1.68 1.01 -1.26 -1.09 120.40 127.43 1ggk s VAL 199 Ca 0.04 -2.05 0.00 0.00 0.00 0.00 0.00 61.98 59.97 1ggk s VAL 199 Cb -0.24 -4.52 0.00 0.00 0.00 0.00 0.00 36.38 31.62 1ggk s VAL 199 CO 0.00 -1.12 0.00 0.61 0.00 0.00 0.00 175.10 174.60 1ggk n GLY 200 N 4.53 4.61 3.34 4.51 0.00 0.80 -4.92 105.19 118.06 1ggk n GLY 200 Ca 0.11 -2.12 -0.21 0.00 0.00 0.00 0.00 46.02 43.80 1ggk n GLY 200 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ggk s HIS 201 N 0.29 1.73 -2.16 1.61 3.76 -0.14 -1.25 115.29 119.14 1ggk s HIS 201 Ca 0.00 -1.55 0.20 0.00 -0.15 0.00 0.00 55.06 53.55 1ggk s HIS 201 Cb 0.00 -0.83 0.53 0.00 1.11 0.00 0.00 32.58 33.39 1ggk s HIS 201 CO 0.00 -0.71 1.44 0.27 -0.85 0.00 0.00 174.74 174.89 1ggk n ASN 202 N -1.43 3.03 -4.20 1.40 6.94 -0.41 -0.50 115.26 120.09 1ggk n ASN 202 Ca 0.04 -1.96 -0.17 0.00 -0.02 0.00 0.00 54.58 52.46 1ggk n ASN 202 Cb 0.63 -0.32 -0.11 0.00 -2.36 0.00 0.00 39.78 37.62 1ggk n ASN 202 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1ggk s THR 203 N -1.36 1.16 -1.89 5.53 -4.23 -1.26 -4.62 115.64 108.96 1ggk s THR 203 Ca 0.38 -1.56 0.30 0.00 -1.18 0.00 0.00 61.69 59.63 1ggk s THR 203 Cb 0.21 -1.33 0.79 0.00 1.34 0.00 0.00 72.50 73.51 1ggk s THR 203 CO 0.28 -0.39 2.11 -0.81 -0.54 0.00 0.00 174.62 175.27 1ggk n PRO 204 N 0.79 0.84 -4.09 3.99 -0.04 -1.26 -4.59 135.00 130.64 1ggk n PRO 204 Ca -0.18 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.21 1ggk n PRO 204 Cb 0.56 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.43 1ggk n PRO 204 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1ggk s ILE 205 N -2.11 0.17 0.42 0.52 -0.00 -1.26 -4.54 121.20 114.39 1ggk s ILE 205 Ca 0.42 -1.78 0.07 0.00 -0.00 0.00 0.00 60.65 59.36 1ggk s ILE 205 Cb 0.20 -1.70 -0.05 0.00 -0.00 0.00 0.00 42.46 40.92 1ggk s ILE 205 CO 0.37 -0.76 0.21 0.12 -0.00 0.00 0.00 174.94 174.87 1ggk s PHE 206 N -3.96 2.59 0.16 1.37 2.19 -0.66 -4.87 117.98 114.81 1ggk s PHE 206 Ca 0.13 -0.59 -0.04 0.00 0.33 0.00 0.00 56.93 56.76 1ggk s PHE 206 Cb 0.07 -1.98 0.01 0.00 -1.31 0.00 0.00 43.02 39.81 1ggk s PHE 206 CO -0.06 0.14 1.41 0.74 1.83 0.00 0.00 175.22 179.27 1ggk h PHE 207 N 1.36 0.66 -2.46 10.12 -1.00 -1.89 -3.41 116.94 120.33 1ggk h PHE 207 Ca -0.42 -0.29 -0.54 0.00 2.81 0.00 0.00 57.97 59.53 1ggk h PHE 207 Cb 1.26 -0.10 -0.14 0.00 3.61 0.00 0.00 35.95 40.57 1ggk h PHE 207 CO 0.63 1.07 -0.71 0.96 -1.61 0.00 0.00 178.31 178.65 1ggk s ILE 208 N -3.65 2.00 -0.14 -0.55 -4.36 -1.26 -2.92 121.20 110.32 1ggk s ILE 208 Ca -0.07 -2.24 -0.05 0.00 -0.26 0.00 0.00 60.65 58.03 1ggk s ILE 208 Cb 0.10 -2.34 -0.25 0.00 1.25 0.00 0.00 42.46 41.22 1ggk s ILE 208 CO 0.85 -0.39 0.28 0.00 0.24 0.00 0.00 174.94 175.93 1ggk n GLN 209 N -0.58 0.75 -5.04 0.37 6.02 -1.26 -4.69 117.38 112.95 1ggk n GLN 209 Ca -0.06 0.25 -0.32 0.00 -0.01 0.00 0.00 57.00 56.86 1ggk n GLN 209 Cb 0.62 -1.68 -0.14 0.00 1.02 0.00 0.00 30.24 30.05 1ggk n GLN 209 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1ggk s ASP 210 N -6.97 3.62 0.48 1.08 -1.08 -1.26 -2.58 116.67 109.96 1ggk s ASP 210 Ca -0.24 -0.32 0.16 0.00 -0.52 0.00 0.00 52.55 51.62 1ggk s ASP 210 Cb 0.07 -0.63 1.16 0.00 -1.46 0.00 0.00 42.92 42.06 1ggk s ASP 210 CO 0.75 0.33 2.06 0.00 0.52 0.00 0.00 175.17 178.83 1ggk h ALA 211 N 5.34 2.05 -0.94 3.66 0.00 -1.76 -2.12 119.26 125.49 1ggk h ALA 211 Ca -0.45 -0.01 0.24 0.00 0.00 0.00 0.00 54.91 54.69 1ggk h ALA 211 Cb 1.14 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 1ggk h ALA 211 CO 0.49 -0.12 0.64 1.25 0.00 0.00 0.00 179.25 181.51 1ggk h HIS 212 N 0.21 0.35 -0.01 0.00 6.17 -1.95 0.13 115.15 120.05 1ggk h HIS 212 Ca 0.15 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.24 1ggk h HIS 212 Cb 0.32 -0.11 0.00 0.00 2.52 0.00 0.00 27.41 30.15 1ggk h HIS 212 CO -0.00 0.07 -0.05 1.63 0.71 0.00 0.00 177.93 180.29 1ggk n LYS 213 N -4.43 1.19 -0.12 5.26 4.76 -0.80 -4.50 118.16 119.52 1ggk n LYS 213 Ca 0.20 -0.52 -0.04 0.00 -2.87 0.00 0.00 58.31 55.08 1ggk n LYS 213 Cb 0.85 -1.49 0.03 0.00 -1.84 0.00 0.00 35.03 32.58 1ggk n LYS 213 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 1ggk h PHE 214 N 1.26 -0.03 -0.05 2.13 3.04 -0.88 -0.80 116.94 121.60 1ggk h PHE 214 Ca 0.00 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.95 1ggk h PHE 214 Cb 0.35 0.07 -0.01 0.00 2.56 0.00 0.00 35.95 38.93 1ggk h PHE 214 CO 0.00 -0.08 -0.11 -1.35 -2.02 0.00 0.00 178.31 174.75 1ggk h PRO 215 N 0.10 0.08 -0.10 6.41 0.11 -1.80 0.10 132.00 136.90 1ggk h PRO 215 Ca 0.20 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.26 1ggk h PRO 215 Cb 0.28 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.38 1ggk h PRO 215 CO -0.33 0.19 -0.09 -0.44 -0.21 0.00 0.00 178.00 177.12 1ggk h ASP 216 N 0.08 0.25 -0.16 -2.05 3.45 -1.51 -1.27 116.42 115.21 1ggk h ASP 216 Ca 0.02 -0.47 -0.02 0.00 0.43 0.00 0.00 57.03 56.99 1ggk h ASP 216 Cb 0.24 -0.07 -0.01 0.00 -0.56 0.00 0.00 39.33 38.93 1ggk h ASP 216 CO 0.01 0.67 0.03 0.15 -1.57 0.00 0.00 179.24 178.54 1ggk h PHE 217 N -0.17 0.27 -0.31 4.55 3.04 -0.80 -2.58 116.94 120.94 1ggk h PHE 217 Ca 0.02 -0.03 0.03 0.00 3.98 0.00 0.00 57.97 61.96 1ggk h PHE 217 Cb 0.60 -0.07 -0.03 0.00 2.56 0.00 0.00 35.95 39.01 1ggk h PHE 217 CO 0.09 0.41 0.13 0.28 -2.02 0.00 0.00 178.31 177.19 1ggk h VAL 218 N 0.05 0.95 -0.66 1.41 2.07 -0.83 -2.33 116.25 116.91 1ggk h VAL 218 Ca 0.05 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.49 1ggk h VAL 218 Cb 0.28 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1ggk h VAL 218 CO 0.00 0.05 0.44 0.45 0.02 0.00 0.00 177.57 178.53 1ggk h HIS 219 N 0.29 0.80 -0.29 1.57 3.86 -1.22 -2.14 115.15 118.03 1ggk h HIS 219 Ca 0.13 0.02 -0.09 0.00 -1.16 0.00 0.00 60.37 59.27 1ggk h HIS 219 Cb 0.08 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.26 1ggk h HIS 219 CO -0.11 0.49 -0.21 0.00 0.86 0.00 0.00 177.93 178.95 1ggk h ALA 220 N 1.60 1.10 0.07 2.45 0.00 -1.00 -3.24 119.26 120.25 1ggk h ALA 220 Ca 0.25 -0.33 -0.28 0.00 0.00 0.00 0.00 54.91 54.55 1ggk h ALA 220 Cb -0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1ggk h ALA 220 CO -0.06 0.56 -1.43 -0.24 0.00 0.00 0.00 179.25 178.08 1ggk h VAL 221 N 0.48 1.24 -3.97 0.00 3.04 -1.30 -2.33 116.25 113.41 1ggk h VAL 221 Ca 0.07 -2.94 -0.47 0.00 -1.01 0.00 0.00 66.70 62.36 1ggk h VAL 221 Cb 0.63 2.73 0.16 0.00 -2.01 0.00 0.00 31.29 32.80 1ggk h VAL 221 CO 0.04 0.80 0.22 -0.54 -1.01 0.00 0.00 177.57 177.08 1ggk s LYS 222 N -2.64 0.86 0.30 4.17 -0.14 -0.83 -4.71 119.74 116.75 1ggk s LYS 222 Ca -0.06 0.73 -0.29 0.00 -1.36 0.00 0.00 55.97 54.99 1ggk s LYS 222 Cb 0.08 -1.77 -0.13 0.00 -1.68 0.00 0.00 37.83 34.33 1ggk s LYS 222 CO 0.84 -2.49 1.39 -2.30 -0.76 0.00 0.00 175.35 172.02 1ggk n PRO 223 N -4.04 2.20 -1.76 -1.68 -0.02 -1.26 -4.83 135.00 123.61 1ggk n PRO 223 Ca 0.06 0.78 -0.41 0.00 -2.02 0.00 0.00 63.50 61.91 1ggk n PRO 223 Cb 0.56 -2.42 -0.00 0.00 -0.02 0.00 0.00 33.50 31.61 1ggk n PRO 223 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1ggk n GLU 224 N 1.32 2.64 0.28 -0.52 1.02 0.03 -4.72 120.64 120.69 1ggk n GLU 224 Ca 0.08 0.93 0.17 0.00 -0.02 0.00 0.00 57.16 58.31 1ggk n GLU 224 Cb 0.35 -2.65 0.76 0.00 -0.02 0.00 0.00 31.44 29.87 1ggk n GLU 224 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1ggk h PRO 225 N 3.19 0.00 0.10 3.49 0.13 -1.89 0.39 132.00 137.42 1ggk h PRO 225 Ca -0.50 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 1ggk h PRO 225 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1ggk h PRO 225 CO 0.66 0.04 -0.05 1.12 -0.23 0.00 0.00 178.00 179.54 1ggk h HIS 226 N 0.00 -0.13 -0.12 1.56 2.07 -1.97 -3.40 115.15 113.16 1ggk h HIS 226 Ca -0.00 -0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1ggk h HIS 226 Cb 0.44 0.04 0.00 0.00 2.57 0.00 0.00 27.41 30.46 1ggk h HIS 226 CO 0.00 0.33 0.00 -2.67 -3.07 0.00 0.00 177.93 172.52 1ggk n TRP 227 N -4.84 0.15 -3.62 6.12 4.27 -1.24 -5.03 117.44 113.25 1ggk n TRP 227 Ca -0.07 -0.16 -0.27 0.00 -3.89 0.00 0.00 57.50 53.11 1ggk n TRP 227 Cb 0.26 -0.01 0.04 0.00 -1.36 0.00 0.00 31.31 30.24 1ggk n TRP 227 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1ggk n ALA 228 N 0.60 -2.43 -2.97 -1.67 0.00 0.13 -4.99 120.51 109.18 1ggk n ALA 228 Ca 0.08 -0.16 -0.11 0.00 0.00 0.00 0.00 53.44 53.25 1ggk n ALA 228 Cb 0.33 -3.95 -0.12 0.00 0.00 0.00 0.00 19.45 15.70 1ggk n ALA 228 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ggk s ILE 229 N -3.51 0.04 0.20 0.00 1.01 -1.25 -4.74 121.20 112.95 1ggk s ILE 229 Ca 0.37 -0.32 0.06 0.00 0.00 0.00 0.00 60.65 60.77 1ggk s ILE 229 Cb -0.11 -0.18 -0.04 0.00 0.01 0.00 0.00 42.46 42.14 1ggk s ILE 229 CO 0.83 -0.18 0.13 -2.16 0.00 0.00 0.00 174.94 173.57 1ggk s PRO 230 N -0.53 2.81 0.01 2.79 0.04 -1.26 -0.79 135.00 138.06 1ggk s PRO 230 Ca -0.06 -0.99 -0.30 0.00 0.04 0.00 0.00 61.00 59.69 1ggk s PRO 230 Cb -0.04 -2.55 -0.03 0.00 0.04 0.00 0.00 34.50 31.92 1ggk s PRO 230 CO 0.00 0.45 1.02 -1.14 0.04 0.00 0.00 177.00 177.37 1ggk s GLN 231 N -3.35 4.53 -1.68 4.56 2.00 -1.26 -4.10 119.66 120.35 1ggk s GLN 231 Ca 0.31 1.49 0.00 0.00 -2.00 0.00 0.00 55.36 55.16 1ggk s GLN 231 Cb -0.09 -3.44 0.00 0.00 0.80 0.00 0.00 33.01 30.28 1ggk s GLN 231 CO 0.23 -0.10 0.00 0.41 -0.50 0.00 0.00 175.29 175.33 1ggk n GLY 232 N 2.97 -0.33 2.94 2.59 0.00 -1.26 -5.00 105.19 107.10 1ggk n GLY 232 Ca 0.07 -0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1ggk n GLY 232 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ggk s GLN 233 N -4.91 0.14 0.00 1.61 -0.21 -1.26 -4.50 119.66 110.53 1ggk s GLN 233 Ca 0.00 -0.11 0.26 0.00 0.02 0.00 0.00 55.36 55.53 1ggk s GLN 233 Cb 0.00 0.06 0.63 0.00 1.00 0.00 0.00 33.01 34.69 1ggk s GLN 233 CO 0.00 -0.02 1.50 -1.13 -2.12 0.00 0.00 175.29 173.52 1ggk n SER 234 N 2.65 2.06 -3.99 5.90 3.41 -1.26 -4.75 113.62 117.64 1ggk n SER 234 Ca -0.15 -1.64 -0.42 0.00 -0.26 0.00 0.00 58.87 56.40 1ggk n SER 234 Cb 0.58 0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 1ggk n SER 234 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ggk n ALA 235 N 0.53 4.97 -3.42 7.33 0.00 -1.26 -4.62 120.51 124.04 1ggk n ALA 235 Ca 0.16 -3.96 -0.12 0.00 0.00 0.00 0.00 53.44 49.52 1ggk n ALA 235 Cb 0.45 -3.44 -0.02 0.00 0.00 0.00 0.00 19.45 16.44 1ggk n ALA 235 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1ggk s HIS 236 N 2.90 -0.52 0.24 0.00 -3.43 -1.26 -4.74 115.29 108.46 1ggk s HIS 236 Ca 0.47 0.31 -0.08 0.00 -0.80 0.00 0.00 55.06 54.95 1ggk s HIS 236 Cb 0.10 0.56 0.39 0.00 -1.43 0.00 0.00 32.58 32.20 1ggk s HIS 236 CO -0.03 -0.85 1.63 -0.44 -2.00 0.00 0.00 174.74 173.05 1ggk h ASP 237 N 2.01 -0.39 0.03 7.38 5.19 -1.89 -3.10 116.42 125.65 1ggk h ASP 237 Ca -0.34 0.19 -0.13 0.00 -0.62 0.00 0.00 57.03 56.14 1ggk h ASP 237 Cb 1.31 0.35 -0.01 0.00 0.18 0.00 0.00 39.33 41.16 1ggk h ASP 237 CO 0.38 -0.18 -0.40 0.71 -3.12 0.00 0.00 179.24 176.62 1ggk h THR 238 N 0.09 1.30 0.82 0.35 1.35 -1.94 -1.62 112.91 113.26 1ggk h THR 238 Ca 0.39 -1.56 -0.04 0.00 -0.55 0.00 0.00 66.41 64.65 1ggk h THR 238 Cb 0.66 1.59 0.01 0.00 -1.73 0.00 0.00 68.15 68.68 1ggk h THR 238 CO -0.66 0.48 -0.39 0.15 -0.25 0.00 0.00 175.52 174.85 1ggk h PHE 239 N 0.40 -1.02 0.00 4.73 3.57 -1.34 -1.84 116.94 121.44 1ggk h PHE 239 Ca 0.03 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 1ggk h PHE 239 Cb 0.88 0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.95 1ggk h PHE 239 CO 0.03 -0.63 -0.19 -1.49 -2.23 0.00 0.00 178.31 173.80 1ggk h TRP 240 N -1.10 0.00 -0.11 0.41 4.06 -1.55 -1.99 115.95 115.67 1ggk h TRP 240 Ca -0.11 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.84 1ggk h TRP 240 Cb 0.84 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.00 1ggk h TRP 240 CO -0.02 0.19 0.07 0.22 -3.56 0.00 0.00 178.44 175.34 1ggk h ASP 241 N 0.00 0.13 -0.60 -3.49 3.58 -1.23 -1.10 116.42 113.72 1ggk h ASP 241 Ca -0.00 -0.05 -0.04 0.00 0.42 0.00 0.00 57.03 57.36 1ggk h ASP 241 Cb 0.38 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.37 1ggk h ASP 241 CO 0.02 0.14 0.23 0.22 -2.88 0.00 0.00 179.24 176.98 1ggk h TYR 242 N 0.12 0.92 -0.41 0.28 5.03 -0.66 -2.71 116.97 119.54 1ggk h TYR 242 Ca 0.04 -0.07 -0.04 0.00 2.58 0.00 0.00 58.73 61.24 1ggk h TYR 242 Cb 0.03 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.02 1ggk h TYR 242 CO -0.06 0.74 0.10 0.28 -1.32 0.00 0.00 178.16 177.91 1ggk h VAL 243 N 0.83 1.23 0.00 1.81 2.07 -1.25 -1.65 116.25 119.29 1ggk h VAL 243 Ca 0.20 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 1ggk h VAL 243 Cb 0.22 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1ggk h VAL 243 CO -0.01 0.28 -0.04 0.77 0.02 0.00 0.00 177.57 178.59 1ggk h SER 244 N 0.53 0.00 0.06 0.57 4.64 -1.12 -1.49 113.55 116.74 1ggk h SER 244 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1ggk h SER 244 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1ggk h SER 244 CO 0.00 0.04 -0.84 0.18 -0.87 0.00 0.00 176.83 175.33 1ggk n LEU 245 N -3.19 1.11 -3.58 5.97 4.77 -1.03 -4.76 117.00 116.28 1ggk n LEU 245 Ca -0.01 -0.48 -0.29 0.00 -0.03 0.00 0.00 56.01 55.20 1ggk n LEU 245 Cb 0.26 -0.03 -0.13 0.00 -2.33 0.00 0.00 43.42 41.19 1ggk n LEU 245 CO 0.26 0.25 -0.29 -1.10 -1.33 0.00 0.00 177.39 175.19 1ggk s GLN 246 N -2.91 0.89 0.48 3.23 -1.52 -0.56 -5.01 119.66 114.26 1ggk s GLN 246 Ca 0.10 -1.64 0.32 0.00 -1.95 0.00 0.00 55.36 52.20 1ggk s GLN 246 Cb 0.17 -1.79 1.68 0.00 -0.22 0.00 0.00 33.01 32.84 1ggk s GLN 246 CO 0.80 -1.18 1.98 -1.00 -0.25 0.00 0.00 175.29 175.64 1ggk h PRO 247 N 6.91 0.00 -0.02 2.91 0.13 -1.86 -1.90 132.00 138.16 1ggk h PRO 247 Ca 0.02 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.16 1ggk h PRO 247 Cb 0.95 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.08 1ggk h PRO 247 CO 0.37 0.00 0.02 1.05 -0.23 0.00 0.00 178.00 179.21 1ggk h GLU 248 N 0.00 0.00 0.00 0.86 4.11 -1.89 -1.11 114.58 116.55 1ggk h GLU 248 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1ggk h GLU 248 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1ggk h GLU 248 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 179.01 180.87 1ggk h THR 249 N 0.00 0.00 -0.94 -1.06 1.35 -1.21 -3.36 112.91 107.69 1ggk h THR 249 Ca 0.01 -0.58 0.11 0.00 -0.55 0.00 0.00 66.41 65.40 1ggk h THR 249 Cb 0.06 1.55 -0.08 0.00 -1.73 0.00 0.00 68.15 67.95 1ggk h THR 249 CO -0.00 0.00 0.57 -0.07 -0.25 0.00 0.00 175.52 175.77 1ggk h LEU 250 N 0.00 0.82 0.53 3.87 3.38 -1.40 -1.70 115.31 120.81 1ggk h LEU 250 Ca 0.00 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1ggk h LEU 250 Cb 0.61 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1ggk h LEU 250 CO 0.00 0.44 -0.32 -0.74 0.09 0.00 0.00 178.44 177.91 1ggk h HIS 251 N 0.91 -0.85 -0.02 1.13 2.76 -1.80 -0.61 115.15 116.67 1ggk h HIS 251 Ca 0.46 -0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.56 1ggk h HIS 251 Cb 0.46 0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.71 1ggk h HIS 251 CO -0.03 -0.49 -0.28 -0.97 -1.30 0.00 0.00 177.93 174.86 1ggk h ASN 252 N -0.81 0.04 -0.71 3.26 -0.00 -1.74 -1.47 115.58 114.15 1ggk h ASN 252 Ca -0.06 -0.01 -0.02 0.00 -0.00 0.00 0.00 56.30 56.21 1ggk h ASN 252 Cb 0.66 -0.01 -0.03 0.00 -0.00 0.00 0.00 38.32 38.93 1ggk h ASN 252 CO 0.07 0.33 0.38 0.58 -0.00 0.00 0.00 177.43 178.79 1ggk h VAL 253 N 0.04 1.22 -0.61 2.57 2.07 -1.01 -1.03 116.25 119.50 1ggk h VAL 253 Ca 0.00 -0.56 0.05 0.00 0.82 0.00 0.00 66.70 67.01 1ggk h VAL 253 Cb 0.52 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 30.54 1ggk h VAL 253 CO 0.04 0.25 0.33 0.24 0.02 0.00 0.00 177.57 178.45 1ggk h MET 254 N 0.98 0.61 -0.53 1.57 2.86 -0.03 -2.49 114.93 117.89 1ggk h MET 254 Ca 0.25 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.83 1ggk h MET 254 Cb 0.05 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 1ggk h MET 254 CO -0.04 0.40 0.25 -1.49 1.06 0.00 0.00 176.91 177.09 1ggk h TRP 255 N 0.63 0.78 -0.13 -0.22 4.06 -1.00 -2.85 115.95 117.22 1ggk h TRP 255 Ca 0.27 -0.04 -0.06 0.00 2.06 0.00 0.00 58.89 61.12 1ggk h TRP 255 Cb 0.15 -0.24 -0.01 0.00 -1.00 0.00 0.00 29.16 28.06 1ggk h TRP 255 CO -0.08 0.61 -0.19 0.00 -3.56 0.00 0.00 178.44 175.21 1ggk h ALA 256 N 1.09 1.44 0.00 1.49 0.00 -0.82 -2.88 119.26 119.58 1ggk h ALA 256 Ca 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ggk h ALA 256 Cb 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ggk h ALA 256 CO -0.02 0.39 0.00 0.52 0.00 0.00 0.00 179.25 180.14 1ggk h MET 257 N 0.20 0.00 -7.57 0.00 2.86 -1.35 -3.35 114.93 105.71 1ggk h MET 257 Ca 0.04 0.00 -0.44 0.00 -2.06 0.00 0.00 59.70 57.24 1ggk h MET 257 Cb 0.46 0.00 0.17 0.00 0.06 0.00 0.00 31.60 32.29 1ggk h MET 257 CO 0.03 0.00 0.28 -1.54 1.06 0.00 0.00 176.91 176.74 1ggk s SER 258 N -5.55 2.35 0.17 1.22 1.04 -1.09 -4.19 113.70 107.65 1ggk s SER 258 Ca 0.08 0.60 0.17 0.00 0.48 0.00 0.00 55.95 57.28 1ggk s SER 258 Cb 0.08 -0.86 0.78 0.00 0.10 0.00 0.00 66.02 66.12 1ggk s SER 258 CO 0.64 -3.24 1.53 0.47 0.98 0.00 0.00 173.24 173.62 1ggk n ASP 259 N -4.16 0.38 0.19 7.02 10.43 -1.26 -2.09 116.55 127.06 1ggk n ASP 259 Ca 0.12 0.62 0.14 0.00 2.57 0.00 0.00 54.79 58.24 1ggk n ASP 259 Cb 0.59 -0.69 0.72 0.00 1.84 0.00 0.00 41.12 43.59 1ggk n ASP 259 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 1ggk h ARG 260 N 0.00 0.00 0.00 -1.24 2.47 -1.89 -2.77 114.38 110.95 1ggk h ARG 260 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1ggk h ARG 260 Cb 0.20 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.52 1ggk h ARG 260 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.94 1ggk n GLY 261 N -1.51 -1.12 2.27 0.04 0.00 -0.89 -4.20 105.19 99.78 1ggk n GLY 261 Ca 0.01 -0.08 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 1ggk n GLY 261 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ggk n ILE 262 N -1.44 -0.40 -1.23 -0.61 -5.35 -1.05 -1.36 119.36 107.92 1ggk n ILE 262 Ca 0.06 -4.06 -0.33 0.00 -0.27 0.00 0.00 62.75 58.15 1ggk n ILE 262 Cb 0.21 -1.93 0.11 0.00 -1.74 0.00 0.00 39.64 36.29 1ggk n ILE 262 CO 0.00 0.00 0.00 -2.84 -1.76 0.00 0.00 176.55 171.95 1ggk s PRO 263 N -1.11 1.89 0.27 6.28 0.02 -1.26 -1.28 135.00 139.80 1ggk s PRO 263 Ca 0.35 1.60 0.11 0.00 0.02 0.00 0.00 61.00 63.09 1ggk s PRO 263 Cb 0.14 -1.82 0.32 0.00 0.02 0.00 0.00 34.50 33.16 1ggk s PRO 263 CO -0.12 -1.99 1.58 -0.09 -0.33 0.00 0.00 177.00 176.05 1ggk h ARG 264 N -0.81 0.00 -1.94 5.54 9.65 -1.60 -3.39 114.38 121.83 1ggk h ARG 264 Ca -0.46 0.00 0.11 0.00 -1.10 0.00 0.00 59.98 58.53 1ggk h ARG 264 Cb 1.28 0.00 -0.18 0.00 -1.39 0.00 0.00 29.97 29.67 1ggk h ARG 264 CO 0.48 0.63 0.54 0.45 2.80 0.00 0.00 179.97 184.87 1ggk s SER 265 N -6.76 -0.35 0.49 -3.80 0.15 -1.26 -4.96 113.70 97.20 1ggk s SER 265 Ca -0.01 0.16 0.33 0.00 0.70 0.00 0.00 55.95 57.13 1ggk s SER 265 Cb 0.12 0.33 1.55 0.00 -1.71 0.00 0.00 66.02 66.32 1ggk s SER 265 CO 0.76 -0.48 1.98 1.88 1.20 0.00 0.00 173.24 178.58 1ggk h TYR 266 N 2.22 0.00 0.00 3.44 0.05 -1.91 -1.78 116.97 118.99 1ggk h TYR 266 Ca -0.20 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.58 1ggk h TYR 266 Cb 1.20 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.94 1ggk h TYR 266 CO 0.27 0.00 -0.02 0.00 -1.05 0.00 0.00 178.16 177.36 1ggk h ARG 267 N 0.00 0.00 -1.02 4.88 3.08 -1.96 -3.36 114.38 116.00 1ggk h ARG 267 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 1ggk h ARG 267 Cb 0.26 0.00 -0.43 0.00 0.08 0.00 0.00 29.97 29.88 1ggk h ARG 267 CO 0.00 0.02 -0.79 0.25 -1.07 0.00 0.00 179.97 178.38 1ggk n THR 268 N -3.11 2.45 -4.28 2.04 -2.24 -0.67 -4.46 114.28 104.01 1ggk n THR 268 Ca 0.02 -4.46 -0.15 0.00 -2.27 0.00 0.00 64.05 57.20 1ggk n THR 268 Cb 0.43 -1.15 -0.10 0.00 -2.10 0.00 0.00 70.33 67.41 1ggk n THR 268 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ggk s MET 269 N -3.58 1.19 0.45 -0.78 0.23 -1.26 -1.84 119.30 113.71 1ggk s MET 269 Ca 0.49 -1.58 -0.01 0.00 -1.03 0.00 0.00 55.69 53.57 1ggk s MET 269 Cb 0.41 -0.43 -0.01 0.00 -1.53 0.00 0.00 34.83 33.26 1ggk s MET 269 CO -0.04 -0.10 0.68 -1.21 -2.03 0.00 0.00 175.02 172.32 1ggk s GLU 270 N -3.88 3.18 -0.01 3.16 2.02 -1.26 -4.28 118.70 117.63 1ggk s GLU 270 Ca 0.25 -0.35 0.05 0.00 0.02 0.00 0.00 54.97 54.95 1ggk s GLU 270 Cb 0.06 -2.53 -0.01 0.00 0.10 0.00 0.00 34.13 31.74 1ggk s GLU 270 CO 0.05 -0.22 -0.18 0.20 0.02 0.00 0.00 175.26 175.13 1ggk s GLY 271 N -4.18 0.87 -0.01 -1.39 0.00 1.00 -4.35 107.32 99.27 1ggk s GLY 271 Ca 0.47 -0.77 -0.01 0.00 0.00 0.00 0.00 44.72 44.41 1ggk s GLY 271 CO 0.39 -0.64 0.03 -1.36 0.00 0.00 0.00 173.10 171.52 1ggk s PHE 272 N -0.42 0.01 -0.26 1.90 0.08 0.34 0.77 117.98 120.40 1ggk s PHE 272 Ca 0.07 -0.02 0.18 0.00 0.12 0.00 0.00 56.93 57.28 1ggk s PHE 272 Cb -0.07 -0.02 0.16 0.00 -0.57 0.00 0.00 43.02 42.52 1ggk s PHE 272 CO -0.01 -0.06 1.49 0.78 -0.10 0.00 0.00 175.22 177.33 1ggk h GLY 273 N 5.79 0.00 0.00 4.36 0.00 -1.75 -0.35 103.07 111.12 1ggk h GLY 273 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1ggk h GLY 273 CO 0.47 0.00 0.00 1.39 0.00 0.00 0.00 176.54 178.40 1ggk n ILE 274 N -3.17 0.00 -1.96 2.60 5.41 -1.26 -4.87 119.36 116.11 1ggk n ILE 274 Ca 0.03 0.00 -0.33 0.00 1.00 0.00 0.00 62.75 63.44 1ggk n ILE 274 Cb 0.66 0.00 0.03 0.00 -0.71 0.00 0.00 39.64 39.62 1ggk n ILE 274 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 1ggk s HIS 275 N 0.00 2.74 -0.15 1.39 3.76 -1.26 -4.92 115.29 116.85 1ggk s HIS 275 Ca 0.00 1.54 -0.29 0.00 -0.15 0.00 0.00 55.06 56.16 1ggk s HIS 275 Cb 0.00 -3.15 -0.00 0.00 1.11 0.00 0.00 32.58 30.54 1ggk s HIS 275 CO 0.00 -1.48 1.01 0.99 -0.85 0.00 0.00 174.74 174.40 1ggk s THR 276 N -2.24 4.75 0.26 1.30 2.01 -1.26 -4.61 115.64 115.84 1ggk s THR 276 Ca 0.67 2.01 0.02 0.00 0.31 0.00 0.00 61.69 64.70 1ggk s THR 276 Cb -0.20 -4.30 0.02 0.00 0.01 0.00 0.00 72.50 68.03 1ggk s THR 276 CO 0.36 -0.06 0.18 0.49 -0.69 0.00 0.00 174.62 174.90 1ggk n PHE 277 N 5.50 -0.96 -5.06 4.92 3.72 -0.21 -4.42 117.46 120.95 1ggk n PHE 277 Ca 0.10 -1.09 -0.31 0.00 -0.05 0.00 0.00 57.45 56.09 1ggk n PHE 277 Cb 0.48 -0.21 -0.15 0.00 -0.94 0.00 0.00 39.48 38.66 1ggk n PHE 277 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1ggk s ARG 278 N -3.04 2.05 -0.17 -1.08 0.52 -0.12 -1.37 118.95 115.74 1ggk s ARG 278 Ca 0.13 -0.97 -0.05 0.00 -0.52 0.00 0.00 55.73 54.33 1ggk s ARG 278 Cb -0.01 -2.07 -0.03 0.00 0.52 0.00 0.00 34.95 33.36 1ggk s ARG 278 CO 0.09 0.55 -0.01 -0.51 0.02 0.00 0.00 175.30 175.43 1ggk s LEU 279 N -0.92 3.34 -0.16 2.53 1.43 0.22 -0.73 118.68 124.39 1ggk s LEU 279 Ca 0.11 -0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 1ggk s LEU 279 Cb -0.10 -1.82 0.00 0.00 0.03 0.00 0.00 46.19 44.30 1ggk s LEU 279 CO 0.01 0.14 -0.17 -0.63 0.23 0.00 0.00 176.35 175.94 1ggk s ILE 280 N 0.53 2.50 0.44 -0.59 -1.09 -0.49 -1.08 121.20 121.42 1ggk s ILE 280 Ca -0.02 -0.82 -0.01 0.00 -2.23 0.00 0.00 60.65 57.57 1ggk s ILE 280 Cb -0.14 -2.05 0.09 0.00 -1.58 0.00 0.00 42.46 38.78 1ggk s ILE 280 CO 0.02 0.52 0.61 -0.46 -1.23 0.00 0.00 174.94 174.40 1ggk n ASN 281 N 4.21 0.68 0.07 3.58 0.23 -0.74 -1.95 115.26 121.34 1ggk n ASN 281 Ca -0.19 -1.61 0.02 0.00 -0.53 0.00 0.00 54.58 52.27 1ggk n ASN 281 Cb 0.51 -0.40 0.38 0.00 -2.08 0.00 0.00 39.78 38.19 1ggk n ASN 281 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ggk h ALA 282 N -0.73 1.53 -0.02 -2.53 0.00 -1.87 -1.69 119.26 113.96 1ggk h ALA 282 Ca -0.20 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1ggk h ALA 282 Cb 0.70 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1ggk h ALA 282 CO 0.20 0.34 0.00 0.39 0.00 0.00 0.00 179.25 180.18 1ggk n GLU 283 N -4.32 1.21 -0.76 0.00 4.71 -1.26 -4.77 120.64 115.45 1ggk n GLU 283 Ca 0.00 -0.30 0.00 0.00 -0.01 0.00 0.00 57.16 56.85 1ggk n GLU 283 Cb 0.22 -1.43 0.00 0.00 -1.01 0.00 0.00 31.44 29.21 1ggk n GLU 283 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ggk n GLY 284 N 1.00 0.55 3.80 0.62 0.00 -0.63 -5.06 105.19 105.46 1ggk n GLY 284 Ca 0.20 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 1ggk n GLY 284 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ggk s LYS 285 N -1.30 4.33 -0.15 1.61 2.20 -1.26 -4.81 119.74 120.37 1ggk s LYS 285 Ca 0.00 0.89 -0.06 0.00 -0.36 0.00 0.00 55.97 56.44 1ggk s LYS 285 Cb 0.00 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 33.04 1ggk s LYS 285 CO 0.00 0.61 0.06 0.00 -0.36 0.00 0.00 175.35 175.66 1ggk s ALA 286 N -1.13 3.44 -0.02 3.13 0.00 -1.26 -1.79 121.76 124.13 1ggk s ALA 286 Ca 0.32 -0.74 0.06 0.00 0.00 0.00 0.00 51.96 51.60 1ggk s ALA 286 Cb -0.21 -1.82 -0.01 0.00 0.00 0.00 0.00 23.12 21.08 1ggk s ALA 286 CO 0.22 0.34 -0.21 0.99 0.00 0.00 0.00 175.76 177.10 1ggk s THR 287 N -0.14 1.64 0.20 0.00 2.01 -0.24 -4.30 115.64 114.81 1ggk s THR 287 Ca 0.07 -0.88 -0.30 0.00 0.31 0.00 0.00 61.69 60.89 1ggk s THR 287 Cb -0.12 -1.37 -0.08 0.00 0.01 0.00 0.00 72.50 70.94 1ggk s THR 287 CO 0.01 0.46 1.02 -0.36 -0.69 0.00 0.00 174.62 175.07 1ggk s PHE 288 N -0.43 3.76 -0.00 4.92 0.08 -0.50 -0.61 117.98 125.20 1ggk s PHE 288 Ca 0.06 1.76 0.01 0.00 0.12 0.00 0.00 56.93 58.88 1ggk s PHE 288 Cb -0.09 -3.14 -0.00 0.00 -0.57 0.00 0.00 43.02 39.22 1ggk s PHE 288 CO -0.00 -0.10 -0.03 0.54 -0.10 0.00 0.00 175.22 175.52 1ggk s VAL 289 N -0.66 0.28 -0.14 -0.44 0.11 -0.47 -0.58 120.40 118.51 1ggk s VAL 289 Ca 0.45 -0.14 0.01 0.00 -2.93 0.00 0.00 61.98 59.37 1ggk s VAL 289 Cb -0.28 -0.25 -0.01 0.00 -1.53 0.00 0.00 36.38 34.32 1ggk s VAL 289 CO 0.34 0.09 -0.16 -0.13 -3.33 0.00 0.00 175.10 171.90 1ggk s ARG 290 N -0.03 3.24 0.19 1.54 0.52 -0.43 -1.04 118.95 122.95 1ggk s ARG 290 Ca 0.01 -0.75 -0.24 0.00 -0.52 0.00 0.00 55.73 54.23 1ggk s ARG 290 Cb -0.02 -2.57 -0.08 0.00 0.52 0.00 0.00 34.95 32.80 1ggk s ARG 290 CO -0.00 0.11 0.77 -0.06 0.02 0.00 0.00 175.30 176.14 1ggk s PHE 291 N 0.57 3.82 0.01 -0.53 0.08 -1.26 -1.10 117.98 119.56 1ggk s PHE 291 Ca -0.10 1.57 0.01 0.00 0.12 0.00 0.00 56.93 58.54 1ggk s PHE 291 Cb -0.16 -2.73 -0.01 0.00 -0.57 0.00 0.00 43.02 39.55 1ggk s PHE 291 CO 0.04 0.45 -0.05 -1.01 -0.10 0.00 0.00 175.22 174.54 1ggk s HIS 292 N -1.29 0.45 -0.17 0.36 3.76 0.17 -2.30 115.29 116.27 1ggk s HIS 292 Ca 0.39 -0.21 0.01 0.00 -0.15 0.00 0.00 55.06 55.10 1ggk s HIS 292 Cb -0.21 -0.28 0.01 0.00 1.11 0.00 0.00 32.58 33.21 1ggk s HIS 292 CO 0.24 -0.04 -0.19 -1.58 -0.85 0.00 0.00 174.74 172.33 1ggk s TRP 293 N -0.50 2.76 -0.23 1.40 0.52 0.23 -0.52 118.94 122.61 1ggk s TRP 293 Ca -0.02 -1.50 -0.06 0.00 0.02 0.00 0.00 56.10 54.53 1ggk s TRP 293 Cb -0.04 -1.90 -0.03 0.00 -1.15 0.00 0.00 33.47 30.35 1ggk s TRP 293 CO -0.00 -0.73 0.04 0.21 0.02 0.00 0.00 176.95 176.49 1ggk s LYS 294 N 1.16 3.65 0.11 4.98 2.36 -0.22 -0.00 119.74 131.77 1ggk s LYS 294 Ca 0.02 -0.49 -0.31 0.00 -2.55 0.00 0.00 55.97 52.64 1ggk s LYS 294 Cb -0.14 -3.22 -0.08 0.00 -1.05 0.00 0.00 37.83 33.34 1ggk s LYS 294 CO -0.09 -0.10 1.35 -1.25 1.55 0.00 0.00 175.35 176.81 1ggk s PRO 295 N 1.34 4.34 0.13 4.03 0.04 -1.26 -0.45 135.00 143.17 1ggk s PRO 295 Ca 0.05 2.02 0.26 0.00 0.04 0.00 0.00 61.00 63.37 1ggk s PRO 295 Cb -0.15 -3.26 0.81 0.00 0.04 0.00 0.00 34.50 31.94 1ggk s PRO 295 CO 0.02 -0.40 1.71 1.28 0.04 0.00 0.00 177.00 179.66 1ggk n LEU 296 N 3.91 0.59 -0.49 -3.56 4.77 -0.47 -2.11 117.00 119.64 1ggk n LEU 296 Ca 0.11 0.46 0.09 0.00 -0.03 0.00 0.00 56.01 56.64 1ggk n LEU 296 Cb 0.43 -0.33 0.35 0.00 -2.33 0.00 0.00 43.42 41.54 1ggk n LEU 296 CO 0.58 -0.10 0.75 0.00 -1.33 0.00 0.00 177.39 177.29 1ggk n ALA 297 N -1.71 2.52 -0.12 -1.18 0.00 -1.26 -4.95 120.51 113.80 1ggk n ALA 297 Ca 0.05 -0.48 0.01 0.00 0.00 0.00 0.00 53.44 53.03 1ggk n ALA 297 Cb 0.40 -1.09 -0.00 0.00 0.00 0.00 0.00 19.45 18.76 1ggk n ALA 297 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ggk n GLY 298 N 1.06 -2.13 3.59 0.00 0.00 -0.89 -4.02 105.19 102.80 1ggk n GLY 298 Ca 0.15 -1.45 -0.34 0.00 0.00 0.00 0.00 46.02 44.37 1ggk n GLY 298 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggk s LYS 299 N -0.62 3.53 -0.05 1.61 1.02 -1.26 -4.32 119.74 119.65 1ggk s LYS 299 Ca 0.00 -0.44 -0.22 0.00 0.02 0.00 0.00 55.97 55.33 1ggk s LYS 299 Cb 0.00 -2.95 0.05 0.00 -0.52 0.00 0.00 37.83 34.41 1ggk s LYS 299 CO 0.00 0.39 0.49 0.00 -0.92 0.00 0.00 175.35 175.31 1ggk s ALA 300 N -0.02 -1.25 0.15 5.17 0.00 -0.77 -4.80 121.76 120.24 1ggk s ALA 300 Ca 0.03 0.89 -0.01 0.00 0.00 0.00 0.00 51.96 52.87 1ggk s ALA 300 Cb -0.13 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 1ggk s ALA 300 CO 0.02 -0.30 0.06 -1.12 0.00 0.00 0.00 175.76 174.42 1ggk s SER 301 N -1.04 0.41 0.78 0.00 0.01 -1.26 -1.77 113.70 110.83 1ggk s SER 301 Ca -0.11 -1.24 -0.05 0.00 1.31 0.00 0.00 55.95 55.87 1ggk s SER 301 Cb -0.03 0.29 0.13 0.00 0.21 0.00 0.00 66.02 66.62 1ggk s SER 301 CO 0.06 -0.73 0.86 0.18 0.41 0.00 0.00 173.24 174.02 1ggk n LEU 302 N -0.15 0.00 -4.49 2.44 4.77 -0.41 -4.61 117.00 114.55 1ggk n LEU 302 Ca -0.04 -1.44 -0.31 0.00 -0.03 0.00 0.00 56.01 54.18 1ggk n LEU 302 Cb 0.64 -0.60 -0.12 0.00 -2.33 0.00 0.00 43.42 41.01 1ggk n LEU 302 CO 0.32 -1.00 -0.47 0.68 -1.33 0.00 0.00 177.39 175.59 1ggk s VAL 303 N -2.65 3.00 0.21 4.08 -7.23 -1.26 -4.93 120.40 111.62 1ggk s VAL 303 Ca 0.53 -1.11 -0.17 0.00 -1.81 0.00 0.00 61.98 59.42 1ggk s VAL 303 Cb -0.02 -2.28 0.20 0.00 0.56 0.00 0.00 36.38 34.83 1ggk s VAL 303 CO 0.36 0.33 1.45 1.87 -0.31 0.00 0.00 175.10 178.80 1ggk n TRP 304 N 1.49 -0.01 0.21 2.82 -0.00 -1.26 -1.71 117.44 118.98 1ggk n TRP 304 Ca -0.16 1.15 0.06 0.00 -0.00 0.00 0.00 57.50 58.55 1ggk n TRP 304 Cb 0.52 -0.82 0.52 0.00 -0.00 0.00 0.00 31.31 31.53 1ggk n TRP 304 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 177.69 177.91 1ggk h ASP 305 N 0.00 0.05 -0.09 5.87 1.82 -1.99 -0.96 116.42 121.12 1ggk h ASP 305 Ca 0.31 -0.01 -0.04 0.00 -0.39 0.00 0.00 57.03 56.90 1ggk h ASP 305 Cb 0.54 -0.01 -0.00 0.00 0.68 0.00 0.00 39.33 40.54 1ggk h ASP 305 CO -0.92 0.17 -0.10 -0.08 -1.61 0.00 0.00 179.24 176.69 1ggk h GLU 306 N 0.05 0.22 -0.07 0.28 4.81 -1.75 -2.26 114.58 115.86 1ggk h GLU 306 Ca 0.01 -0.12 0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1ggk h GLU 306 Cb 0.23 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1ggk h GLU 306 CO 0.01 0.66 -0.01 0.00 -0.73 0.00 0.00 179.01 178.95 1ggk h ALA 307 N 0.55 0.05 -0.55 2.92 0.00 -1.17 0.36 119.26 121.42 1ggk h ALA 307 Ca 0.01 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1ggk h ALA 307 Cb 0.63 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1ggk h ALA 307 CO 0.02 -0.48 0.27 0.37 0.00 0.00 0.00 179.25 179.44 1ggk h GLN 308 N 0.01 0.78 -0.60 0.00 4.15 -1.24 -2.26 115.11 115.97 1ggk h GLN 308 Ca 0.03 -0.11 -0.07 0.00 0.77 0.00 0.00 58.65 59.28 1ggk h GLN 308 Cb 0.04 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.56 1ggk h GLN 308 CO -0.06 0.63 0.11 -0.22 -1.93 0.00 0.00 178.83 177.36 1ggk h LYS 309 N 0.74 0.96 0.00 1.69 3.64 -1.15 -2.65 116.57 119.80 1ggk h LYS 309 Ca 0.19 -0.23 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1ggk h LYS 309 Cb 0.10 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1ggk h LYS 309 CO -0.03 0.88 -0.08 1.25 -2.27 0.00 0.00 179.45 179.20 1ggk h LEU 310 N 0.91 0.00 -2.06 5.20 5.85 -0.48 -1.58 115.31 123.15 1ggk h LEU 310 Ca 0.19 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 1ggk h LEU 310 Cb 0.38 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.40 1ggk h LEU 310 CO 0.01 0.08 -0.09 0.71 -0.34 0.00 0.00 178.44 178.81 1ggk h THR 311 N 0.00 0.60 0.00 1.05 1.35 -1.03 -0.54 112.91 114.34 1ggk h THR 311 Ca -0.00 -0.38 -0.18 0.00 -0.55 0.00 0.00 66.41 65.30 1ggk h THR 311 Cb 0.16 1.24 -0.03 0.00 -1.73 0.00 0.00 68.15 67.79 1ggk h THR 311 CO 0.01 0.09 -1.01 1.23 -0.25 0.00 0.00 175.52 175.59 1ggk h GLY 312 N 0.57 0.00 2.00 5.82 0.00 -1.43 -3.24 103.07 106.80 1ggk h GLY 312 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 1ggk h GLY 312 CO 0.01 0.00 -0.29 3.21 0.00 0.00 0.00 176.54 179.47 1ggk h ARG 313 N -1.00 0.00 -0.94 4.80 2.47 -1.38 -3.40 114.38 114.93 1ggk h ARG 313 Ca -0.27 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.39 1ggk h ARG 313 Cb 1.17 0.00 -0.18 0.00 -1.65 0.00 0.00 29.97 29.31 1ggk h ARG 313 CO -0.16 0.29 -0.43 0.34 0.56 0.00 0.00 179.97 180.57 1ggk s ASP 314 N -6.90 -1.44 0.22 7.04 2.15 -0.22 -5.02 116.67 112.50 1ggk s ASP 314 Ca -0.03 -0.85 0.19 0.00 0.43 0.00 0.00 52.55 52.28 1ggk s ASP 314 Cb 0.15 1.85 0.89 0.00 -0.30 0.00 0.00 42.92 45.50 1ggk s ASP 314 CO 0.71 -0.15 1.57 -0.81 -0.17 0.00 0.00 175.17 176.32 1ggk n PRO 315 N 4.17 0.13 -0.60 4.34 -0.04 -1.22 -1.68 135.00 140.09 1ggk n PRO 315 Ca 0.12 0.50 0.04 0.00 -0.04 0.00 0.00 63.50 64.11 1ggk n PRO 315 Cb 0.57 -1.82 0.25 0.00 -0.04 0.00 0.00 33.50 32.47 1ggk n PRO 315 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1ggk n ASP 316 N -2.07 3.62 -0.14 3.54 8.00 -1.26 0.01 116.55 128.25 1ggk n ASP 316 Ca 0.01 -3.24 -0.03 0.00 0.71 0.00 0.00 54.79 52.23 1ggk n ASP 316 Cb 0.12 -0.59 0.05 0.00 -0.02 0.00 0.00 41.12 40.68 1ggk n ASP 316 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1ggk h PHE 317 N 1.66 0.14 -0.32 1.24 3.04 -1.68 -0.76 116.94 120.27 1ggk h PHE 317 Ca 0.09 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 62.00 1ggk h PHE 317 Cb 1.61 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 40.11 1ggk h PHE 317 CO 0.72 -0.00 -0.08 0.45 -2.02 0.00 0.00 178.31 177.38 1ggk h HIS 318 N 0.22 0.70 -0.89 0.41 3.86 -1.87 -1.56 115.15 116.02 1ggk h HIS 318 Ca 0.22 -0.15 0.06 0.00 -1.16 0.00 0.00 60.37 59.34 1ggk h HIS 318 Cb 0.29 -0.17 -0.06 0.00 1.06 0.00 0.00 27.41 28.53 1ggk h HIS 318 CO -0.22 0.80 0.56 -0.09 0.86 0.00 0.00 177.93 179.84 1ggk h ARG 319 N 0.39 1.00 -0.43 2.45 2.43 -1.89 -0.89 114.38 117.45 1ggk h ARG 319 Ca 0.08 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 59.06 1ggk h ARG 319 Cb 0.58 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1ggk h ARG 319 CO 0.03 0.66 -0.25 -0.09 -1.51 0.00 0.00 179.97 178.82 1ggk h ARG 320 N 1.03 0.92 -0.27 0.20 2.43 -1.01 -2.36 114.38 115.32 1ggk h ARG 320 Ca 0.38 -0.42 -0.18 0.00 -0.81 0.00 0.00 59.98 58.95 1ggk h ARG 320 Cb 0.14 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1ggk h ARG 320 CO -0.16 1.08 -0.53 1.49 -1.51 0.00 0.00 179.97 180.33 1ggk h GLU 321 N 0.75 0.80 0.34 0.20 4.22 -0.85 -1.25 114.58 118.79 1ggk h GLU 321 Ca 0.09 -0.50 -0.01 0.00 0.08 0.00 0.00 59.36 59.02 1ggk h GLU 321 Cb 0.82 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.12 1ggk h GLU 321 CO 0.07 1.13 -0.21 1.25 -2.18 0.00 0.00 179.01 179.07 1ggk h LEU 322 N 0.62 -0.51 -0.23 1.64 5.85 -1.17 -0.42 115.31 121.09 1ggk h LEU 322 Ca 0.02 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1ggk h LEU 322 Cb 1.12 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.29 1ggk h LEU 322 CO 0.12 -0.33 0.15 -0.25 -0.34 0.00 0.00 178.44 177.78 1ggk h TRP 323 N -0.52 0.30 -0.29 1.25 2.91 -1.17 -2.46 115.95 115.97 1ggk h TRP 323 Ca -0.04 0.00 -0.10 0.00 1.13 0.00 0.00 58.89 59.89 1ggk h TRP 323 Cb 0.43 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 28.97 1ggk h TRP 323 CO -0.09 0.20 -0.24 0.93 -1.03 0.00 0.00 178.44 178.22 1ggk h GLU 324 N 0.31 0.55 -0.23 2.65 5.08 -1.20 -2.04 114.58 119.69 1ggk h GLU 324 Ca 0.08 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1ggk h GLU 324 Cb -0.02 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1ggk h GLU 324 CO -0.02 0.74 0.15 0.00 -1.00 0.00 0.00 179.01 178.89 1ggk h ALA 325 N 1.26 0.29 -0.65 3.43 0.00 -0.77 -1.71 119.26 121.11 1ggk h ALA 325 Ca 0.07 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1ggk h ALA 325 Cb 0.67 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1ggk h ALA 325 CO 0.05 -0.22 0.21 0.82 0.00 0.00 0.00 179.25 180.11 1ggk h ILE 326 N 0.30 1.25 0.00 0.00 2.04 -1.26 0.22 117.51 120.06 1ggk h ILE 326 Ca 0.08 -0.85 -0.02 0.00 1.00 0.00 0.00 64.86 65.07 1ggk h ILE 326 Cb -0.02 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1ggk h ILE 326 CO -0.02 0.33 -0.10 -0.33 0.00 0.00 0.00 178.15 178.03 1ggk h GLU 327 N 0.95 0.00 -0.00 2.37 5.08 -1.14 -2.47 114.58 119.36 1ggk h GLU 327 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1ggk h GLU 327 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1ggk h GLU 327 CO -0.01 0.10 -0.46 0.00 -1.00 0.00 0.00 179.01 177.64 1ggk n ALA 328 N -2.50 3.50 -0.39 3.43 0.00 -0.66 -2.79 120.51 121.11 1ggk n ALA 328 Ca -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1ggk n ALA 328 Cb 0.18 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1ggk n ALA 328 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ggk n GLY 329 N 1.45 0.74 3.02 0.00 0.00 -0.93 -4.60 105.19 104.86 1ggk n GLY 329 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1ggk n GLY 329 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ggk n ASP 330 N 0.00 4.62 -4.69 1.61 10.43 0.73 -4.96 116.55 124.29 1ggk n ASP 330 Ca 0.00 -2.96 -0.42 0.00 2.57 0.00 0.00 54.79 53.98 1ggk n ASP 330 Cb 0.00 -1.61 -0.03 0.00 1.84 0.00 0.00 41.12 41.32 1ggk n ASP 330 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1ggk s PHE 331 N 2.28 2.22 0.11 1.24 2.99 -1.26 -4.40 117.98 121.16 1ggk s PHE 331 Ca 0.45 0.00 -0.32 0.00 0.00 0.00 0.00 56.93 57.07 1ggk s PHE 331 Cb 0.09 -4.18 -0.12 0.00 0.00 0.00 0.00 43.02 38.81 1ggk s PHE 331 CO -0.02 -4.84 1.79 -2.30 -0.00 0.00 0.00 175.22 169.84 1ggk n PRO 332 N 5.49 2.59 -4.72 0.24 -0.02 -1.25 -4.82 135.00 132.51 1ggk n PRO 332 Ca 0.18 0.94 -0.25 0.00 -2.02 0.00 0.00 63.50 62.35 1ggk n PRO 332 Cb 0.38 -2.80 -0.16 0.00 -0.02 0.00 0.00 33.50 30.89 1ggk n PRO 332 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ggk s GLU 333 N 2.43 1.58 0.04 -0.52 2.02 -1.26 -1.47 118.70 121.52 1ggk s GLU 333 Ca 0.82 -0.53 0.02 0.00 0.02 0.00 0.00 54.97 55.30 1ggk s GLU 333 Cb -0.55 -1.39 -0.02 0.00 0.10 0.00 0.00 34.13 32.27 1ggk s GLU 333 CO 0.39 0.21 -0.07 0.71 0.02 0.00 0.00 175.26 176.52 1ggk s TYR 334 N 0.08 0.60 -0.20 1.61 2.02 -0.48 -1.36 117.35 119.61 1ggk s TYR 334 Ca -0.04 -0.47 -0.06 0.00 -0.37 0.00 0.00 57.07 56.14 1ggk s TYR 334 Cb -0.11 -0.37 -0.03 0.00 -0.40 0.00 0.00 41.96 41.06 1ggk s TYR 334 CO 0.02 -0.09 0.03 -2.00 -1.57 0.00 0.00 175.55 171.94 1ggk s GLU 335 N -1.44 3.73 0.09 -0.62 2.12 0.40 -0.75 118.70 122.23 1ggk s GLU 335 Ca -0.10 -0.46 -0.30 0.00 0.36 0.00 0.00 54.97 54.47 1ggk s GLU 335 Cb -0.09 -3.15 -0.06 0.00 0.26 0.00 0.00 34.13 31.08 1ggk s GLU 335 CO 0.00 0.06 1.20 -1.17 -0.54 0.00 0.00 175.26 174.81 1ggk s LEU 336 N 0.90 4.39 0.06 2.70 2.96 -0.52 -1.06 118.68 128.11 1ggk s LEU 336 Ca 0.02 2.06 0.03 0.00 -0.22 0.00 0.00 54.13 56.03 1ggk s LEU 336 Cb -0.14 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 1ggk s LEU 336 CO 0.02 -0.44 -0.10 -0.83 -1.32 0.00 0.00 176.35 173.69 1ggk s GLY 337 N 0.83 0.66 -0.05 7.98 0.00 0.32 -1.09 107.32 115.97 1ggk s GLY 337 Ca 0.57 -0.92 0.05 0.00 0.00 0.00 0.00 44.72 44.43 1ggk s GLY 337 CO 0.31 -0.97 -0.22 -1.36 0.00 0.00 0.00 173.10 170.86 1ggk s PHE 338 N -1.63 2.19 -0.34 1.90 2.99 -0.06 -0.66 117.98 122.37 1ggk s PHE 338 Ca -0.05 -0.66 -0.13 0.00 0.00 0.00 0.00 56.93 56.10 1ggk s PHE 338 Cb -0.08 -1.45 -0.01 0.00 0.00 0.00 0.00 43.02 41.48 1ggk s PHE 338 CO 0.01 -0.21 0.23 -0.65 -0.00 0.00 0.00 175.22 174.60 1ggk s GLN 339 N -0.07 3.45 -0.20 0.44 -0.21 -0.26 -0.19 119.66 122.62 1ggk s GLN 339 Ca -0.04 -0.68 -0.06 0.00 0.02 0.00 0.00 55.36 54.60 1ggk s GLN 339 Cb -0.13 -3.79 -0.03 0.00 1.00 0.00 0.00 33.01 30.06 1ggk s GLN 339 CO 0.03 -0.46 0.03 -0.51 -2.12 0.00 0.00 175.29 172.27 1ggk s LEU 340 N 1.71 3.47 -0.12 2.90 1.02 -1.26 -1.31 118.68 125.09 1ggk s LEU 340 Ca 0.06 -0.11 -0.01 0.00 0.02 0.00 0.00 54.13 54.10 1ggk s LEU 340 Cb -0.17 -1.89 0.03 0.00 0.02 0.00 0.00 46.19 44.18 1ggk s LEU 340 CO 0.10 0.09 -0.06 -0.63 0.02 0.00 0.00 176.35 175.87 1ggk s ILE 341 N 0.87 0.94 0.56 -0.59 1.01 0.26 -5.01 121.20 119.24 1ggk s ILE 341 Ca 0.02 -0.29 -0.21 0.00 0.00 0.00 0.00 60.65 60.17 1ggk s ILE 341 Cb -0.14 -1.02 -0.04 0.00 0.01 0.00 0.00 42.46 41.27 1ggk s ILE 341 CO 0.02 0.30 1.33 -2.84 0.00 0.00 0.00 174.94 173.75 1ggk s PRO 342 N 1.74 3.05 0.45 2.79 0.02 -1.26 -1.41 135.00 140.38 1ggk s PRO 342 Ca 0.04 2.16 0.15 0.00 0.02 0.00 0.00 61.00 63.37 1ggk s PRO 342 Cb -0.13 -2.17 1.09 0.00 0.02 0.00 0.00 34.50 33.30 1ggk s PRO 342 CO -0.08 -1.24 2.01 1.49 -0.33 0.00 0.00 177.00 178.86 1ggk h GLU 343 N 1.29 0.31 0.00 5.54 4.81 -1.96 -0.43 114.58 124.15 1ggk h GLU 343 Ca -0.51 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.70 1ggk h GLU 343 Cb 1.30 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.61 1ggk h GLU 343 CO 0.56 0.21 -0.00 0.93 -0.73 0.00 0.00 179.01 179.98 1ggk h GLU 344 N 0.32 0.00 -0.49 1.92 3.07 -1.94 -2.29 114.58 115.17 1ggk h GLU 344 Ca 0.23 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 1ggk h GLU 344 Cb 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 1ggk h GLU 344 CO -0.05 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.31 1ggk n ASP 345 N -3.10 2.60 -0.30 1.42 9.92 -0.17 -4.54 116.55 122.39 1ggk n ASP 345 Ca -0.00 -2.05 0.13 0.00 -0.53 0.00 0.00 54.79 52.34 1ggk n ASP 345 Cb 0.25 -0.34 0.30 0.00 -0.64 0.00 0.00 41.12 40.70 1ggk n ASP 345 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 1ggk h GLU 346 N 2.69 0.23 -0.69 -1.24 4.81 -1.51 -1.50 114.58 117.38 1ggk h GLU 346 Ca 0.00 -0.01 -0.28 0.00 -0.13 0.00 0.00 59.36 58.94 1ggk h GLU 346 Cb 0.69 -0.05 -0.17 0.00 0.63 0.00 0.00 28.75 29.85 1ggk h GLU 346 CO 0.03 0.15 0.29 1.19 -0.73 0.00 0.00 179.01 179.94 1ggk n PHE 347 N -5.19 2.21 1.34 0.92 3.01 -1.26 -4.59 117.46 113.89 1ggk n PHE 347 Ca 0.22 -1.45 0.13 0.00 1.01 0.00 0.00 57.45 57.36 1ggk n PHE 347 Cb 0.69 -0.69 0.43 0.00 -0.01 0.00 0.00 39.48 39.90 1ggk n PHE 347 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1ggk n LYS 348 N -0.69 1.14 -3.50 -1.08 5.02 -0.56 -4.95 118.16 113.53 1ggk n LYS 348 Ca 0.43 -0.66 -0.20 0.00 -2.02 0.00 0.00 58.31 55.85 1ggk n LYS 348 Cb 1.35 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 34.85 1ggk n LYS 348 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1ggk s PHE 349 N -2.32 2.68 0.30 2.13 0.40 -1.26 -5.00 117.98 114.90 1ggk s PHE 349 Ca 0.29 -0.49 0.30 0.00 -0.60 0.00 0.00 56.93 56.42 1ggk s PHE 349 Cb 0.20 -2.19 1.39 0.00 0.51 0.00 0.00 43.02 42.93 1ggk s PHE 349 CO 0.45 -0.18 2.02 -0.44 0.70 0.00 0.00 175.22 177.77 1ggk h ASP 350 N 0.97 0.00 -1.79 1.36 3.45 -1.96 -3.44 116.42 115.00 1ggk h ASP 350 Ca -0.41 0.00 -0.59 0.00 0.43 0.00 0.00 57.03 56.46 1ggk h ASP 350 Cb 1.27 0.00 -0.11 0.00 -0.56 0.00 0.00 39.33 39.93 1ggk h ASP 350 CO 0.56 0.11 -0.59 0.72 -1.57 0.00 0.00 179.24 178.47 1ggk s PHE 351 N -3.93 2.54 -0.06 4.55 -0.12 -1.26 -5.05 117.98 114.66 1ggk s PHE 351 Ca -0.01 -0.52 -0.25 0.00 -0.05 0.00 0.00 56.93 56.09 1ggk s PHE 351 Cb 0.11 -1.65 -0.03 0.00 -0.63 0.00 0.00 43.02 40.82 1ggk s PHE 351 CO 0.57 0.41 0.79 0.34 -0.05 0.00 0.00 175.22 177.28 1ggk s ASP 352 N -3.75 7.10 0.57 1.98 3.68 -1.26 -4.94 116.67 120.04 1ggk s ASP 352 Ca 0.36 1.32 0.29 0.00 2.13 0.00 0.00 52.55 56.66 1ggk s ASP 352 Cb 0.03 -2.46 1.73 0.00 -1.45 0.00 0.00 42.92 40.77 1ggk s ASP 352 CO 0.20 -0.18 2.21 -0.07 0.13 0.00 0.00 175.17 177.45 1ggk h LEU 353 N 6.90 0.00 -0.90 -1.34 3.38 -1.97 -2.11 115.31 119.27 1ggk h LEU 353 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1ggk h LEU 353 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1ggk h LEU 353 CO 0.76 0.04 0.00 0.18 0.09 0.00 0.00 178.44 179.51 1ggk n LEU 354 N -3.77 1.36 -4.60 1.67 4.77 -1.26 -4.50 117.00 110.66 1ggk n LEU 354 Ca -0.03 -0.55 -0.39 0.00 -0.03 0.00 0.00 56.01 55.01 1ggk n LEU 354 Cb 0.13 -0.08 -0.10 0.00 -2.33 0.00 0.00 43.42 41.05 1ggk n LEU 354 CO 0.28 0.28 0.01 -0.62 -1.33 0.00 0.00 177.39 176.01 1ggk s ASP 355 N -1.63 6.20 0.00 -1.43 3.68 -0.80 -4.37 116.67 118.33 1ggk s ASP 355 Ca 0.33 0.22 0.18 0.00 2.13 0.00 0.00 52.55 55.40 1ggk s ASP 355 Cb 0.17 -2.19 0.68 0.00 -1.45 0.00 0.00 42.92 40.13 1ggk s ASP 355 CO 0.27 -0.15 1.49 -0.81 0.13 0.00 0.00 175.17 176.09 1ggk n PRO 356 N 5.27 1.61 -0.03 4.34 -0.04 -1.26 -3.09 135.00 141.80 1ggk n PRO 356 Ca -0.10 -0.93 0.12 0.00 -0.04 0.00 0.00 63.50 62.56 1ggk n PRO 356 Cb 0.51 -1.34 0.24 0.00 -0.04 0.00 0.00 33.50 32.87 1ggk n PRO 356 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1ggk n THR 357 N 0.17 0.07 -5.08 0.52 -2.24 -1.26 -1.65 114.28 104.81 1ggk n THR 357 Ca 0.14 -0.45 -0.32 0.00 -2.27 0.00 0.00 64.05 61.15 1ggk n THR 357 Cb 0.27 1.12 -0.15 0.00 -2.10 0.00 0.00 70.33 69.47 1ggk n THR 357 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ggk s LYS 358 N -1.93 2.44 0.39 -0.78 -0.14 -1.18 -4.82 119.74 113.72 1ggk s LYS 358 Ca 0.32 -0.81 0.08 0.00 -1.36 0.00 0.00 55.97 54.20 1ggk s LYS 358 Cb 0.20 -2.25 -0.00 0.00 -1.68 0.00 0.00 37.83 34.10 1ggk s LYS 358 CO 0.31 0.54 0.48 -0.48 -0.76 0.00 0.00 175.35 175.44 1ggk s LEU 359 N -0.53 3.66 -0.42 3.17 0.05 -1.26 -4.86 118.68 118.49 1ggk s LEU 359 Ca 0.07 -0.45 -0.09 0.00 0.05 0.00 0.00 54.13 53.71 1ggk s LEU 359 Cb -0.11 -2.51 0.08 0.00 -2.05 0.00 0.00 46.19 41.60 1ggk s LEU 359 CO 0.01 -0.64 0.27 -0.63 -0.55 0.00 0.00 176.35 174.81 1ggk s ILE 360 N -2.34 4.21 0.27 1.48 1.01 -1.26 -5.07 121.20 119.51 1ggk s ILE 360 Ca 0.50 -1.46 -0.31 0.00 0.00 0.00 0.00 60.65 59.39 1ggk s ILE 360 Cb -0.08 -3.61 -0.12 0.00 0.01 0.00 0.00 42.46 38.66 1ggk s ILE 360 CO 0.31 -0.54 1.60 -2.65 0.00 0.00 0.00 174.94 173.66 1ggk n PRO 361 N 4.91 2.64 0.26 2.79 -0.02 -1.26 -4.84 135.00 139.49 1ggk n PRO 361 Ca -0.10 0.94 0.11 0.00 -2.02 0.00 0.00 63.50 62.44 1ggk n PRO 361 Cb 0.43 -2.72 0.73 0.00 -0.02 0.00 0.00 33.50 31.91 1ggk n PRO 361 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1ggk h GLU 362 N 5.13 0.00 0.00 -0.52 5.08 -1.98 -0.26 114.58 122.03 1ggk h GLU 362 Ca -0.46 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.86 1ggk h GLU 362 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1ggk h GLU 362 CO 0.82 0.09 -0.18 0.93 -1.00 0.00 0.00 179.01 179.68 1ggk h GLU 363 N 0.00 0.00 0.04 2.33 4.39 -1.96 -3.10 114.58 116.28 1ggk h GLU 363 Ca -0.00 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.38 1ggk h GLU 363 Cb 0.22 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.83 1ggk h GLU 363 CO 0.01 0.18 -1.79 1.28 -1.16 0.00 0.00 179.01 177.53 1ggk n LEU 364 N -4.15 2.20 -3.72 1.33 4.77 -0.25 -4.85 117.00 112.33 1ggk n LEU 364 Ca -0.02 0.30 -0.30 0.00 -0.03 0.00 0.00 56.01 55.96 1ggk n LEU 364 Cb 0.25 -0.98 -0.15 0.00 -2.33 0.00 0.00 43.42 40.21 1ggk n LEU 364 CO 0.35 0.55 -0.33 -0.69 -1.33 0.00 0.00 177.39 175.94 1ggk s VAL 365 N -2.46 0.79 0.66 4.08 1.01 -0.35 -5.07 120.40 119.06 1ggk s VAL 365 Ca -0.29 -1.34 -0.18 0.00 0.00 0.00 0.00 61.98 60.17 1ggk s VAL 365 Cb 0.08 -1.60 -0.01 0.00 0.00 0.00 0.00 36.38 34.85 1ggk s VAL 365 CO 0.63 -0.68 1.29 -0.81 0.00 0.00 0.00 175.10 175.53 1ggk n PRO 366 N 4.89 1.07 -2.82 2.72 -0.04 -1.19 -4.31 135.00 135.31 1ggk n PRO 366 Ca -0.02 0.42 -0.42 0.00 -0.04 0.00 0.00 63.50 63.44 1ggk n PRO 366 Cb 0.42 -2.53 -0.04 0.00 -0.04 0.00 0.00 33.50 31.31 1ggk n PRO 366 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ggk s VAL 367 N -1.42 4.86 -0.29 0.52 1.01 -1.26 -4.53 120.40 119.29 1ggk s VAL 367 Ca 0.82 1.78 -0.18 0.00 0.00 0.00 0.00 61.98 64.40 1ggk s VAL 367 Cb -0.38 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 31.79 1ggk s VAL 367 CO 0.41 0.04 0.54 -1.10 0.00 0.00 0.00 175.10 174.99 1ggk s GLN 368 N 1.93 3.92 -0.28 2.72 -0.21 0.74 -4.82 119.66 123.67 1ggk s GLN 368 Ca 0.42 0.19 -0.29 0.00 0.02 0.00 0.00 55.36 55.71 1ggk s GLN 368 Cb -0.17 -3.71 -0.00 0.00 1.00 0.00 0.00 33.01 30.13 1ggk s GLN 368 CO 0.15 -0.47 1.31 1.03 -2.12 0.00 0.00 175.29 175.19 1ggk s ARG 369 N 2.40 3.95 -0.03 2.91 0.52 -1.26 -0.88 118.95 126.56 1ggk s ARG 369 Ca 0.21 1.32 0.10 0.00 -0.52 0.00 0.00 55.73 56.85 1ggk s ARG 369 Cb -0.15 -3.87 -0.16 0.00 0.52 0.00 0.00 34.95 31.29 1ggk s ARG 369 CO 0.11 -1.07 0.20 0.28 0.02 0.00 0.00 175.30 174.84 1ggk n VAL 370 N 6.10 0.12 -1.21 3.52 0.31 -0.25 -4.97 118.33 121.95 1ggk n VAL 370 Ca 0.15 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1ggk n VAL 370 Cb 0.46 0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 1ggk n VAL 370 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ggk n GLY 371 N 1.98 -1.18 2.90 2.92 0.00 -1.17 -0.97 105.19 109.66 1ggk n GLY 371 Ca -0.04 -0.94 -0.11 0.00 0.00 0.00 0.00 46.02 44.93 1ggk n GLY 371 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ggk s LYS 372 N -1.23 0.10 -0.06 1.61 2.20 -0.74 -1.44 119.74 120.18 1ggk s LYS 372 Ca 0.00 -0.19 0.04 0.00 -0.36 0.00 0.00 55.97 55.47 1ggk s LYS 372 Cb 0.00 0.03 -0.02 0.00 -1.51 0.00 0.00 37.83 36.34 1ggk s LYS 372 CO 0.00 -0.02 -0.19 1.41 -0.36 0.00 0.00 175.35 176.19 1ggk s MET 373 N -0.45 2.64 -0.10 4.03 -2.45 0.07 -1.94 119.30 121.10 1ggk s MET 373 Ca -0.05 -0.80 0.02 0.00 -1.25 0.00 0.00 55.69 53.61 1ggk s MET 373 Cb -0.03 -2.30 0.01 0.00 1.25 0.00 0.00 34.83 33.76 1ggk s MET 373 CO -0.00 0.45 -0.16 0.08 1.05 0.00 0.00 175.02 176.44 1ggk s VAL 374 N -0.31 1.50 -0.43 10.11 1.01 -0.50 -1.38 120.40 130.40 1ggk s VAL 374 Ca 0.01 -0.67 -0.14 0.00 0.00 0.00 0.00 61.98 61.18 1ggk s VAL 374 Cb -0.13 -1.36 0.05 0.00 0.00 0.00 0.00 36.38 34.94 1ggk s VAL 374 CO 0.03 0.44 0.33 -0.76 0.00 0.00 0.00 175.10 175.13 1ggk s LEU 375 N 0.79 5.29 -0.02 3.92 1.02 -0.54 -1.41 118.68 127.73 1ggk s LEU 375 Ca -0.11 -1.14 0.03 0.00 0.02 0.00 0.00 54.13 52.94 1ggk s LEU 375 Cb -0.16 -2.14 0.05 0.00 0.02 0.00 0.00 46.19 43.96 1ggk s LEU 375 CO 0.02 -0.53 0.92 -0.46 0.02 0.00 0.00 176.35 176.31 1ggk n ASN 376 N 5.14 1.47 -3.67 2.29 0.23 -0.76 -3.90 115.26 116.06 1ggk n ASN 376 Ca -0.12 -1.97 -0.11 0.00 -0.53 0.00 0.00 54.58 51.85 1ggk n ASN 376 Cb 0.45 -0.09 -0.08 0.00 -2.08 0.00 0.00 39.78 37.98 1ggk n ASN 376 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1ggk s ARG 377 N -1.04 0.63 0.72 -3.83 3.52 -1.12 -4.99 118.95 112.83 1ggk s ARG 377 Ca 0.06 0.93 -0.11 0.00 -0.13 0.00 0.00 55.73 56.48 1ggk s ARG 377 Cb 0.05 0.20 0.02 0.00 -1.56 0.00 0.00 34.95 33.66 1ggk s ARG 377 CO 0.01 -0.12 1.09 -0.80 -0.81 0.00 0.00 175.30 174.67 1ggk s ASN 378 N 0.95 5.27 1.06 -2.12 0.01 -1.26 -1.61 114.94 117.24 1ggk s ASN 378 Ca -0.05 1.23 -0.15 0.00 -0.71 0.00 0.00 52.86 53.18 1ggk s ASN 378 Cb -0.05 -2.03 0.22 0.00 0.41 0.00 0.00 41.25 39.79 1ggk s ASN 378 CO -0.08 -1.46 1.11 -2.84 -1.51 0.00 0.00 177.10 172.31 1ggk s PRO 379 N -5.28 -0.09 -0.18 -0.60 0.02 -1.26 -3.98 135.00 123.63 1ggk s PRO 379 Ca 0.59 0.27 -0.11 0.00 0.02 0.00 0.00 61.00 61.77 1ggk s PRO 379 Cb -0.12 -1.70 -0.21 0.00 0.02 0.00 0.00 34.50 32.49 1ggk s PRO 379 CO 0.53 -3.02 0.16 -0.25 -0.33 0.00 0.00 177.00 174.08 1ggk n ASP 380 N -4.34 2.01 -3.83 2.53 10.43 -1.26 -1.26 116.55 120.83 1ggk n ASP 380 Ca 0.08 0.23 -0.26 0.00 2.57 0.00 0.00 54.79 57.41 1ggk n ASP 380 Cb 0.58 -0.82 -0.17 0.00 1.84 0.00 0.00 41.12 42.55 1ggk n ASP 380 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 1ggk s ASN 381 N -6.96 2.36 0.14 -2.24 3.84 -1.26 -4.65 114.94 106.17 1ggk s ASN 381 Ca -0.28 -0.46 -0.24 0.00 0.21 0.00 0.00 52.86 52.09 1ggk s ASN 381 Cb 0.08 -0.70 -0.01 0.00 -0.55 0.00 0.00 41.25 40.07 1ggk s ASN 381 CO 0.66 -0.20 1.63 0.15 -2.79 0.00 0.00 177.10 176.55 1ggk h PHE 382 N 8.22 -0.69 0.06 0.43 3.57 -1.98 -1.80 116.94 124.73 1ggk h PHE 382 Ca -0.22 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.33 1ggk h PHE 382 Cb 1.12 0.33 -0.03 0.00 2.79 0.00 0.00 35.95 40.16 1ggk h PHE 382 CO 0.43 -0.34 -0.16 0.35 -2.23 0.00 0.00 178.31 176.36 1ggk h PHE 383 N -0.32 -0.43 -0.37 0.41 3.04 -1.96 -0.57 116.94 116.74 1ggk h PHE 383 Ca 0.10 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.99 1ggk h PHE 383 Cb 0.48 0.18 -0.02 0.00 2.56 0.00 0.00 35.95 39.15 1ggk h PHE 383 CO -0.36 -0.24 -0.07 0.00 -2.02 0.00 0.00 178.31 175.62 1ggk h ALA 384 N 0.58 1.19 0.00 2.41 0.00 -1.95 -2.62 119.26 118.87 1ggk h ALA 384 Ca 0.04 -0.26 -0.43 0.00 0.00 0.00 0.00 54.91 54.25 1ggk h ALA 384 Cb 0.34 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 1ggk h ALA 384 CO -0.12 0.52 -2.48 0.39 0.00 0.00 0.00 179.25 177.56 1ggk n GLU 385 N -4.21 0.59 0.00 0.00 1.02 -0.69 -4.38 120.64 112.97 1ggk n GLU 385 Ca 0.01 0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.37 1ggk n GLU 385 Cb 0.31 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 1ggk n GLU 385 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1ggk n ASN 386 N -3.89 0.00 -0.34 1.62 2.85 -0.27 -3.11 115.26 112.12 1ggk n ASN 386 Ca -0.50 0.33 0.22 0.00 -0.11 0.00 0.00 54.58 54.52 1ggk n ASN 386 Cb 0.91 -0.33 0.46 0.00 1.24 0.00 0.00 39.78 42.06 1ggk n ASN 386 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 1ggk h GLU 387 N 0.00 0.39 -0.00 1.20 4.57 -1.33 0.33 114.58 119.74 1ggk h GLU 387 Ca 0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1ggk h GLU 387 Cb 0.00 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1ggk h GLU 387 CO 0.00 0.26 -0.12 1.04 -1.18 0.00 0.00 179.01 179.01 1ggk n GLN 388 N -4.94 0.76 -2.17 1.92 6.02 -1.00 -4.92 117.38 113.05 1ggk n GLN 388 Ca 0.30 -0.29 -0.37 0.00 -0.01 0.00 0.00 57.00 56.62 1ggk n GLN 388 Cb 0.92 -1.49 -0.00 0.00 1.02 0.00 0.00 30.24 30.68 1ggk n GLN 388 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ggk s ALA 389 N -2.44 2.98 -0.12 -1.58 0.00 0.10 -4.90 121.76 115.80 1ggk s ALA 389 Ca 0.29 1.02 -0.01 0.00 0.00 0.00 0.00 51.96 53.27 1ggk s ALA 389 Cb 0.20 -3.42 0.03 0.00 0.00 0.00 0.00 23.12 19.93 1ggk s ALA 389 CO 0.47 -0.78 -0.06 0.00 0.00 0.00 0.00 175.76 175.39 1ggk s ALA 390 N -1.48 1.28 0.01 0.00 0.00 -1.26 -5.05 121.76 115.26 1ggk s ALA 390 Ca 0.64 -0.57 -0.01 0.00 0.00 0.00 0.00 51.96 52.02 1ggk s ALA 390 Cb -0.31 -0.95 -0.04 0.00 0.00 0.00 0.00 23.12 21.82 1ggk s ALA 390 CO 0.38 -0.53 0.11 -0.06 0.00 0.00 0.00 175.76 175.66 1ggk s PHE 391 N 1.73 3.36 -0.23 0.00 0.08 -1.26 -5.02 117.98 116.63 1ggk s PHE 391 Ca 0.04 0.23 -0.10 0.00 0.12 0.00 0.00 56.93 57.22 1ggk s PHE 391 Cb -0.13 -1.75 0.09 0.00 -0.57 0.00 0.00 43.02 40.66 1ggk s PHE 391 CO -0.08 0.58 0.52 -1.58 -0.10 0.00 0.00 175.22 174.56 1ggk s HIS 392 N -1.27 -0.92 0.15 0.36 5.65 -1.26 -4.97 115.29 113.03 1ggk s HIS 392 Ca 0.26 1.77 0.30 0.00 0.25 0.00 0.00 55.06 57.63 1ggk s HIS 392 Cb -0.12 0.47 1.64 0.00 -1.18 0.00 0.00 32.58 33.39 1ggk s HIS 392 CO 0.17 -0.50 1.92 -1.00 -0.65 0.00 0.00 174.74 174.68 1ggk h PRO 393 N 7.63 0.00 0.00 2.88 0.13 -1.92 -0.83 132.00 139.89 1ggk h PRO 393 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1ggk h PRO 393 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1ggk h PRO 393 CO 0.17 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.35 1ggk n GLY 394 N -1.22 -1.40 3.52 1.56 0.00 -1.26 -4.53 105.19 101.86 1ggk n GLY 394 Ca -0.02 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 1ggk n GLY 394 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ggk s HIS 395 N -3.00 3.03 0.49 1.61 3.76 -0.32 -4.96 115.29 115.89 1ggk s HIS 395 Ca 0.12 -1.62 0.04 0.00 -0.15 0.00 0.00 55.06 53.45 1ggk s HIS 395 Cb 0.17 -4.53 -0.02 0.00 1.11 0.00 0.00 32.58 29.31 1ggk s HIS 395 CO 0.48 -1.64 0.09 0.96 -0.85 0.00 0.00 174.74 173.78 1ggk s ILE 396 N 3.24 1.51 0.15 0.60 -4.36 -1.26 -1.46 121.20 119.62 1ggk s ILE 396 Ca 0.45 -1.88 0.05 0.00 -0.26 0.00 0.00 60.65 59.02 1ggk s ILE 396 Cb -0.00 -2.38 -0.04 0.00 1.25 0.00 0.00 42.46 41.28 1ggk s ILE 396 CO -0.01 0.00 -0.12 0.68 0.24 0.00 0.00 174.94 175.74 1ggk s VAL 397 N -2.80 1.31 0.15 8.37 -7.23 -1.26 -4.90 120.40 114.04 1ggk s VAL 397 Ca 0.19 -2.02 -0.34 0.00 -1.81 0.00 0.00 61.98 58.01 1ggk s VAL 397 Cb 0.02 -1.81 -0.14 0.00 0.56 0.00 0.00 36.38 35.01 1ggk s VAL 397 CO 0.11 -0.65 1.56 -2.65 -0.31 0.00 0.00 175.10 173.16 1ggk n PRO 398 N -0.08 2.05 0.00 4.82 -0.02 -1.26 -1.74 135.00 138.78 1ggk n PRO 398 Ca -0.11 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1ggk n PRO 398 Cb 0.60 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1ggk n PRO 398 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ggk n GLY 399 N 3.34 2.07 3.38 -1.23 0.00 -1.26 -3.51 105.19 107.98 1ggk n GLY 399 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1ggk n GLY 399 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ggk s LEU 400 N 0.00 2.50 0.26 0.99 1.43 -0.71 -1.39 118.68 121.77 1ggk s LEU 400 Ca 0.00 -0.94 -0.18 0.00 -1.03 0.00 0.00 54.13 51.98 1ggk s LEU 400 Cb 0.00 -0.88 0.01 0.00 0.03 0.00 0.00 46.19 45.35 1ggk s LEU 400 CO 0.00 -0.04 0.61 -0.62 0.23 0.00 0.00 176.35 176.53 1ggk s ASP 401 N -3.03 -0.19 0.56 2.29 3.68 0.09 -4.76 116.67 115.31 1ggk s ASP 401 Ca 0.21 -0.73 -0.01 0.00 2.13 0.00 0.00 52.55 54.15 1ggk s ASP 401 Cb -0.04 0.66 0.06 0.00 -1.45 0.00 0.00 42.92 42.15 1ggk s ASP 401 CO 0.09 -1.25 0.40 0.49 0.13 0.00 0.00 175.17 175.02 1ggk n PHE 402 N -0.42 -3.28 -4.17 -5.34 3.01 -1.26 -0.95 117.46 105.05 1ggk n PHE 402 Ca -0.03 -0.66 -0.16 0.00 1.01 0.00 0.00 57.45 57.61 1ggk n PHE 402 Cb 0.60 -0.29 -0.06 0.00 -0.01 0.00 0.00 39.48 39.72 1ggk n PHE 402 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1ggk s THR 403 N -1.13 0.00 -1.85 4.37 -4.23 -1.26 -4.29 115.64 107.25 1ggk s THR 403 Ca 0.26 -1.79 0.05 0.00 -1.18 0.00 0.00 61.69 59.02 1ggk s THR 403 Cb -0.01 -2.55 0.14 0.00 1.34 0.00 0.00 72.50 71.42 1ggk s THR 403 CO 0.17 0.00 1.07 0.59 -0.54 0.00 0.00 174.62 175.91 1ggk n ASN 404 N -1.27 1.00 -4.69 3.99 3.02 -1.26 -4.71 115.26 111.34 1ggk n ASN 404 Ca 0.03 -2.03 -0.54 0.00 -0.03 0.00 0.00 54.58 52.02 1ggk n ASN 404 Cb 0.62 -0.16 -0.06 0.00 -0.61 0.00 0.00 39.78 39.57 1ggk n ASN 404 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ggk n ASP 405 N -0.01 2.62 0.27 6.41 -0.08 -1.26 -4.84 116.55 119.64 1ggk n ASP 405 Ca 0.05 1.05 0.16 0.00 -1.51 0.00 0.00 54.79 54.55 1ggk n ASP 405 Cb 0.18 -1.22 0.60 0.00 2.34 0.00 0.00 41.12 43.02 1ggk n ASP 405 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1ggk h PRO 406 N 7.37 0.00 -0.01 -0.67 0.13 -1.78 -0.19 132.00 136.85 1ggk h PRO 406 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1ggk h PRO 406 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1ggk h PRO 406 CO 0.93 0.03 -0.04 1.25 -0.23 0.00 0.00 178.00 179.94 1ggk h LEU 407 N 0.00 0.05 -0.39 1.56 5.85 -1.82 -3.04 115.31 117.53 1ggk h LEU 407 Ca -0.00 -0.66 0.03 0.00 0.84 0.00 0.00 57.88 58.09 1ggk h LEU 407 Cb 0.59 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 1ggk h LEU 407 CO 0.00 0.70 0.19 0.25 -0.34 0.00 0.00 178.44 179.24 1ggk h LEU 408 N -0.59 0.27 -0.44 2.25 5.85 -1.86 -2.52 115.31 118.27 1ggk h LEU 408 Ca -0.00 0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.83 1ggk h LEU 408 Cb 0.70 -0.03 -0.09 0.00 0.37 0.00 0.00 40.66 41.61 1ggk h LEU 408 CO 0.01 0.20 -0.26 1.56 -0.34 0.00 0.00 178.44 179.61 1ggk h GLN 409 N 0.38 -0.16 0.00 1.25 1.08 -1.10 -2.21 115.11 114.35 1ggk h GLN 409 Ca 0.17 0.01 -0.08 0.00 -1.45 0.00 0.00 58.65 57.30 1ggk h GLN 409 Cb 0.08 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.54 1ggk h GLN 409 CO -0.12 -0.11 -0.36 0.78 -0.95 0.00 0.00 178.83 178.07 1ggk h GLY 410 N -0.17 0.00 0.85 3.46 0.00 -1.54 -2.89 103.07 102.77 1ggk h GLY 410 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.58 1ggk h GLY 410 CO -0.54 0.00 0.63 3.21 0.00 0.00 0.00 176.54 179.84 1ggk h ARG 411 N 0.00 1.14 -0.78 4.80 3.08 -0.95 -2.56 114.38 119.11 1ggk h ARG 411 Ca -0.00 -0.07 0.11 0.00 0.07 0.00 0.00 59.98 60.08 1ggk h ARG 411 Cb 0.86 -0.26 -0.05 0.00 0.08 0.00 0.00 29.97 30.60 1ggk h ARG 411 CO 0.05 0.76 0.51 -0.07 -1.07 0.00 0.00 179.97 180.14 1ggk h LEU 412 N 1.18 0.59 -0.11 3.04 3.38 -1.28 -2.38 115.31 119.73 1ggk h LEU 412 Ca 0.40 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.38 1ggk h LEU 412 Cb 0.09 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1ggk h LEU 412 CO -0.14 0.34 0.03 0.15 0.09 0.00 0.00 178.44 178.91 1ggk h PHE 413 N 0.65 0.19 -0.30 1.13 3.57 -1.61 -3.39 116.94 117.18 1ggk h PHE 413 Ca 0.36 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.80 1ggk h PHE 413 Cb 0.53 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 1ggk h PHE 413 CO -0.00 0.35 0.03 1.03 -2.23 0.00 0.00 178.31 177.49 1ggk h SER 414 N -0.03 0.48 -0.29 0.41 0.87 -1.39 -3.25 113.55 110.35 1ggk h SER 414 Ca 0.03 -0.27 -0.06 0.00 -1.23 0.00 0.00 61.79 60.26 1ggk h SER 414 Cb 0.26 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 1ggk h SER 414 CO 0.00 0.64 -0.02 1.88 -0.53 0.00 0.00 176.83 178.80 1ggk h TYR 415 N 0.31 0.67 -0.14 2.24 0.05 -1.75 -1.63 116.97 116.73 1ggk h TYR 415 Ca 0.09 -0.09 -0.05 0.00 0.05 0.00 0.00 58.73 58.73 1ggk h TYR 415 Cb 0.37 -0.19 -0.00 0.00 1.01 0.00 0.00 36.73 37.92 1ggk h TYR 415 CO 0.03 0.66 -0.11 1.15 -1.05 0.00 0.00 178.16 178.83 1ggk h THR 416 N 0.60 1.34 0.00 -2.88 2.02 -1.80 -3.18 112.91 109.02 1ggk h THR 416 Ca 0.12 -1.24 0.02 0.00 0.77 0.00 0.00 66.41 66.09 1ggk h THR 416 Cb 0.41 1.85 -0.03 0.00 -1.74 0.00 0.00 68.15 68.64 1ggk h THR 416 CO 0.02 0.36 -0.16 -0.78 0.37 0.00 0.00 175.52 175.32 1ggk h ASP 417 N -0.04 -0.48 -0.46 4.18 3.58 -1.53 -3.04 116.42 118.63 1ggk h ASP 417 Ca 0.03 0.07 -0.02 0.00 0.42 0.00 0.00 57.03 57.52 1ggk h ASP 417 Cb 0.62 0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.85 1ggk h ASP 417 CO 0.03 -0.23 0.21 0.00 -2.88 0.00 0.00 179.24 176.37 1ggk h THR 418 N -0.27 1.18 0.00 2.25 1.03 -1.40 -2.76 112.91 112.94 1ggk h THR 418 Ca 0.05 -0.56 -0.02 0.00 -0.01 0.00 0.00 66.41 65.87 1ggk h THR 418 Cb 0.34 0.57 -0.00 0.00 -1.07 0.00 0.00 68.15 67.99 1ggk h THR 418 CO -0.16 0.22 -0.10 1.56 -0.01 0.00 0.00 175.52 177.03 1ggk h GLN 419 N 0.71 0.00 -0.60 0.00 4.20 -1.51 -2.32 115.11 115.60 1ggk h GLN 419 Ca 0.17 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.90 1ggk h GLN 419 Cb 0.13 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.87 1ggk h GLN 419 CO -0.02 0.10 0.38 0.82 -0.67 0.00 0.00 178.83 179.44 1ggk h ILE 420 N 0.00 1.10 0.00 2.54 1.08 -1.50 -1.27 117.51 119.47 1ggk h ILE 420 Ca -0.00 -0.26 -0.30 0.00 -0.39 0.00 0.00 64.86 63.91 1ggk h ILE 420 Cb 0.36 0.28 -0.05 0.00 -3.07 0.00 0.00 36.82 34.34 1ggk h ILE 420 CO 0.01 0.14 -1.74 -1.54 -0.69 0.00 0.00 178.15 174.33 1ggk n SER 421 N -4.71 0.89 -0.15 1.72 3.41 -1.11 -1.26 113.62 112.41 1ggk n SER 421 Ca 0.05 0.39 -0.11 0.00 -0.26 0.00 0.00 58.87 58.95 1ggk n SER 421 Cb 0.06 -0.06 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 1ggk n SER 421 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1ggk h ARG 422 N 0.00 0.87 -0.11 4.33 2.43 -1.33 -3.25 114.38 117.32 1ggk h ARG 422 Ca -0.30 -0.33 0.00 0.00 -0.81 0.00 0.00 59.98 58.54 1ggk h ARG 422 Cb 2.02 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.52 1ggk h ARG 422 CO 0.08 0.97 0.00 1.28 -1.51 0.00 0.00 179.97 180.79 1ggk n LEU 423 N -4.27 2.70 0.00 3.80 4.77 -0.49 -4.49 117.00 119.03 1ggk n LEU 423 Ca -0.00 -1.16 0.00 0.00 -0.03 0.00 0.00 56.01 54.82 1ggk n LEU 423 Cb 0.38 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1ggk n LEU 423 CO 0.44 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 1ggk n GLY 424 N 1.07 0.76 0.00 -0.72 0.00 -0.97 -4.88 105.19 100.45 1ggk n GLY 424 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1ggk n GLY 424 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggk n GLY 425 N -2.19 -2.40 0.21 -0.02 0.00 -0.39 -4.83 105.19 95.58 1ggk n GLY 425 Ca 0.00 -1.26 0.10 0.00 0.00 0.00 0.00 46.02 44.86 1ggk n GLY 425 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ggk n PRO 426 N -0.67 1.28 -1.09 1.61 -0.04 -1.26 -3.79 135.00 131.04 1ggk n PRO 426 Ca 0.00 -0.42 -0.17 0.00 -0.04 0.00 0.00 63.50 62.87 1ggk n PRO 426 Cb 0.00 -1.32 0.19 0.00 -0.04 0.00 0.00 33.50 32.33 1ggk n PRO 426 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ggk n ASN 427 N -0.36 3.45 0.32 3.54 3.02 -1.26 -4.61 115.26 119.36 1ggk n ASN 427 Ca 0.14 -3.63 0.21 0.00 -0.03 0.00 0.00 54.58 51.27 1ggk n ASN 427 Cb 0.16 -0.77 1.06 0.00 -0.61 0.00 0.00 39.78 39.62 1ggk n ASN 427 CO 0.00 0.00 0.00 2.19 -2.62 0.00 0.00 177.26 176.83 1ggk h PHE 428 N 1.11 0.00 0.00 3.10 -5.15 -1.90 -1.77 116.94 112.33 1ggk h PHE 428 Ca 0.49 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.26 1ggk h PHE 428 Cb 2.49 0.00 0.00 0.00 0.22 0.00 0.00 35.95 38.66 1ggk h PHE 428 CO 1.41 0.01 0.00 -2.39 -2.00 0.00 0.00 178.31 175.34 1ggk n HIS 429 N -3.16 0.12 1.06 6.09 1.44 -1.26 -2.42 115.22 117.09 1ggk n HIS 429 Ca -0.02 0.04 0.12 0.00 -2.01 0.00 0.00 57.72 55.85 1ggk n HIS 429 Cb 0.14 -0.57 0.16 0.00 0.12 0.00 0.00 29.99 29.84 1ggk n HIS 429 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1ggk n GLU 430 N -1.60 0.40 -2.30 -1.40 1.02 -0.66 -3.11 120.64 112.99 1ggk n GLU 430 Ca 0.05 -0.28 -0.41 0.00 -0.02 0.00 0.00 57.16 56.50 1ggk n GLU 430 Cb 0.25 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.15 1ggk n GLU 430 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1ggk s ILE 431 N -2.79 3.44 0.31 -3.67 1.01 -1.01 -4.89 121.20 113.59 1ggk s ILE 431 Ca 0.15 1.17 0.07 0.00 0.00 0.00 0.00 60.65 62.04 1ggk s ILE 431 Cb 0.18 -3.75 0.30 0.00 0.01 0.00 0.00 42.46 39.20 1ggk s ILE 431 CO 0.67 0.17 1.71 -0.65 0.00 0.00 0.00 174.94 176.84 1ggk h PRO 432 N 5.51 0.45 0.00 2.79 0.11 -1.90 -0.87 132.00 138.09 1ggk h PRO 432 Ca -0.44 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 1ggk h PRO 432 Cb 1.21 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1ggk h PRO 432 CO 0.77 0.30 -0.14 0.97 -0.21 0.00 0.00 178.00 179.69 1ggk h ILE 433 N 0.46 0.34 0.00 4.15 6.09 -1.91 -3.15 117.51 123.50 1ggk h ILE 433 Ca 0.62 -0.91 0.00 0.00 -1.37 0.00 0.00 64.86 63.19 1ggk h ILE 433 Cb 1.20 1.69 0.00 0.00 0.47 0.00 0.00 36.82 40.18 1ggk h ILE 433 CO -0.52 0.14 -0.95 0.59 -3.07 0.00 0.00 178.15 174.34 1ggk n ASN 434 N -3.28 0.67 -4.77 2.19 3.02 -0.34 -4.95 115.26 107.80 1ggk n ASN 434 Ca 0.00 0.04 -0.39 0.00 -0.03 0.00 0.00 54.58 54.20 1ggk n ASN 434 Cb 0.39 0.58 -0.01 0.00 -0.61 0.00 0.00 39.78 40.13 1ggk n ASN 434 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1ggk s ARG 435 N -3.25 4.03 0.82 3.52 0.52 -1.17 -4.90 118.95 118.52 1ggk s ARG 435 Ca 0.03 2.12 -0.11 0.00 -0.52 0.00 0.00 55.73 57.25 1ggk s ARG 435 Cb 0.13 -2.78 0.09 0.00 0.52 0.00 0.00 34.95 32.90 1ggk s ARG 435 CO 0.78 -0.43 1.10 -2.14 0.02 0.00 0.00 175.30 174.63 1ggk s PRO 436 N -2.19 1.83 0.01 3.54 0.02 -1.26 -4.95 135.00 132.00 1ggk s PRO 436 Ca 0.56 1.19 0.22 0.00 0.02 0.00 0.00 61.00 62.99 1ggk s PRO 436 Cb -0.37 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.28 1ggk s PRO 436 CO 0.48 -1.95 0.99 0.25 -0.33 0.00 0.00 177.00 176.44 1ggk n THR 437 N -3.73 0.05 -2.74 0.99 -2.24 -1.26 -4.93 114.28 100.41 1ggk n THR 437 Ca 0.09 -0.11 -0.21 0.00 -2.27 0.00 0.00 64.05 61.55 1ggk n THR 437 Cb 0.53 0.55 0.03 0.00 -2.10 0.00 0.00 70.33 69.34 1ggk n THR 437 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ggk s PRO 439 N -4.69 3.49 -0.09 0.00 0.02 -1.26 -5.05 135.00 127.42 1ggk s PRO 439 Ca 0.55 1.71 -0.04 0.00 0.02 0.00 0.00 61.00 63.25 1ggk s PRO 439 Cb -0.10 -2.17 0.05 0.00 0.02 0.00 0.00 34.50 32.29 1ggk s PRO 439 CO 0.38 -0.76 0.20 1.52 -0.33 0.00 0.00 177.00 178.01 1ggk s TYR 440 N -1.65 -0.27 -0.05 6.54 1.13 -1.26 -5.01 117.35 116.79 1ggk s TYR 440 Ca 0.69 0.70 -0.02 0.00 -1.41 0.00 0.00 57.07 57.03 1ggk s TYR 440 Cb -0.27 -0.09 0.03 0.00 -1.10 0.00 0.00 41.96 40.53 1ggk s TYR 440 CO 0.31 -0.25 0.11 -1.01 -2.51 0.00 0.00 175.55 172.19 1ggk s HIS 441 N 1.80 -0.10 0.00 -3.49 3.76 -1.26 -5.16 115.29 110.84 1ggk s HIS 441 Ca -0.03 0.35 0.00 0.00 -0.15 0.00 0.00 55.06 55.23 1ggk s HIS 441 Cb -0.12 -0.11 0.00 0.00 1.11 0.00 0.00 32.58 33.46 1ggk s HIS 441 CO -0.07 -0.13 0.00 0.27 -0.85 0.00 0.00 174.74 173.96 1ggk n ASN 442 N 4.05 0.00 -0.75 1.40 0.23 -1.26 -4.95 115.26 113.98 1ggk n ASN 442 Ca -0.25 -0.30 0.06 0.00 -0.53 0.00 0.00 54.58 53.56 1ggk n ASN 442 Cb 0.52 0.00 0.18 0.00 -2.08 0.00 0.00 39.78 38.40 1ggk n ASN 442 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1ggk n PHE 443 N 0.00 0.57 -2.28 -2.53 3.01 -1.26 -4.93 117.46 110.04 1ggk n PHE 443 Ca 0.00 -0.53 -0.40 0.00 1.01 0.00 0.00 57.45 57.54 1ggk n PHE 443 Cb 0.00 -0.05 -0.03 0.00 -0.01 0.00 0.00 39.48 39.40 1ggk n PHE 443 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1ggk s GLN 444 N -1.13 4.39 0.17 -1.08 -0.21 -1.26 -4.73 119.66 115.80 1ggk s GLN 444 Ca 0.28 1.99 -0.01 0.00 0.02 0.00 0.00 55.36 57.64 1ggk s GLN 444 Cb 0.15 -3.02 -0.04 0.00 1.00 0.00 0.00 33.01 31.10 1ggk s GLN 444 CO 0.17 -0.08 0.09 1.03 -2.12 0.00 0.00 175.29 174.38 1ggk s ARG 445 N -1.79 1.08 3.57 2.91 1.81 -1.26 -5.10 118.95 120.18 1ggk s ARG 445 Ca 0.49 -1.55 0.00 0.00 -1.72 0.00 0.00 55.73 52.96 1ggk s ARG 445 Cb -0.35 0.21 0.00 0.00 -0.45 0.00 0.00 34.95 34.36 1ggk s ARG 445 CO 0.46 -0.32 0.00 -0.25 -0.68 0.00 0.00 175.30 174.51 1ggk n ASP 446 N -0.20 0.00 0.00 0.23 8.00 -1.26 -5.06 116.55 118.26 1ggk n ASP 446 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 1ggk n ASP 446 Cb 0.65 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.75 1ggk n ASP 446 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ggk n GLY 447 N 0.00 -0.73 3.65 0.44 0.00 -1.26 -4.71 105.19 102.59 1ggk n GLY 447 Ca 0.00 -1.54 -0.40 0.00 0.00 0.00 0.00 46.02 44.08 1ggk n GLY 447 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1ggk n MET 448 N -0.19 1.47 -3.06 1.61 1.56 -1.26 -2.97 117.12 114.28 1ggk n MET 448 Ca 0.00 0.53 -0.20 0.00 -0.27 0.00 0.00 57.70 57.76 1ggk n MET 448 Cb 0.00 -2.20 0.04 0.00 2.15 0.00 0.00 33.22 33.21 1ggk n MET 448 CO 0.00 0.00 0.00 0.72 -0.73 0.00 0.00 175.97 175.96 1ggk n HIS 449 N -0.66 -1.92 -2.21 1.12 8.25 -1.26 -4.54 115.22 113.99 1ggk n HIS 449 Ca 0.09 0.57 -0.42 0.00 -0.26 0.00 0.00 57.72 57.70 1ggk n HIS 449 Cb 0.41 -4.16 -0.03 0.00 1.12 0.00 0.00 29.99 27.33 1ggk n HIS 449 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1ggk s ARG 450 N -5.70 4.25 -0.25 -0.41 6.06 -1.16 -4.93 118.95 116.81 1ggk s ARG 450 Ca 0.33 1.95 -0.16 0.00 -2.50 0.00 0.00 55.73 55.35 1ggk s ARG 450 Cb -0.15 -3.72 -0.14 0.00 0.06 0.00 0.00 34.95 31.01 1ggk s ARG 450 CO 0.41 -0.67 -0.18 -1.33 -2.50 0.00 0.00 175.30 171.03 1ggk n MET 451 N 6.08 0.57 -1.80 5.12 2.81 -1.26 -4.96 117.12 123.69 1ggk n MET 451 Ca 0.14 0.36 -0.42 0.00 -1.81 0.00 0.00 57.70 55.98 1ggk n MET 451 Cb 0.44 -1.57 -0.03 0.00 -0.71 0.00 0.00 33.22 31.35 1ggk n MET 451 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1ggk s GLY 452 N -5.24 1.57 -0.42 3.03 0.00 -1.26 -4.99 107.32 100.01 1ggk s GLY 452 Ca -0.35 1.52 -0.13 0.00 0.00 0.00 0.00 44.72 45.76 1ggk s GLY 452 CO 0.51 2.71 0.30 -0.42 0.00 0.00 0.00 173.10 176.20 1ggk s ILE 453 N 0.81 4.89 0.13 0.90 1.01 -1.26 -5.02 121.20 122.66 1ggk s ILE 453 Ca 0.70 -0.99 -0.29 0.00 0.00 0.00 0.00 60.65 60.07 1ggk s ILE 453 Cb -0.47 -3.84 -0.06 0.00 0.01 0.00 0.00 42.46 38.09 1ggk s ILE 453 CO 0.36 -0.42 0.92 -1.81 0.00 0.00 0.00 174.94 173.99 1ggk s ASP 454 N 2.05 7.48 -0.01 3.58 1.11 -1.26 -4.94 116.67 124.68 1ggk s ASP 454 Ca 0.04 1.76 0.18 0.00 0.18 0.00 0.00 52.55 54.71 1ggk s ASP 454 Cb -0.22 -2.57 -0.22 0.00 1.07 0.00 0.00 42.92 40.99 1ggk s ASP 454 CO 0.07 0.01 0.70 0.35 1.18 0.00 0.00 175.17 177.47 1ggk n THR 455 N 2.47 0.00 -1.67 -1.27 -2.24 -1.26 -4.95 114.28 105.35 1ggk n THR 455 Ca 0.00 -0.14 -0.53 0.00 -2.27 0.00 0.00 64.05 61.11 1ggk n THR 455 Cb 0.49 0.81 -0.06 0.00 -2.10 0.00 0.00 70.33 69.47 1ggk n THR 455 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ggk n ASN 456 N -1.57 2.61 0.28 3.42 2.85 -1.26 -4.84 115.26 116.74 1ggk n ASN 456 Ca 0.02 1.06 0.12 0.00 -0.11 0.00 0.00 54.58 55.66 1ggk n ASN 456 Cb 0.32 -1.25 0.78 0.00 1.24 0.00 0.00 39.78 40.87 1ggk n ASN 456 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ggk h PRO 457 N 7.07 0.00 -5.91 1.20 0.11 -1.93 -3.42 132.00 129.12 1ggk h PRO 457 Ca -0.47 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.01 1ggk h PRO 457 Cb 1.30 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.36 1ggk h PRO 457 CO 0.91 0.01 -0.51 0.00 -0.21 0.00 0.00 178.00 178.20 1ggk s ALA 458 N -4.80 3.91 -0.10 -0.75 0.00 -1.26 -5.01 121.76 113.75 1ggk s ALA 458 Ca -0.05 -0.83 0.19 0.00 0.00 0.00 0.00 51.96 51.27 1ggk s ALA 458 Cb 0.16 -1.79 0.42 0.00 0.00 0.00 0.00 23.12 21.92 1ggk s ALA 458 CO 0.61 0.78 1.19 0.27 0.00 0.00 0.00 175.76 178.61 1ggk n ASN 459 N 0.63 1.32 -3.71 0.00 2.04 -1.26 -5.03 115.26 109.25 1ggk n ASN 459 Ca -0.08 -2.87 -0.09 0.00 -0.44 0.00 0.00 54.58 51.10 1ggk n ASN 459 Cb 0.52 -0.40 -0.02 0.00 -2.53 0.00 0.00 39.78 37.34 1ggk n ASN 459 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 1ggk s TYR 460 N -1.48 -0.31 -0.01 -2.53 -0.85 -1.26 -4.86 117.35 106.05 1ggk s TYR 460 Ca 0.36 -0.07 -0.11 0.00 -0.52 0.00 0.00 57.07 56.74 1ggk s TYR 460 Cb 0.38 0.66 0.01 0.00 0.38 0.00 0.00 41.96 43.39 1ggk s TYR 460 CO -0.12 -1.11 0.21 -1.83 -1.52 0.00 0.00 175.55 171.18 1ggk s GLU 461 N -3.86 0.56 0.38 -3.49 4.04 -1.26 -4.20 118.70 110.87 1ggk s GLU 461 Ca 0.08 -0.30 -0.25 0.00 0.04 0.00 0.00 54.97 54.54 1ggk s GLU 461 Cb -0.04 0.24 -0.09 0.00 0.02 0.00 0.00 34.13 34.26 1ggk s GLU 461 CO 0.00 -0.14 1.08 -1.25 -1.84 0.00 0.00 175.26 173.11 1ggk s PRO 462 N -1.34 4.21 0.08 -4.83 0.04 -1.26 -5.19 135.00 126.71 1ggk s PRO 462 Ca -0.14 1.62 0.05 0.00 0.04 0.00 0.00 61.00 62.57 1ggk s PRO 462 Cb -0.06 -2.66 -0.03 0.00 0.04 0.00 0.00 34.50 31.78 1ggk s PRO 462 CO 0.03 -0.13 -0.14 0.54 0.04 0.00 0.00 177.00 177.34 1ggk s ASN 463 N -1.38 1.76 -0.02 6.66 2.20 -1.26 -5.03 114.94 117.86 1ggk s ASN 463 Ca 0.56 -0.66 0.19 0.00 -0.94 0.00 0.00 52.86 52.01 1ggk s ASN 463 Cb -0.25 -0.05 -0.29 0.00 -2.00 0.00 0.00 41.25 38.66 1ggk s ASN 463 CO 0.32 -0.09 0.48 -1.54 -2.94 0.00 0.00 177.10 173.33 1ggk n SER 464 N 1.12 0.61 0.28 3.54 3.41 -1.26 -1.74 113.62 119.59 1ggk n SER 464 Ca -0.20 -0.14 0.17 0.00 -0.26 0.00 0.00 58.87 58.44 1ggk n SER 464 Cb 0.55 1.76 0.78 0.00 -0.26 0.00 0.00 64.21 67.03 1ggk n SER 464 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 1ggk h ILE 465 N 0.00 0.18 0.00 -1.33 3.07 -1.99 -2.76 117.51 114.69 1ggk h ILE 465 Ca 0.00 -0.49 -0.00 0.00 1.55 0.00 0.00 64.86 65.92 1ggk h ILE 465 Cb 0.82 1.41 -0.01 0.00 -0.27 0.00 0.00 36.82 38.78 1ggk h ILE 465 CO 0.00 0.05 -0.14 -3.20 -1.05 0.00 0.00 178.15 173.82 1ggk n ASN 466 N -3.24 1.90 -3.82 2.16 5.15 -1.26 -4.93 115.26 111.23 1ggk n ASN 466 Ca -0.01 -2.96 -0.27 0.00 -0.60 0.00 0.00 54.58 50.74 1ggk n ASN 466 Cb 0.26 -0.40 0.03 0.00 -0.53 0.00 0.00 39.78 39.14 1ggk n ASN 466 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1ggk n ASP 467 N -1.15 -3.64 -1.70 1.20 2.03 -1.04 -2.06 116.55 110.19 1ggk n ASP 467 Ca 0.14 -0.78 -0.18 0.00 0.52 0.00 0.00 54.79 54.49 1ggk n ASP 467 Cb 0.66 -4.02 -0.04 0.00 -0.72 0.00 0.00 41.12 37.00 1ggk n ASP 467 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1ggk n ASN 468 N -2.92 -5.17 -4.88 1.67 5.15 -0.71 -5.01 115.26 103.39 1ggk n ASN 468 Ca -0.08 0.21 -0.36 0.00 -0.60 0.00 0.00 54.58 53.75 1ggk n ASN 468 Cb 0.58 -4.24 -0.06 0.00 -0.53 0.00 0.00 39.78 35.54 1ggk n ASN 468 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1ggk s TRP 469 N -2.77 3.60 0.53 1.20 0.52 -0.88 -3.69 118.94 117.45 1ggk s TRP 469 Ca 0.00 0.56 -0.18 0.00 0.02 0.00 0.00 56.10 56.49 1ggk s TRP 469 Cb 0.00 -1.97 -0.07 0.00 -1.15 0.00 0.00 33.47 30.29 1ggk s TRP 469 CO 0.00 0.68 1.04 -1.25 0.02 0.00 0.00 176.95 177.44 1ggk s PRO 470 N -1.41 3.62 -0.01 4.98 0.04 -1.26 -4.92 135.00 136.04 1ggk s PRO 470 Ca 0.22 1.29 -0.00 0.00 0.04 0.00 0.00 61.00 62.54 1ggk s PRO 470 Cb -0.13 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 1ggk s PRO 470 CO 0.11 -0.57 0.07 1.03 0.04 0.00 0.00 177.00 177.68 1ggk s ARG 471 N -3.59 3.05 0.80 4.56 0.52 -1.24 -5.06 118.95 117.98 1ggk s ARG 471 Ca 0.66 -0.48 -0.14 0.00 -0.52 0.00 0.00 55.73 55.24 1ggk s ARG 471 Cb -0.16 -2.85 0.06 0.00 0.52 0.00 0.00 34.95 32.53 1ggk s ARG 471 CO 0.27 0.65 1.11 0.39 0.02 0.00 0.00 175.30 177.74 1ggk n GLU 472 N 1.27 0.22 -4.10 3.54 1.02 -1.26 -5.02 120.64 116.30 1ggk n GLU 472 Ca -0.14 0.15 -0.21 0.00 -0.02 0.00 0.00 57.16 56.94 1ggk n GLU 472 Cb 0.53 -2.36 -0.17 0.00 -0.02 0.00 0.00 31.44 29.42 1ggk n GLU 472 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1ggk s THR 473 N -2.08 0.58 0.91 2.62 2.01 -1.26 -5.09 115.64 113.34 1ggk s THR 473 Ca 0.72 -0.11 -0.11 0.00 0.31 0.00 0.00 61.69 62.51 1ggk s THR 473 Cb -0.30 -0.62 0.13 0.00 0.01 0.00 0.00 72.50 71.72 1ggk s THR 473 CO 0.52 0.25 1.07 -2.65 -0.69 0.00 0.00 174.62 173.12 1ggk n PRO 474 N 4.29 -0.39 -2.14 4.92 -0.02 -1.26 -2.08 135.00 138.31 1ggk n PRO 474 Ca -0.21 -0.05 -0.34 0.00 -2.02 0.00 0.00 63.50 60.88 1ggk n PRO 474 Cb 0.51 -2.33 0.01 0.00 -0.02 0.00 0.00 33.50 31.67 1ggk n PRO 474 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1ggk s PRO 475 N -4.48 3.24 0.16 0.52 0.04 -1.26 -1.10 135.00 132.12 1ggk s PRO 475 Ca 0.66 1.53 -0.21 0.00 0.04 0.00 0.00 61.00 63.02 1ggk s PRO 475 Cb -0.23 -2.00 0.07 0.00 0.04 0.00 0.00 34.50 32.38 1ggk s PRO 475 CO 0.58 -0.93 1.01 0.41 0.04 0.00 0.00 177.00 178.12 1ggk n GLY 476 N -0.07 0.59 0.23 0.56 0.00 -1.26 -4.78 105.19 100.46 1ggk n GLY 476 Ca 0.11 -1.13 0.10 0.00 0.00 0.00 0.00 46.02 45.09 1ggk n GLY 476 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ggk h PRO 477 N 0.00 0.00 -3.12 1.61 0.13 -1.96 -3.40 132.00 125.26 1ggk h PRO 477 Ca -0.26 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.70 1ggk h PRO 477 Cb 1.15 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.02 1ggk h PRO 477 CO 0.35 0.23 -0.43 0.15 -0.23 0.00 0.00 178.00 178.06 1ggk s LYS 478 N -3.76 0.28 -0.82 0.86 1.02 -1.26 -4.89 119.74 111.17 1ggk s LYS 478 Ca -0.00 0.36 -0.02 0.00 0.02 0.00 0.00 55.97 56.33 1ggk s LYS 478 Cb 0.11 0.11 0.02 0.00 -0.52 0.00 0.00 37.83 37.55 1ggk s LYS 478 CO 0.63 -0.05 0.09 0.54 -0.92 0.00 0.00 175.35 175.64 1ggk n ARG 479 N 3.09 -2.60 -2.78 1.68 5.12 -1.26 -4.95 116.66 114.97 1ggk n ARG 479 Ca -0.14 0.40 -0.20 0.00 -1.93 0.00 0.00 57.85 55.98 1ggk n ARG 479 Cb 0.58 -4.99 0.05 0.00 -1.16 0.00 0.00 32.46 26.93 1ggk n ARG 479 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1ggk s GLY 480 N -2.16 1.83 0.73 -0.13 0.00 -1.26 -4.96 107.32 101.37 1ggk s GLY 480 Ca 0.08 -1.63 -0.11 0.00 0.00 0.00 0.00 44.72 43.06 1ggk s GLY 480 CO 0.10 -1.28 1.08 -0.32 0.00 0.00 0.00 173.10 172.68 1ggk s GLY 481 N -4.51 1.74 0.03 0.20 0.00 -0.26 -4.80 107.32 99.72 1ggk s GLY 481 Ca 0.59 0.25 -0.30 0.00 0.00 0.00 0.00 44.72 45.27 1ggk s GLY 481 CO 0.38 0.59 1.13 -0.12 0.00 0.00 0.00 173.10 175.09 1ggk s PHE 482 N -2.86 3.48 -0.04 1.90 5.36 -1.26 -4.13 117.98 120.43 1ggk s PHE 482 Ca 0.61 1.42 0.02 0.00 -0.96 0.00 0.00 56.93 58.02 1ggk s PHE 482 Cb -0.17 -3.33 0.01 0.00 -0.34 0.00 0.00 43.02 39.20 1ggk s PHE 482 CO 0.54 -0.89 -0.08 -2.00 -1.46 0.00 0.00 175.22 171.33 1ggk s GLU 483 N 1.16 1.01 0.40 10.12 2.12 -1.26 -4.99 118.70 127.26 1ggk s GLU 483 Ca 0.56 -0.24 -0.24 0.00 0.36 0.00 0.00 54.97 55.42 1ggk s GLU 483 Cb -0.26 -0.93 -0.09 0.00 0.26 0.00 0.00 34.13 33.10 1ggk s GLU 483 CO 0.28 0.02 1.05 -1.12 -0.54 0.00 0.00 175.26 174.95 1ggk s SER 484 N 0.55 6.73 0.17 -1.70 0.01 -1.26 -4.99 113.70 113.21 1ggk s SER 484 Ca -0.09 2.04 -0.32 0.00 1.31 0.00 0.00 55.95 58.89 1ggk s SER 484 Cb -0.12 -2.58 -0.12 0.00 0.21 0.00 0.00 66.02 63.41 1ggk s SER 484 CO 0.01 -0.51 1.77 0.00 0.41 0.00 0.00 173.24 174.91 1ggk n TYR 485 N -0.13 2.70 -1.56 2.43 9.36 -1.26 -4.89 117.16 123.82 1ggk n TYR 485 Ca 0.05 -0.03 -0.40 0.00 3.32 0.00 0.00 57.90 60.84 1ggk n TYR 485 Cb 0.50 -2.70 -0.02 0.00 -0.63 0.00 0.00 39.34 36.50 1ggk n TYR 485 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1ggk n GLN 486 N 4.61 3.42 -2.02 2.98 6.02 -1.26 -4.96 117.38 126.16 1ggk n GLN 486 Ca 0.17 -2.48 -0.39 0.00 -0.01 0.00 0.00 57.00 54.29 1ggk n GLN 486 Cb 0.36 -2.99 0.00 0.00 1.02 0.00 0.00 30.24 28.63 1ggk n GLN 486 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1ggk s GLU 487 N 2.32 3.76 -0.04 -1.09 2.12 -1.26 -4.99 118.70 119.53 1ggk s GLU 487 Ca 0.59 2.13 -0.27 0.00 0.36 0.00 0.00 54.97 57.78 1ggk s GLU 487 Cb 0.16 -2.60 -0.03 0.00 0.26 0.00 0.00 34.13 31.91 1ggk s GLU 487 CO -0.07 -0.65 0.84 0.50 -0.54 0.00 0.00 175.26 175.34 1ggk s ARG 488 N -2.45 4.49 -0.13 4.30 3.52 -1.26 -5.05 118.95 122.37 1ggk s ARG 488 Ca 0.61 1.15 -0.01 0.00 -0.13 0.00 0.00 55.73 57.34 1ggk s ARG 488 Cb -0.37 -3.46 -0.02 0.00 -1.56 0.00 0.00 34.95 29.53 1ggk s ARG 488 CO 0.47 -0.01 -0.08 0.08 -0.81 0.00 0.00 175.30 174.96 1ggk s VAL 489 N 0.95 3.54 -0.24 7.11 1.01 -1.26 -5.10 120.40 126.41 1ggk s VAL 489 Ca 0.45 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 1ggk s VAL 489 Cb -0.19 -2.51 0.12 0.00 0.00 0.00 0.00 36.38 33.80 1ggk s VAL 489 CO 0.23 0.53 0.50 -1.83 0.00 0.00 0.00 175.10 174.52 1ggk s GLU 490 N 0.12 0.43 0.00 2.72 -1.05 -1.26 -5.15 118.70 114.51 1ggk s GLU 490 Ca -0.03 1.10 0.00 0.00 -0.15 0.00 0.00 54.97 55.88 1ggk s GLU 490 Cb -0.14 0.42 0.00 0.00 -0.44 0.00 0.00 34.13 33.97 1ggk s GLU 490 CO 0.04 -0.32 0.00 0.41 0.95 0.00 0.00 175.26 176.34 1ggk n GLY 491 N 5.41 0.32 3.96 -3.83 0.00 -1.26 -5.15 105.19 104.63 1ggk n GLY 491 Ca -0.08 -1.09 -0.22 0.00 0.00 0.00 0.00 46.02 44.63 1ggk n GLY 491 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ggk s ASN 492 N 0.00 6.08 -0.52 1.61 0.01 -1.26 -5.02 114.94 115.84 1ggk s ASN 492 Ca 0.00 0.24 -0.27 0.00 -0.71 0.00 0.00 52.86 52.12 1ggk s ASN 492 Cb 0.00 -1.70 -0.03 0.00 0.41 0.00 0.00 41.25 39.93 1ggk s ASN 492 CO 0.00 -0.44 1.96 -0.54 -1.51 0.00 0.00 177.10 176.58 1ggk s LYS 493 N -4.34 2.68 0.08 -0.60 1.02 -1.26 -4.96 119.74 112.37 1ggk s LYS 493 Ca 0.43 0.98 0.05 0.00 0.02 0.00 0.00 55.97 57.45 1ggk s LYS 493 Cb -0.10 -4.39 -0.03 0.00 -0.52 0.00 0.00 37.83 32.80 1ggk s LYS 493 CO 0.35 -2.64 -0.13 0.14 -0.92 0.00 0.00 175.35 172.15 1ggk s VAL 494 N 9.22 1.07 -0.91 3.17 -7.23 -1.26 -5.06 120.40 119.39 1ggk s VAL 494 Ca 0.77 -1.37 -0.09 0.00 -1.81 0.00 0.00 61.98 59.48 1ggk s VAL 494 Cb -0.16 -1.11 0.23 0.00 0.56 0.00 0.00 36.38 35.90 1ggk s VAL 494 CO 0.25 -0.30 0.84 -0.13 -0.31 0.00 0.00 175.10 175.45 1ggk s ARG 495 N -1.94 3.61 -0.03 4.82 0.52 -1.26 -5.02 118.95 119.64 1ggk s ARG 495 Ca -0.01 -2.88 -0.18 0.00 -0.52 0.00 0.00 55.73 52.14 1ggk s ARG 495 Cb -0.09 -4.29 0.03 0.00 0.52 0.00 0.00 34.95 31.13 1ggk s ARG 495 CO 0.02 -1.25 0.38 -2.00 0.02 0.00 0.00 175.30 172.47 1ggk s GLU 496 N -0.64 0.72 0.07 3.54 2.12 -1.26 -5.15 118.70 118.11 1ggk s GLU 496 Ca 0.24 -0.05 -0.20 0.00 0.36 0.00 0.00 54.97 55.32 1ggk s GLU 496 Cb -0.11 0.33 -0.07 0.00 0.26 0.00 0.00 34.13 34.54 1ggk s GLU 496 CO -0.09 -0.20 0.60 0.50 -0.54 0.00 0.00 175.26 175.53 1ggk s ARG 497 N -1.17 4.26 0.26 4.30 6.06 -1.26 -5.04 118.95 126.36 1ggk s ARG 497 Ca -0.12 0.78 -0.30 0.00 -2.50 0.00 0.00 55.73 53.60 1ggk s ARG 497 Cb -0.04 -3.26 -0.10 0.00 0.06 0.00 0.00 34.95 31.61 1ggk s ARG 497 CO 0.05 0.57 1.30 0.45 -2.50 0.00 0.00 175.30 175.17 1ggk s SER 498 N -0.91 6.87 0.52 -2.12 0.15 -1.26 -4.90 113.70 112.04 1ggk s SER 498 Ca 0.30 2.52 0.23 0.00 0.70 0.00 0.00 55.95 59.70 1ggk s SER 498 Cb -0.20 -2.63 1.35 0.00 -1.71 0.00 0.00 66.02 62.83 1ggk s SER 498 CO 0.19 -0.51 2.00 -0.65 1.20 0.00 0.00 173.24 175.48 1ggk h PRO 499 N 4.49 0.04 0.00 5.44 0.11 -2.00 -0.07 132.00 140.01 1ggk h PRO 499 Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ggk h PRO 499 Cb 1.22 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ggk h PRO 499 CO 0.72 0.03 0.00 -1.13 -0.21 0.00 0.00 178.00 177.41 1ggk n SER 500 N -4.40 0.40 -0.02 -2.05 3.41 -1.26 -2.47 113.62 107.22 1ggk n SER 500 Ca 0.09 0.60 0.12 0.00 -0.26 0.00 0.00 58.87 59.42 1ggk n SER 500 Cb 0.55 -0.69 0.28 0.00 -0.26 0.00 0.00 64.21 64.09 1ggk n SER 500 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1ggk n PHE 501 N -1.94 0.00 -0.89 7.33 3.01 -0.04 -4.27 117.46 120.66 1ggk n PHE 501 Ca 0.02 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.39 1ggk n PHE 501 Cb 0.19 -0.25 -0.13 0.00 -0.01 0.00 0.00 39.48 39.28 1ggk n PHE 501 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ggk n GLY 502 N 1.49 2.91 2.77 1.37 0.00 -1.03 -4.81 105.19 107.89 1ggk n GLY 502 Ca 0.06 -0.93 -0.17 0.00 0.00 0.00 0.00 46.02 44.97 1ggk n GLY 502 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ggk s GLU 503 N 0.69 -0.01 0.00 1.61 -6.30 -1.26 -5.06 118.70 108.36 1ggk s GLU 503 Ca 0.51 0.41 0.03 0.00 -2.50 0.00 0.00 54.97 53.42 1ggk s GLU 503 Cb 0.24 -0.35 0.01 0.00 0.00 0.00 0.00 34.13 34.03 1ggk s GLU 503 CO -0.00 -0.28 0.48 0.66 0.02 0.00 0.00 175.26 176.14 1ggk n TYR 504 N 5.01 0.00 -0.01 5.30 4.01 -1.26 -4.86 117.16 125.35 1ggk n TYR 504 Ca -0.10 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.65 1ggk n TYR 504 Cb 0.50 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.50 1ggk n TYR 504 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1ggk n TYR 505 N -0.14 0.00 0.09 -0.72 4.01 -1.26 -4.61 117.16 114.53 1ggk n TYR 505 Ca 0.02 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.68 1ggk n TYR 505 Cb 0.08 -0.14 0.01 0.00 -0.31 0.00 0.00 39.34 38.97 1ggk n TYR 505 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1ggk h SER 506 N 0.00 0.20 -0.21 7.72 4.64 -1.89 -2.64 113.55 121.37 1ggk h SER 506 Ca -0.04 -0.16 -0.03 0.00 -0.47 0.00 0.00 61.79 61.10 1ggk h SER 506 Cb 0.57 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1ggk h SER 506 CO 0.00 0.95 0.03 0.45 -0.87 0.00 0.00 176.83 177.39 1ggk h HIS 507 N 0.09 0.38 -0.90 4.77 3.86 -1.92 -0.68 115.15 120.76 1ggk h HIS 507 Ca -0.03 -0.06 0.16 0.00 -1.16 0.00 0.00 60.37 59.28 1ggk h HIS 507 Cb 1.47 -0.10 -0.10 0.00 1.06 0.00 0.00 27.41 29.73 1ggk h HIS 507 CO 0.02 0.51 0.48 -1.35 0.86 0.00 0.00 177.93 178.45 1ggk h PRO 508 N 0.15 0.64 -0.26 2.45 0.11 -1.83 -0.95 132.00 132.31 1ggk h PRO 508 Ca 0.06 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.07 1ggk h PRO 508 Cb 0.34 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 1ggk h PRO 508 CO 0.01 0.42 -0.10 -0.09 -0.21 0.00 0.00 178.00 178.03 1ggk h ARG 509 N 0.66 0.53 -0.79 1.05 2.43 -1.15 -0.96 114.38 116.15 1ggk h ARG 509 Ca 0.50 -0.22 0.14 0.00 -0.81 0.00 0.00 59.98 59.59 1ggk h ARG 509 Cb 0.73 -0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 30.17 1ggk h ARG 509 CO -0.37 0.77 0.36 1.25 -1.51 0.00 0.00 179.97 180.46 1ggk h LEU 510 N 0.26 0.40 -0.17 3.80 5.85 0.05 -1.46 115.31 124.04 1ggk h LEU 510 Ca 0.06 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1ggk h LEU 510 Cb 0.60 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1ggk h LEU 510 CO 0.03 0.17 0.06 0.15 -0.34 0.00 0.00 178.44 178.51 1ggk h PHE 511 N 0.53 0.28 -0.26 1.25 3.04 -1.01 -2.93 116.94 117.85 1ggk h PHE 511 Ca 0.42 -0.03 0.03 0.00 3.98 0.00 0.00 57.97 62.38 1ggk h PHE 511 Cb 0.60 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 39.00 1ggk h PHE 511 CO -0.13 0.37 0.06 2.35 -2.02 0.00 0.00 178.31 178.95 1ggk h TRP 512 N 0.11 0.11 0.00 0.41 2.91 -0.61 -2.71 115.95 116.17 1ggk h TRP 512 Ca 0.06 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.09 1ggk h TRP 512 Cb 0.22 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 28.86 1ggk h TRP 512 CO -0.00 0.04 0.00 1.28 -1.03 0.00 0.00 178.44 178.73 1ggk n LEU 513 N -5.07 0.03 -0.06 0.65 4.77 -0.60 -2.53 117.00 114.18 1ggk n LEU 513 Ca -0.01 0.51 0.11 0.00 -0.03 0.00 0.00 56.01 56.58 1ggk n LEU 513 Cb 0.10 -0.50 0.08 0.00 -2.33 0.00 0.00 43.42 40.78 1ggk n LEU 513 CO 0.28 -0.22 0.25 -1.20 -1.33 0.00 0.00 177.39 175.17 1ggk n SER 514 N -1.53 0.89 -4.83 -1.43 7.64 -1.03 -4.85 113.62 108.48 1ggk n SER 514 Ca 0.04 -0.73 -0.31 0.00 1.01 0.00 0.00 58.87 58.88 1ggk n SER 514 Cb 0.20 0.58 0.03 0.00 -1.01 0.00 0.00 64.21 64.00 1ggk n SER 514 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1ggk s GLN 515 N -2.91 3.23 0.88 1.43 -1.52 -1.05 -4.39 119.66 115.32 1ggk s GLN 515 Ca 0.12 0.96 -0.12 0.00 -1.95 0.00 0.00 55.36 54.37 1ggk s GLN 515 Cb 0.17 -2.03 0.12 0.00 -0.22 0.00 0.00 33.01 31.05 1ggk s GLN 515 CO 0.74 -0.87 1.11 0.95 -0.25 0.00 0.00 175.29 176.98 1ggk s THR 516 N -2.93 2.50 0.22 -0.19 -4.23 -1.26 -4.85 115.64 104.90 1ggk s THR 516 Ca 0.58 0.16 -0.08 0.00 -1.18 0.00 0.00 61.69 61.18 1ggk s THR 516 Cb -0.13 -2.85 0.19 0.00 1.34 0.00 0.00 72.50 71.04 1ggk s THR 516 CO 0.49 -0.21 1.85 -0.65 -0.54 0.00 0.00 174.62 175.57 1ggk h PRO 517 N -1.39 1.18 0.00 3.99 0.11 -1.98 -1.11 132.00 132.79 1ggk h PRO 517 Ca -0.49 -0.13 -0.10 0.00 0.11 0.00 0.00 66.00 65.39 1ggk h PRO 517 Cb 1.30 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1ggk h PRO 517 CO 0.60 0.85 -0.48 0.27 -0.21 0.00 0.00 178.00 179.03 1ggk h PHE 518 N 1.18 0.00 -0.03 0.65 -0.00 -1.98 -2.48 116.94 114.28 1ggk h PHE 518 Ca 0.30 0.00 -0.15 0.00 -0.00 0.00 0.00 57.97 58.12 1ggk h PHE 518 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 35.94 1ggk h PHE 518 CO 0.00 0.48 -0.68 0.93 -0.00 0.00 0.00 178.31 179.04 1ggk h GLU 519 N 0.00 0.13 -0.62 6.09 5.08 -1.71 -2.60 114.58 120.95 1ggk h GLU 519 Ca -0.00 -0.10 -0.09 0.00 -1.00 0.00 0.00 59.36 58.16 1ggk h GLU 519 Cb 1.04 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 1ggk h GLU 519 CO 0.06 0.76 0.03 1.96 -1.00 0.00 0.00 179.01 180.82 1ggk h GLN 520 N 0.09 1.07 -0.82 2.33 4.20 -1.04 -1.77 115.11 119.17 1ggk h GLN 520 Ca -0.01 -0.33 -0.04 0.00 0.06 0.00 0.00 58.65 58.34 1ggk h GLN 520 Cb 1.21 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 28.85 1ggk h GLN 520 CO 0.10 1.03 0.37 -0.09 -0.67 0.00 0.00 178.83 179.57 1ggk h ARG 521 N 0.97 1.19 -0.09 1.46 9.65 -1.36 -1.16 114.38 125.05 1ggk h ARG 521 Ca 0.18 -0.19 -0.11 0.00 -1.10 0.00 0.00 59.98 58.76 1ggk h ARG 521 Cb 0.53 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 28.88 1ggk h ARG 521 CO 0.03 0.93 -0.46 0.45 2.80 0.00 0.00 179.97 183.72 1ggk h HIS 522 N 1.18 0.26 -0.10 2.20 3.86 -1.08 -1.26 115.15 120.21 1ggk h HIS 522 Ca 0.28 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.40 1ggk h HIS 522 Cb 0.15 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 1ggk h HIS 522 CO 0.02 0.64 0.02 0.82 0.86 0.00 0.00 177.93 180.28 1ggk h ILE 523 N 0.18 1.21 -0.23 2.45 2.04 -0.74 0.23 117.51 122.64 1ggk h ILE 523 Ca 0.01 -0.65 0.04 0.00 1.00 0.00 0.00 64.86 65.26 1ggk h ILE 523 Cb 0.88 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 38.38 1ggk h ILE 523 CO 0.07 0.19 -0.00 0.58 0.00 0.00 0.00 178.15 178.98 1ggk h VAL 524 N -0.07 0.83 -0.55 1.67 2.07 -0.99 -1.93 116.25 117.28 1ggk h VAL 524 Ca 0.03 -0.02 -0.06 0.00 0.82 0.00 0.00 66.70 67.47 1ggk h VAL 524 Cb 0.28 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1ggk h VAL 524 CO 0.00 0.01 0.11 0.44 0.02 0.00 0.00 177.57 178.16 1ggk h ASP 525 N 0.07 0.81 0.22 0.57 3.45 -1.12 -0.87 116.42 119.55 1ggk h ASP 525 Ca 0.11 -0.16 -0.01 0.00 0.43 0.00 0.00 57.03 57.40 1ggk h ASP 525 Cb 0.14 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 38.70 1ggk h ASP 525 CO -0.19 0.81 -0.11 1.23 -1.57 0.00 0.00 179.24 179.42 1ggk h GLY 526 N 0.99 -0.31 0.44 2.75 0.00 -0.41 -0.72 103.07 105.82 1ggk h GLY 526 Ca 0.18 0.11 0.09 0.00 0.00 0.00 0.00 47.33 47.71 1ggk h GLY 526 CO 0.00 -0.11 0.29 0.74 0.00 0.00 0.00 176.54 177.46 1ggk h PHE 527 N -0.37 0.52 -0.28 5.60 0.04 -1.26 -1.01 116.94 120.18 1ggk h PHE 527 Ca -0.03 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 1ggk h PHE 527 Cb 0.29 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 1ggk h PHE 527 CO -0.04 0.17 -0.01 0.77 -0.60 0.00 0.00 178.31 178.60 1ggk h SER 528 N 0.51 0.49 0.25 2.17 0.02 -1.00 -1.16 113.55 114.83 1ggk h SER 528 Ca 0.33 -0.32 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1ggk h SER 528 Cb 0.37 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 1ggk h SER 528 CO -0.28 0.69 -0.14 0.15 -1.14 0.00 0.00 176.83 176.10 1ggk h PHE 529 N 0.28 -0.37 -0.58 3.45 3.04 -0.89 -2.20 116.94 119.67 1ggk h PHE 529 Ca 0.08 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.01 1ggk h PHE 529 Cb 0.44 0.13 -0.03 0.00 2.56 0.00 0.00 35.95 39.06 1ggk h PHE 529 CO 0.04 -0.23 0.32 0.93 -2.02 0.00 0.00 178.31 177.35 1ggk h GLU 530 N -0.37 0.81 0.00 1.11 4.39 -1.13 -2.71 114.58 116.67 1ggk h GLU 530 Ca -0.03 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.58 1ggk h GLU 530 Cb 0.31 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1ggk h GLU 530 CO 0.03 0.61 0.00 -0.07 -1.16 0.00 0.00 179.01 178.42 1ggk h LEU 531 N 0.78 0.00 -0.76 1.33 3.38 -1.19 -2.30 115.31 116.55 1ggk h LEU 531 Ca 0.21 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 1ggk h LEU 531 Cb 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1ggk h LEU 531 CO -0.03 0.00 -0.29 0.77 0.09 0.00 0.00 178.44 178.97 1ggk h SER 532 N 0.00 0.00 0.45 -0.43 4.64 -1.06 -2.53 113.55 114.62 1ggk h SER 532 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ggk h SER 532 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1ggk h SER 532 CO 0.00 0.29 -0.15 0.29 -0.87 0.00 0.00 176.83 176.40 1ggk n LYS 533 N -3.35 0.53 -2.73 4.77 4.76 -0.87 -4.82 118.16 116.46 1ggk n LYS 533 Ca 0.01 -0.19 -0.42 0.00 -2.87 0.00 0.00 58.31 54.83 1ggk n LYS 533 Cb 0.52 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 32.18 1ggk n LYS 533 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1ggk s VAL 534 N -2.60 4.76 0.02 -0.18 1.01 -0.96 -4.61 120.40 117.84 1ggk s VAL 534 Ca 0.25 1.91 -0.20 0.00 0.00 0.00 0.00 61.98 63.94 1ggk s VAL 534 Cb 0.20 -4.26 -0.19 0.00 0.00 0.00 0.00 36.38 32.12 1ggk s VAL 534 CO 0.51 -0.08 1.19 0.58 0.00 0.00 0.00 175.10 177.30 1ggk h VAL 535 N 5.30 1.41 -3.69 2.92 2.07 -1.87 -3.42 116.25 118.97 1ggk h VAL 535 Ca -0.25 -1.80 -0.56 0.00 0.82 0.00 0.00 66.70 64.91 1ggk h VAL 535 Cb 1.10 2.33 -0.07 0.00 -1.52 0.00 0.00 31.29 33.13 1ggk h VAL 535 CO 0.91 0.53 0.93 -0.13 0.02 0.00 0.00 177.57 179.83 1ggk s ARG 536 N -3.59 3.73 0.52 1.57 0.52 -1.26 -4.94 118.95 115.49 1ggk s ARG 536 Ca -0.14 0.59 0.20 0.00 -0.52 0.00 0.00 55.73 55.86 1ggk s ARG 536 Cb 0.04 -3.91 1.31 0.00 0.52 0.00 0.00 34.95 32.91 1ggk s ARG 536 CO 0.80 -1.38 2.07 -1.35 0.02 0.00 0.00 175.30 175.46 1ggk h PRO 537 N 9.26 0.02 0.00 3.54 0.11 -1.99 -1.86 132.00 141.08 1ggk h PRO 537 Ca -0.23 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.84 1ggk h PRO 537 Cb 1.06 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 1ggk h PRO 537 CO 1.13 0.02 -0.16 0.10 -0.21 0.00 0.00 178.00 178.87 1ggk h TYR 538 N 0.02 0.00 -0.48 0.65 -0.00 -1.98 -2.26 116.97 112.93 1ggk h TYR 538 Ca 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 58.73 58.76 1ggk h TYR 538 Cb 0.46 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.17 1ggk h TYR 538 CO -0.00 0.16 -0.08 0.82 -0.00 0.00 0.00 178.16 179.06 1ggk h ILE 539 N 0.00 1.26 -0.41 -0.90 2.04 -1.75 -1.59 117.51 116.15 1ggk h ILE 539 Ca -0.00 -1.17 -0.04 0.00 1.00 0.00 0.00 64.86 64.65 1ggk h ILE 539 Cb 0.34 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 1ggk h ILE 539 CO 0.02 0.41 0.11 0.03 0.00 0.00 0.00 178.15 178.72 1ggk h ARG 540 N 0.78 0.65 -0.06 2.37 3.08 -1.53 -2.20 114.38 117.47 1ggk h ARG 540 Ca 0.13 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1ggk h ARG 540 Cb 0.59 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 1ggk h ARG 540 CO 0.04 0.66 0.04 0.93 -1.07 0.00 0.00 179.97 180.56 1ggk h GLU 541 N 0.53 0.08 -0.32 0.04 5.08 -1.37 -1.85 114.58 116.76 1ggk h GLU 541 Ca 0.13 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1ggk h GLU 541 Cb 0.29 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1ggk h GLU 541 CO -0.00 0.07 0.06 0.00 -1.00 0.00 0.00 179.01 178.14 1ggk h ARG 542 N 0.05 0.47 -0.35 2.33 3.08 -1.18 -1.95 114.38 116.83 1ggk h ARG 542 Ca 0.02 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1ggk h ARG 542 Cb 0.02 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1ggk h ARG 542 CO -0.00 0.45 0.08 0.28 -1.07 0.00 0.00 179.97 179.71 1ggk h VAL 543 N 0.46 1.22 -0.64 2.04 2.07 -1.11 -2.17 116.25 118.13 1ggk h VAL 543 Ca 0.11 -0.76 0.03 0.00 0.82 0.00 0.00 66.70 66.90 1ggk h VAL 543 Cb 0.21 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1ggk h VAL 543 CO -0.00 0.26 0.39 0.58 0.02 0.00 0.00 177.57 178.82 1ggk h VAL 544 N 0.41 1.07 -0.31 2.57 2.07 -1.03 0.95 116.25 121.98 1ggk h VAL 544 Ca 0.11 -0.26 0.06 0.00 0.82 0.00 0.00 66.70 67.43 1ggk h VAL 544 Cb 0.31 0.24 -0.05 0.00 -1.52 0.00 0.00 31.29 30.26 1ggk h VAL 544 CO 0.00 0.14 -0.04 -0.78 0.02 0.00 0.00 177.57 176.91 1ggk h ASP 545 N 0.76 -0.22 -0.73 0.57 -0.00 -1.23 -0.56 116.42 115.01 1ggk h ASP 545 Ca 0.26 0.08 0.02 0.00 -0.00 0.00 0.00 57.03 57.40 1ggk h ASP 545 Cb 0.04 0.16 -0.04 0.00 -0.00 0.00 0.00 39.33 39.49 1ggk h ASP 545 CO -0.11 -0.07 0.47 1.56 -0.00 0.00 0.00 179.24 181.09 1ggk h GLN 546 N 0.04 0.91 -0.15 0.28 1.08 -0.58 -1.11 115.11 115.57 1ggk h GLN 546 Ca 0.15 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.29 1ggk h GLN 546 Cb 0.22 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 1ggk h GLN 546 CO -0.29 0.60 0.06 -0.07 -0.95 0.00 0.00 178.83 178.18 1ggk h LEU 547 N 0.94 0.19 -1.75 1.46 3.38 0.11 -2.03 115.31 117.61 1ggk h LEU 547 Ca 0.29 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 1ggk h LEU 547 Cb -0.03 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1ggk h LEU 547 CO -0.09 0.18 -0.01 0.00 0.09 0.00 0.00 178.44 178.60 1ggk h ALA 548 N 1.85 1.01 0.00 1.53 0.00 0.20 -1.87 119.26 121.98 1ggk h ALA 548 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ggk h ALA 548 Cb 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ggk h ALA 548 CO -0.01 0.02 0.00 0.45 0.00 0.00 0.00 179.25 179.71 1ggk h HIS 549 N 0.00 0.00 0.00 0.00 3.86 -1.27 -3.34 115.15 114.40 1ggk h HIS 549 Ca -0.00 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.02 1ggk h HIS 549 Cb 0.42 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.86 1ggk h HIS 549 CO 0.00 0.00 -1.26 -0.89 0.86 0.00 0.00 177.93 176.64 1ggk n ILE 550 N -2.54 1.50 -3.64 2.45 5.41 -0.75 -4.33 119.36 117.45 1ggk n ILE 550 Ca 0.04 -0.01 -0.05 0.00 1.00 0.00 0.00 62.75 63.74 1ggk n ILE 550 Cb 0.40 -2.14 -0.07 0.00 -0.71 0.00 0.00 39.64 37.12 1ggk n ILE 550 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1ggk s ASP 551 N -6.58 -0.74 0.21 4.38 -1.08 -0.91 -4.73 116.67 107.22 1ggk s ASP 551 Ca -0.27 1.18 -0.10 0.00 -0.52 0.00 0.00 52.55 52.85 1ggk s ASP 551 Cb 0.06 1.33 0.15 0.00 -1.46 0.00 0.00 42.92 43.01 1ggk s ASP 551 CO 0.46 -0.19 1.83 -0.07 0.52 0.00 0.00 175.17 177.72 1ggk h LEU 552 N 6.60 0.95 -0.48 -1.34 -0.00 -1.81 -2.46 115.31 116.78 1ggk h LEU 552 Ca -0.29 -0.09 -0.06 0.00 -0.00 0.00 0.00 57.88 57.45 1ggk h LEU 552 Cb 1.21 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 41.61 1ggk h LEU 552 CO 0.17 0.76 0.08 0.74 -0.00 0.00 0.00 178.44 180.19 1ggk h THR 553 N 1.06 1.25 -0.07 0.22 2.02 -1.97 0.72 112.91 116.14 1ggk h THR 553 Ca 0.27 -0.92 0.03 0.00 0.77 0.00 0.00 66.41 66.56 1ggk h THR 553 Cb 0.02 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.32 1ggk h THR 553 CO -0.05 0.32 -0.11 0.25 0.37 0.00 0.00 175.52 176.31 1ggk h LEU 554 N 0.66 -0.35 -0.51 2.58 6.46 -1.90 -1.99 115.31 120.26 1ggk h LEU 554 Ca 0.14 0.06 -0.10 0.00 -0.12 0.00 0.00 57.88 57.86 1ggk h LEU 554 Cb 0.39 0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.47 1ggk h LEU 554 CO 0.01 -0.16 -0.09 0.00 -0.62 0.00 0.00 178.44 177.59 1ggk h ALA 555 N 0.88 0.70 -0.83 1.25 0.00 -1.32 -1.97 119.26 117.96 1ggk h ALA 555 Ca 0.07 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1ggk h ALA 555 Cb 0.25 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1ggk h ALA 555 CO -0.17 0.59 0.50 1.96 0.00 0.00 0.00 179.25 182.13 1ggk h GLN 556 N 0.83 1.13 -0.52 0.00 4.20 -0.68 0.15 115.11 120.22 1ggk h GLN 556 Ca 0.13 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 58.64 1ggk h GLN 556 Cb 0.64 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1ggk h GLN 556 CO 0.04 0.79 -0.06 0.00 -0.67 0.00 0.00 178.83 178.93 1ggk h ALA 557 N 1.27 0.71 -0.28 3.87 0.00 -1.31 -1.87 119.26 121.66 1ggk h ALA 557 Ca 0.30 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1ggk h ALA 557 Cb -0.04 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1ggk h ALA 557 CO -0.06 0.59 -0.29 0.28 0.00 0.00 0.00 179.25 179.77 1ggk h VAL 558 N 0.84 1.31 -0.52 0.00 2.07 -1.06 -3.16 116.25 115.72 1ggk h VAL 558 Ca 0.14 -1.46 0.08 0.00 0.82 0.00 0.00 66.70 66.28 1ggk h VAL 558 Cb 0.62 1.61 -0.06 0.00 -1.52 0.00 0.00 31.29 31.94 1ggk h VAL 558 CO 0.04 0.46 0.18 0.00 0.02 0.00 0.00 177.57 178.27 1ggk h ALA 559 N 0.69 0.64 -0.43 1.67 0.00 -0.55 -2.53 119.26 118.76 1ggk h ALA 559 Ca 0.04 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1ggk h ALA 559 Cb 0.86 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1ggk h ALA 559 CO 0.07 -0.22 0.08 -0.22 0.00 0.00 0.00 179.25 178.96 1ggk h LYS 560 N 0.35 0.65 0.00 0.00 1.63 -1.35 -0.77 116.57 117.08 1ggk h LYS 560 Ca 0.26 -0.13 -0.00 0.00 -0.85 0.00 0.00 60.65 59.93 1ggk h LYS 560 Cb 0.29 -0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 31.82 1ggk h LYS 560 CO -0.27 0.61 -0.01 -0.91 -3.45 0.00 0.00 179.45 175.43 1ggk h ASN 561 N 0.63 0.00 -0.25 4.20 2.35 -1.42 -2.79 115.58 118.30 1ggk h ASN 561 Ca 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1ggk h ASN 561 Cb 0.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1ggk h ASN 561 CO 0.00 0.01 0.00 0.18 -1.65 0.00 0.00 177.43 175.97 1ggk n LEU 562 N -3.10 3.09 -3.21 1.61 4.77 -0.56 -4.98 117.00 114.62 1ggk n LEU 562 Ca 0.01 -1.36 -0.20 0.00 -0.03 0.00 0.00 56.01 54.42 1ggk n LEU 562 Cb 0.31 -0.16 0.07 0.00 -2.33 0.00 0.00 43.42 41.31 1ggk n LEU 562 CO 0.27 0.64 0.19 0.61 -1.33 0.00 0.00 177.39 177.77 1ggk n GLY 563 N 1.25 -0.35 3.57 -0.72 0.00 -0.73 -5.04 105.19 103.17 1ggk n GLY 563 Ca 0.16 0.12 -0.30 0.00 0.00 0.00 0.00 46.02 46.00 1ggk n GLY 563 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ggk s ILE 564 N -3.29 3.39 -0.08 -0.61 1.01 -0.40 -5.02 121.20 116.19 1ggk s ILE 564 Ca 0.41 -1.18 -0.01 0.00 0.00 0.00 0.00 60.65 59.88 1ggk s ILE 564 Cb -0.18 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.70 1ggk s ILE 564 CO 0.64 0.17 -0.04 -1.61 0.00 0.00 0.00 174.94 174.11 1ggk s GLU 565 N -2.03 2.91 0.36 2.79 2.02 -1.26 -4.24 118.70 119.25 1ggk s GLU 565 Ca 0.20 -0.49 -0.24 0.00 0.02 0.00 0.00 54.97 54.47 1ggk s GLU 565 Cb -0.11 -2.70 -0.10 0.00 0.10 0.00 0.00 34.13 31.32 1ggk s GLU 565 CO 0.12 0.65 0.93 -0.51 0.02 0.00 0.00 175.26 176.47 1ggk s LEU 566 N -0.75 4.18 0.70 1.80 1.43 -1.26 -5.05 118.68 119.73 1ggk s LEU 566 Ca 0.11 1.74 -0.11 0.00 -1.03 0.00 0.00 54.13 54.84 1ggk s LEU 566 Cb -0.11 -4.19 0.01 0.00 0.03 0.00 0.00 46.19 41.93 1ggk s LEU 566 CO 0.02 -0.18 1.08 0.42 0.23 0.00 0.00 176.35 177.93 1ggk s THR 567 N -1.83 3.67 0.30 5.49 -4.23 -1.26 -4.88 115.64 112.90 1ggk s THR 567 Ca 0.54 0.54 0.02 0.00 -1.18 0.00 0.00 61.69 61.62 1ggk s THR 567 Cb -0.15 -3.51 0.12 0.00 1.34 0.00 0.00 72.50 70.31 1ggk s THR 567 CO 0.19 -0.71 1.81 0.44 -0.54 0.00 0.00 174.62 175.81 1ggk h ASP 568 N -0.64 0.58 -0.66 3.99 3.45 -1.99 -1.20 116.42 119.95 1ggk h ASP 568 Ca -0.45 -0.14 -0.03 0.00 0.43 0.00 0.00 57.03 56.85 1ggk h ASP 568 Cb 1.24 -0.15 -0.03 0.00 -0.56 0.00 0.00 39.33 39.83 1ggk h ASP 568 CO 0.63 0.68 0.29 0.44 -1.57 0.00 0.00 179.24 179.71 1ggk h ASP 569 N 0.56 0.88 -0.43 6.45 5.19 -1.99 -2.20 116.42 124.88 1ggk h ASP 569 Ca 0.11 -0.15 -0.04 0.00 -0.62 0.00 0.00 57.03 56.33 1ggk h ASP 569 Cb 0.44 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 39.70 1ggk h ASP 569 CO 0.02 0.78 0.13 1.56 -3.12 0.00 0.00 179.24 178.61 1ggk h GLN 570 N 0.92 0.74 0.00 3.56 4.20 -1.62 -2.22 115.11 120.69 1ggk h GLN 570 Ca 0.22 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1ggk h GLN 570 Cb 0.15 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1ggk h GLN 570 CO -0.02 0.67 0.00 -0.07 -0.67 0.00 0.00 178.83 178.73 1ggk h LEU 571 N 0.72 0.00 -2.54 1.46 3.38 -0.66 -2.83 115.31 114.84 1ggk h LEU 571 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1ggk h LEU 571 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1ggk h LEU 571 CO -0.00 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.12 1ggk n ASN 572 N -2.72 3.23 -4.73 -0.43 3.02 -0.84 -4.99 115.26 107.80 1ggk n ASN 572 Ca 0.00 -1.94 -0.42 0.00 -0.03 0.00 0.00 54.58 52.19 1ggk n ASN 572 Cb 0.21 -0.28 -0.02 0.00 -0.61 0.00 0.00 39.78 39.08 1ggk n ASN 572 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1ggk n ILE 573 N 1.08 0.81 -2.52 2.41 5.41 -1.07 -4.93 119.36 120.54 1ggk n ILE 573 Ca 0.16 -0.20 -0.42 0.00 1.00 0.00 0.00 62.75 63.29 1ggk n ILE 573 Cb 0.51 -1.89 -0.03 0.00 -0.71 0.00 0.00 39.64 37.51 1ggk n ILE 573 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1ggk s THR 574 N 0.22 4.29 0.73 1.39 -1.32 -1.26 -5.02 115.64 114.67 1ggk s THR 574 Ca 0.67 1.67 -0.15 0.00 -1.21 0.00 0.00 61.69 62.67 1ggk s THR 574 Cb -0.52 -4.07 0.04 0.00 -1.51 0.00 0.00 72.50 66.44 1ggk s THR 574 CO 0.46 0.14 1.19 -2.16 -2.21 0.00 0.00 174.62 172.03 1ggk s PRO 575 N 0.94 2.17 0.87 7.08 0.04 -1.26 -4.99 135.00 139.84 1ggk s PRO 575 Ca 0.56 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 63.17 1ggk s PRO 575 Cb -0.27 -1.84 0.11 0.00 0.04 0.00 0.00 34.50 32.54 1ggk s PRO 575 CO 0.29 -1.80 1.09 -1.25 0.04 0.00 0.00 177.00 175.38 1ggk s PRO 576 N -4.00 1.50 0.96 0.56 0.04 -1.26 -5.03 135.00 127.78 1ggk s PRO 576 Ca 0.73 0.75 -0.12 0.00 0.04 0.00 0.00 61.00 62.39 1ggk s PRO 576 Cb -0.27 -1.84 0.17 0.00 0.04 0.00 0.00 34.50 32.59 1ggk s PRO 576 CO 0.46 -2.05 1.10 -1.25 0.04 0.00 0.00 177.00 175.30 1ggk s PRO 577 N -5.01 0.72 0.97 0.56 0.04 -1.26 -4.96 135.00 126.05 1ggk s PRO 577 Ca 0.63 0.51 -0.12 0.00 0.04 0.00 0.00 61.00 62.06 1ggk s PRO 577 Cb -0.17 -1.77 0.17 0.00 0.04 0.00 0.00 34.50 32.77 1ggk s PRO 577 CO 0.56 -2.54 1.09 -0.51 0.04 0.00 0.00 177.00 175.64 1ggk s ASP 578 N -3.58 2.78 -0.43 6.66 -0.00 -1.26 -4.75 116.67 116.10 1ggk s ASP 578 Ca 0.65 1.54 -0.15 0.00 -0.00 0.00 0.00 52.55 54.58 1ggk s ASP 578 Cb -0.18 -2.20 0.04 0.00 -0.00 0.00 0.00 42.92 40.58 1ggk s ASP 578 CO 0.57 -3.08 0.33 -0.69 -0.00 0.00 0.00 175.17 172.29 1ggk s VAL 579 N -2.81 5.22 -1.45 -1.27 1.01 -1.15 -4.49 120.40 115.46 1ggk s VAL 579 Ca 0.65 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.79 1ggk s VAL 579 Cb -0.20 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1ggk s VAL 579 CO 0.59 -0.39 0.24 0.59 0.00 0.00 0.00 175.10 176.12 1ggk n ASN 580 N 5.17 -0.18 0.00 3.32 4.13 -1.26 -0.95 115.26 125.49 1ggk n ASN 580 Ca -0.11 -1.17 0.00 0.00 1.68 0.00 0.00 54.58 54.97 1ggk n ASN 580 Cb 0.46 -2.20 0.00 0.00 -1.54 0.00 0.00 39.78 36.50 1ggk n ASN 580 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ggk n GLY 581 N -2.29 0.54 3.84 7.41 0.00 -1.26 -5.01 105.19 108.42 1ggk n GLY 581 Ca -0.30 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 1ggk n GLY 581 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ggk s LEU 582 N 0.00 4.27 0.00 0.99 2.01 -0.12 -4.97 118.68 120.86 1ggk s LEU 582 Ca 0.00 1.20 0.00 0.00 0.01 0.00 0.00 54.13 55.34 1ggk s LEU 582 Cb 0.00 -3.55 0.00 0.00 0.01 0.00 0.00 46.19 42.65 1ggk s LEU 582 CO 0.00 0.01 0.80 1.17 1.01 0.00 0.00 176.35 179.34 1ggk n LYS 583 N 0.47 1.84 0.00 1.70 4.81 -1.26 -2.92 118.16 122.79 1ggk n LYS 583 Ca -0.02 -1.12 0.00 0.00 -0.87 0.00 0.00 58.31 56.29 1ggk n LYS 583 Cb 0.52 -0.86 0.00 0.00 0.02 0.00 0.00 35.03 34.71 1ggk n LYS 583 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1ggk n LYS 584 N -0.32 0.00 -3.49 1.64 2.85 -1.26 -4.78 118.16 112.80 1ggk n LYS 584 Ca 0.00 0.00 -0.21 0.00 -1.05 0.00 0.00 58.31 57.05 1ggk n LYS 584 Cb 0.29 0.00 -0.13 0.00 -0.65 0.00 0.00 35.03 34.54 1ggk n LYS 584 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1ggk s ASP 585 N 0.00 1.92 0.64 -5.58 3.68 -1.26 -5.03 116.67 111.04 1ggk s ASP 585 Ca 0.00 -0.57 0.37 0.00 2.13 0.00 0.00 52.55 54.47 1ggk s ASP 585 Cb 0.00 0.21 2.04 0.00 -1.45 0.00 0.00 42.92 43.72 1ggk s ASP 585 CO 0.00 -0.36 2.21 1.55 0.13 0.00 0.00 175.17 178.70 1ggk h PRO 586 N 8.33 0.00 0.00 4.34 0.13 -1.98 -2.05 132.00 140.77 1ggk h PRO 586 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 1ggk h PRO 586 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1ggk h PRO 586 CO 0.32 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.96 1ggk n SER 587 N -3.28 0.00 0.09 1.44 3.41 -1.26 -2.09 113.62 111.93 1ggk n SER 587 Ca -0.02 0.31 0.12 0.00 -0.26 0.00 0.00 58.87 59.03 1ggk n SER 587 Cb 0.19 -0.41 0.28 0.00 -0.26 0.00 0.00 64.21 64.00 1ggk n SER 587 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1ggk h LEU 588 N 0.00 0.00-10.13 1.04 3.38 -1.72 -3.46 115.31 104.42 1ggk h LEU 588 Ca 0.00 -0.10 -0.51 0.00 0.09 0.00 0.00 57.88 57.36 1ggk h LEU 588 Cb 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ggk h LEU 588 CO 0.00 0.05 -0.03 -0.55 0.09 0.00 0.00 178.44 178.00 1ggk s SER 589 N -4.46 6.48 0.02 -0.43 0.15 -0.89 -4.93 113.70 109.65 1ggk s SER 589 Ca 0.08 0.89 -0.03 0.00 0.70 0.00 0.00 55.95 57.60 1ggk s SER 589 Cb 0.13 -2.22 -0.28 0.00 -1.71 0.00 0.00 66.02 61.94 1ggk s SER 589 CO 0.66 -0.29 0.93 -0.07 1.20 0.00 0.00 173.24 175.68 1ggk h LEU 590 N 1.49 0.39 -0.73 3.45 3.38 -1.90 -3.41 115.31 117.98 1ggk h LEU 590 Ca -0.47 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 56.99 1ggk h LEU 590 Cb 1.19 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1ggk h LEU 590 CO 0.65 1.41 0.00 -1.22 0.09 0.00 0.00 178.44 179.37 1ggk n TYR 591 N -3.46 0.00 -0.04 1.13 4.01 -1.26 -4.79 117.16 112.75 1ggk n TYR 591 Ca -0.14 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.51 1ggk n TYR 591 Cb 1.04 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 40.04 1ggk n TYR 591 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ggk h ALA 592 N 0.00 0.13 -2.90 -0.72 0.00 -1.86 -3.31 119.26 110.60 1ggk h ALA 592 Ca 0.00 0.08 -0.72 0.00 0.00 0.00 0.00 54.91 54.27 1ggk h ALA 592 Cb 0.01 0.15 -0.32 0.00 0.00 0.00 0.00 17.79 17.63 1ggk h ALA 592 CO 0.00 -0.48 -0.40 0.42 0.00 0.00 0.00 179.25 178.80 1ggk s ILE 593 N -6.20 3.95 0.42 0.00 -1.09 -1.26 -5.10 121.20 111.91 1ggk s ILE 593 Ca -0.13 -2.15 -0.26 0.00 -2.23 0.00 0.00 60.65 55.88 1ggk s ILE 593 Cb 0.10 -3.61 -0.09 0.00 -1.58 0.00 0.00 42.46 37.29 1ggk s ILE 593 CO 0.68 -0.79 1.39 -2.84 -1.23 0.00 0.00 174.94 172.15 1ggk s PRO 594 N 0.93 3.85 0.00 2.79 0.02 -1.25 -4.94 135.00 136.40 1ggk s PRO 594 Ca 0.09 2.34 0.05 0.00 0.02 0.00 0.00 61.00 63.50 1ggk s PRO 594 Cb -0.23 -2.73 0.08 0.00 0.02 0.00 0.00 34.50 31.63 1ggk s PRO 594 CO -0.03 -0.66 1.02 -0.40 -0.33 0.00 0.00 177.00 176.60 1ggk n ASP 595 N 0.01 0.18 -4.46 2.53 5.68 -1.26 -5.11 116.55 114.11 1ggk n ASP 595 Ca 0.04 -1.98 -0.36 0.00 -0.50 0.00 0.00 54.79 51.99 1ggk n ASP 595 Cb 0.42 -0.21 0.07 0.00 -1.14 0.00 0.00 41.12 40.26 1ggk n ASP 595 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ggk n GLY 596 N 0.09 -1.57 3.03 6.12 0.00 -1.26 -4.02 105.19 107.58 1ggk n GLY 596 Ca 0.01 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 1ggk n GLY 596 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ggk s ASP 597 N -1.46 0.32 0.00 1.61 2.15 -1.26 -4.92 116.67 113.11 1ggk s ASP 597 Ca 0.65 0.60 0.29 0.00 0.43 0.00 0.00 52.55 54.52 1ggk s ASP 597 Cb -0.35 0.78 1.28 0.00 -0.30 0.00 0.00 42.92 44.33 1ggk s ASP 597 CO 0.58 -0.24 1.94 0.55 -0.17 0.00 0.00 175.17 177.82 1ggk n VAL 598 N 5.36 0.00 -2.13 1.11 3.14 -1.26 -4.85 118.33 119.70 1ggk n VAL 598 Ca -0.06 -0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.90 1ggk n VAL 598 Cb 0.50 -0.45 -0.03 0.00 -1.06 0.00 0.00 33.84 32.80 1ggk n VAL 598 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 1ggk s LYS 599 N -2.87 4.33 0.00 1.45 2.20 -1.26 -2.25 119.74 121.35 1ggk s LYS 599 Ca 0.18 2.15 0.00 0.00 -0.36 0.00 0.00 55.97 57.94 1ggk s LYS 599 Cb 0.19 -3.18 0.00 0.00 -1.51 0.00 0.00 37.83 33.34 1ggk s LYS 599 CO 0.52 -0.36 0.00 0.41 -0.36 0.00 0.00 175.35 175.56 1ggk n GLY 600 N 2.63 1.18 3.77 5.54 0.00 -0.38 -5.01 105.19 112.93 1ggk n GLY 600 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1ggk n GLY 600 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ggk s ARG 601 N -0.42 1.22 0.00 1.61 1.81 -0.95 -4.84 118.95 117.38 1ggk s ARG 601 Ca 0.00 0.42 0.02 0.00 -1.72 0.00 0.00 55.73 54.45 1ggk s ARG 601 Cb 0.00 -1.84 -0.01 0.00 -0.45 0.00 0.00 34.95 32.66 1ggk s ARG 601 CO 0.00 -2.17 -0.06 0.54 -0.68 0.00 0.00 175.30 172.92 1ggk s VAL 602 N -3.19 0.49 0.02 3.52 0.11 -1.26 -1.88 120.40 118.22 1ggk s VAL 602 Ca 0.63 -0.39 0.07 0.00 -2.93 0.00 0.00 61.98 59.37 1ggk s VAL 602 Cb -0.15 -0.44 -0.03 0.00 -1.53 0.00 0.00 36.38 34.23 1ggk s VAL 602 CO 0.54 0.06 -0.21 -0.69 -3.33 0.00 0.00 175.10 171.47 1ggk s VAL 603 N -0.33 2.57 -0.20 2.04 1.01 -0.37 -0.12 120.40 124.99 1ggk s VAL 603 Ca 0.01 -1.16 -0.09 0.00 0.00 0.00 0.00 61.98 60.73 1ggk s VAL 603 Cb -0.04 -2.03 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 1ggk s VAL 603 CO -0.00 0.41 0.11 0.00 0.00 0.00 0.00 175.10 175.62 1ggk s ALA 604 N -0.83 3.53 -0.25 5.51 0.00 -0.74 -0.84 121.76 128.14 1ggk s ALA 604 Ca 0.13 -0.77 -0.00 0.00 0.00 0.00 0.00 51.96 51.31 1ggk s ALA 604 Cb -0.10 -2.09 0.04 0.00 0.00 0.00 0.00 23.12 20.96 1ggk s ALA 604 CO 0.03 0.07 -0.08 0.42 0.00 0.00 0.00 175.76 176.19 1ggk s ILE 605 N 0.56 2.61 -0.35 0.00 1.01 -0.60 -0.64 121.20 123.79 1ggk s ILE 605 Ca 0.06 -1.23 -0.18 0.00 0.00 0.00 0.00 60.65 59.30 1ggk s ILE 605 Cb -0.12 -2.38 -0.00 0.00 0.01 0.00 0.00 42.46 39.96 1ggk s ILE 605 CO 0.00 0.13 0.49 -0.76 0.00 0.00 0.00 174.94 174.80 1ggk s LEU 606 N 1.25 4.37 0.70 2.97 1.43 -1.05 -0.87 118.68 127.47 1ggk s LEU 606 Ca -0.03 -0.06 -0.03 0.00 -1.03 0.00 0.00 54.13 52.98 1ggk s LEU 606 Cb -0.18 -2.55 0.09 0.00 0.03 0.00 0.00 46.19 43.59 1ggk s LEU 606 CO -0.05 -0.46 0.98 -0.76 0.23 0.00 0.00 176.35 176.29 1ggk s LEU 607 N 2.34 2.98 0.22 1.79 1.43 -0.12 -4.33 118.68 122.99 1ggk s LEU 607 Ca 0.18 0.00 -0.01 0.00 -1.03 0.00 0.00 54.13 53.27 1ggk s LEU 607 Cb -0.16 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 1ggk s LEU 607 CO 0.13 -1.70 0.17 0.54 0.23 0.00 0.00 176.35 175.72 1ggk s ASN 608 N -4.62 0.30 0.00 2.29 2.20 -1.26 -4.80 114.94 109.06 1ggk s ASN 608 Ca 0.63 -1.41 0.14 0.00 -0.94 0.00 0.00 52.86 51.29 1ggk s ASN 608 Cb -0.08 0.41 0.85 0.00 -2.00 0.00 0.00 41.25 40.43 1ggk s ASN 608 CO 0.44 -0.88 1.27 -0.90 -2.94 0.00 0.00 177.10 174.08 1ggk n ASP 609 N -0.42 0.00 -2.95 3.54 3.85 -1.26 -3.88 116.55 115.42 1ggk n ASP 609 Ca 0.02 -0.44 -0.14 0.00 -0.71 0.00 0.00 54.79 53.52 1ggk n ASP 609 Cb 0.65 -0.00 0.03 0.00 -1.35 0.00 0.00 41.12 40.45 1ggk n ASP 609 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1ggk n GLU 610 N -1.00 0.97 -2.10 0.11 1.02 -1.26 -4.46 120.64 113.92 1ggk n GLU 610 Ca 0.11 -2.62 -0.41 0.00 -0.02 0.00 0.00 57.16 54.22 1ggk n GLU 610 Cb 0.05 -1.36 -0.02 0.00 -0.02 0.00 0.00 31.44 30.09 1ggk n GLU 610 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1ggk s VAL 611 N -0.97 2.69 -0.43 2.62 1.01 -1.25 -2.95 120.40 121.13 1ggk s VAL 611 Ca 0.31 0.69 -0.27 0.00 0.00 0.00 0.00 61.98 62.71 1ggk s VAL 611 Cb 0.31 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 1ggk s VAL 611 CO -0.08 0.16 2.16 -0.60 0.00 0.00 0.00 175.10 176.75 1ggk s ARG 612 N -1.68 2.62 0.45 2.72 3.52 -0.89 -1.85 118.95 123.84 1ggk s ARG 612 Ca 0.50 1.39 0.31 0.00 -0.13 0.00 0.00 55.73 57.79 1ggk s ARG 612 Cb -0.40 -4.44 1.47 0.00 -1.56 0.00 0.00 34.95 30.03 1ggk s ARG 612 CO 0.52 -2.69 1.93 0.66 -0.81 0.00 0.00 175.30 174.91 1ggk h SER 613 N 16.62 0.00 0.41 -2.12 4.64 -1.91 -2.12 113.55 129.07 1ggk h SER 613 Ca -0.30 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.89 1ggk h SER 613 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 1ggk h SER 613 CO 1.11 0.00 -0.59 0.00 -0.87 0.00 0.00 176.83 176.48 1ggk h ALA 614 N 2.07 0.91 -0.00 5.18 0.00 -1.99 -1.95 119.26 123.48 1ggk h ALA 614 Ca 0.00 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 1ggk h ALA 614 Cb 0.24 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1ggk h ALA 614 CO 0.00 0.72 -0.00 -0.44 0.00 0.00 0.00 179.25 179.53 1ggk h ASP 615 N 0.14 0.01 -0.74 0.00 3.45 -1.66 -2.97 116.42 114.64 1ggk h ASP 615 Ca -0.00 -0.40 0.00 0.00 0.43 0.00 0.00 57.03 57.05 1ggk h ASP 615 Cb 1.07 -0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.80 1ggk h ASP 615 CO 0.09 0.41 0.47 0.25 -1.57 0.00 0.00 179.24 178.89 1ggk h LEU 616 N -0.39 0.87 -0.40 1.55 6.46 -1.38 -1.17 115.31 120.85 1ggk h LEU 616 Ca 0.00 -0.04 -0.17 0.00 -0.12 0.00 0.00 57.88 57.55 1ggk h LEU 616 Cb 0.41 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.10 1ggk h LEU 616 CO 0.00 0.65 -0.80 -0.07 -0.62 0.00 0.00 178.44 177.60 1ggk h LEU 617 N 1.02 0.06 -0.67 2.25 3.38 -1.40 -1.24 115.31 118.71 1ggk h LEU 617 Ca 0.27 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 58.05 1ggk h LEU 617 Cb -0.08 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1ggk h LEU 617 CO -0.05 0.84 -0.52 0.00 0.09 0.00 0.00 178.44 178.80 1ggk h ALA 618 N 1.16 0.85 0.09 1.53 0.00 -1.28 -2.77 119.26 118.85 1ggk h ALA 618 Ca -0.02 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 1ggk h ALA 618 Cb 1.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1ggk h ALA 618 CO 0.11 0.68 -0.04 0.82 0.00 0.00 0.00 179.25 180.81 1ggk h ILE 619 N 0.30 1.15 0.00 0.00 2.04 -1.10 -2.95 117.51 116.95 1ggk h ILE 619 Ca 0.01 -1.07 -0.08 0.00 1.00 0.00 0.00 64.86 64.72 1ggk h ILE 619 Cb 1.01 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.90 1ggk h ILE 619 CO 0.09 0.25 -0.39 -0.07 0.00 0.00 0.00 178.15 178.04 1ggk h LEU 620 N -0.63 0.00 0.01 1.44 3.38 -1.26 -2.67 115.31 115.58 1ggk h LEU 620 Ca -0.01 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.70 1ggk h LEU 620 Cb 0.51 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.27 1ggk h LEU 620 CO 0.02 0.39 -1.13 0.50 0.09 0.00 0.00 178.44 178.30 1ggk h LYS 621 N 0.00 0.34 -0.53 1.13 3.64 -1.60 -2.39 116.57 117.17 1ggk h LYS 621 Ca -0.00 -0.48 -0.06 0.00 -1.27 0.00 0.00 60.65 58.84 1ggk h LYS 621 Cb 0.73 0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.69 1ggk h LYS 621 CO 0.05 1.18 0.10 0.00 -2.27 0.00 0.00 179.45 178.52 1ggk h ALA 622 N 0.63 0.70 -0.46 5.00 0.00 -1.37 -2.40 119.26 121.35 1ggk h ALA 622 Ca -0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 1ggk h ALA 622 Cb 1.82 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.39 1ggk h ALA 622 CO 0.19 0.42 0.19 -0.07 0.00 0.00 0.00 179.25 179.98 1ggk h LEU 623 N 0.75 0.63 -1.05 0.00 3.38 -1.50 -2.71 115.31 114.81 1ggk h LEU 623 Ca 0.16 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1ggk h LEU 623 Cb 0.38 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1ggk h LEU 623 CO 0.01 0.62 0.15 0.50 0.09 0.00 0.00 178.44 179.80 1ggk h LYS 624 N 0.60 0.83 -0.38 1.13 3.11 -1.39 -0.15 116.57 120.31 1ggk h LYS 624 Ca 0.15 -0.16 0.01 0.00 -2.81 0.00 0.00 60.65 57.84 1ggk h LYS 624 Cb 0.18 -0.13 -0.02 0.00 -1.00 0.00 0.00 32.23 31.26 1ggk h LYS 624 CO -0.01 0.74 0.25 0.00 -2.81 0.00 0.00 179.45 177.62 1ggk h ALA 625 N 1.36 1.74 -0.01 5.00 0.00 -1.12 -2.30 119.26 123.93 1ggk h ALA 625 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ggk h ALA 625 Cb 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1ggk h ALA 625 CO -0.00 0.23 -0.41 1.63 0.00 0.00 0.00 179.25 180.70 1ggk n LYS 626 N -4.48 0.99 -2.50 0.00 4.76 -0.71 -4.97 118.16 111.25 1ggk n LYS 626 Ca 0.03 -0.74 -0.02 0.00 -2.87 0.00 0.00 58.31 54.70 1ggk n LYS 626 Cb 0.07 -1.48 0.01 0.00 -1.84 0.00 0.00 35.03 31.78 1ggk n LYS 626 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ggk n GLY 627 N 1.39 0.73 3.65 0.72 0.00 -0.50 -4.10 105.19 107.09 1ggk n GLY 627 Ca 0.10 -0.63 -0.35 0.00 0.00 0.00 0.00 46.02 45.14 1ggk n GLY 627 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ggk s VAL 628 N -2.87 4.43 0.49 1.61 1.01 -0.19 -1.25 120.40 123.63 1ggk s VAL 628 Ca 0.04 -0.19 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 1ggk s VAL 628 Cb -0.02 -2.91 -0.06 0.00 0.00 0.00 0.00 36.38 33.39 1ggk s VAL 628 CO 0.05 0.56 0.88 -1.00 0.00 0.00 0.00 175.10 175.59 1ggk s HIS 629 N -0.40 3.51 0.04 5.22 3.76 -0.79 -4.30 115.29 122.33 1ggk s HIS 629 Ca 0.08 1.17 0.08 0.00 -0.15 0.00 0.00 55.06 56.24 1ggk s HIS 629 Cb -0.12 -2.57 -0.03 0.00 1.11 0.00 0.00 32.58 30.98 1ggk s HIS 629 CO 0.02 -0.31 -0.23 0.00 -0.85 0.00 0.00 174.74 173.37 1ggk s ALA 630 N -2.65 1.95 -0.21 -1.40 0.00 -1.26 -1.23 121.76 116.96 1ggk s ALA 630 Ca 0.53 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 51.39 1ggk s ALA 630 Cb -0.10 -0.41 0.04 0.00 0.00 0.00 0.00 23.12 22.65 1ggk s ALA 630 CO 0.38 0.45 -0.14 0.15 0.00 0.00 0.00 175.76 176.60 1ggk s LYS 631 N -1.11 2.38 -0.38 0.00 1.02 -0.02 -4.93 119.74 116.70 1ggk s LYS 631 Ca 0.09 -0.94 -0.24 0.00 0.02 0.00 0.00 55.97 54.90 1ggk s LYS 631 Cb -0.09 -2.56 0.01 0.00 -0.52 0.00 0.00 37.83 34.68 1ggk s LYS 631 CO 0.02 -0.39 0.82 -0.51 -0.92 0.00 0.00 175.35 174.37 1ggk s LEU 632 N 1.30 4.10 0.07 3.17 1.43 -1.26 -1.56 118.68 125.93 1ggk s LEU 632 Ca -0.01 0.33 0.05 0.00 -1.03 0.00 0.00 54.13 53.47 1ggk s LEU 632 Cb -0.16 -3.08 -0.04 0.00 0.03 0.00 0.00 46.19 42.94 1ggk s LEU 632 CO -0.09 -0.81 -0.06 -0.76 0.23 0.00 0.00 176.35 174.86 1ggk s LEU 633 N 3.26 3.19 0.31 1.79 1.02 -0.05 -1.04 118.68 127.15 1ggk s LEU 633 Ca 0.33 -0.27 -0.11 0.00 0.02 0.00 0.00 54.13 54.11 1ggk s LEU 633 Cb -0.13 -1.93 0.01 0.00 0.02 0.00 0.00 46.19 44.17 1ggk s LEU 633 CO 0.19 0.21 0.55 -0.47 0.02 0.00 0.00 176.35 176.85 1ggk s TYR 634 N -1.18 0.51 -2.14 0.29 5.04 -1.16 -0.95 117.35 117.76 1ggk s TYR 634 Ca 0.21 -0.90 0.28 0.00 -2.44 0.00 0.00 57.07 54.23 1ggk s TYR 634 Cb -0.11 0.26 1.49 0.00 0.35 0.00 0.00 41.96 43.95 1ggk s TYR 634 CO 0.13 -1.17 1.98 -1.13 -1.34 0.00 0.00 175.55 174.02 1ggk n SER 635 N -0.93 0.48 -3.76 4.32 3.41 -1.26 -2.39 113.62 113.49 1ggk n SER 635 Ca -0.02 -1.24 -0.09 0.00 -0.26 0.00 0.00 58.87 57.26 1ggk n SER 635 Cb 0.61 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.52 1ggk n SER 635 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ggk s ARG 636 N -1.98 1.48 0.53 4.33 1.70 -1.26 -4.92 118.95 118.83 1ggk s ARG 636 Ca 0.41 -0.89 -0.04 0.00 -0.47 0.00 0.00 55.73 54.74 1ggk s ARG 636 Cb 0.20 0.54 0.11 0.00 -0.57 0.00 0.00 34.95 35.23 1ggk s ARG 636 CO 0.33 -0.64 0.73 -1.33 -1.08 0.00 0.00 175.30 173.30 1ggk n MET 637 N -0.38 -0.21 0.00 3.89 2.81 -1.26 -4.81 117.12 117.17 1ggk n MET 637 Ca -0.08 -1.61 0.00 0.00 -1.81 0.00 0.00 57.70 54.19 1ggk n MET 637 Cb 0.62 -0.59 0.00 0.00 -0.71 0.00 0.00 33.22 32.53 1ggk n MET 637 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ggk n GLY 638 N -0.21 1.07 3.35 3.03 0.00 -1.26 -4.98 105.19 106.18 1ggk n GLY 638 Ca 0.11 -1.58 -0.19 0.00 0.00 0.00 0.00 46.02 44.36 1ggk n GLY 638 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ggk s GLU 639 N 0.00 1.33 0.04 1.61 2.02 -1.26 -0.88 118.70 121.55 1ggk s GLU 639 Ca 0.00 -1.56 0.06 0.00 0.02 0.00 0.00 54.97 53.49 1ggk s GLU 639 Cb 0.00 -1.17 -0.02 0.00 0.10 0.00 0.00 34.13 33.04 1ggk s GLU 639 CO 0.00 0.20 -0.16 0.14 0.02 0.00 0.00 175.26 175.46 1ggk s VAL 640 N -2.80 1.30 -0.23 2.63 -7.23 -0.64 -4.97 120.40 108.46 1ggk s VAL 640 Ca 0.21 -1.07 -0.06 0.00 -1.81 0.00 0.00 61.98 59.26 1ggk s VAL 640 Cb -0.02 -1.16 -0.02 0.00 0.56 0.00 0.00 36.38 35.74 1ggk s VAL 640 CO 0.07 0.07 0.03 -0.89 -0.31 0.00 0.00 175.10 174.07 1ggk s THR 641 N -0.83 4.00 1.02 5.32 2.01 -1.26 -0.06 115.64 125.84 1ggk s THR 641 Ca 0.04 -0.28 -0.12 0.00 0.31 0.00 0.00 61.69 61.63 1ggk s THR 641 Cb -0.08 -2.85 0.20 0.00 0.01 0.00 0.00 72.50 69.78 1ggk s THR 641 CO 0.01 0.38 1.09 0.00 -0.69 0.00 0.00 174.62 175.41 1ggk s ALA 642 N 1.42 0.76 0.30 7.40 0.00 0.45 -4.28 121.76 127.82 1ggk s ALA 642 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.67 1ggk s ALA 642 Cb -0.15 -3.13 0.51 0.00 0.00 0.00 0.00 23.12 20.36 1ggk s ALA 642 CO 0.01 -2.98 1.93 0.38 0.00 0.00 0.00 175.76 175.11 1ggk h ASP 643 N -2.00 0.91 -0.10 0.00 2.03 -1.60 0.34 116.42 115.99 1ggk h ASP 643 Ca -0.56 -0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.74 1ggk h ASP 643 Cb 1.33 -0.20 0.00 0.00 -0.83 0.00 0.00 39.33 39.63 1ggk h ASP 643 CO 0.57 0.61 0.00 -0.90 -1.03 0.00 0.00 179.24 178.48 1ggk n ASP 644 N -4.46 1.19 0.00 4.15 3.85 -1.26 -4.85 116.55 115.16 1ggk n ASP 644 Ca 0.12 -2.07 0.00 0.00 -0.71 0.00 0.00 54.79 52.13 1ggk n ASP 644 Cb 0.15 -0.31 0.00 0.00 -1.35 0.00 0.00 41.12 39.61 1ggk n ASP 644 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ggk n GLY 645 N 0.38 0.76 3.75 6.12 0.00 0.11 -5.02 105.19 111.28 1ggk n GLY 645 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1ggk n GLY 645 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ggk s THR 646 N -2.93 3.56 -0.31 2.61 2.01 -1.25 -4.68 115.64 114.66 1ggk s THR 646 Ca 0.00 1.47 -0.11 0.00 0.31 0.00 0.00 61.69 63.36 1ggk s THR 646 Cb 0.00 -3.94 -0.02 0.00 0.01 0.00 0.00 72.50 68.55 1ggk s THR 646 CO 0.00 0.31 0.19 -0.69 -0.69 0.00 0.00 174.62 173.74 1ggk s VAL 647 N -0.76 5.00 -0.19 3.82 1.01 -1.26 0.17 120.40 128.19 1ggk s VAL 647 Ca 0.47 -0.17 -0.08 0.00 0.00 0.00 0.00 61.98 62.19 1ggk s VAL 647 Cb -0.32 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1ggk s VAL 647 CO 0.39 0.11 0.09 -0.76 0.00 0.00 0.00 175.10 174.93 1ggk s LEU 648 N 1.69 3.96 0.10 3.92 2.01 0.91 -4.94 118.68 126.33 1ggk s LEU 648 Ca 0.06 0.14 -0.30 0.00 0.01 0.00 0.00 54.13 54.04 1ggk s LEU 648 Cb -0.17 -2.01 -0.05 0.00 0.01 0.00 0.00 46.19 43.97 1ggk s LEU 648 CO 0.09 0.18 0.99 -2.16 1.01 0.00 0.00 176.35 176.45 1ggk s PRO 649 N 0.33 4.66 -0.07 1.29 0.04 -1.26 -1.63 135.00 138.37 1ggk s PRO 649 Ca 0.05 1.48 -0.20 0.00 0.04 0.00 0.00 61.00 62.37 1ggk s PRO 649 Cb -0.12 -3.38 -0.04 0.00 0.04 0.00 0.00 34.50 31.00 1ggk s PRO 649 CO -0.01 0.14 0.58 0.42 0.04 0.00 0.00 177.00 178.18 1ggk s ILE 650 N 0.18 5.06 -0.00 0.56 1.01 -0.06 -4.88 121.20 123.07 1ggk s ILE 650 Ca 0.48 1.20 -0.19 0.00 0.00 0.00 0.00 60.65 62.14 1ggk s ILE 650 Cb -0.24 -3.92 -0.32 0.00 0.01 0.00 0.00 42.46 37.99 1ggk s ILE 650 CO 0.30 0.33 0.98 0.00 0.00 0.00 0.00 174.94 176.56 1ggk h ALA 651 N 6.37 -0.09 -2.72 9.38 0.00 -1.42 -3.42 119.26 127.37 1ggk h ALA 651 Ca -0.42 -0.75 0.09 0.00 0.00 0.00 0.00 54.91 53.83 1ggk h ALA 651 Cb 1.19 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 19.02 1ggk h ALA 651 CO 0.73 0.53 0.33 0.00 0.00 0.00 0.00 179.25 180.84 1ggk s ALA 652 N -2.65 -1.49 0.73 0.00 0.00 -1.24 -5.05 121.76 112.06 1ggk s ALA 652 Ca -0.11 0.13 -0.08 0.00 0.00 0.00 0.00 51.96 51.90 1ggk s ALA 652 Cb 0.03 0.74 0.07 0.00 0.00 0.00 0.00 23.12 23.96 1ggk s ALA 652 CO 0.89 -0.95 1.05 0.95 0.00 0.00 0.00 175.76 177.70 1ggk s THR 653 N -3.60 2.21 0.20 0.00 -4.23 -1.26 -2.97 115.64 105.99 1ggk s THR 653 Ca 0.09 -0.22 -0.10 0.00 -1.18 0.00 0.00 61.69 60.27 1ggk s THR 653 Cb -0.03 -2.99 0.14 0.00 1.34 0.00 0.00 72.50 70.96 1ggk s THR 653 CO -0.00 0.00 1.82 -0.26 -0.54 0.00 0.00 174.62 175.64 1ggk h PHE 654 N -0.71 1.01 -0.08 3.99 0.05 -1.80 -2.07 116.94 117.33 1ggk h PHE 654 Ca -0.44 -0.02 -0.13 0.00 3.82 0.00 0.00 57.97 61.19 1ggk h PHE 654 Cb 1.32 -0.32 -0.01 0.00 2.00 0.00 0.00 35.95 38.93 1ggk h PHE 654 CO 0.27 0.71 -0.55 0.00 -0.18 0.00 0.00 178.31 178.56 1ggk h ALA 655 N 1.21 0.93 0.00 2.45 0.00 -1.91 -3.28 119.26 118.66 1ggk h ALA 655 Ca 0.26 -0.51 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 1ggk h ALA 655 Cb 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ggk h ALA 655 CO -0.04 0.69 -0.48 0.78 0.00 0.00 0.00 179.25 180.20 1ggk h GLY 656 N 1.42 0.00 -6.21 0.00 0.00 -1.81 -3.37 103.07 93.10 1ggk h GLY 656 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1ggk h GLY 656 CO 0.08 0.00 -0.87 0.00 0.00 0.00 0.00 176.54 175.75 1ggk n ALA 657 N -2.28 3.12 -0.68 3.60 0.00 -0.82 -4.88 120.51 118.56 1ggk n ALA 657 Ca 0.00 -3.92 -0.31 0.00 0.00 0.00 0.00 53.44 49.21 1ggk n ALA 657 Cb 0.62 -0.85 0.17 0.00 0.00 0.00 0.00 19.45 19.39 1ggk n ALA 657 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ggk n PRO 658 N 1.45 -0.89 0.29 0.00 -0.04 -1.24 -4.85 135.00 129.73 1ggk n PRO 658 Ca 0.25 -0.21 0.18 0.00 -0.04 0.00 0.00 63.50 63.68 1ggk n PRO 658 Cb 0.47 -2.06 0.99 0.00 -0.04 0.00 0.00 33.50 32.85 1ggk n PRO 658 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1ggk h SER 659 N -1.93 0.00 -0.76 3.54 4.64 -1.87 -1.64 113.55 115.52 1ggk h SER 659 Ca -0.48 0.00 0.18 0.00 -0.47 0.00 0.00 61.79 61.02 1ggk h SER 659 Cb 1.30 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.34 1ggk h SER 659 CO 0.39 0.00 0.52 -0.07 -0.87 0.00 0.00 176.83 176.80 1ggk h LEU 660 N 0.00 0.25 -0.01 5.97 3.38 -1.95 -2.17 115.31 120.78 1ggk h LEU 660 Ca 0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1ggk h LEU 660 Cb 0.18 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1ggk h LEU 660 CO -0.00 0.12 -0.18 0.35 0.09 0.00 0.00 178.44 178.82 1ggk n THR 661 N -4.43 0.00 -4.28 0.22 -2.24 -0.62 -4.92 114.28 98.01 1ggk n THR 661 Ca 0.15 -0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.69 1ggk n THR 661 Cb 0.65 -0.23 -0.08 0.00 -2.10 0.00 0.00 70.33 68.57 1ggk n THR 661 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1ggk s VAL 662 N -2.98 2.99 -0.56 2.28 -7.23 -0.82 -4.95 120.40 109.12 1ggk s VAL 662 Ca 0.13 -1.92 0.23 0.00 -1.81 0.00 0.00 61.98 58.62 1ggk s VAL 662 Cb 0.19 -2.82 -0.06 0.00 0.56 0.00 0.00 36.38 34.25 1ggk s VAL 662 CO 0.59 -0.27 1.10 0.47 -0.31 0.00 0.00 175.10 176.68 1ggk n ASP 663 N -0.96 0.65 -3.53 4.85 9.92 0.83 -5.00 116.55 123.30 1ggk n ASP 663 Ca -0.05 -0.04 -0.09 0.00 -0.53 0.00 0.00 54.79 54.08 1ggk n ASP 663 Cb 0.61 0.59 -0.03 0.00 -0.64 0.00 0.00 41.12 41.65 1ggk n ASP 663 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ggk s ALA 664 N -3.22 -1.87 -0.11 2.24 0.00 -1.24 -4.35 121.76 113.20 1ggk s ALA 664 Ca 0.04 1.24 0.03 0.00 0.00 0.00 0.00 51.96 53.27 1ggk s ALA 664 Cb 0.14 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.29 1ggk s ALA 664 CO 0.78 -0.56 -0.23 0.08 0.00 0.00 0.00 175.76 175.83 1ggk s VAL 665 N -2.40 2.02 -0.10 0.00 1.01 -0.36 -1.79 120.40 118.76 1ggk s VAL 665 Ca 0.03 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.05 1ggk s VAL 665 Cb -0.01 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 1ggk s VAL 665 CO -0.05 0.55 -0.16 -0.63 0.00 0.00 0.00 175.10 174.81 1ggk s ILE 666 N 0.54 2.81 -0.25 2.22 1.09 0.19 0.05 121.20 127.85 1ggk s ILE 666 Ca -0.14 -0.76 0.02 0.00 -1.10 0.00 0.00 60.65 58.67 1ggk s ILE 666 Cb -0.17 -2.14 0.06 0.00 -1.06 0.00 0.00 42.46 39.15 1ggk s ILE 666 CO 0.04 0.55 -0.09 -0.69 -0.10 0.00 0.00 174.94 174.65 1ggk s VAL 667 N 0.11 1.94 0.65 2.92 1.01 0.11 -2.53 120.40 124.61 1ggk s VAL 667 Ca -0.08 -1.48 -0.10 0.00 0.00 0.00 0.00 61.98 60.33 1ggk s VAL 667 Cb -0.15 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 1ggk s VAL 667 CO 0.05 -0.04 1.03 -2.16 0.00 0.00 0.00 175.10 173.98 1ggk s PRO 668 N 1.21 3.16 0.84 2.72 0.05 -1.26 -1.33 135.00 140.38 1ggk s PRO 668 Ca -0.08 0.48 -0.11 0.00 0.05 0.00 0.00 61.00 61.34 1ggk s PRO 668 Cb -0.19 -2.10 0.10 0.00 0.05 0.00 0.00 34.50 32.35 1ggk s PRO 668 CO -0.06 -0.78 1.09 0.00 0.05 0.00 0.00 177.00 177.30 1ggk n GLY 670 N -1.20 0.08 3.34 0.00 0.00 -1.26 -2.10 105.19 104.05 1ggk n GLY 670 Ca 0.08 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 1ggk n GLY 670 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ggk n ASN 671 N 0.00 4.56 0.28 1.61 4.05 -1.15 -4.76 115.26 119.84 1ggk n ASN 671 Ca 0.00 -2.89 0.14 0.00 0.45 0.00 0.00 54.58 52.28 1ggk n ASN 671 Cb 0.00 -1.72 0.84 0.00 1.23 0.00 0.00 39.78 40.14 1ggk n ASN 671 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 1ggk h ILE 672 N 5.14 0.63 0.00 -1.44 1.08 -1.92 -1.22 117.51 119.77 1ggk h ILE 672 Ca 0.48 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.93 1ggk h ILE 672 Cb 0.81 0.98 -0.00 0.00 -3.07 0.00 0.00 36.82 35.53 1ggk h ILE 672 CO 1.58 0.00 -0.08 0.00 -0.69 0.00 0.00 178.15 178.95 1ggk h ALA 673 N 1.97 1.08 -0.71 1.87 0.00 -1.98 0.55 119.26 122.05 1ggk h ALA 673 Ca 0.01 -0.08 0.12 0.00 0.00 0.00 0.00 54.91 54.97 1ggk h ALA 673 Cb 0.07 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.76 1ggk h ALA 673 CO -0.00 0.11 0.28 0.22 0.00 0.00 0.00 179.25 179.85 1ggk h ASP 674 N 0.00 0.27 -0.01 0.00 -0.00 -1.62 -3.28 116.42 111.78 1ggk h ASP 674 Ca -0.00 0.10 0.00 0.00 -0.00 0.00 0.00 57.03 57.13 1ggk h ASP 674 Cb 0.44 0.07 0.00 0.00 -0.00 0.00 0.00 39.33 39.85 1ggk h ASP 674 CO 0.01 0.12 0.00 2.30 -0.00 0.00 0.00 179.24 181.67 1ggk n ILE 675 N -4.99 0.11 0.19 2.25 -5.35 -0.98 -4.73 119.36 105.86 1ggk n ILE 675 Ca 0.12 -0.55 0.06 0.00 -0.27 0.00 0.00 62.75 62.11 1ggk n ILE 675 Cb 0.36 1.00 0.54 0.00 -1.74 0.00 0.00 39.64 39.80 1ggk n ILE 675 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ggk h ALA 676 N 0.52 1.82 -0.06 -1.28 0.00 -0.96 -2.72 119.26 116.59 1ggk h ALA 676 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ggk h ALA 676 Cb 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1ggk h ALA 676 CO 0.00 0.14 0.00 -0.25 0.00 0.00 0.00 179.25 179.14 1ggk n ASP 677 N -4.44 2.96 -4.66 0.00 10.43 -1.26 -4.92 116.55 114.65 1ggk n ASP 677 Ca -0.02 -1.97 -0.43 0.00 2.57 0.00 0.00 54.79 54.94 1ggk n ASP 677 Cb 0.15 -0.02 -0.02 0.00 1.84 0.00 0.00 41.12 43.07 1ggk n ASP 677 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 1ggk s ASN 678 N -1.96 7.06 0.24 -2.24 3.84 -1.03 -4.96 114.94 115.89 1ggk s ASN 678 Ca 0.29 1.47 -0.05 0.00 0.21 0.00 0.00 52.86 54.79 1ggk s ASN 678 Cb 0.20 -2.54 0.43 0.00 -0.55 0.00 0.00 41.25 38.79 1ggk s ASN 678 CO 0.30 -0.69 1.74 1.23 -2.79 0.00 0.00 177.10 176.89 1ggk h GLY 679 N 9.51 1.13 0.98 1.21 0.00 -1.92 -2.62 103.07 111.37 1ggk h GLY 679 Ca -0.21 -0.17 -0.06 0.00 0.00 0.00 0.00 47.33 46.89 1ggk h GLY 679 CO 0.98 -0.05 0.08 -0.55 0.00 0.00 0.00 176.54 176.99 1ggk h ASP 680 N 0.49 0.78 -0.23 0.19 3.45 -1.97 -1.02 116.42 118.11 1ggk h ASP 680 Ca 0.40 -0.26 -0.01 0.00 0.43 0.00 0.00 57.03 57.59 1ggk h ASP 680 Cb 0.56 -0.21 -0.01 0.00 -0.56 0.00 0.00 39.33 39.11 1ggk h ASP 680 CO -0.36 0.84 0.12 0.00 -1.57 0.00 0.00 179.24 178.27 1ggk h ALA 681 N 0.97 0.30 -0.11 3.45 0.00 -1.80 0.05 119.26 122.12 1ggk h ALA 681 Ca 0.15 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1ggk h ALA 681 Cb 0.39 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1ggk h ALA 681 CO 0.01 -0.15 0.07 -0.91 0.00 0.00 0.00 179.25 178.26 1ggk h ASN 682 N 0.26 0.14 -0.86 0.00 2.35 -1.43 -2.65 115.58 113.39 1ggk h ASN 682 Ca 0.08 -0.06 0.01 0.00 -0.55 0.00 0.00 56.30 55.78 1ggk h ASN 682 Cb 0.09 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.38 1ggk h ASN 682 CO -0.01 0.15 0.56 0.22 -1.65 0.00 0.00 177.43 176.70 1ggk h TYR 683 N 0.11 1.09 -0.57 1.19 5.03 -1.17 -1.46 116.97 121.19 1ggk h TYR 683 Ca 0.04 0.02 0.11 0.00 2.58 0.00 0.00 58.73 61.48 1ggk h TYR 683 Cb 0.04 -0.37 -0.08 0.00 1.55 0.00 0.00 36.73 37.87 1ggk h TYR 683 CO -0.05 0.69 0.09 -0.92 -1.32 0.00 0.00 178.16 176.65 1ggk h TYR 684 N 1.17 0.14 -0.06 -3.82 5.03 -0.62 -0.23 116.97 118.57 1ggk h TYR 684 Ca 0.31 0.04 -0.11 0.00 2.58 0.00 0.00 58.73 61.55 1ggk h TYR 684 Cb -0.12 0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.17 1ggk h TYR 684 CO 0.00 -0.05 -0.48 -0.07 -1.32 0.00 0.00 178.16 176.24 1ggk h LEU 685 N 0.22 0.15 -0.48 2.82 3.38 -1.17 -2.89 115.31 117.34 1ggk h LEU 685 Ca 0.29 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 58.03 1ggk h LEU 685 Cb 0.44 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1ggk h LEU 685 CO -0.40 0.61 -0.61 0.24 0.09 0.00 0.00 178.44 178.37 1ggk h MET 686 N 0.12 0.51 -0.10 1.13 2.86 -0.48 -2.16 114.93 116.81 1ggk h MET 686 Ca 0.01 -0.35 -0.11 0.00 -2.06 0.00 0.00 59.70 57.18 1ggk h MET 686 Cb 0.89 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.60 1ggk h MET 686 CO 0.07 0.96 -0.37 1.49 1.06 0.00 0.00 176.91 180.12 1ggk h GLU 687 N 0.38 0.43 -0.57 1.72 4.81 -1.05 -1.66 114.58 118.64 1ggk h GLU 687 Ca -0.01 -0.33 -0.01 0.00 -0.13 0.00 0.00 59.36 58.89 1ggk h GLU 687 Cb 1.16 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.57 1ggk h GLU 687 CO 0.11 0.96 0.33 0.00 -0.73 0.00 0.00 179.01 179.67 1ggk h ALA 688 N 0.47 0.73 -0.46 2.92 0.00 -1.59 -1.79 119.26 119.55 1ggk h ALA 688 Ca -0.02 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.84 1ggk h ALA 688 Cb 1.01 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 1ggk h ALA 688 CO 0.08 0.23 0.22 -0.92 0.00 0.00 0.00 179.25 178.87 1ggk h TYR 689 N 0.77 0.41 -0.88 0.00 3.20 -1.40 -2.00 116.97 117.07 1ggk h TYR 689 Ca 0.20 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.09 1ggk h TYR 689 Cb 0.02 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.13 1ggk h TYR 689 CO -0.02 0.21 0.54 -0.22 -1.64 0.00 0.00 178.16 177.03 1ggk h LYS 690 N 0.45 1.19 -0.52 1.82 3.64 -0.87 -2.83 116.57 119.44 1ggk h LYS 690 Ca 0.20 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1ggk h LYS 690 Cb 0.11 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1ggk h LYS 690 CO -0.14 0.82 0.00 0.72 -2.27 0.00 0.00 179.45 178.58 1ggk n HIS 691 N -4.37 0.47 -2.33 1.91 8.25 -0.71 -4.91 115.22 113.53 1ggk n HIS 691 Ca 0.10 -0.19 -0.18 0.00 -0.26 0.00 0.00 57.72 57.19 1ggk n HIS 691 Cb 0.05 -0.10 -0.01 0.00 1.12 0.00 0.00 29.99 31.05 1ggk n HIS 691 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1ggk n LEU 692 N 0.19 -1.83 -4.85 2.41 4.77 -1.01 -4.91 117.00 111.78 1ggk n LEU 692 Ca 0.08 -0.01 -0.33 0.00 -0.03 0.00 0.00 56.01 55.73 1ggk n LEU 692 Cb 0.36 -2.65 -0.06 0.00 -2.33 0.00 0.00 43.42 38.74 1ggk n LEU 692 CO 0.08 -0.21 0.36 -0.54 -1.33 0.00 0.00 177.39 175.74 1ggk s LYS 693 N -4.88 3.98 0.32 3.23 1.02 -0.79 -1.10 119.74 121.51 1ggk s LYS 693 Ca 0.00 0.58 -0.29 0.00 0.02 0.00 0.00 55.97 56.29 1ggk s LYS 693 Cb 0.00 -2.57 -0.10 0.00 -0.52 0.00 0.00 37.83 34.63 1ggk s LYS 693 CO 0.00 0.25 1.31 -2.14 -0.92 0.00 0.00 175.35 173.85 1ggk s PRO 694 N -2.75 4.36 -0.07 -1.68 0.02 -1.26 -4.59 135.00 129.03 1ggk s PRO 694 Ca 0.50 2.21 0.04 0.00 0.02 0.00 0.00 61.00 63.77 1ggk s PRO 694 Cb -0.12 -3.08 -0.00 0.00 0.02 0.00 0.00 34.50 31.32 1ggk s PRO 694 CO 0.19 -0.20 -0.21 0.42 -0.33 0.00 0.00 177.00 176.87 1ggk s ILE 695 N -0.98 1.77 -0.10 2.83 1.01 -1.06 -1.23 121.20 123.44 1ggk s ILE 695 Ca 0.50 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 60.29 1ggk s ILE 695 Cb -0.40 -1.53 0.01 0.00 0.01 0.00 0.00 42.46 40.56 1ggk s ILE 695 CO 0.51 0.50 -0.16 0.00 0.00 0.00 0.00 174.94 175.79 1ggk s ALA 696 N 0.18 1.68 -0.18 9.38 0.00 0.11 -0.85 121.76 132.08 1ggk s ALA 696 Ca -0.11 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.16 1ggk s ALA 696 Cb -0.15 -0.77 0.03 0.00 0.00 0.00 0.00 23.12 22.23 1ggk s ALA 696 CO 0.05 0.02 -0.15 -0.51 0.00 0.00 0.00 175.76 175.17 1ggk s LEU 697 N 0.81 2.17 -0.17 0.00 1.43 -0.35 0.09 118.68 122.67 1ggk s LEU 697 Ca -0.10 -0.74 -0.13 0.00 -1.03 0.00 0.00 54.13 52.13 1ggk s LEU 697 Cb -0.16 -1.34 -0.05 0.00 0.03 0.00 0.00 46.19 44.68 1ggk s LEU 697 CO 0.01 -0.07 0.26 0.00 0.23 0.00 0.00 176.35 176.78 1ggk s ALA 698 N 1.35 3.61 0.00 4.21 0.00 -0.44 -2.92 121.76 127.57 1ggk s ALA 698 Ca 0.02 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.48 1ggk s ALA 698 Cb -0.14 -2.35 0.00 0.00 0.00 0.00 0.00 23.12 20.63 1ggk s ALA 698 CO -0.10 0.11 0.00 0.41 0.00 0.00 0.00 175.76 176.18 1ggk n GLY 699 N 3.38 2.55 0.00 0.00 0.00 0.10 -1.45 105.19 109.76 1ggk n GLY 699 Ca -0.13 0.35 0.13 0.00 0.00 0.00 0.00 46.02 46.37 1ggk n GLY 699 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ggk n ASP 700 N 7.24 0.00 0.23 1.61 8.00 -1.26 -2.24 116.55 130.13 1ggk n ASP 700 Ca 0.00 0.07 0.16 0.00 0.71 0.00 0.00 54.79 55.73 1ggk n ASP 700 Cb 0.00 -0.34 0.73 0.00 -0.02 0.00 0.00 41.12 41.49 1ggk n ASP 700 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ggk h ALA 701 N 3.15 1.00 0.00 2.24 0.00 -1.52 -0.98 119.26 123.16 1ggk h ALA 701 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ggk h ALA 701 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1ggk h ALA 701 CO 0.00 0.00 0.12 0.00 0.00 0.00 0.00 179.25 179.37 1ggk h ARG 702 N 0.00 0.00 -0.71 0.00 3.08 -1.61 -2.03 114.38 113.10 1ggk h ARG 702 Ca 0.00 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.18 1ggk h ARG 702 Cb 0.28 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 1ggk h ARG 702 CO 0.00 0.00 0.47 0.87 -1.07 0.00 0.00 179.97 180.24 1ggk h LYS 703 N 0.00 0.44 -0.00 0.04 1.57 -1.43 -1.85 116.57 115.34 1ggk h LYS 703 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1ggk h LYS 703 Cb 0.23 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 1ggk h LYS 703 CO 0.00 0.29 0.05 0.74 -0.57 0.00 0.00 179.45 179.96 1ggk h PHE 704 N 0.45 0.00 -0.87 -1.35 -1.00 -1.60 -3.06 116.94 109.51 1ggk h PHE 704 Ca 0.34 0.00 0.17 0.00 2.81 0.00 0.00 57.97 61.29 1ggk h PHE 704 Cb 0.70 0.00 -0.07 0.00 3.61 0.00 0.00 35.95 40.20 1ggk h PHE 704 CO -0.00 0.00 0.57 0.87 -1.61 0.00 0.00 178.31 178.14 1ggk h LYS 705 N 0.00 0.50 -0.22 1.51 1.57 -1.55 0.08 116.57 118.46 1ggk h LYS 705 Ca 0.00 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 1ggk h LYS 705 Cb 0.09 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1ggk h LYS 705 CO -0.00 0.33 -0.19 0.00 -0.57 0.00 0.00 179.45 179.02 1ggk h ALA 706 N 1.62 1.27 -0.66 3.86 0.00 -1.78 -1.37 119.26 122.20 1ggk h ALA 706 Ca 0.45 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ggk h ALA 706 Cb 0.95 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1ggk h ALA 706 CO -0.18 0.48 0.43 1.15 0.00 0.00 0.00 179.25 181.13 1ggk h THR 707 N 0.35 1.18 -0.43 0.00 2.02 -1.18 -2.89 112.91 111.95 1ggk h THR 707 Ca 0.06 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1ggk h THR 707 Cb 0.54 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 1ggk h THR 707 CO 0.04 0.17 0.00 2.30 0.37 0.00 0.00 175.52 178.40 1ggk n ILE 708 N -4.42 2.29 -3.69 3.11 -5.35 -0.82 -4.97 119.36 105.50 1ggk n ILE 708 Ca 0.07 -1.55 -0.26 0.00 -0.27 0.00 0.00 62.75 60.74 1ggk n ILE 708 Cb 0.05 -0.15 0.06 0.00 -1.74 0.00 0.00 39.64 37.87 1ggk n ILE 708 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1ggk n LYS 709 N 0.20 -7.25 -3.07 6.28 4.76 -0.72 -4.97 118.16 113.39 1ggk n LYS 709 Ca 0.23 0.76 -0.39 0.00 -2.87 0.00 0.00 58.31 56.05 1ggk n LYS 709 Cb 0.96 -5.77 -0.06 0.00 -1.84 0.00 0.00 35.03 28.32 1ggk n LYS 709 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1ggk s ILE 710 N -3.32 4.49 0.84 -0.18 -1.09 -0.60 -5.03 121.20 116.32 1ggk s ILE 710 Ca 0.60 1.52 -0.11 0.00 -2.23 0.00 0.00 60.65 60.43 1ggk s ILE 710 Cb -0.27 -4.04 0.10 0.00 -1.58 0.00 0.00 42.46 36.67 1ggk s ILE 710 CO 0.76 0.49 1.09 0.00 -1.23 0.00 0.00 174.94 176.05 1ggk s ALA 711 N -1.19 1.83 0.17 9.38 0.00 -1.26 -4.71 121.76 125.98 1ggk s ALA 711 Ca 0.35 0.13 -0.13 0.00 0.00 0.00 0.00 51.96 52.30 1ggk s ALA 711 Cb -0.21 -3.25 0.07 0.00 0.00 0.00 0.00 23.12 19.73 1ggk s ALA 711 CO 0.24 -2.13 1.79 -0.44 0.00 0.00 0.00 175.76 175.21 1ggk h ASP 712 N -1.39 0.68 -0.97 0.00 3.45 -1.99 -1.89 116.42 114.31 1ggk h ASP 712 Ca -0.47 -0.08 0.19 0.00 0.43 0.00 0.00 57.03 57.10 1ggk h ASP 712 Cb 1.26 -0.17 -0.09 0.00 -0.56 0.00 0.00 39.33 39.77 1ggk h ASP 712 CO 0.52 0.57 0.61 -0.61 -1.57 0.00 0.00 179.24 178.76 1ggk h GLN 713 N 0.74 0.64 0.00 3.56 4.15 -2.04 -3.48 115.11 118.67 1ggk h GLN 713 Ca 0.19 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.58 1ggk h GLN 713 Cb 0.03 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.58 1ggk h GLN 713 CO -0.03 0.42 0.00 0.41 -1.93 0.00 0.00 178.83 177.70 1ggk n GLY 714 N -1.40 -2.15 3.52 2.39 0.00 -0.71 -5.09 105.19 101.75 1ggk n GLY 714 Ca 0.21 -2.11 -0.09 0.00 0.00 0.00 0.00 46.02 44.04 1ggk n GLY 714 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ggk s GLU 715 N -0.30 0.74 0.19 1.61 -1.05 -1.26 -4.63 118.70 114.01 1ggk s GLU 715 Ca 0.00 -0.20 -0.33 0.00 -0.15 0.00 0.00 54.97 54.30 1ggk s GLU 715 Cb 0.00 0.34 -0.14 0.00 -0.44 0.00 0.00 34.13 33.90 1ggk s GLU 715 CO 0.00 -0.31 1.53 0.39 0.95 0.00 0.00 175.26 177.82 1ggk n GLU 716 N -0.04 2.16 0.00 -4.83 1.02 -1.26 -1.97 120.64 115.73 1ggk n GLU 716 Ca -0.08 0.78 0.00 0.00 -0.02 0.00 0.00 57.16 57.83 1ggk n GLU 716 Cb 0.61 -2.51 0.00 0.00 -0.02 0.00 0.00 31.44 29.51 1ggk n GLU 716 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ggk n GLY 717 N 2.96 2.40 3.24 0.62 0.00 -1.26 -4.90 105.19 108.25 1ggk n GLY 717 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1ggk n GLY 717 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ggk s ILE 718 N -2.58 3.62 -0.14 -0.61 -1.09 -0.83 -2.58 121.20 117.00 1ggk s ILE 718 Ca 0.00 -1.25 -0.21 0.00 -2.23 0.00 0.00 60.65 56.96 1ggk s ILE 718 Cb 0.00 -3.09 -0.03 0.00 -1.58 0.00 0.00 42.46 37.76 1ggk s ILE 718 CO 0.00 -0.21 0.62 -0.69 -1.23 0.00 0.00 174.94 173.43 1ggk s VAL 719 N 1.36 5.06 -0.01 2.92 1.01 -0.03 -4.63 120.40 126.08 1ggk s VAL 719 Ca -0.02 1.23 -0.03 0.00 0.00 0.00 0.00 61.98 63.17 1ggk s VAL 719 Cb -0.20 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.23 1ggk s VAL 719 CO 0.02 0.20 0.06 -1.83 0.00 0.00 0.00 175.10 173.55 1ggk s GLU 720 N 1.27 0.16 0.29 2.72 -1.05 -1.26 -1.21 118.70 119.62 1ggk s GLU 720 Ca 0.31 -0.08 -0.19 0.00 -0.15 0.00 0.00 54.97 54.86 1ggk s GLU 720 Cb -0.16 0.07 0.02 0.00 -0.44 0.00 0.00 34.13 33.62 1ggk s GLU 720 CO 0.13 -0.03 0.69 0.00 0.95 0.00 0.00 175.26 177.00 1ggk s ALA 721 N -0.38 -1.01 0.21 -0.84 0.00 -1.15 -5.02 121.76 113.57 1ggk s ALA 721 Ca -0.04 -0.45 -0.03 0.00 0.00 0.00 0.00 51.96 51.43 1ggk s ALA 721 Cb -0.03 0.86 0.18 0.00 0.00 0.00 0.00 23.12 24.13 1ggk s ALA 721 CO 0.00 -1.01 1.59 -0.44 0.00 0.00 0.00 175.76 175.90 1ggk h ASP 722 N 2.03 0.69 -5.25 0.00 3.32 -1.91 0.31 116.42 115.61 1ggk h ASP 722 Ca -0.22 -0.29 -0.10 0.00 0.02 0.00 0.00 57.03 56.44 1ggk h ASP 722 Cb 1.25 -0.19 -0.13 0.00 0.22 0.00 0.00 39.33 40.48 1ggk h ASP 722 CO 0.27 0.99 -0.34 -0.94 -1.72 0.00 0.00 179.24 177.50 1ggk s SER 723 N -6.83 0.06 -1.20 6.45 1.04 -1.26 -2.83 113.70 109.12 1ggk s SER 723 Ca -0.08 -0.85 -0.17 0.00 0.48 0.00 0.00 55.95 55.33 1ggk s SER 723 Cb 0.12 0.42 0.10 0.00 0.10 0.00 0.00 66.02 66.76 1ggk s SER 723 CO 0.83 -0.86 1.56 0.00 0.98 0.00 0.00 173.24 175.75 1ggk s ALA 724 N -3.95 3.45 0.00 5.32 0.00 -1.26 -4.84 121.76 120.48 1ggk s ALA 724 Ca 0.16 -2.96 0.00 0.00 0.00 0.00 0.00 51.96 49.16 1ggk s ALA 724 Cb 0.04 -4.42 0.00 0.00 0.00 0.00 0.00 23.12 18.73 1ggk s ALA 724 CO -0.02 -3.15 0.00 -0.40 0.00 0.00 0.00 175.76 172.19 1ggk n ASP 725 N 7.47 0.00 0.00 0.00 5.75 -1.26 -4.60 116.55 123.91 1ggk n ASP 725 Ca 0.41 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.19 1ggk n ASP 725 Cb 0.46 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 1ggk n ASP 725 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ggk n GLY 726 N 4.55 -0.01 0.21 6.12 0.00 -1.26 -3.37 105.19 111.43 1ggk n GLY 726 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1ggk n GLY 726 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ggk h SER 727 N 0.00 0.00 -0.63 1.61 4.64 -1.98 -3.21 113.55 113.98 1ggk h SER 727 Ca 0.00 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.38 1ggk h SER 727 Cb 0.00 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.00 1ggk h SER 727 CO 0.00 0.27 -0.50 0.15 -0.87 0.00 0.00 176.83 175.89 1ggk h PHE 728 N 0.00 -1.57 -0.37 4.77 3.04 -1.91 0.40 116.94 121.30 1ggk h PHE 728 Ca -0.00 0.09 -0.06 0.00 3.98 0.00 0.00 57.97 61.98 1ggk h PHE 728 Cb 0.68 0.77 -0.02 0.00 2.56 0.00 0.00 35.95 39.94 1ggk h PHE 728 CO 0.00 -0.37 -0.03 0.52 -2.02 0.00 0.00 178.31 176.41 1ggk h MET 729 N -0.16 0.60 -0.01 1.11 2.86 -1.58 -2.53 114.93 115.23 1ggk h MET 729 Ca 0.10 -0.15 -0.13 0.00 -2.06 0.00 0.00 59.70 57.46 1ggk h MET 729 Cb 0.43 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 1ggk h MET 729 CO -0.68 0.65 -0.61 -0.44 1.06 0.00 0.00 176.91 176.89 1ggk h ASP 730 N 0.57 0.05 -0.21 1.22 3.32 -0.97 -0.35 116.42 120.05 1ggk h ASP 730 Ca 0.11 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 1ggk h ASP 730 Cb 0.41 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 1ggk h ASP 730 CO 0.02 0.65 -0.21 -0.33 -1.72 0.00 0.00 179.24 177.65 1ggk h GLU 731 N 0.03 0.51 -0.12 3.56 5.08 -0.13 -2.53 114.58 120.99 1ggk h GLU 731 Ca -0.01 -0.27 0.03 0.00 -1.00 0.00 0.00 59.36 58.12 1ggk h GLU 731 Cb 1.09 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 1ggk h GLU 731 CO 0.08 0.85 -0.09 1.25 -1.00 0.00 0.00 179.01 180.11 1ggk h LEU 732 N 0.19 -0.27 -1.57 1.33 7.12 -1.34 -2.31 115.31 118.46 1ggk h LEU 732 Ca 0.03 0.06 -0.02 0.00 0.13 0.00 0.00 57.88 58.08 1ggk h LEU 732 Cb 0.76 0.14 -0.00 0.00 -0.53 0.00 0.00 40.66 41.03 1ggk h LEU 732 CO 0.05 -0.12 -0.10 -0.07 -0.13 0.00 0.00 178.44 178.08 1ggk h LEU 733 N -0.09 0.00 -0.23 2.25 3.38 -1.08 -2.23 115.31 117.32 1ggk h LEU 733 Ca 0.08 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.84 1ggk h LEU 733 Cb 0.20 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.96 1ggk h LEU 733 CO -0.18 0.10 -0.66 0.74 0.09 0.00 0.00 178.44 178.53 1ggk h THR 734 N 0.00 1.27 -0.44 0.22 2.02 -0.98 -2.80 112.91 112.20 1ggk h THR 734 Ca -0.00 -1.84 -0.11 0.00 0.77 0.00 0.00 66.41 65.23 1ggk h THR 734 Cb 0.51 1.79 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 1ggk h THR 734 CO 0.01 0.59 -0.16 -0.07 0.37 0.00 0.00 175.52 176.26 1ggk h LEU 735 N 0.62 0.84 -1.06 2.58 3.38 -1.16 -2.99 115.31 117.52 1ggk h LEU 735 Ca -0.02 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 1ggk h LEU 735 Cb 1.28 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1ggk h LEU 735 CO 0.14 1.00 0.06 0.24 0.09 0.00 0.00 178.44 179.97 1ggk h MET 736 N 0.74 0.73 0.00 1.13 2.86 -1.33 -1.71 114.93 117.35 1ggk h MET 736 Ca 0.11 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1ggk h MET 736 Cb 0.68 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 1ggk h MET 736 CO 0.05 0.70 -0.08 0.00 1.06 0.00 0.00 176.91 178.64 1ggk h ALA 737 N 1.37 1.10 -0.01 6.32 0.00 -1.35 -1.92 119.26 124.77 1ggk h ALA 737 Ca 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1ggk h ALA 737 Cb 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1ggk h ALA 737 CO 0.01 0.10 -0.03 0.00 0.00 0.00 0.00 179.25 179.33 1ggk n ALA 738 N -2.18 2.63 0.00 0.00 0.00 -0.66 -4.08 120.51 116.22 1ggk n ALA 738 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1ggk n ALA 738 Cb 0.27 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1ggk n ALA 738 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1ggk n HIS 739 N 0.04 0.00 -4.29 0.00 -0.00 -0.72 -4.76 115.22 105.49 1ggk n HIS 739 Ca 0.18 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.75 1ggk n HIS 739 Cb 0.35 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.23 1ggk n HIS 739 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1ggk s ARG 740 N 0.00 1.21 -1.07 1.57 1.81 -1.26 -4.83 118.95 116.38 1ggk s ARG 740 Ca 0.00 -1.58 -0.09 0.00 -1.72 0.00 0.00 55.73 52.34 1ggk s ARG 740 Cb 0.00 -0.56 0.27 0.00 -0.45 0.00 0.00 34.95 34.21 1ggk s ARG 740 CO 0.00 -0.05 1.05 0.08 -0.68 0.00 0.00 175.30 175.71 1ggk s VAL 741 N -3.43 5.87 0.53 3.52 1.01 -0.26 -4.89 120.40 122.75 1ggk s VAL 741 Ca 0.24 -3.34 0.21 0.00 0.00 0.00 0.00 61.98 59.09 1ggk s VAL 741 Cb 0.05 -4.54 0.33 0.00 0.00 0.00 0.00 36.38 32.22 1ggk s VAL 741 CO 0.05 -1.16 2.08 -0.50 0.00 0.00 0.00 175.10 175.57 1ggk h TRP 742 N 6.76 0.00 0.00 5.22 -0.00 -1.93 -2.58 115.95 123.43 1ggk h TRP 742 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.06 1ggk h TRP 742 Cb 0.89 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.05 1ggk h TRP 742 CO 0.79 0.00 0.00 -1.13 -0.00 0.00 0.00 178.44 178.10 1ggk n SER 743 N -4.41 0.62 -0.05 -3.49 3.41 -1.26 -2.46 113.62 105.98 1ggk n SER 743 Ca 0.03 0.72 0.13 0.00 -0.26 0.00 0.00 58.87 59.50 1ggk n SER 743 Cb 0.34 -0.83 0.47 0.00 -0.26 0.00 0.00 64.21 63.93 1ggk n SER 743 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1ggk n ARG 744 N -2.26 0.25 -0.25 4.33 0.63 -0.97 -4.35 116.66 114.04 1ggk n ARG 744 Ca 0.00 -0.10 -0.06 0.00 -0.92 0.00 0.00 57.85 56.77 1ggk n ARG 744 Cb 0.12 -1.50 -0.01 0.00 0.45 0.00 0.00 32.46 31.52 1ggk n ARG 744 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 1ggk h ILE 745 N 0.23 0.09 -1.01 5.15 2.04 -1.68 0.98 117.51 123.32 1ggk h ILE 745 Ca 0.00 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.11 1ggk h ILE 745 Cb 0.46 0.09 -0.09 0.00 -0.74 0.00 0.00 36.82 36.54 1ggk h ILE 745 CO 0.00 0.00 0.65 -0.65 0.00 0.00 0.00 178.15 178.15 1ggk h PRO 746 N -0.15 0.43 0.00 2.37 0.11 -1.85 -2.11 132.00 130.79 1ggk h PRO 746 Ca 0.23 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.22 1ggk h PRO 746 Cb 0.56 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 1ggk h PRO 746 CO -0.75 0.28 -0.46 0.87 -0.21 0.00 0.00 178.00 177.73 1ggk h LYS 747 N 0.44 0.00 0.00 1.05 6.56 -1.11 -3.37 116.57 120.14 1ggk h LYS 747 Ca 0.57 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.16 1ggk h LYS 747 Cb 1.37 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.03 1ggk h LYS 747 CO -0.28 0.42 0.00 0.44 -2.06 0.00 0.00 179.45 177.97 1ggk n ILE 748 N -3.20 0.86 0.21 1.86 -5.35 -0.79 -3.47 119.36 109.48 1ggk n ILE 748 Ca 0.02 0.22 0.07 0.00 -0.27 0.00 0.00 62.75 62.79 1ggk n ILE 748 Cb 0.71 -0.95 0.44 0.00 -1.74 0.00 0.00 39.64 38.10 1ggk n ILE 748 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1ggk h ASP 749 N 0.00 0.00 0.00 7.28 3.45 -1.73 -3.39 116.42 122.02 1ggk h ASP 749 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1ggk h ASP 749 Cb 0.25 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 1ggk h ASP 749 CO 0.00 0.30 0.00 2.29 -1.57 0.00 0.00 179.24 180.26 1ggk n LYS 750 N -3.65 0.00 -2.61 3.56 2.85 -1.23 -4.93 118.16 112.16 1ggk n LYS 750 Ca -0.01 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.25 1ggk n LYS 750 Cb 0.42 0.00 -0.00 0.00 -0.65 0.00 0.00 35.03 34.80 1ggk n LYS 750 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 1ggk n ILE 751 N 0.00 -1.17 -2.63 0.58 0.00 -1.26 -4.79 119.36 110.08 1ggk n ILE 751 Ca 0.00 0.14 -0.42 0.00 0.00 0.00 0.00 62.75 62.47 1ggk n ILE 751 Cb 0.00 -2.28 -0.02 0.00 0.00 0.00 0.00 39.64 37.34 1ggk n ILE 751 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1ggk s PRO 752 N -0.03 3.66 0.00 9.51 0.04 -1.26 -5.07 135.00 141.85 1ggk s PRO 752 Ca -0.01 -1.38 0.00 0.00 0.04 0.00 0.00 61.00 59.65 1ggk s PRO 752 Cb 0.00 -5.30 0.00 0.00 0.04 0.00 0.00 34.50 29.24 1ggk s PRO 752 CO 0.02 -2.13 0.08 0.00 0.04 0.00 0.00 177.00 175.01