#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ggk s SER 28 N 0.00 5.65 0.12 -1.12 0.15 -1.26 -4.89 113.70 112.34 1ggk s SER 28 Ca 0.00 -1.61 0.19 0.00 0.70 0.00 0.00 55.95 55.23 1ggk s SER 28 Cb 0.00 -1.99 -0.08 0.00 -1.71 0.00 0.00 66.02 62.24 1ggk s SER 28 CO 0.00 -0.58 0.91 0.18 1.20 0.00 0.00 173.24 174.96 1ggk n LEU 29 N 4.91 0.86 -4.78 3.45 4.77 -1.26 -4.88 117.00 120.07 1ggk n LEU 29 Ca -0.09 0.36 -0.34 0.00 -0.03 0.00 0.00 56.01 55.91 1ggk n LEU 29 Cb 0.42 0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.55 1ggk n LEU 29 CO 0.40 0.01 0.75 0.00 -1.33 0.00 0.00 177.39 177.21 1ggk s ALA 30 N -3.11 2.61 0.57 -1.18 0.00 -1.26 -4.99 121.76 114.40 1ggk s ALA 30 Ca -0.02 0.60 -0.20 0.00 0.00 0.00 0.00 51.96 52.34 1ggk s ALA 30 Cb 0.09 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 1ggk s ALA 30 CO 0.80 -0.98 1.20 -1.25 0.00 0.00 0.00 175.76 175.53 1ggk s PRO 31 N -3.81 3.14 0.23 0.00 0.04 -1.26 -4.95 135.00 128.39 1ggk s PRO 31 Ca 0.68 1.81 0.01 0.00 0.04 0.00 0.00 61.00 63.54 1ggk s PRO 31 Cb -0.20 -2.02 0.23 0.00 0.04 0.00 0.00 34.50 32.55 1ggk s PRO 31 CO 0.35 -1.07 1.57 1.49 0.04 0.00 0.00 177.00 179.38 1ggk h GLU 32 N 1.11 0.41 0.00 4.56 4.57 -1.96 -2.44 114.58 120.84 1ggk h GLU 32 Ca -0.50 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.43 1ggk h GLU 32 Cb 1.29 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 1ggk h GLU 32 CO 0.56 0.83 0.00 -0.40 -1.18 0.00 0.00 179.01 178.82 1ggk n ASP 33 N -3.96 0.26 -0.11 1.04 5.68 -1.26 -4.86 116.55 113.35 1ggk n ASP 33 Ca -0.02 0.58 -0.01 0.00 -0.50 0.00 0.00 54.79 54.83 1ggk n ASP 33 Cb 0.57 -0.63 -0.01 0.00 -1.14 0.00 0.00 41.12 39.91 1ggk n ASP 33 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ggk n GLY 34 N -0.48 0.51 0.00 6.12 0.00 -0.92 -4.93 105.19 105.49 1ggk n GLY 34 Ca 0.02 -0.57 0.09 0.00 0.00 0.00 0.00 46.02 45.56 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 0.90 0.00 0.26 1.61 3.41 -1.26 -3.34 113.62 115.19 1ggk n SER 35 Ca -0.01 -1.20 0.14 0.00 -0.26 0.00 0.00 58.87 57.53 1ggk n SER 35 Cb 0.07 0.00 0.65 0.00 -0.26 0.00 0.00 64.21 64.67 1ggk n SER 35 CO 0.00 0.00 0.00 1.12 -0.16 0.00 0.00 175.04 176.00 1ggk h HIS 36 N 0.00 0.00 -3.11 7.33 2.07 -1.91 -3.44 115.15 116.08 1ggk h HIS 36 Ca 0.00 0.00 -0.67 0.00 -2.85 0.00 0.00 60.37 56.85 1ggk h HIS 36 Cb 0.00 0.00 -0.13 0.00 2.57 0.00 0.00 27.41 29.85 1ggk h HIS 36 CO 0.00 0.11 -0.57 0.50 -3.07 0.00 0.00 177.93 174.90 1ggk s ARG 37 N -3.81 3.26 0.46 5.12 6.06 -1.21 -5.00 118.95 123.84 1ggk s ARG 37 Ca -0.00 -0.32 -0.15 0.00 -2.50 0.00 0.00 55.73 52.76 1ggk s ARG 37 Cb 0.11 -2.97 -0.08 0.00 0.06 0.00 0.00 34.95 32.07 1ggk s ARG 37 CO 0.58 0.67 0.91 -1.25 -2.50 0.00 0.00 175.30 173.70 1ggk s PRO 38 N -0.75 3.94 0.27 5.12 0.04 -1.26 -4.99 135.00 137.37 1ggk s PRO 38 Ca 0.12 0.83 -0.29 0.00 0.04 0.00 0.00 61.00 61.69 1ggk s PRO 38 Cb -0.12 -2.23 -0.10 0.00 0.04 0.00 0.00 34.50 32.10 1ggk s PRO 38 CO 0.03 -0.15 1.28 0.00 0.04 0.00 0.00 177.00 178.19 1ggk s ALA 39 N -2.47 3.50 -1.23 8.56 0.00 -1.26 -4.91 121.76 123.95 1ggk s ALA 39 Ca 0.57 1.15 -0.08 0.00 0.00 0.00 0.00 51.96 53.60 1ggk s ALA 39 Cb -0.10 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.48 1ggk s ALA 39 CO 0.28 -0.53 3.00 0.00 0.00 0.00 0.00 175.76 178.51 1ggk n ALA 40 N 1.55 7.20 -2.94 0.00 0.00 -1.26 -4.81 120.51 120.26 1ggk n ALA 40 Ca 0.02 -3.27 -0.11 0.00 0.00 0.00 0.00 53.44 50.08 1ggk n ALA 40 Cb 0.42 -3.04 -0.06 0.00 0.00 0.00 0.00 19.45 16.78 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 1.30 0.95 0.12 0.00 -1.05 -1.25 -4.83 118.70 113.95 1ggk s GLU 41 Ca 0.67 -0.67 -0.33 0.00 -0.15 0.00 0.00 54.97 54.49 1ggk s GLU 41 Cb 0.22 0.41 -0.12 0.00 -0.44 0.00 0.00 34.13 34.20 1ggk s GLU 41 CO -0.06 -0.34 1.72 -2.30 0.95 0.00 0.00 175.26 175.23 1ggk n PRO 42 N 0.06 2.46 -4.02 -4.83 -0.02 -1.26 -4.97 135.00 122.41 1ggk n PRO 42 Ca -0.17 0.89 -0.08 0.00 -2.02 0.00 0.00 63.50 62.12 1ggk n PRO 42 Cb 0.62 -2.72 -0.10 0.00 -0.02 0.00 0.00 33.50 31.28 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 1.94 0.16 0.65 3.45 -4.23 -1.13 -4.97 115.64 111.52 1ggk s THR 43 Ca 0.81 -1.33 -0.11 0.00 -1.18 0.00 0.00 61.69 59.88 1ggk s THR 43 Cb -0.59 -0.88 -0.02 0.00 1.34 0.00 0.00 72.50 72.35 1ggk s THR 43 CO 0.39 -0.73 1.04 -2.16 -0.54 0.00 0.00 174.62 172.62 1ggk s PRO 44 N -2.66 3.34 -0.05 3.99 0.04 -1.26 -3.06 135.00 135.34 1ggk s PRO 44 Ca -0.05 0.84 -0.37 0.00 0.04 0.00 0.00 61.00 61.46 1ggk s PRO 44 Cb -0.01 -2.04 -0.15 0.00 0.04 0.00 0.00 34.50 32.33 1ggk s PRO 44 CO -0.05 -0.78 1.58 -2.30 0.04 0.00 0.00 177.00 175.50 1ggk n PRO 45 N -2.87 1.42 0.00 0.56 -0.02 -1.26 -1.39 135.00 131.45 1ggk n PRO 45 Ca 0.07 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1ggk n PRO 45 Cb 0.54 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 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 3.47 2.92 0.14 -1.23 0.00 -1.26 -4.91 105.19 104.33 1ggk n GLY 46 Ca 0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.15 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 0.08 -2.49 4.61 0.00 -1.60 -3.45 119.26 116.41 1ggk h ALA 47 Ca 0.00 0.08 -0.23 0.00 0.00 0.00 0.00 54.91 54.76 1ggk h ALA 47 Cb 0.00 0.22 -0.15 0.00 0.00 0.00 0.00 17.79 17.86 1ggk h ALA 47 CO 0.00 -0.51 -0.63 1.14 0.00 0.00 0.00 179.25 179.24 1ggk s GLN 48 N -6.19 1.11 0.30 0.00 -2.07 -1.26 -5.09 119.66 106.46 1ggk s GLN 48 Ca -0.14 -1.57 -0.30 0.00 -1.82 0.00 0.00 55.36 51.54 1ggk s GLN 48 Cb 0.11 0.19 -0.11 0.00 -1.09 0.00 0.00 33.01 32.10 1ggk s GLN 48 CO 0.68 -0.32 1.58 -2.14 -1.32 0.00 0.00 175.29 173.78 1ggk s PRO 49 N -4.09 4.12 0.74 9.60 0.02 -1.26 -4.98 135.00 139.14 1ggk s PRO 49 Ca 0.33 2.58 -0.11 0.00 0.02 0.00 0.00 61.00 63.81 1ggk s PRO 49 Cb 0.07 -3.02 0.04 0.00 0.02 0.00 0.00 34.50 31.61 1ggk s PRO 49 CO 0.08 -0.62 1.08 0.95 -0.33 0.00 0.00 177.00 178.16 1ggk s THR 50 N -0.13 3.56 0.23 0.99 -4.23 -1.26 -4.67 115.64 110.13 1ggk s THR 50 Ca 0.62 0.51 -0.13 0.00 -1.18 0.00 0.00 61.69 61.52 1ggk s THR 50 Cb -0.48 -3.08 -0.00 0.00 1.34 0.00 0.00 72.50 70.28 1ggk s THR 50 CO 0.50 -0.65 0.45 0.00 -0.54 0.00 0.00 174.62 174.38 1ggk s ALA 51 N -2.93 -0.26 0.25 3.99 0.00 -1.26 -5.02 121.76 116.52 1ggk s ALA 51 Ca 0.60 -0.82 -0.30 0.00 0.00 0.00 0.00 51.96 51.44 1ggk s ALA 51 Cb -0.16 1.03 -0.14 0.00 0.00 0.00 0.00 23.12 23.84 1ggk s ALA 51 CO 0.55 -0.82 1.22 -2.30 0.00 0.00 0.00 175.76 174.41 1ggk n PRO 52 N -0.36 1.62 -0.18 0.00 -0.02 -1.26 -4.70 135.00 130.11 1ggk n PRO 52 Ca -0.03 0.57 0.14 0.00 -2.02 0.00 0.00 63.50 62.16 1ggk n PRO 52 Cb 0.62 -2.10 0.47 0.00 -0.02 0.00 0.00 33.50 32.47 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 3.15 0.81 2.00 -1.23 0.00 -1.48 -0.86 103.07 105.46 1ggk h GLY 53 Ca -0.43 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.69 1ggk h GLY 53 CO 0.68 0.08 0.00 -1.14 0.00 0.00 0.00 176.54 176.16 1ggk n SER 54 N -4.49 0.45 0.00 0.19 3.41 -1.26 -0.59 113.62 111.33 1ggk n SER 54 Ca 0.14 0.54 -0.18 0.00 -0.26 0.00 0.00 58.87 59.11 1ggk n SER 54 Cb 0.48 -0.66 -0.14 0.00 -0.26 0.00 0.00 64.21 63.63 1ggk n SER 54 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1ggk h LEU 55 N 0.00 0.32 -0.21 1.04 3.38 -1.53 -3.24 115.31 115.07 1ggk h LEU 55 Ca 0.00 -0.71 -0.22 0.00 0.09 0.00 0.00 57.88 57.04 1ggk h LEU 55 Cb 0.63 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1ggk h LEU 55 CO 0.00 1.63 -0.88 0.50 0.09 0.00 0.00 178.44 179.78 1ggk h LYS 56 N 0.06 0.47 -2.00 1.13 1.63 -1.33 -3.40 116.57 113.13 1ggk h LYS 56 Ca -0.38 -0.46 -0.54 0.00 -0.85 0.00 0.00 60.65 58.42 1ggk h LYS 56 Cb 2.03 0.12 -0.39 0.00 -0.60 0.00 0.00 32.23 33.39 1ggk h LYS 56 CO 0.09 1.11 -1.13 0.00 -3.45 0.00 0.00 179.45 176.07 1ggk n ALA 57 N -2.55 2.33 0.33 5.00 0.00 0.24 -3.85 120.51 122.01 1ggk n ALA 57 Ca -0.07 -3.41 0.11 0.00 0.00 0.00 0.00 53.44 50.07 1ggk n ALA 57 Cb 0.80 -0.84 0.47 0.00 0.00 0.00 0.00 19.45 19.88 1ggk n ALA 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ggk n PRO 58 N 1.09 0.15 0.00 0.00 -0.04 -1.22 -2.16 135.00 132.82 1ggk n PRO 58 Ca 0.22 0.46 0.11 0.00 -0.04 0.00 0.00 63.50 64.25 1ggk n PRO 58 Cb 0.56 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 1ggk n PRO 58 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1ggk n ASP 59 N -2.14 1.23 -4.72 3.54 8.00 -1.26 -4.89 116.55 116.31 1ggk n ASP 59 Ca 0.01 -1.04 -0.42 0.00 0.71 0.00 0.00 54.79 54.06 1ggk n ASP 59 Cb 0.16 0.68 -0.03 0.00 -0.02 0.00 0.00 41.12 41.92 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 -2.81 3.80 0.22 -3.53 2.01 -0.92 -5.01 115.64 109.39 1ggk s THR 60 Ca 0.13 1.34 -0.23 0.00 0.31 0.00 0.00 61.69 63.23 1ggk s THR 60 Cb 0.17 -3.85 0.04 0.00 0.01 0.00 0.00 72.50 68.87 1ggk s THR 60 CO 0.74 0.13 0.80 0.00 -0.69 0.00 0.00 174.62 175.60 1ggk s ARG 61 N 0.76 1.51 0.27 4.92 3.03 -1.26 -5.05 118.95 123.13 1ggk s ARG 61 Ca 0.58 -0.81 -0.06 0.00 2.03 0.00 0.00 55.73 57.47 1ggk s ARG 61 Cb -0.31 0.53 0.03 0.00 -1.03 0.00 0.00 34.95 34.16 1ggk s ARG 61 CO 0.31 -0.69 0.48 0.27 -1.13 0.00 0.00 175.30 174.54 1ggk n ASN 62 N -0.45 -1.36 0.15 -2.89 0.23 -1.26 -5.04 115.26 104.63 1ggk n ASN 62 Ca -0.06 -2.27 0.00 0.00 -0.53 0.00 0.00 54.58 51.73 1ggk n ASN 62 Cb 0.60 2.37 0.23 0.00 -2.08 0.00 0.00 39.78 40.89 1ggk n ASN 62 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1ggk h GLU 63 N 0.00 0.00 -0.03 -3.83 4.81 -1.97 -2.31 114.58 111.25 1ggk h GLU 63 Ca -0.22 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.95 1ggk h GLU 63 Cb 0.89 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.27 1ggk h GLU 63 CO 0.29 0.54 -0.18 -0.22 -0.73 0.00 0.00 179.01 178.71 1ggk h LYS 64 N 0.00 0.18 -0.43 1.92 1.63 -1.97 -3.01 116.57 114.89 1ggk h LYS 64 Ca -0.01 -0.15 -0.05 0.00 -0.85 0.00 0.00 60.65 59.59 1ggk h LYS 64 Cb 0.98 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.62 1ggk h LYS 64 CO 0.07 0.81 0.06 -0.07 -3.45 0.00 0.00 179.45 176.87 1ggk h LEU 65 N -0.40 0.62 -0.79 5.20 3.38 -1.96 -2.55 115.31 118.81 1ggk h LEU 65 Ca -0.01 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.73 1ggk h LEU 65 Cb 0.85 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1ggk h LEU 65 CO 0.04 0.65 -0.27 0.78 0.09 0.00 0.00 178.44 179.73 1ggk h ASN 66 N 0.64 0.62 0.70 -0.43 2.35 -1.47 -2.93 115.58 115.06 1ggk h ASN 66 Ca 0.14 -0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1ggk h ASN 66 Cb 0.31 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1ggk h ASN 66 CO 0.00 0.87 0.00 -1.54 -1.65 0.00 0.00 177.43 175.11 1ggk n SER 67 N -4.10 0.00 -0.04 5.81 3.41 -0.98 -2.17 113.62 115.55 1ggk n SER 67 Ca -0.00 0.21 0.14 0.00 -0.26 0.00 0.00 58.87 58.96 1ggk n SER 67 Cb 0.44 -0.40 0.57 0.00 -0.26 0.00 0.00 64.21 64.56 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 -1.40 0.25 0.28 1.04 4.77 -1.06 -3.98 117.00 116.90 1ggk n LEU 68 Ca 0.09 0.21 0.12 0.00 -0.03 0.00 0.00 56.01 56.40 1ggk n LEU 68 Cb 0.26 -0.32 0.78 0.00 -2.33 0.00 0.00 43.42 41.81 1ggk n LEU 68 CO 0.22 0.05 1.08 -0.08 -1.33 0.00 0.00 177.39 177.33 1ggk h GLU 69 N 0.19 0.00 0.00 3.23 4.57 -1.51 -1.20 114.58 119.86 1ggk h GLU 69 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1ggk h GLU 69 Cb 0.42 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1ggk h GLU 69 CO 0.00 0.03 -0.05 0.38 -1.18 0.00 0.00 179.01 178.18 1ggk h ASP 70 N 0.00 0.00 -0.00 1.04 -0.00 -1.81 -3.08 116.42 112.57 1ggk h ASP 70 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1ggk h ASP 70 Cb 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.39 1ggk h ASP 70 CO 0.00 0.05 -0.38 1.33 -0.00 0.00 0.00 179.24 180.25 1ggk n VAL 71 N -3.28 0.00 -2.27 4.15 0.24 -0.47 -5.01 118.33 111.69 1ggk n VAL 71 Ca -0.01 -0.31 -0.39 0.00 -2.04 0.00 0.00 64.34 61.59 1ggk n VAL 71 Cb 0.23 1.08 -0.02 0.00 -1.47 0.00 0.00 33.84 33.66 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 -1.78 4.18 -0.05 7.34 0.52 -1.12 -5.04 118.95 123.01 1ggk s ARG 72 Ca 0.08 1.93 0.06 0.00 -0.52 0.00 0.00 55.73 57.27 1ggk s ARG 72 Cb 0.09 -2.82 -0.01 0.00 0.52 0.00 0.00 34.95 32.73 1ggk s ARG 72 CO 0.38 -0.23 -0.23 0.15 0.02 0.00 0.00 175.30 175.39 1ggk s LYS 73 N -2.09 2.28 0.00 3.54 -0.14 -1.26 -5.03 119.74 117.04 1ggk s LYS 73 Ca 0.54 -0.82 0.00 0.00 -1.36 0.00 0.00 55.97 54.33 1ggk s LYS 73 Cb -0.33 -1.96 0.00 0.00 -1.68 0.00 0.00 37.83 33.86 1ggk s LYS 73 CO 0.42 0.35 0.00 0.41 -0.76 0.00 0.00 175.35 175.77 1ggk n GLY 74 N 2.97 1.26 0.00 -3.33 0.00 -1.26 -5.07 105.19 99.75 1ggk n GLY 74 Ca -0.17 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.24 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 -4.75 1.61 3.41 -1.26 -5.08 113.62 107.54 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 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.51 2.68 -0.95 4.33 1.02 -1.26 -2.12 120.64 123.83 1ggk n GLU 76 Ca 0.00 0.95 0.00 0.00 -0.02 0.00 0.00 57.16 58.09 1ggk n GLU 76 Cb 0.00 -2.71 0.00 0.00 -0.02 0.00 0.00 31.44 28.71 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 1.58 -3.44 -4.93 1.62 3.02 -1.26 -5.03 115.26 106.83 1ggk n ASN 77 Ca 0.06 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.32 1ggk n ASN 77 Cb 0.37 -1.72 -0.04 0.00 -0.61 0.00 0.00 39.78 37.79 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 -1.77 3.50 0.49 3.10 2.02 -0.90 -5.09 117.35 118.69 1ggk s TYR 78 Ca 0.00 0.26 -0.20 0.00 -0.37 0.00 0.00 57.07 56.77 1ggk s TYR 78 Cb 0.00 -1.78 -0.08 0.00 -0.40 0.00 0.00 41.96 39.70 1ggk s TYR 78 CO 0.00 0.52 1.02 0.00 -1.57 0.00 0.00 175.55 175.51 1ggk s ALA 79 N -1.65 2.90 0.08 3.71 0.00 -1.26 -5.02 121.76 120.51 1ggk s ALA 79 Ca 0.36 0.51 -0.31 0.00 0.00 0.00 0.00 51.96 52.52 1ggk s ALA 79 Cb -0.12 -3.22 -0.07 0.00 0.00 0.00 0.00 23.12 19.71 1ggk s ALA 79 CO 0.28 -0.28 1.41 -1.17 0.00 0.00 0.00 175.76 176.00 1ggk s LEU 80 N -3.59 4.35 0.18 0.00 2.96 -1.26 -5.01 118.68 116.31 1ggk s LEU 80 Ca 0.65 2.28 -0.04 0.00 -0.22 0.00 0.00 54.13 56.80 1ggk s LEU 80 Cb -0.14 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 1ggk s LEU 80 CO 0.21 -0.69 0.17 0.42 -1.32 0.00 0.00 176.35 175.14 1ggk s THR 81 N 1.60 0.04 1.22 3.68 -4.23 -1.26 -2.02 115.64 114.66 1ggk s THR 81 Ca 0.65 -1.81 -0.18 0.00 -1.18 0.00 0.00 61.69 59.17 1ggk s THR 81 Cb -0.35 -2.22 0.29 0.00 1.34 0.00 0.00 72.50 71.55 1ggk s THR 81 CO 0.29 -0.19 1.05 0.42 -0.54 0.00 0.00 174.62 175.66 1ggk s THR 82 N -4.08 1.64 -0.25 3.99 -4.23 0.33 -4.87 115.64 108.16 1ggk s THR 82 Ca 0.29 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 61.08 1ggk s THR 82 Cb 0.06 -2.34 0.33 0.00 1.34 0.00 0.00 72.50 71.89 1ggk s THR 82 CO 0.07 0.00 1.82 0.78 -0.54 0.00 0.00 174.62 176.75 1ggk h ASN 83 N -2.67 0.00 -0.04 3.99 2.35 -2.00 -2.67 115.58 114.54 1ggk h ASN 83 Ca -0.49 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.26 1ggk h ASN 83 Cb 1.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.69 1ggk h ASN 83 CO 0.39 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 176.17 1ggk n GLN 84 N -2.74 1.84 -0.51 0.81 1.13 -1.26 -4.95 117.38 111.70 1ggk n GLN 84 Ca 0.02 -1.23 0.00 0.00 -1.94 0.00 0.00 57.00 53.85 1ggk n GLN 84 Cb 0.33 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.21 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 1.22 0.71 3.74 1.08 0.00 -1.01 -5.07 105.19 105.88 1ggk n GLY 85 Ca 0.18 -0.28 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 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 5.12 0.33 1.61 1.01 -1.26 -4.79 120.40 120.42 1ggk s VAL 86 Ca 0.00 0.99 -0.28 0.00 0.00 0.00 0.00 61.98 62.69 1ggk s VAL 86 Cb 0.00 -3.82 -0.10 0.00 0.00 0.00 0.00 36.38 32.46 1ggk s VAL 86 CO 0.00 0.37 1.19 -0.13 0.00 0.00 0.00 175.10 176.53 1ggk s ARG 87 N 0.29 4.39 -0.19 2.72 0.52 -1.26 -0.51 118.95 124.91 1ggk s ARG 87 Ca 0.27 1.95 -0.08 0.00 -0.52 0.00 0.00 55.73 57.35 1ggk s ARG 87 Cb -0.16 -3.01 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 1ggk s ARG 87 CO 0.12 -0.06 0.08 0.42 0.02 0.00 0.00 175.30 175.88 1ggk s ILE 88 N -1.22 4.99 -0.09 1.52 1.01 -0.86 -4.90 121.20 121.64 1ggk s ILE 88 Ca 0.49 0.04 -0.12 0.00 0.00 0.00 0.00 60.65 61.06 1ggk s ILE 88 Cb -0.34 -3.26 -0.28 0.00 0.01 0.00 0.00 42.46 38.59 1ggk s ILE 88 CO 0.44 0.45 0.53 0.00 0.00 0.00 0.00 174.94 176.37 1ggk h ALA 89 N 6.69 0.23 -3.35 9.38 0.00 -1.95 -3.46 119.26 126.81 1ggk h ALA 89 Ca -0.38 -1.19 -0.58 0.00 0.00 0.00 0.00 54.91 52.76 1ggk h ALA 89 Cb 1.16 0.54 -0.40 0.00 0.00 0.00 0.00 17.79 19.09 1ggk h ALA 89 CO 0.72 1.01 -0.76 0.34 0.00 0.00 0.00 179.25 180.56 1ggk s ASP 90 N -7.12 3.85 -0.32 0.00 3.68 -1.26 -4.98 116.67 110.50 1ggk s ASP 90 Ca -0.20 -1.42 0.05 0.00 2.13 0.00 0.00 52.55 53.11 1ggk s ASP 90 Cb 0.05 -0.96 0.57 0.00 -1.45 0.00 0.00 42.92 41.13 1ggk s ASP 90 CO 0.79 -0.35 1.69 -0.67 0.13 0.00 0.00 175.17 176.76 1ggk n ASP 91 N 4.78 3.89 -0.00 -0.34 4.64 -1.26 -4.22 116.55 124.03 1ggk n ASP 91 Ca -0.05 -3.17 0.03 0.00 -1.38 0.00 0.00 54.79 50.21 1ggk n ASP 91 Cb 0.43 -0.75 -0.04 0.00 -1.04 0.00 0.00 41.12 39.73 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 -0.53 1.76 -4.14 -0.67 1.13 -1.26 -5.07 117.38 108.61 1ggk n GLN 92 Ca 0.42 -0.04 -0.14 0.00 -1.94 0.00 0.00 57.00 55.31 1ggk n GLN 92 Cb 1.35 -1.02 -0.11 0.00 0.11 0.00 0.00 30.24 30.58 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 -2.30 1.23 0.52 1.08 0.01 -1.26 -5.15 114.94 109.06 1ggk s ASN 93 Ca -0.01 -0.74 -0.12 0.00 -0.71 0.00 0.00 52.86 51.28 1ggk s ASN 93 Cb 0.04 0.03 -0.06 0.00 0.41 0.00 0.00 41.25 41.67 1ggk s ASN 93 CO 0.24 -0.26 0.93 -0.44 -1.51 0.00 0.00 177.10 176.06 1ggk s SER 94 N -2.19 6.43 -0.12 -1.22 0.01 -1.26 -4.99 113.70 110.36 1ggk s SER 94 Ca 0.01 1.35 -0.28 0.00 1.31 0.00 0.00 55.95 58.34 1ggk s SER 94 Cb -0.05 -2.43 -0.01 0.00 0.21 0.00 0.00 66.02 63.74 1ggk s SER 94 CO -0.00 -0.64 0.93 -0.22 0.41 0.00 0.00 173.24 173.72 1ggk s LEU 95 N -4.45 4.23 0.21 2.44 2.96 -1.26 -5.05 118.68 117.76 1ggk s LEU 95 Ca 0.55 1.40 0.02 0.00 -0.22 0.00 0.00 54.13 55.87 1ggk s LEU 95 Cb -0.10 -3.43 -0.05 0.00 0.50 0.00 0.00 46.19 43.11 1ggk s LEU 95 CO 0.40 -0.41 0.04 0.00 -1.32 0.00 0.00 176.35 175.07 1ggk s ARG 96 N 1.96 1.25 -0.96 1.98 1.70 -1.26 -2.03 118.95 121.59 1ggk s ARG 96 Ca 0.45 -1.64 -0.17 0.00 -0.47 0.00 0.00 55.73 53.89 1ggk s ARG 96 Cb -0.18 -0.27 0.15 0.00 -0.57 0.00 0.00 34.95 34.08 1ggk s ARG 96 CO 0.16 -0.20 1.13 0.00 -1.08 0.00 0.00 175.30 175.31 1ggk s ALA 97 N -3.70 3.55 0.00 7.88 0.00 -0.90 -4.79 121.76 123.80 1ggk s ALA 97 Ca 0.30 -2.93 0.00 0.00 0.00 0.00 0.00 51.96 49.34 1ggk s ALA 97 Cb 0.07 -3.99 0.00 0.00 0.00 0.00 0.00 23.12 19.19 1ggk s ALA 97 CO 0.09 -2.87 0.00 0.41 0.00 0.00 0.00 175.76 173.39 1ggk n GLY 98 N 5.10 1.46 0.00 0.00 0.00 -1.26 -3.95 105.19 106.53 1ggk n GLY 98 Ca 0.25 -1.74 0.12 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.26 0.00 -0.38 1.61 3.41 -1.26 -1.99 113.62 114.75 1ggk n SER 99 Ca 0.00 0.37 0.08 0.00 -0.26 0.00 0.00 58.87 59.06 1ggk n SER 99 Cb 0.00 -0.45 0.18 0.00 -0.26 0.00 0.00 64.21 63.68 1ggk n SER 99 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1ggk n ARG 100 N -1.45 1.67 -3.24 4.33 0.63 -1.26 -5.07 116.66 112.27 1ggk n ARG 100 Ca 0.07 -2.79 -0.21 0.00 -0.92 0.00 0.00 57.85 54.00 1ggk n ARG 100 Cb 0.26 -1.60 0.04 0.00 0.45 0.00 0.00 32.46 31.61 1ggk n ARG 100 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1ggk s GLY 101 N -2.74 1.89 0.44 5.14 0.00 -0.84 -5.05 107.32 106.15 1ggk s GLY 101 Ca 0.36 -1.93 -0.24 0.00 0.00 0.00 0.00 44.72 42.91 1ggk s GLY 101 CO 0.02 -1.74 1.19 2.56 0.00 0.00 0.00 173.10 175.13 1ggk s PRO 102 N -4.56 3.83 0.41 2.90 0.04 -1.26 -4.60 135.00 131.75 1ggk s PRO 102 Ca 0.55 1.86 -0.24 0.00 0.04 0.00 0.00 61.00 63.20 1ggk s PRO 102 Cb -0.05 -2.51 -0.08 0.00 0.04 0.00 0.00 34.50 31.89 1ggk s PRO 102 CO 0.35 -0.51 1.12 0.99 0.04 0.00 0.00 177.00 178.98 1ggk s THR 103 N -1.46 3.37 0.06 1.26 2.01 -1.26 -2.12 115.64 117.49 1ggk s THR 103 Ca 0.61 1.09 -0.01 0.00 0.31 0.00 0.00 61.69 63.70 1ggk s THR 103 Cb -0.31 -3.59 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 1ggk s THR 103 CO 0.38 0.05 0.23 -0.76 -0.69 0.00 0.00 174.62 173.82 1ggk s LEU 104 N -2.62 4.35 0.42 4.42 1.43 -0.86 -4.94 118.68 120.88 1ggk s LEU 104 Ca 0.58 0.31 0.17 0.00 -1.03 0.00 0.00 54.13 54.16 1ggk s LEU 104 Cb -0.27 -2.97 0.94 0.00 0.03 0.00 0.00 46.19 43.92 1ggk s LEU 104 CO 0.34 0.16 1.91 0.25 0.23 0.00 0.00 176.35 179.24 1ggk h LEU 105 N 3.11 0.00 0.00 1.79 5.85 -1.96 -2.96 115.31 121.14 1ggk h LEU 105 Ca -0.45 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1ggk h LEU 105 Cb 1.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1ggk h LEU 105 CO 0.75 0.27 0.00 -1.84 -0.34 0.00 0.00 178.44 177.28 1ggk n GLU 106 N -3.98 0.42 -2.31 1.25 0.28 -1.26 -4.56 120.64 110.47 1ggk n GLU 106 Ca -0.02 0.06 -0.34 0.00 -0.16 0.00 0.00 57.16 56.70 1ggk n GLU 106 Cb 0.34 -1.50 -0.04 0.00 1.43 0.00 0.00 31.44 31.67 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 -2.32 5.85 0.43 -1.84 3.68 -1.12 -4.76 116.67 116.59 1ggk s ASP 107 Ca 0.23 -1.10 0.23 0.00 2.13 0.00 0.00 52.55 54.04 1ggk s ASP 107 Cb 0.13 -2.57 0.79 0.00 -1.45 0.00 0.00 42.92 39.82 1ggk s ASP 107 CO 0.26 -2.11 1.77 2.19 0.13 0.00 0.00 175.17 177.41 1ggk h PHE 108 N 10.47 0.00 -0.08 -5.34 -0.00 -1.92 -2.99 116.94 117.09 1ggk h PHE 108 Ca 0.15 0.00 -0.05 0.00 -0.00 0.00 0.00 57.97 58.08 1ggk h PHE 108 Cb 1.01 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.96 1ggk h PHE 108 CO 1.25 0.23 -0.15 0.82 -0.00 0.00 0.00 178.31 180.46 1ggk h ILE 109 N 0.00 1.41 -0.29 0.88 2.04 -1.98 -2.84 117.51 116.73 1ggk h ILE 109 Ca -0.00 -1.44 0.00 0.00 1.00 0.00 0.00 64.86 64.41 1ggk h ILE 109 Cb 0.84 2.18 -0.01 0.00 -0.74 0.00 0.00 36.82 39.08 1ggk h ILE 109 CO 0.03 0.41 0.19 0.25 0.00 0.00 0.00 178.15 179.02 1ggk h LEU 110 N -0.24 0.34 -1.08 1.44 5.85 -1.94 -2.88 115.31 116.80 1ggk h LEU 110 Ca 0.00 -0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.63 1ggk h LEU 110 Cb 0.73 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 1ggk h LEU 110 CO 0.03 0.27 -0.04 0.03 -0.34 0.00 0.00 178.44 178.39 1ggk h ARG 111 N 0.39 0.60 -0.23 1.25 3.08 -1.58 -0.63 114.38 117.26 1ggk h ARG 111 Ca 0.11 -0.15 -0.14 0.00 0.07 0.00 0.00 59.98 59.87 1ggk h ARG 111 Cb -0.02 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 1ggk h ARG 111 CO -0.02 0.66 -0.39 1.49 -1.07 0.00 0.00 179.97 180.64 1ggk h GLU 112 N 0.57 0.66 -0.04 0.04 4.81 -1.50 0.66 114.58 119.77 1ggk h GLU 112 Ca 0.11 -0.41 0.03 0.00 -0.13 0.00 0.00 59.36 58.97 1ggk h GLU 112 Cb 0.42 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.80 1ggk h GLU 112 CO 0.02 1.03 -0.20 -0.22 -0.73 0.00 0.00 179.01 178.90 1ggk h LYS 113 N 0.37 -0.29 -0.19 1.92 3.64 -1.29 0.14 116.57 120.87 1ggk h LYS 113 Ca 0.02 0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.25 1ggk h LYS 113 Cb 0.98 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1ggk h LYS 113 CO 0.09 -0.19 -0.56 0.82 -2.27 0.00 0.00 179.45 177.34 1ggk h ILE 114 N -0.30 1.32 -0.20 2.00 1.08 -1.09 -2.64 117.51 117.67 1ggk h ILE 114 Ca 0.07 -1.80 0.03 0.00 -0.39 0.00 0.00 64.86 62.77 1ggk h ILE 114 Cb 0.40 1.77 -0.03 0.00 -3.07 0.00 0.00 36.82 35.89 1ggk h ILE 114 CO -0.22 0.56 0.03 0.74 -0.69 0.00 0.00 178.15 178.57 1ggk h THR 115 N 0.44 0.89 -0.51 -0.27 2.02 -0.42 0.21 112.91 115.27 1ggk h THR 115 Ca 0.01 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 1ggk h THR 115 Cb 1.11 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 1ggk h THR 115 CO 0.11 0.02 0.20 -0.74 0.37 0.00 0.00 175.52 175.47 1ggk h HIS 116 N 0.10 0.79 -0.62 3.16 -0.00 -0.66 -2.62 115.15 115.31 1ggk h HIS 116 Ca 0.09 -0.06 0.05 0.00 -0.00 0.00 0.00 60.37 60.45 1ggk h HIS 116 Cb 0.10 -0.23 -0.05 0.00 -0.00 0.00 0.00 27.41 27.22 1ggk h HIS 116 CO -0.15 0.66 0.34 0.35 -0.00 0.00 0.00 177.93 179.12 1ggk h PHE 117 N 0.69 0.63 0.00 5.26 3.57 -1.16 -2.35 116.94 123.59 1ggk h PHE 117 Ca 0.17 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 1ggk h PHE 117 Cb 0.21 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 1ggk h PHE 117 CO 0.01 0.31 -0.07 -0.44 -2.23 0.00 0.00 178.31 175.88 1ggk h ASP 118 N 0.64 0.00 -0.45 0.41 3.45 -0.22 -2.99 116.42 117.25 1ggk h ASP 118 Ca 0.27 0.00 -0.28 0.00 0.43 0.00 0.00 57.03 57.46 1ggk h ASP 118 Cb 0.16 0.00 -0.17 0.00 -0.56 0.00 0.00 39.33 38.75 1ggk h ASP 118 CO -0.17 0.07 -0.16 1.41 -1.57 0.00 0.00 179.24 178.83 1ggk n HIS 119 N -4.02 1.49 0.03 4.55 8.25 -0.89 -4.76 115.22 119.87 1ggk n HIS 119 Ca -0.03 -1.83 -0.15 0.00 -0.26 0.00 0.00 57.72 55.45 1ggk n HIS 119 Cb 0.16 -0.54 -0.04 0.00 1.12 0.00 0.00 29.99 30.69 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 1.28 0.56 -6.56 -0.41 5.08 -1.45 -3.45 114.58 109.63 1ggk h GLU 120 Ca 0.27 -0.52 -0.52 0.00 -1.00 0.00 0.00 59.36 57.59 1ggk h GLU 120 Cb 1.54 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.89 1ggk h GLU 120 CO 0.53 1.15 0.16 1.03 -1.00 0.00 0.00 179.01 180.88 1ggk s ARG 121 N -3.50 4.43 0.24 2.33 1.81 -1.26 -5.09 118.95 117.92 1ggk s ARG 121 Ca -0.08 1.05 0.11 0.00 -1.72 0.00 0.00 55.73 55.10 1ggk s ARG 121 Cb 0.09 -3.07 -0.05 0.00 -0.45 0.00 0.00 34.95 31.47 1ggk s ARG 121 CO 0.88 0.48 -0.21 0.96 -0.68 0.00 0.00 175.30 176.73 1ggk s ILE 122 N -1.33 2.37 0.37 1.52 -4.36 -1.26 -5.12 121.20 113.38 1ggk s ILE 122 Ca 0.40 -2.24 -0.28 0.00 -0.26 0.00 0.00 60.65 58.27 1ggk s ILE 122 Cb -0.20 -2.20 -0.10 0.00 1.25 0.00 0.00 42.46 41.20 1ggk s ILE 122 CO 0.24 -0.30 1.38 -2.84 0.24 0.00 0.00 174.94 173.66 1ggk s PRO 123 N -3.18 4.15 0.81 0.37 0.02 -1.26 -5.01 135.00 130.90 1ggk s PRO 123 Ca 0.26 2.35 -0.12 0.00 0.02 0.00 0.00 61.00 63.51 1ggk s PRO 123 Cb -0.06 -2.95 0.08 0.00 0.02 0.00 0.00 34.50 31.59 1ggk s PRO 123 CO 0.12 -0.41 1.17 -1.83 -0.33 0.00 0.00 177.00 175.73 1ggk s GLU 124 N -2.03 1.96 0.42 5.54 -1.05 -1.26 -4.86 118.70 117.41 1ggk s GLU 124 Ca 0.52 0.14 -0.26 0.00 -0.15 0.00 0.00 54.97 55.23 1ggk s GLU 124 Cb -0.42 -1.95 -0.08 0.00 -0.44 0.00 0.00 34.13 31.24 1ggk s GLU 124 CO 0.56 -1.61 1.30 1.03 0.95 0.00 0.00 175.26 177.49 1ggk s ARG 125 N -5.55 3.90 0.27 -4.83 0.52 -1.26 -4.91 118.95 107.09 1ggk s ARG 125 Ca 0.62 2.14 -0.04 0.00 -0.52 0.00 0.00 55.73 57.93 1ggk s ARG 125 Cb -0.11 -2.70 0.35 0.00 0.52 0.00 0.00 34.95 33.00 1ggk s ARG 125 CO 0.49 -0.54 1.93 0.97 0.02 0.00 0.00 175.30 178.18 1ggk h ILE 126 N 2.37 1.21 -3.96 1.52 6.09 -1.98 -3.37 117.51 119.39 1ggk h ILE 126 Ca -0.50 -0.43 -0.33 0.00 -1.37 0.00 0.00 64.86 62.23 1ggk h ILE 126 Cb 1.25 -0.15 -0.22 0.00 0.47 0.00 0.00 36.82 38.17 1ggk h ILE 126 CO 0.62 0.23 -0.75 0.68 -3.07 0.00 0.00 178.15 175.86 1ggk s VAL 127 N -6.04 0.75 -0.77 2.19 -7.23 -1.26 -4.82 120.40 103.21 1ggk s VAL 127 Ca -0.12 -1.11 -0.02 0.00 -1.81 0.00 0.00 61.98 58.92 1ggk s VAL 127 Cb 0.18 -0.77 0.00 0.00 0.56 0.00 0.00 36.38 36.36 1ggk s VAL 127 CO 0.81 -0.29 0.21 1.41 -0.31 0.00 0.00 175.10 176.93 1ggk n HIS 128 N 1.49 -0.80 -0.00 2.82 8.25 0.59 -4.92 115.22 122.66 1ggk n HIS 128 Ca -0.22 0.18 -0.03 0.00 -0.26 0.00 0.00 57.72 57.39 1ggk n HIS 128 Cb 0.55 -2.59 0.22 0.00 1.12 0.00 0.00 29.99 29.28 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 0.47 1.15 -2.27 -1.41 0.00 -1.73 -3.41 119.26 112.06 1ggk h ALA 129 Ca -0.25 -0.31 -0.64 0.00 0.00 0.00 0.00 54.91 53.72 1ggk h ALA 129 Cb 1.17 -0.13 -0.14 0.00 0.00 0.00 0.00 17.79 18.69 1ggk h ALA 129 CO 0.27 0.53 0.15 0.50 0.00 0.00 0.00 179.25 180.70 1ggk s ARG 130 N -4.65 3.56 0.18 0.00 6.06 -1.26 -4.33 118.95 118.51 1ggk s ARG 130 Ca -0.07 -0.07 -0.19 0.00 -2.50 0.00 0.00 55.73 52.90 1ggk s ARG 130 Cb 0.14 -3.85 0.04 0.00 0.06 0.00 0.00 34.95 31.34 1ggk s ARG 130 CO 0.79 -0.83 0.54 0.20 -2.50 0.00 0.00 175.30 173.51 1ggk s GLY 131 N 1.86 -0.30 -0.02 8.12 0.00 -1.26 -1.41 107.32 114.32 1ggk s GLY 131 Ca 0.24 0.04 0.02 0.00 0.00 0.00 0.00 44.72 45.02 1ggk s GLY 131 CO 0.16 -0.11 -0.08 -0.56 0.00 0.00 0.00 173.10 172.51 1ggk s SER 132 N -2.82 0.98 0.21 1.64 0.01 0.75 -4.97 113.70 109.51 1ggk s SER 132 Ca 0.05 -0.15 0.04 0.00 1.31 0.00 0.00 55.95 57.21 1ggk s SER 132 Cb -0.01 -0.20 -0.05 0.00 0.21 0.00 0.00 66.02 65.98 1ggk s SER 132 CO -0.07 0.07 -0.03 0.00 0.41 0.00 0.00 173.24 173.62 1ggk s ALA 133 N 0.04 1.77 0.12 1.44 0.00 -1.26 -1.36 121.76 122.51 1ggk s ALA 133 Ca -0.00 -1.71 -0.20 0.00 0.00 0.00 0.00 51.96 50.05 1ggk s ALA 133 Cb -0.06 0.36 0.05 0.00 0.00 0.00 0.00 23.12 23.47 1ggk s ALA 133 CO -0.00 -0.20 0.49 0.00 0.00 0.00 0.00 175.76 176.06 1ggk s ALA 134 N -3.36 -1.24 0.35 0.00 0.00 -0.89 -4.57 121.76 112.05 1ggk s ALA 134 Ca 0.26 0.27 -0.00 0.00 0.00 0.00 0.00 51.96 52.48 1ggk s ALA 134 Cb 0.05 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.84 1ggk s ALA 134 CO 0.07 -0.66 0.56 -1.01 0.00 0.00 0.00 175.76 174.72 1ggk s HIS 135 N -3.53 3.50 0.00 0.00 3.76 0.13 -1.89 115.29 117.27 1ggk s HIS 135 Ca 0.01 0.40 0.00 0.00 -0.15 0.00 0.00 55.06 55.31 1ggk s HIS 135 Cb 0.00 -1.93 0.00 0.00 1.11 0.00 0.00 32.58 31.76 1ggk s HIS 135 CO -0.10 0.10 0.00 0.41 -0.85 0.00 0.00 174.74 174.29 1ggk n GLY 136 N -1.77 1.57 3.13 -2.22 0.00 -0.83 -2.33 105.19 102.73 1ggk n GLY 136 Ca -0.04 -0.63 -0.08 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.27 0.29 0.06 1.61 -0.85 0.01 -1.58 117.35 114.63 1ggk s TYR 137 Ca 0.00 -0.71 0.07 0.00 -0.52 0.00 0.00 57.07 55.92 1ggk s TYR 137 Cb 0.00 -0.20 -0.03 0.00 0.38 0.00 0.00 41.96 42.11 1ggk s TYR 137 CO 0.00 -0.41 -0.20 0.12 -1.52 0.00 0.00 175.55 173.54 1ggk s PHE 138 N -3.32 1.75 -0.13 -3.49 5.36 0.20 -1.07 117.98 117.28 1ggk s PHE 138 Ca 0.01 -0.39 -0.07 0.00 -0.96 0.00 0.00 56.93 55.53 1ggk s PHE 138 Cb 0.03 -1.01 0.05 0.00 -0.34 0.00 0.00 43.02 41.75 1ggk s PHE 138 CO -0.08 0.12 0.30 -1.14 -1.46 0.00 0.00 175.22 172.97 1ggk s GLN 139 N -1.40 0.27 0.52 10.12 0.74 -0.34 -1.25 119.66 128.33 1ggk s GLN 139 Ca 0.06 0.62 -0.18 0.00 0.05 0.00 0.00 55.36 55.91 1ggk s GLN 139 Cb -0.09 -0.08 -0.07 0.00 1.10 0.00 0.00 33.01 33.87 1ggk s GLN 139 CO 0.02 -0.16 1.01 -1.25 -0.55 0.00 0.00 175.29 174.37 1ggk s PRO 140 N 1.28 3.78 0.25 1.67 0.04 -1.26 -1.65 135.00 139.11 1ggk s PRO 140 Ca -0.09 1.13 0.13 0.00 0.04 0.00 0.00 61.00 62.21 1ggk s PRO 140 Cb -0.09 -2.10 0.10 0.00 0.04 0.00 0.00 34.50 32.45 1ggk s PRO 140 CO -0.10 -0.42 1.45 1.88 0.04 0.00 0.00 177.00 179.86 1ggk h TYR 141 N 1.06 0.00 -2.89 0.56 0.99 -0.96 -3.41 116.97 112.31 1ggk h TYR 141 Ca -0.48 0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.31 1ggk h TYR 141 Cb 1.20 0.00 -0.08 0.00 1.00 0.00 0.00 36.73 38.85 1ggk h TYR 141 CO 0.61 0.61 0.26 -1.59 -0.00 0.00 0.00 178.16 178.05 1ggk s LYS 142 N -3.02 1.50 0.13 4.88 -2.85 -1.26 -4.88 119.74 114.24 1ggk s LYS 142 Ca 0.02 -0.74 -0.31 0.00 -1.00 0.00 0.00 55.97 53.95 1ggk s LYS 142 Cb 0.09 0.57 -0.07 0.00 -2.06 0.00 0.00 37.83 36.35 1ggk s LYS 142 CO 0.76 -0.67 1.27 0.45 0.10 0.00 0.00 175.35 177.25 1ggk s SER 143 N -2.84 6.97 -0.29 0.03 0.15 -1.26 -4.58 113.70 111.89 1ggk s SER 143 Ca 0.07 2.22 0.10 0.00 0.70 0.00 0.00 55.95 59.05 1ggk s SER 143 Cb -0.04 -2.59 0.60 0.00 -1.71 0.00 0.00 66.02 62.28 1ggk s SER 143 CO -0.01 -0.51 1.60 0.18 1.20 0.00 0.00 173.24 175.70 1ggk n LEU 144 N 3.38 4.92 0.33 3.45 4.77 -0.58 -4.74 117.00 128.52 1ggk n LEU 144 Ca 0.08 -3.42 0.20 0.00 -0.03 0.00 0.00 56.01 52.84 1ggk n LEU 144 Cb 0.44 -0.67 1.08 0.00 -2.33 0.00 0.00 43.42 41.94 1ggk n LEU 144 CO 0.57 0.97 1.15 0.77 -1.33 0.00 0.00 177.39 179.52 1ggk h SER 145 N 1.62 0.00 0.53 -1.43 4.64 -1.80 -1.59 113.55 115.53 1ggk h SER 145 Ca 0.23 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.43 1ggk h SER 145 Cb 1.94 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 64.02 1ggk h SER 145 CO 0.53 0.00 -0.57 0.44 -0.87 0.00 0.00 176.83 176.36 1ggk h ASP 146 N 0.00 0.04 0.00 4.97 3.45 -1.99 -3.31 116.42 119.58 1ggk h ASP 146 Ca 0.00 -0.02 -0.00 0.00 0.43 0.00 0.00 57.03 57.43 1ggk h ASP 146 Cb 0.17 -0.01 -0.00 0.00 -0.56 0.00 0.00 39.33 38.92 1ggk h ASP 146 CO 0.00 0.61 -1.81 2.30 -1.57 0.00 0.00 179.24 178.76 1ggk n ILE 147 N -3.87 0.02 -3.74 0.35 -5.35 -0.66 -4.77 119.36 101.34 1ggk n ILE 147 Ca -0.01 -0.41 -0.13 0.00 -0.27 0.00 0.00 62.75 61.93 1ggk n ILE 147 Cb 0.58 0.09 -0.11 0.00 -1.74 0.00 0.00 39.64 38.46 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 -3.22 -0.01 -1.63 7.28 -1.32 -0.81 -3.49 115.64 112.45 1ggk s THR 148 Ca -0.06 0.02 0.11 0.00 -1.21 0.00 0.00 61.69 60.54 1ggk s THR 148 Cb 0.11 -0.53 0.36 0.00 -1.51 0.00 0.00 72.50 70.93 1ggk s THR 148 CO 0.73 0.01 1.24 2.29 -2.21 0.00 0.00 174.62 176.69 1ggk n LYS 149 N 3.18 2.18 -1.76 7.08 2.85 0.67 -3.83 118.16 128.55 1ggk n LYS 149 Ca -0.15 -1.44 -0.42 0.00 -1.05 0.00 0.00 58.31 55.25 1ggk n LYS 149 Cb 0.57 -1.46 -0.03 0.00 -0.65 0.00 0.00 35.03 33.46 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 -1.60 3.62 0.22 0.58 0.00 -1.23 -4.65 121.76 118.70 1ggk s ALA 150 Ca 0.26 1.26 -0.07 0.00 0.00 0.00 0.00 51.96 53.41 1ggk s ALA 150 Cb 0.15 -3.81 0.34 0.00 0.00 0.00 0.00 23.12 19.81 1ggk s ALA 150 CO 0.15 -1.46 1.75 0.22 0.00 0.00 0.00 175.76 176.42 1ggk h ASP 151 N 9.98 0.31 0.21 0.00 3.58 -1.92 -0.92 116.42 127.67 1ggk h ASP 151 Ca -0.47 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.06 1ggk h ASP 151 Cb 1.22 0.04 0.00 0.00 1.72 0.00 0.00 39.33 42.31 1ggk h ASP 151 CO 0.94 0.17 0.00 2.22 -2.88 0.00 0.00 179.24 179.69 1ggk n PHE 152 N -4.96 0.00 0.06 0.28 1.16 -1.26 -2.20 117.46 110.54 1ggk n PHE 152 Ca 0.11 0.00 0.04 0.00 -1.87 0.00 0.00 57.45 55.73 1ggk n PHE 152 Cb 0.31 -0.36 0.08 0.00 -1.61 0.00 0.00 39.48 37.90 1ggk n PHE 152 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 1ggk n LEU 153 N -1.36 2.27 -0.08 5.98 4.77 -0.35 -4.73 117.00 123.49 1ggk n LEU 153 Ca 0.03 -1.60 0.14 0.00 -0.03 0.00 0.00 56.01 54.56 1ggk n LEU 153 Cb 0.08 -0.10 0.68 0.00 -2.33 0.00 0.00 43.42 41.75 1ggk n LEU 153 CO 0.07 0.53 0.93 -1.54 -1.33 0.00 0.00 177.39 176.06 1ggk n SER 154 N 0.32 0.31 -3.67 -1.43 3.41 -0.93 -1.53 113.62 110.10 1ggk n SER 154 Ca 0.07 -0.50 -0.09 0.00 -0.26 0.00 0.00 58.87 58.09 1ggk n SER 154 Cb 0.31 -0.13 -0.09 0.00 -0.26 0.00 0.00 64.21 64.04 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 -2.46 -0.73 0.22 4.04 3.68 -1.26 -4.67 116.67 115.49 1ggk s ASP 155 Ca 0.30 1.22 0.23 0.00 2.13 0.00 0.00 52.55 56.44 1ggk s ASP 155 Cb 0.20 1.11 0.93 0.00 -1.45 0.00 0.00 42.92 43.71 1ggk s ASP 155 CO 0.46 -0.22 1.70 -0.81 0.13 0.00 0.00 175.17 176.44 1ggk n PRO 156 N 4.12 0.18 0.03 4.34 -0.04 -1.26 -1.47 135.00 140.90 1ggk n PRO 156 Ca -0.21 0.36 0.12 0.00 -0.04 0.00 0.00 63.50 63.74 1ggk n PRO 156 Cb 0.57 -1.82 0.23 0.00 -0.04 0.00 0.00 33.50 32.44 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 -2.16 0.56 -4.66 3.54 3.02 -1.26 -4.64 115.26 109.66 1ggk n ASN 157 Ca 0.03 -0.02 -0.43 0.00 -0.03 0.00 0.00 54.58 54.13 1ggk n ASN 157 Cb 0.26 0.17 -0.02 0.00 -0.61 0.00 0.00 39.78 39.58 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 -3.08 4.22 -0.15 3.52 2.20 -0.54 -5.02 119.74 120.89 1ggk s LYS 158 Ca 0.09 1.42 -0.04 0.00 -0.36 0.00 0.00 55.97 57.07 1ggk s LYS 158 Cb 0.16 -3.69 -0.03 0.00 -1.51 0.00 0.00 37.83 32.75 1ggk s LYS 158 CO 0.70 -0.69 -0.01 -1.50 -0.36 0.00 0.00 175.35 173.49 1ggk s ILE 159 N 3.37 4.17 -0.17 5.43 1.10 -1.26 -4.40 121.20 129.44 1ggk s ILE 159 Ca 0.48 -0.26 0.00 0.00 -0.51 0.00 0.00 60.65 60.36 1ggk s ILE 159 Cb -0.17 -2.83 0.01 0.00 0.15 0.00 0.00 42.46 39.62 1ggk s ILE 159 CO 0.10 0.50 -0.17 -0.89 -2.11 0.00 0.00 174.94 172.38 1ggk s THR 160 N 0.16 2.45 0.54 4.00 2.01 -0.38 -4.97 115.64 119.46 1ggk s THR 160 Ca 0.00 -0.83 -0.20 0.00 0.31 0.00 0.00 61.69 60.98 1ggk s THR 160 Cb -0.13 -2.04 -0.06 0.00 0.01 0.00 0.00 72.50 70.28 1ggk s THR 160 CO 0.02 0.52 1.14 -2.84 -0.69 0.00 0.00 174.62 172.77 1ggk s PRO 161 N 1.05 3.37 0.06 4.92 0.02 -1.26 -0.63 135.00 142.52 1ggk s PRO 161 Ca -0.01 1.66 -0.00 0.00 0.02 0.00 0.00 61.00 62.67 1ggk s PRO 161 Cb -0.14 -2.06 -0.04 0.00 0.02 0.00 0.00 34.50 32.28 1ggk s PRO 161 CO -0.05 -0.84 -0.04 0.14 -0.33 0.00 0.00 177.00 175.88 1ggk s VAL 162 N -1.72 0.31 -0.10 3.83 -7.23 -0.61 -2.60 120.40 112.28 1ggk s VAL 162 Ca 0.72 -1.73 -0.00 0.00 -1.81 0.00 0.00 61.98 59.16 1ggk s VAL 162 Cb -0.25 -1.40 0.02 0.00 0.56 0.00 0.00 36.38 35.31 1ggk s VAL 162 CO 0.29 -0.91 -0.07 0.12 -0.31 0.00 0.00 175.10 174.22 1ggk s PHE 163 N -3.55 1.34 -0.07 2.82 5.36 -0.85 -1.97 117.98 121.07 1ggk s PHE 163 Ca 0.05 -0.63 0.02 0.00 -0.96 0.00 0.00 56.93 55.42 1ggk s PHE 163 Cb 0.05 -1.14 -0.03 0.00 -0.34 0.00 0.00 43.02 41.57 1ggk s PHE 163 CO -0.08 -0.46 -0.12 0.08 -1.46 0.00 0.00 175.22 173.18 1ggk s VAL 164 N 1.63 3.24 -0.08 3.12 1.01 -0.79 -1.45 120.40 127.07 1ggk s VAL 164 Ca 0.03 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.39 1ggk s VAL 164 Cb -0.13 -2.30 0.01 0.00 0.00 0.00 0.00 36.38 33.97 1ggk s VAL 164 CO -0.07 0.58 -0.15 -0.60 0.00 0.00 0.00 175.10 174.87 1ggk s ARG 165 N -0.56 2.04 -0.04 2.72 3.52 -0.40 -2.09 118.95 124.13 1ggk s ARG 165 Ca 0.08 -0.52 -0.01 0.00 -0.13 0.00 0.00 55.73 55.16 1ggk s ARG 165 Cb -0.12 -1.66 -0.04 0.00 -1.56 0.00 0.00 34.95 31.57 1ggk s ARG 165 CO 0.02 0.03 0.03 -0.06 -0.81 0.00 0.00 175.30 174.50 1ggk s PHE 166 N 0.71 3.18 0.36 5.12 0.40 -0.47 -1.73 117.98 125.55 1ggk s PHE 166 Ca -0.13 0.17 -0.09 0.00 -0.60 0.00 0.00 56.93 56.28 1ggk s PHE 166 Cb -0.16 -1.74 0.03 0.00 0.51 0.00 0.00 43.02 41.66 1ggk s PHE 166 CO 0.03 0.50 0.62 -1.54 0.70 0.00 0.00 175.22 175.53 1ggk s SER 167 N -1.35 0.45 0.16 1.36 1.04 -1.07 -0.18 113.70 114.12 1ggk s SER 167 Ca 0.18 -1.29 0.02 0.00 0.48 0.00 0.00 55.95 55.33 1ggk s SER 167 Cb -0.12 0.75 0.02 0.00 0.10 0.00 0.00 66.02 66.77 1ggk s SER 167 CO 0.08 -1.47 0.15 0.35 0.98 0.00 0.00 173.24 173.34 1ggk n THR 168 N -0.54 0.00 -0.05 2.02 -2.24 -0.50 -0.74 114.28 112.24 1ggk n THR 168 Ca -0.03 -0.62 -0.10 0.00 -2.27 0.00 0.00 64.05 61.03 1ggk n THR 168 Cb 0.61 -0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 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 -1.02 1.07 0.02 2.28 0.31 -1.24 -3.73 118.33 116.02 1ggk n VAL 169 Ca 0.01 0.04 -0.12 0.00 -0.01 0.00 0.00 64.34 64.25 1ggk n VAL 169 Cb 0.18 -1.83 -0.09 0.00 -0.91 0.00 0.00 33.84 31.19 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 -0.50 -0.11 -7.29 5.55 -0.00 -1.96 0.17 115.11 110.97 1ggk h GLN 170 Ca -0.18 0.01 -0.51 0.00 -0.00 0.00 0.00 58.65 57.97 1ggk h GLN 170 Cb 0.91 0.02 0.17 0.00 0.00 0.00 0.00 27.48 28.58 1ggk h GLN 170 CO -0.11 0.40 0.25 0.20 0.00 0.00 0.00 178.83 179.58 1ggk s GLY 171 N -3.28 1.67 1.10 2.39 0.00 -1.26 -4.79 107.32 103.15 1ggk s GLY 171 Ca -0.15 0.36 -0.18 0.00 0.00 0.00 0.00 44.72 44.75 1ggk s GLY 171 CO 0.60 0.77 1.21 -0.32 0.00 0.00 0.00 173.10 175.35 1ggk s GLY 172 N -3.04 1.67 0.56 0.20 0.00 -1.26 -4.05 107.32 101.40 1ggk s GLY 172 Ca 0.64 -1.07 0.33 0.00 0.00 0.00 0.00 44.72 44.63 1ggk s GLY 172 CO 0.57 -0.23 2.08 0.00 0.00 0.00 0.00 173.10 175.52 1ggk h ALA 173 N -2.17 1.08 -0.64 3.20 0.00 -1.95 -1.44 119.26 117.33 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 1.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 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 -0.40 2.75 3.86 0.00 0.00 -1.26 -4.73 105.19 105.41 1ggk n GLY 174 Ca -0.01 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.97 4.29 0.50 1.61 1.04 -0.54 -5.06 113.70 114.56 1ggk s SER 175 Ca 0.49 0.91 -0.08 0.00 0.48 0.00 0.00 55.95 57.75 1ggk s SER 175 Cb 0.30 -1.48 -0.04 0.00 0.10 0.00 0.00 66.02 64.90 1ggk s SER 175 CO 0.26 -2.05 0.84 0.00 0.98 0.00 0.00 173.24 173.27 1ggk s ALA 176 N -3.43 3.32 -0.07 5.32 0.00 -1.26 -4.93 121.76 120.69 1ggk s ALA 176 Ca 0.62 -0.34 -0.22 0.00 0.00 0.00 0.00 51.96 52.03 1ggk s ALA 176 Cb -0.12 -2.73 -0.30 0.00 0.00 0.00 0.00 23.12 19.97 1ggk s ALA 176 CO 0.51 -0.36 0.79 -0.44 0.00 0.00 0.00 175.76 176.27 1ggk h ASP 177 N 0.33 0.38 -0.55 0.00 3.45 -1.06 -3.38 116.42 115.58 1ggk h ASP 177 Ca -0.46 -0.93 -0.34 0.00 0.43 0.00 0.00 57.03 55.73 1ggk h ASP 177 Cb 1.20 -0.12 -0.14 0.00 -0.56 0.00 0.00 39.33 39.70 1ggk h ASP 177 CO 0.62 1.39 0.39 0.35 -1.57 0.00 0.00 179.24 180.43 1ggk n THR 178 N -4.15 2.86 -1.98 0.35 -2.24 -1.26 -4.91 114.28 102.94 1ggk n THR 178 Ca -0.16 -1.85 -0.28 0.00 -2.27 0.00 0.00 64.05 59.48 1ggk n THR 178 Cb 0.79 -1.40 0.08 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 -2.19 2.20 -0.17 2.28 -7.23 -1.26 -4.35 120.40 109.68 1ggk s VAL 179 Ca 0.36 -0.04 -0.21 0.00 -1.81 0.00 0.00 61.98 60.28 1ggk s VAL 179 Cb 0.26 -3.04 -0.03 0.00 0.56 0.00 0.00 36.38 34.14 1ggk s VAL 179 CO -0.04 -0.05 0.63 -0.60 -0.31 0.00 0.00 175.10 174.73 1ggk s ARG 180 N -5.47 4.25 -0.09 4.82 3.52 -1.26 -4.64 118.95 120.08 1ggk s ARG 180 Ca 0.61 0.65 -0.33 0.00 -0.13 0.00 0.00 55.73 56.53 1ggk s ARG 180 Cb -0.11 -3.55 0.14 0.00 -1.56 0.00 0.00 34.95 29.88 1ggk s ARG 180 CO 0.48 -0.17 1.41 0.34 -0.81 0.00 0.00 175.30 176.55 1ggk s ASP 181 N 1.10 -0.01 0.62 -2.12 3.68 -1.07 -4.63 116.67 114.25 1ggk s ASP 181 Ca 0.30 -0.03 -0.15 0.00 2.13 0.00 0.00 52.55 54.80 1ggk s ASP 181 Cb -0.16 0.03 -0.02 0.00 -1.45 0.00 0.00 42.92 41.32 1ggk s ASP 181 CO 0.11 -0.06 1.07 -0.63 0.13 0.00 0.00 175.17 175.79 1ggk s ILE 182 N -2.09 3.74 -0.09 4.11 -1.09 -1.26 -4.59 121.20 119.94 1ggk s ILE 182 Ca 0.15 0.78 0.03 0.00 -2.23 0.00 0.00 60.65 59.38 1ggk s ILE 182 Cb 0.07 -3.33 -0.01 0.00 -1.58 0.00 0.00 42.46 37.61 1ggk s ILE 182 CO -0.06 -0.53 -0.19 -0.13 -1.23 0.00 0.00 174.94 172.80 1ggk s ARG 183 N -4.22 2.88 0.46 2.79 1.81 -1.26 -3.58 118.95 117.83 1ggk s ARG 183 Ca 0.63 -0.79 -0.07 0.00 -1.72 0.00 0.00 55.73 53.78 1ggk s ARG 183 Cb -0.16 -2.38 -0.04 0.00 -0.45 0.00 0.00 34.95 31.92 1ggk s ARG 183 CO 0.40 0.35 0.79 0.20 -0.68 0.00 0.00 175.30 176.36 1ggk s GLY 184 N -0.04 1.64 -0.30 -3.53 0.00 0.08 -1.02 107.32 104.15 1ggk s GLY 184 Ca -0.05 -0.40 0.04 0.00 0.00 0.00 0.00 44.72 44.31 1ggk s GLY 184 CO 0.04 -0.22 0.49 -0.12 0.00 0.00 0.00 173.10 173.29 1ggk s PHE 185 N -2.65 -1.33 -0.14 1.90 2.19 0.69 -2.59 117.98 116.05 1ggk s PHE 185 Ca 0.49 0.51 -0.01 0.00 0.33 0.00 0.00 56.93 58.25 1ggk s PHE 185 Cb -0.10 0.03 -0.02 0.00 -1.31 0.00 0.00 43.02 41.62 1ggk s PHE 185 CO 0.41 -1.04 -0.11 0.00 1.83 0.00 0.00 175.22 176.31 1ggk s ALA 186 N 2.52 2.69 -0.10 11.12 0.00 -0.70 -1.14 121.76 136.14 1ggk s ALA 186 Ca 0.11 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.20 1ggk s ALA 186 Cb -0.11 -1.30 0.01 0.00 0.00 0.00 0.00 23.12 21.72 1ggk s ALA 186 CO -0.25 0.20 -0.20 0.99 0.00 0.00 0.00 175.76 176.49 1ggk s THR 187 N 0.42 1.82 -0.31 0.00 2.01 0.10 -1.28 115.64 118.40 1ggk s THR 187 Ca -0.09 -0.86 -0.06 0.00 0.31 0.00 0.00 61.69 60.99 1ggk s THR 187 Cb -0.16 -1.60 0.02 0.00 0.01 0.00 0.00 72.50 70.77 1ggk s THR 187 CO 0.05 0.50 0.08 -0.75 -0.69 0.00 0.00 174.62 173.81 1ggk s LYS 188 N 0.59 2.94 -0.26 4.92 2.20 -0.53 0.25 119.74 129.86 1ggk s LYS 188 Ca -0.14 -0.96 -0.11 0.00 -0.36 0.00 0.00 55.97 54.40 1ggk s LYS 188 Cb -0.17 -3.38 -0.05 0.00 -1.51 0.00 0.00 37.83 32.72 1ggk s LYS 188 CO 0.04 -0.51 0.19 -0.06 -0.36 0.00 0.00 175.35 174.66 1ggk s PHE 189 N 1.46 3.26 -1.25 4.03 0.40 0.94 -2.00 117.98 124.83 1ggk s PHE 189 Ca 0.01 0.19 -0.12 0.00 -0.60 0.00 0.00 56.93 56.41 1ggk s PHE 189 Cb -0.18 -2.35 0.17 0.00 0.51 0.00 0.00 43.02 41.17 1ggk s PHE 189 CO 0.02 -0.07 1.65 0.66 0.70 0.00 0.00 175.22 178.19 1ggk n TYR 190 N 4.75 4.01 -1.75 0.36 4.01 -1.07 -1.53 117.16 125.93 1ggk n TYR 190 Ca -0.14 -3.08 -0.30 0.00 -0.16 0.00 0.00 57.90 54.22 1ggk n TYR 190 Cb 0.52 -2.09 0.06 0.00 -0.31 0.00 0.00 39.34 37.53 1ggk n TYR 190 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1ggk s THR 191 N 1.06 3.32 -0.40 -0.72 -4.23 -1.13 -4.52 115.64 109.02 1ggk s THR 191 Ca 0.42 0.43 0.26 0.00 -1.18 0.00 0.00 61.69 61.61 1ggk s THR 191 Cb 0.03 -3.33 0.28 0.00 1.34 0.00 0.00 72.50 70.82 1ggk s THR 191 CO 0.00 -0.56 1.76 -0.33 -0.54 0.00 0.00 174.62 174.96 1ggk h GLU 192 N -0.82 0.00 -0.27 3.99 5.08 -1.96 -2.99 114.58 117.61 1ggk h GLU 192 Ca -0.46 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 57.78 1ggk h GLU 192 Cb 1.26 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.44 1ggk h GLU 192 CO 0.62 0.00 -0.12 0.39 -1.00 0.00 0.00 179.01 178.90 1ggk n GLU 193 N -2.40 1.92 0.00 2.33 1.02 -1.26 -4.86 120.64 117.38 1ggk n GLU 193 Ca 0.02 -3.12 0.00 0.00 -0.02 0.00 0.00 57.16 54.04 1ggk n GLU 193 Cb 0.27 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 29.91 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 -1.06 3.02 3.76 0.62 0.00 -1.13 -4.77 105.19 105.62 1ggk n GLY 194 Ca 0.29 -2.04 -0.40 0.00 0.00 0.00 0.00 46.02 43.87 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 -2.66 4.23 -0.16 -0.61 1.01 -1.26 -2.82 121.20 118.92 1ggk s ILE 195 Ca 0.00 1.95 0.00 0.00 0.00 0.00 0.00 60.65 62.61 1ggk s ILE 195 Cb 0.00 -4.26 0.03 0.00 0.01 0.00 0.00 42.46 38.23 1ggk s ILE 195 CO 0.00 0.48 -0.14 0.12 0.00 0.00 0.00 174.94 175.41 1ggk s PHE 196 N -1.01 2.26 -0.24 3.97 5.36 -0.59 -4.28 117.98 123.44 1ggk s PHE 196 Ca 0.40 -1.33 -0.09 0.00 -0.96 0.00 0.00 56.93 54.96 1ggk s PHE 196 Cb -0.25 -1.62 -0.04 0.00 -0.34 0.00 0.00 43.02 40.77 1ggk s PHE 196 CO 0.30 -0.69 0.11 -0.51 -1.46 0.00 0.00 175.22 172.97 1ggk s ASP 197 N 1.46 5.61 -0.48 6.13 -0.00 -1.04 -0.04 116.67 128.30 1ggk s ASP 197 Ca 0.04 -0.05 -0.11 0.00 -0.00 0.00 0.00 52.55 52.43 1ggk s ASP 197 Cb -0.14 -2.01 0.12 0.00 -0.00 0.00 0.00 42.92 40.89 1ggk s ASP 197 CO -0.10 0.02 0.38 -0.22 -0.00 0.00 0.00 175.17 175.25 1ggk s LEU 198 N 1.30 5.78 -0.59 1.23 0.20 0.14 -4.58 118.68 122.17 1ggk s LEU 198 Ca 0.06 -1.83 -0.12 0.00 0.69 0.00 0.00 54.13 52.93 1ggk s LEU 198 Cb -0.15 -2.06 0.15 0.00 -0.43 0.00 0.00 46.19 43.70 1ggk s LEU 198 CO 0.05 -0.72 0.50 -0.69 -0.29 0.00 0.00 176.35 175.20 1ggk s VAL 199 N 1.44 4.81 0.09 1.68 1.01 -1.26 -0.72 120.40 127.44 1ggk s VAL 199 Ca 0.05 -1.95 0.00 0.00 0.00 0.00 0.00 61.98 60.08 1ggk s VAL 199 Cb -0.27 -4.09 -0.00 0.00 0.00 0.00 0.00 36.38 32.03 1ggk s VAL 199 CO 0.01 -0.87 0.00 0.61 0.00 0.00 0.00 175.10 174.85 1ggk n GLY 200 N 4.68 4.07 3.39 4.51 0.00 -0.29 -4.91 105.19 116.65 1ggk n GLY 200 Ca -0.04 -2.22 -0.20 0.00 0.00 0.00 0.00 46.02 43.56 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 -1.37 1.71 -1.12 1.61 3.76 -1.07 -0.22 115.29 118.58 1ggk s HIS 201 Ca 0.00 -1.20 0.17 0.00 -0.15 0.00 0.00 55.06 53.88 1ggk s HIS 201 Cb 0.00 -1.03 0.69 0.00 1.11 0.00 0.00 32.58 33.35 1ggk s HIS 201 CO 0.00 -0.29 1.59 0.27 -0.85 0.00 0.00 174.74 175.45 1ggk n ASN 202 N -0.81 4.58 -4.14 1.40 6.94 -0.19 -1.45 115.26 121.59 1ggk n ASN 202 Ca -0.01 -2.45 -0.17 0.00 -0.02 0.00 0.00 54.58 51.92 1ggk n ASN 202 Cb 0.66 -0.57 -0.12 0.00 -2.36 0.00 0.00 39.78 37.39 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 -1.89 0.98 -1.23 5.53 -4.23 -1.26 -4.63 115.64 108.92 1ggk s THR 203 Ca 0.48 -1.22 0.29 0.00 -1.18 0.00 0.00 61.69 60.07 1ggk s THR 203 Cb 0.32 -0.96 0.37 0.00 1.34 0.00 0.00 72.50 73.57 1ggk s THR 203 CO 0.23 -0.24 1.96 -0.81 -0.54 0.00 0.00 174.62 175.22 1ggk n PRO 204 N 1.39 0.23 -4.32 3.99 -0.04 -1.26 -4.65 135.00 130.33 1ggk n PRO 204 Ca -0.21 -0.01 -0.17 0.00 -0.04 0.00 0.00 63.50 63.07 1ggk n PRO 204 Cb 0.54 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 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 -2.78 0.76 0.43 0.52 -0.00 -1.26 -4.49 121.20 114.37 1ggk s ILE 205 Ca 0.21 -2.00 0.07 0.00 -0.00 0.00 0.00 60.65 58.92 1ggk s ILE 205 Cb 0.20 -2.50 -0.04 0.00 -0.00 0.00 0.00 42.46 40.11 1ggk s ILE 205 CO 0.50 -0.15 0.19 0.12 -0.00 0.00 0.00 174.94 175.60 1ggk s PHE 206 N -3.61 2.46 0.14 1.37 2.19 0.16 -4.87 117.98 115.81 1ggk s PHE 206 Ca 0.33 -0.64 0.20 0.00 0.33 0.00 0.00 56.93 57.15 1ggk s PHE 206 Cb 0.07 -1.93 0.70 0.00 -1.31 0.00 0.00 43.02 40.54 1ggk s PHE 206 CO 0.11 0.13 1.74 0.74 1.83 0.00 0.00 175.22 179.77 1ggk h PHE 207 N 1.36 0.00 -3.75 10.12 -1.00 -1.89 -3.40 116.94 118.38 1ggk h PHE 207 Ca -0.42 0.00 -0.26 0.00 2.81 0.00 0.00 57.97 60.10 1ggk h PHE 207 Cb 1.26 0.00 -0.15 0.00 3.61 0.00 0.00 35.95 40.67 1ggk h PHE 207 CO 0.72 0.35 -0.69 0.96 -1.61 0.00 0.00 178.31 178.05 1ggk s ILE 208 N -3.58 0.74 -0.16 -0.55 -4.36 -1.26 -3.04 121.20 108.99 1ggk s ILE 208 Ca 0.00 -1.97 0.07 0.00 -0.26 0.00 0.00 60.65 58.50 1ggk s ILE 208 Cb 0.11 -1.87 -0.23 0.00 1.25 0.00 0.00 42.46 41.71 1ggk s ILE 208 CO 0.68 -0.70 0.21 0.00 0.24 0.00 0.00 174.94 175.37 1ggk n GLN 209 N -0.14 0.68 -5.24 0.37 6.02 -1.26 -4.67 117.38 113.14 1ggk n GLN 209 Ca -0.10 0.17 -0.31 0.00 -0.01 0.00 0.00 57.00 56.75 1ggk n GLN 209 Cb 0.62 -1.63 -0.16 0.00 1.02 0.00 0.00 30.24 30.08 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 -6.22 3.02 0.61 1.08 -1.08 -1.26 -2.38 116.67 110.44 1ggk s ASP 210 Ca -0.17 -0.51 0.32 0.00 -0.52 0.00 0.00 52.55 51.67 1ggk s ASP 210 Cb 0.07 -0.89 1.88 0.00 -1.46 0.00 0.00 42.92 42.53 1ggk s ASP 210 CO 0.76 0.23 2.21 0.00 0.52 0.00 0.00 175.17 178.89 1ggk h ALA 211 N 6.14 1.50 -0.17 3.66 0.00 -1.80 -2.04 119.26 126.54 1ggk h ALA 211 Ca -0.31 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.63 1ggk h ALA 211 Cb 1.18 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1ggk h ALA 211 CO 0.47 -0.12 0.12 1.25 0.00 0.00 0.00 179.25 180.97 1ggk h HIS 212 N 0.00 0.12 -0.15 0.00 6.17 -1.95 -0.65 115.15 118.68 1ggk h HIS 212 Ca 0.03 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.11 1ggk h HIS 212 Cb 0.20 -0.04 0.00 0.00 2.52 0.00 0.00 27.41 30.09 1ggk h HIS 212 CO 0.00 0.07 0.00 1.63 0.71 0.00 0.00 177.93 180.34 1ggk n LYS 213 N -4.51 1.72 0.03 5.26 5.02 -0.77 -4.44 118.16 120.49 1ggk n LYS 213 Ca 0.00 -1.08 -0.10 0.00 -2.02 0.00 0.00 58.31 55.11 1ggk n LYS 213 Cb 0.16 -1.40 -0.04 0.00 -0.02 0.00 0.00 35.03 33.73 1ggk n LYS 213 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 1ggk h PHE 214 N 2.21 -0.34 -0.86 2.13 3.04 -1.26 -1.02 116.94 120.85 1ggk h PHE 214 Ca 0.00 0.01 0.09 0.00 3.98 0.00 0.00 57.97 62.06 1ggk h PHE 214 Cb 0.48 0.16 -0.06 0.00 2.56 0.00 0.00 35.95 39.09 1ggk h PHE 214 CO 0.10 -0.20 0.56 -1.35 -2.02 0.00 0.00 178.31 175.39 1ggk h PRO 215 N -0.20 0.83 0.05 6.41 0.11 -1.80 -0.23 132.00 137.17 1ggk h PRO 215 Ca 0.06 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 1ggk h PRO 215 Cb 0.29 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.21 1ggk h PRO 215 CO -0.17 0.55 -0.03 -0.44 -0.21 0.00 0.00 178.00 177.71 1ggk h ASP 216 N 0.85 -0.06 -0.44 -2.05 5.19 -1.67 0.69 116.42 118.94 1ggk h ASP 216 Ca 0.39 -0.41 -0.08 0.00 -0.62 0.00 0.00 57.03 56.32 1ggk h ASP 216 Cb 0.39 0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.89 1ggk h ASP 216 CO -0.16 0.39 -0.01 0.15 -3.12 0.00 0.00 179.24 176.48 1ggk h PHE 217 N -0.52 0.92 -0.40 4.55 3.04 -0.76 -1.82 116.94 121.95 1ggk h PHE 217 Ca -0.01 -0.14 -0.14 0.00 3.98 0.00 0.00 57.97 61.66 1ggk h PHE 217 Cb 0.46 -0.25 -0.01 0.00 2.56 0.00 0.00 35.95 38.72 1ggk h PHE 217 CO 0.07 0.85 -0.30 0.28 -2.02 0.00 0.00 178.31 177.19 1ggk h VAL 218 N 0.80 1.28 -0.96 1.41 2.07 -1.03 -2.63 116.25 117.18 1ggk h VAL 218 Ca 0.15 -1.47 0.05 0.00 0.82 0.00 0.00 66.70 66.25 1ggk h VAL 218 Cb 0.49 1.33 -0.06 0.00 -1.52 0.00 0.00 31.29 31.53 1ggk h VAL 218 CO 0.02 0.49 0.62 0.45 0.02 0.00 0.00 177.57 179.18 1ggk h HIS 219 N 0.73 1.16 -0.71 1.57 3.86 -0.65 -1.44 115.15 119.68 1ggk h HIS 219 Ca 0.08 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.26 1ggk h HIS 219 Cb 0.89 -0.38 -0.03 0.00 1.06 0.00 0.00 27.41 28.94 1ggk h HIS 219 CO 0.06 0.63 0.22 0.00 0.86 0.00 0.00 177.93 179.71 1ggk h ALA 220 N 1.42 1.06 0.17 2.45 0.00 -1.10 -3.25 119.26 120.02 1ggk h ALA 220 Ca 0.40 -0.22 -0.30 0.00 0.00 0.00 0.00 54.91 54.80 1ggk h ALA 220 Cb 0.09 -0.28 0.02 0.00 0.00 0.00 0.00 17.79 17.62 1ggk h ALA 220 CO -0.15 0.64 -1.36 -0.24 0.00 0.00 0.00 179.25 178.13 1ggk h VAL 221 N 1.05 1.38 -3.14 0.00 3.04 -1.10 -3.07 116.25 114.42 1ggk h VAL 221 Ca 0.23 -2.91 -0.43 0.00 -1.01 0.00 0.00 66.70 62.59 1ggk h VAL 221 Cb 0.29 2.96 0.22 0.00 -2.01 0.00 0.00 31.29 32.74 1ggk h VAL 221 CO -0.01 0.86 -0.03 -0.54 -1.01 0.00 0.00 177.57 176.84 1ggk s LYS 222 N -2.63 -1.34 0.28 4.17 -0.14 -0.58 -4.72 119.74 114.78 1ggk s LYS 222 Ca -0.06 0.77 -0.30 0.00 -1.36 0.00 0.00 55.97 55.01 1ggk s LYS 222 Cb 0.06 -1.51 -0.13 0.00 -1.68 0.00 0.00 37.83 34.58 1ggk s LYS 222 CO 0.90 -3.99 1.46 -2.30 -0.76 0.00 0.00 175.35 170.67 1ggk n PRO 223 N -5.09 2.31 -2.10 -1.68 -0.02 -1.26 -4.82 135.00 122.34 1ggk n PRO 223 Ca 0.03 0.82 -0.39 0.00 -2.02 0.00 0.00 63.50 61.93 1ggk n PRO 223 Cb 0.55 -2.51 -0.01 0.00 -0.02 0.00 0.00 33.50 31.51 1ggk n PRO 223 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ggk s GLU 224 N -0.73 3.99 0.46 -0.52 2.02 -0.28 -4.73 118.70 118.91 1ggk s GLU 224 Ca 0.64 2.09 0.23 0.00 0.02 0.00 0.00 54.97 57.95 1ggk s GLU 224 Cb -0.58 -2.75 1.11 0.00 0.10 0.00 0.00 34.13 32.02 1ggk s GLU 224 CO 0.52 -0.45 1.93 -1.00 0.02 0.00 0.00 175.26 176.28 1ggk h PRO 225 N 2.68 0.00 0.00 0.39 0.13 -1.90 0.47 132.00 133.77 1ggk h PRO 225 Ca -0.49 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.64 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 0.63 0.22 -0.00 1.12 -0.23 0.00 0.00 178.00 179.73 1ggk h HIS 226 N 0.00 -0.00 -0.00 1.56 2.07 -1.97 -3.39 115.15 113.42 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 0.55 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.53 1ggk h HIS 226 CO 0.00 0.46 -0.00 -2.67 -3.07 0.00 0.00 177.93 172.65 1ggk n TRP 227 N -4.87 0.00 -3.66 6.12 4.27 -1.21 -5.04 117.44 113.05 1ggk n TRP 227 Ca -0.08 0.00 -0.22 0.00 -3.89 0.00 0.00 57.50 53.30 1ggk n TRP 227 Cb 0.24 0.00 0.04 0.00 -1.36 0.00 0.00 31.31 30.23 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 0.03 -2.15 -2.79 -1.67 0.00 0.16 -4.98 120.51 109.11 1ggk n ALA 228 Ca 0.01 -0.15 -0.17 0.00 0.00 0.00 0.00 53.44 53.12 1ggk n ALA 228 Cb 0.03 -2.64 -0.15 0.00 0.00 0.00 0.00 19.45 16.69 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 -3.62 0.57 0.25 0.00 1.01 -1.26 -4.74 121.20 113.41 1ggk s ILE 229 Ca 0.12 -0.29 0.08 0.00 0.00 0.00 0.00 60.65 60.56 1ggk s ILE 229 Cb -0.03 -0.49 -0.04 0.00 0.01 0.00 0.00 42.46 41.91 1ggk s ILE 229 CO 0.82 0.17 0.13 -2.16 0.00 0.00 0.00 174.94 173.89 1ggk s PRO 230 N -0.08 2.73 -0.17 2.79 0.04 -1.26 -1.12 135.00 137.93 1ggk s PRO 230 Ca 0.02 -1.15 -0.19 0.00 0.04 0.00 0.00 61.00 59.72 1ggk s PRO 230 Cb -0.04 -2.45 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 1ggk s PRO 230 CO -0.00 0.40 0.55 -1.14 0.04 0.00 0.00 177.00 176.84 1ggk s GLN 231 N -3.73 4.25 -1.38 4.56 2.00 -1.26 -4.09 119.66 120.01 1ggk s GLN 231 Ca 0.32 0.51 0.00 0.00 -2.00 0.00 0.00 55.36 54.19 1ggk s GLN 231 Cb -0.08 -3.53 0.00 0.00 0.80 0.00 0.00 33.01 30.21 1ggk s GLN 231 CO 0.23 -0.08 0.00 0.41 -0.50 0.00 0.00 175.29 175.35 1ggk n GLY 232 N 3.66 -0.29 2.95 2.59 0.00 -1.26 -5.00 105.19 107.84 1ggk n GLY 232 Ca -0.04 -0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 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 -4.80 0.09 0.00 1.61 -0.21 -1.26 -4.53 119.66 110.56 1ggk s GLN 233 Ca 0.00 0.18 0.27 0.00 0.02 0.00 0.00 55.36 55.83 1ggk s GLN 233 Cb 0.00 -0.01 1.04 0.00 1.00 0.00 0.00 33.01 35.04 1ggk s GLN 233 CO 0.00 -0.05 1.74 -1.13 -2.12 0.00 0.00 175.29 173.73 1ggk n SER 234 N 3.32 1.48 -4.13 5.90 3.41 -1.26 -4.70 113.62 117.64 1ggk n SER 234 Ca -0.16 -1.51 -0.43 0.00 -0.26 0.00 0.00 58.87 56.52 1ggk n SER 234 Cb 0.57 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 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 0.16 4.63 -3.60 7.33 0.00 -1.26 -4.63 120.51 123.14 1ggk n ALA 235 Ca 0.19 -3.99 -0.10 0.00 0.00 0.00 0.00 53.44 49.54 1ggk n ALA 235 Cb 0.35 -3.41 -0.02 0.00 0.00 0.00 0.00 19.45 16.37 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 2.86 -0.35 0.21 0.00 -3.43 -1.26 -4.80 115.29 108.52 1ggk s HIS 236 Ca 0.48 0.02 -0.09 0.00 -0.80 0.00 0.00 55.06 54.66 1ggk s HIS 236 Cb 0.08 0.61 0.29 0.00 -1.43 0.00 0.00 32.58 32.12 1ggk s HIS 236 CO -0.01 -1.03 1.75 -0.44 -2.00 0.00 0.00 174.74 173.02 1ggk h ASP 237 N 2.02 0.27 0.34 7.38 5.19 -1.88 -3.05 116.42 126.68 1ggk h ASP 237 Ca -0.27 0.07 -0.06 0.00 -0.62 0.00 0.00 57.03 56.15 1ggk h ASP 237 Cb 1.28 0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.82 1ggk h ASP 237 CO 0.31 0.16 -0.29 0.71 -3.12 0.00 0.00 179.24 177.01 1ggk h THR 238 N 0.44 1.14 0.82 0.35 1.35 -1.94 0.15 112.91 115.22 1ggk h THR 238 Ca 0.31 -1.02 -0.04 0.00 -0.55 0.00 0.00 66.41 65.11 1ggk h THR 238 Cb 0.37 1.56 0.01 0.00 -1.73 0.00 0.00 68.15 68.36 1ggk h THR 238 CO -0.30 0.28 -0.39 0.15 -0.25 0.00 0.00 175.52 175.01 1ggk h PHE 239 N 0.00 -1.02 0.00 4.73 3.57 -1.43 -2.30 116.94 120.49 1ggk h PHE 239 Ca -0.00 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.42 1ggk h PHE 239 Cb 0.54 0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.61 1ggk h PHE 239 CO 0.00 -0.63 -0.25 -1.49 -2.23 0.00 0.00 178.31 173.71 1ggk h TRP 240 N -1.29 0.00 0.31 0.41 4.06 -1.58 0.09 115.95 117.95 1ggk h TRP 240 Ca -0.11 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.83 1ggk h TRP 240 Cb 0.84 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.99 1ggk h TRP 240 CO -0.00 0.25 -0.23 0.22 -3.56 0.00 0.00 178.44 175.11 1ggk h ASP 241 N 0.00 -0.59 -0.81 -3.49 3.58 -0.63 -0.80 116.42 113.67 1ggk h ASP 241 Ca -0.00 0.05 0.01 0.00 0.42 0.00 0.00 57.03 57.50 1ggk h ASP 241 Cb 0.44 0.19 -0.04 0.00 1.72 0.00 0.00 39.33 41.64 1ggk h ASP 241 CO 0.03 -0.35 0.53 0.22 -2.88 0.00 0.00 179.24 176.78 1ggk h TYR 242 N -0.54 1.02 -0.57 0.28 5.03 -0.73 -2.18 116.97 119.28 1ggk h TYR 242 Ca -0.02 0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.24 1ggk h TYR 242 Cb 0.47 -0.34 -0.02 0.00 1.55 0.00 0.00 36.73 38.38 1ggk h TYR 242 CO -0.12 0.65 0.08 0.28 -1.32 0.00 0.00 178.16 177.72 1ggk h VAL 243 N 1.09 1.25 0.00 1.81 2.07 -0.83 -1.45 116.25 120.19 1ggk h VAL 243 Ca 0.29 -0.97 -0.05 0.00 0.82 0.00 0.00 66.70 66.79 1ggk h VAL 243 Cb -0.11 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1ggk h VAL 243 CO -0.06 0.36 -0.23 0.77 0.02 0.00 0.00 177.57 178.42 1ggk h SER 244 N 0.88 0.00 0.29 0.57 4.64 -0.53 -2.81 113.55 116.59 1ggk h SER 244 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1ggk h SER 244 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1ggk h SER 244 CO 0.01 0.23 -0.77 0.18 -0.87 0.00 0.00 176.83 175.61 1ggk n LEU 245 N -3.56 0.71 -3.59 5.97 4.77 -0.77 -4.69 117.00 115.84 1ggk n LEU 245 Ca -0.01 -0.20 -0.28 0.00 -0.03 0.00 0.00 56.01 55.49 1ggk n LEU 245 Cb 0.38 -0.13 -0.12 0.00 -2.33 0.00 0.00 43.42 41.22 1ggk n LEU 245 CO 0.33 0.16 -0.25 -1.10 -1.33 0.00 0.00 177.39 175.21 1ggk s GLN 246 N -3.03 1.22 0.16 3.23 -1.52 -0.62 -5.00 119.66 114.11 1ggk s GLN 246 Ca 0.09 -2.14 0.10 0.00 -1.95 0.00 0.00 55.36 51.45 1ggk s GLN 246 Cb 0.16 -2.01 0.52 0.00 -0.22 0.00 0.00 33.01 31.46 1ggk s GLN 246 CO 0.78 -1.27 1.24 -0.35 -0.25 0.00 0.00 175.29 175.45 1ggk n PRO 247 N 3.14 0.06 0.26 2.91 -0.04 -1.26 -1.57 135.00 138.50 1ggk n PRO 247 Ca 0.18 0.53 0.11 0.00 -0.04 0.00 0.00 63.50 64.28 1ggk n PRO 247 Cb 0.40 -1.79 0.70 0.00 -0.04 0.00 0.00 33.50 32.76 1ggk n PRO 247 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1ggk h GLU 248 N 0.00 0.00 0.00 0.54 4.11 -1.90 -2.78 114.58 114.55 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 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1ggk h GLU 248 CO 0.00 0.11 0.00 0.25 0.07 0.00 0.00 179.01 179.44 1ggk n THR 249 N -3.94 0.72 0.10 -1.06 -2.24 -0.61 -4.26 114.28 103.00 1ggk n THR 249 Ca -0.02 0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1ggk n THR 249 Cb 0.20 -0.93 0.30 0.00 -2.10 0.00 0.00 70.33 67.80 1ggk n THR 249 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1ggk h LEU 250 N 0.00 0.25 0.14 3.22 3.38 -1.71 -2.82 115.31 117.77 1ggk h LEU 250 Ca 0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1ggk h LEU 250 Cb 0.46 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1ggk h LEU 250 CO 0.00 0.52 -0.07 -0.74 0.09 0.00 0.00 178.44 178.24 1ggk h HIS 251 N 0.23 -0.17 -0.02 1.13 2.76 -1.82 -1.36 115.15 115.89 1ggk h HIS 251 Ca 0.04 -0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.13 1ggk h HIS 251 Cb 0.59 0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.60 1ggk h HIS 251 CO 0.01 -0.06 -0.33 -0.97 -1.30 0.00 0.00 177.93 175.28 1ggk h ASN 252 N -0.24 0.03 -0.86 3.26 -0.00 -1.79 -2.27 115.58 113.71 1ggk h ASN 252 Ca -0.02 -0.01 -0.00 0.00 -0.00 0.00 0.00 56.30 56.27 1ggk h ASN 252 Cb 0.19 -0.01 -0.04 0.00 -0.00 0.00 0.00 38.32 38.46 1ggk h ASN 252 CO 0.03 0.36 0.53 0.58 -0.00 0.00 0.00 177.43 178.93 1ggk h VAL 253 N 0.03 1.24 -0.23 2.57 2.07 -1.29 -1.13 116.25 119.50 1ggk h VAL 253 Ca 0.00 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.03 1ggk h VAL 253 Cb 0.60 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1ggk h VAL 253 CO 0.04 0.25 0.12 0.24 0.02 0.00 0.00 177.57 178.24 1ggk h MET 254 N 1.19 0.25 -0.85 1.57 2.86 -0.65 -1.58 114.93 117.71 1ggk h MET 254 Ca 0.31 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.93 1ggk h MET 254 Cb -0.06 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.50 1ggk h MET 254 CO -0.06 0.17 0.49 -1.49 1.06 0.00 0.00 176.91 177.08 1ggk h TRP 255 N 0.26 1.15 0.00 -0.22 4.06 -1.31 -2.48 115.95 117.41 1ggk h TRP 255 Ca 0.09 -0.02 -0.10 0.00 2.06 0.00 0.00 58.89 60.92 1ggk h TRP 255 Cb 0.01 -0.37 -0.01 0.00 -1.00 0.00 0.00 29.16 27.78 1ggk h TRP 255 CO -0.09 0.78 -0.49 0.00 -3.56 0.00 0.00 178.44 175.09 1ggk h ALA 256 N 1.27 0.96 0.00 1.49 0.00 -0.78 -2.69 119.26 119.50 1ggk h ALA 256 Ca 0.30 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ggk h ALA 256 Cb -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1ggk h ALA 256 CO -0.05 0.61 -0.33 0.52 0.00 0.00 0.00 179.25 180.00 1ggk h MET 257 N 0.00 0.00 -7.79 0.00 2.86 -1.25 -3.35 114.93 105.41 1ggk h MET 257 Ca -0.00 0.00 -0.44 0.00 -2.06 0.00 0.00 59.70 57.20 1ggk h MET 257 Cb 1.01 0.00 0.17 0.00 0.06 0.00 0.00 31.60 32.85 1ggk h MET 257 CO 0.06 0.00 0.39 -1.54 1.06 0.00 0.00 176.91 176.88 1ggk s SER 258 N -4.78 2.70 0.00 1.22 1.04 -0.94 -4.14 113.70 108.80 1ggk s SER 258 Ca 0.07 0.27 0.11 0.00 0.48 0.00 0.00 55.95 56.88 1ggk s SER 258 Cb 0.11 -0.30 0.51 0.00 0.10 0.00 0.00 66.02 66.45 1ggk s SER 258 CO 0.67 -2.99 1.30 0.47 0.98 0.00 0.00 173.24 173.67 1ggk n ASP 259 N -3.94 0.00 0.12 7.02 10.43 -1.26 -1.95 116.55 126.97 1ggk n ASP 259 Ca 0.16 0.31 0.10 0.00 2.57 0.00 0.00 54.79 57.92 1ggk n ASP 259 Cb 0.59 -0.39 0.59 0.00 1.84 0.00 0.00 41.12 43.75 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 0.16 0.00 -1.24 2.47 -1.89 -1.20 114.38 112.68 1ggk h ARG 260 Ca 0.00 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1ggk h ARG 260 Cb 0.14 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.43 1ggk h ARG 260 CO 0.00 0.10 0.00 0.41 0.56 0.00 0.00 179.97 181.04 1ggk n GLY 261 N -1.54 -0.97 2.20 0.04 0.00 -0.82 -4.17 105.19 99.92 1ggk n GLY 261 Ca 0.02 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.47 -0.66 -2.01 -0.61 -5.35 -0.45 -2.58 119.36 106.23 1ggk n ILE 262 Ca 0.04 -3.99 -0.36 0.00 -0.27 0.00 0.00 62.75 58.17 1ggk n ILE 262 Cb 0.16 -1.82 0.03 0.00 -1.74 0.00 0.00 39.64 36.28 1ggk n ILE 262 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1ggk s PRO 263 N -1.20 3.07 0.33 6.28 0.04 -1.26 -1.17 135.00 141.09 1ggk s PRO 263 Ca 0.35 1.88 0.09 0.00 0.04 0.00 0.00 61.00 63.36 1ggk s PRO 263 Cb 0.18 -2.02 0.57 0.00 0.04 0.00 0.00 34.50 33.27 1ggk s PRO 263 CO -0.11 -1.14 1.76 -0.09 0.04 0.00 0.00 177.00 177.46 1ggk h ARG 264 N 1.08 0.14 -2.17 4.56 9.65 -1.66 -3.41 114.38 122.56 1ggk h ARG 264 Ca -0.50 -0.06 0.12 0.00 -1.10 0.00 0.00 59.98 58.44 1ggk h ARG 264 Cb 1.29 -0.00 -0.16 0.00 -1.39 0.00 0.00 29.97 29.71 1ggk h ARG 264 CO 0.56 0.51 0.53 0.45 2.80 0.00 0.00 179.97 184.81 1ggk s SER 265 N -6.90 -0.34 0.44 -3.80 0.15 -1.26 -4.96 113.70 97.02 1ggk s SER 265 Ca -0.04 0.02 0.20 0.00 0.70 0.00 0.00 55.95 56.83 1ggk s SER 265 Cb 0.14 0.36 1.02 0.00 -1.71 0.00 0.00 66.02 65.82 1ggk s SER 265 CO 0.75 -0.57 1.91 1.88 1.20 0.00 0.00 173.24 178.41 1ggk h TYR 266 N 2.02 0.00 0.00 3.44 0.05 -1.90 -1.13 116.97 119.45 1ggk h TYR 266 Ca -0.21 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.53 1ggk h TYR 266 Cb 1.23 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.96 1ggk h TYR 266 CO 0.26 0.26 -0.23 0.00 -1.05 0.00 0.00 178.16 177.40 1ggk h ARG 267 N 0.00 0.00 -1.93 4.88 3.08 -1.97 -3.36 114.38 115.08 1ggk h ARG 267 Ca -0.00 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.41 1ggk h ARG 267 Cb 0.57 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 30.24 1ggk h ARG 267 CO 0.03 0.23 -0.27 0.25 -1.07 0.00 0.00 179.97 179.15 1ggk n THR 268 N -3.40 3.19 -3.85 2.04 -2.24 -0.43 -4.42 114.28 105.17 1ggk n THR 268 Ca 0.00 -5.19 -0.10 0.00 -2.27 0.00 0.00 64.05 56.49 1ggk n THR 268 Cb 0.43 -1.34 -0.08 0.00 -2.10 0.00 0.00 70.33 67.24 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 -3.68 0.70 0.57 -0.78 0.23 -1.25 -1.66 119.30 113.43 1ggk s MET 269 Ca 0.48 -0.68 -0.04 0.00 -1.03 0.00 0.00 55.69 54.42 1ggk s MET 269 Cb 0.34 0.29 0.02 0.00 -1.53 0.00 0.00 34.83 33.95 1ggk s MET 269 CO -0.20 -0.20 0.86 -1.21 -2.03 0.00 0.00 175.02 172.24 1ggk s GLU 270 N -2.71 2.82 0.08 3.16 2.02 -1.26 -4.44 118.70 118.36 1ggk s GLU 270 Ca -0.04 -0.20 0.06 0.00 0.02 0.00 0.00 54.97 54.81 1ggk s GLU 270 Cb -0.00 -2.33 -0.03 0.00 0.10 0.00 0.00 34.13 31.86 1ggk s GLU 270 CO -0.05 -0.69 -0.15 0.20 0.02 0.00 0.00 175.26 174.59 1ggk s GLY 271 N -4.33 0.93 -0.09 -1.39 0.00 -0.98 -4.21 107.32 97.26 1ggk s GLY 271 Ca 0.54 -1.05 -0.13 0.00 0.00 0.00 0.00 44.72 44.09 1ggk s GLY 271 CO 0.43 -1.07 0.33 -1.36 0.00 0.00 0.00 173.10 171.43 1ggk s PHE 272 N -1.25 -0.31 -1.02 1.90 0.08 -0.53 -1.58 117.98 115.26 1ggk s PHE 272 Ca -0.00 0.71 0.26 0.00 0.12 0.00 0.00 56.93 58.02 1ggk s PHE 272 Cb -0.10 0.12 0.64 0.00 -0.57 0.00 0.00 43.02 43.11 1ggk s PHE 272 CO 0.03 -0.24 1.51 0.41 -0.10 0.00 0.00 175.22 176.82 1ggk n GLY 273 N 2.40 -1.28 5.00 4.36 0.00 -0.81 -2.61 105.19 112.25 1ggk n GLY 273 Ca -0.16 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1ggk n GLY 273 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ggk n ILE 274 N -1.48 0.00 -1.75 -0.61 5.41 -1.26 -4.86 119.36 114.81 1ggk n ILE 274 Ca 0.06 0.00 -0.32 0.00 1.00 0.00 0.00 62.75 63.49 1ggk n ILE 274 Cb 0.34 0.00 0.04 0.00 -0.71 0.00 0.00 39.64 39.31 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 2.76 0.02 1.39 3.76 -1.26 -4.91 115.29 117.06 1ggk s HIS 275 Ca 0.00 1.53 -0.30 0.00 -0.15 0.00 0.00 55.06 56.14 1ggk s HIS 275 Cb 0.00 -3.08 -0.04 0.00 1.11 0.00 0.00 32.58 30.57 1ggk s HIS 275 CO 0.00 -1.50 0.99 0.99 -0.85 0.00 0.00 174.74 174.37 1ggk s THR 276 N -2.51 4.74 0.14 1.30 2.01 -1.26 -4.63 115.64 115.44 1ggk s THR 276 Ca 0.64 2.02 0.01 0.00 0.31 0.00 0.00 61.69 64.67 1ggk s THR 276 Cb -0.18 -4.29 0.01 0.00 0.01 0.00 0.00 72.50 68.05 1ggk s THR 276 CO 0.43 0.18 0.09 0.49 -0.69 0.00 0.00 174.62 175.12 1ggk n PHE 277 N 3.71 -0.97 -4.79 4.92 3.72 0.06 -4.37 117.46 119.75 1ggk n PHE 277 Ca 0.06 -0.62 -0.27 0.00 -0.05 0.00 0.00 57.45 56.56 1ggk n PHE 277 Cb 0.50 -0.11 -0.14 0.00 -0.94 0.00 0.00 39.48 38.79 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 -2.57 1.57 -0.10 -1.08 0.52 -0.45 -0.76 118.95 116.09 1ggk s ARG 278 Ca 0.07 -0.97 -0.02 0.00 -0.52 0.00 0.00 55.73 54.29 1ggk s ARG 278 Cb -0.01 -1.69 -0.03 0.00 0.52 0.00 0.00 34.95 33.75 1ggk s ARG 278 CO 0.04 0.44 -0.02 -0.51 0.02 0.00 0.00 175.30 175.27 1ggk s LEU 279 N -1.11 3.42 -0.11 2.53 1.43 0.04 -2.04 118.68 122.84 1ggk s LEU 279 Ca 0.09 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.25 1ggk s LEU 279 Cb -0.09 -1.78 0.02 0.00 0.03 0.00 0.00 46.19 44.36 1ggk s LEU 279 CO 0.01 0.33 -0.14 -0.63 0.23 0.00 0.00 176.35 176.15 1ggk s ILE 280 N -0.61 1.45 0.69 -0.59 -1.09 0.11 -1.79 121.20 119.37 1ggk s ILE 280 Ca 0.10 -0.60 -0.01 0.00 -2.23 0.00 0.00 60.65 57.90 1ggk s ILE 280 Cb -0.12 -1.34 0.10 0.00 -1.58 0.00 0.00 42.46 39.53 1ggk s ILE 280 CO 0.02 0.43 0.96 0.54 -1.23 0.00 0.00 174.94 175.66 1ggk s ASN 281 N 1.10 4.55 0.52 3.58 2.20 -1.07 -0.23 114.94 125.59 1ggk s ASN 281 Ca -0.04 -0.20 0.16 0.00 -0.94 0.00 0.00 52.86 51.84 1ggk s ASN 281 Cb -0.14 -0.30 1.27 0.00 -2.00 0.00 0.00 41.25 40.08 1ggk s ASN 281 CO -0.03 -1.71 2.15 0.00 -2.94 0.00 0.00 177.10 174.57 1ggk h ALA 282 N -0.43 2.01 -0.01 3.54 0.00 -1.88 -0.04 119.26 122.45 1ggk h ALA 282 Ca -0.38 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1ggk h ALA 282 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ggk h ALA 282 CO 0.44 -0.02 -0.08 0.39 0.00 0.00 0.00 179.25 179.99 1ggk n GLU 283 N -4.53 1.29 -0.71 0.00 4.71 -1.26 -4.74 120.64 115.39 1ggk n GLU 283 Ca -0.03 -0.68 0.00 0.00 -0.01 0.00 0.00 57.16 56.44 1ggk n GLU 283 Cb 0.10 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.05 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 1.21 0.72 3.76 0.62 0.00 -0.03 -5.05 105.19 106.42 1ggk n GLY 284 Ca 0.17 -0.62 -0.39 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.51 4.45 -0.01 1.61 2.20 -1.26 -4.81 119.74 120.40 1ggk s LYS 285 Ca 0.00 0.98 -0.11 0.00 -0.36 0.00 0.00 55.97 56.48 1ggk s LYS 285 Cb 0.00 -3.34 -0.05 0.00 -1.51 0.00 0.00 37.83 32.93 1ggk s LYS 285 CO 0.00 0.36 0.33 0.00 -0.36 0.00 0.00 175.35 175.68 1ggk s ALA 286 N -0.28 3.76 -0.08 3.13 0.00 -1.26 -2.61 121.76 124.42 1ggk s ALA 286 Ca 0.36 -0.39 -0.01 0.00 0.00 0.00 0.00 51.96 51.92 1ggk s ALA 286 Cb -0.20 -2.23 0.03 0.00 0.00 0.00 0.00 23.12 20.71 1ggk s ALA 286 CO 0.22 0.55 -0.02 0.99 0.00 0.00 0.00 175.76 177.50 1ggk s THR 287 N -1.16 0.53 0.37 0.00 2.01 -0.74 -4.26 115.64 112.39 1ggk s THR 287 Ca 0.24 0.02 -0.28 0.00 0.31 0.00 0.00 61.69 61.98 1ggk s THR 287 Cb -0.15 -0.65 -0.11 0.00 0.01 0.00 0.00 72.50 71.60 1ggk s THR 287 CO 0.13 0.28 1.46 -0.36 -0.69 0.00 0.00 174.62 175.44 1ggk s PHE 288 N 1.89 2.67 -0.03 4.92 0.08 -0.91 -0.78 117.98 125.83 1ggk s PHE 288 Ca 0.05 1.20 -0.04 0.00 0.12 0.00 0.00 56.93 58.26 1ggk s PHE 288 Cb -0.12 -3.96 0.01 0.00 -0.57 0.00 0.00 43.02 38.37 1ggk s PHE 288 CO -0.06 -2.81 0.09 0.54 -0.10 0.00 0.00 175.22 172.88 1ggk s VAL 289 N -1.09 0.02 -0.04 -0.44 0.11 0.06 -1.83 120.40 117.19 1ggk s VAL 289 Ca 0.52 -0.17 0.05 0.00 -2.93 0.00 0.00 61.98 59.46 1ggk s VAL 289 Cb -0.45 -0.19 -0.02 0.00 -1.53 0.00 0.00 36.38 34.18 1ggk s VAL 289 CO 0.61 -0.09 -0.19 -0.13 -3.33 0.00 0.00 175.10 171.97 1ggk s ARG 290 N -0.26 2.37 -0.02 1.54 0.52 -0.27 -0.76 118.95 122.08 1ggk s ARG 290 Ca -0.03 -0.79 -0.16 0.00 -0.52 0.00 0.00 55.73 54.22 1ggk s ARG 290 Cb -0.02 -2.25 -0.05 0.00 0.52 0.00 0.00 34.95 33.14 1ggk s ARG 290 CO 0.00 0.58 0.45 -0.06 0.02 0.00 0.00 175.30 176.29 1ggk s PHE 291 N -0.65 3.69 0.04 -0.53 0.08 -1.26 -2.05 117.98 117.30 1ggk s PHE 291 Ca 0.10 1.01 0.04 0.00 0.12 0.00 0.00 56.93 58.20 1ggk s PHE 291 Cb -0.11 -2.38 -0.02 0.00 -0.57 0.00 0.00 43.02 39.94 1ggk s PHE 291 CO 0.00 0.52 -0.13 -1.01 -0.10 0.00 0.00 175.22 174.51 1ggk s HIS 292 N -0.67 1.11 -0.15 0.36 3.76 -0.38 -1.93 115.29 117.38 1ggk s HIS 292 Ca 0.25 -0.37 0.01 0.00 -0.15 0.00 0.00 55.06 54.80 1ggk s HIS 292 Cb -0.17 -0.65 0.02 0.00 1.11 0.00 0.00 32.58 32.89 1ggk s HIS 292 CO 0.13 0.02 -0.19 -1.58 -0.85 0.00 0.00 174.74 172.27 1ggk s TRP 293 N -0.94 2.56 -0.20 1.40 0.52 -0.62 -0.37 118.94 121.28 1ggk s TRP 293 Ca -0.00 -1.40 -0.04 0.00 0.02 0.00 0.00 56.10 54.67 1ggk s TRP 293 Cb -0.08 -1.78 -0.02 0.00 -1.15 0.00 0.00 33.47 30.44 1ggk s TRP 293 CO 0.01 -0.69 -0.03 0.21 0.02 0.00 0.00 176.95 176.48 1ggk s LYS 294 N 1.13 3.50 0.01 4.98 2.20 0.84 -2.31 119.74 130.08 1ggk s LYS 294 Ca -0.00 -0.58 -0.30 0.00 -0.36 0.00 0.00 55.97 54.73 1ggk s LYS 294 Cb -0.14 -3.02 -0.05 0.00 -1.51 0.00 0.00 37.83 33.12 1ggk s LYS 294 CO -0.08 -0.06 1.24 -1.25 -0.36 0.00 0.00 175.35 174.84 1ggk s PRO 295 N 1.16 4.37 0.46 4.03 0.04 -1.26 -0.32 135.00 143.47 1ggk s PRO 295 Ca 0.02 1.78 0.27 0.00 0.04 0.00 0.00 61.00 63.11 1ggk s PRO 295 Cb -0.15 -3.47 0.75 0.00 0.04 0.00 0.00 34.50 31.67 1ggk s PRO 295 CO 0.00 -0.39 1.75 -0.07 0.04 0.00 0.00 177.00 178.33 1ggk h LEU 296 N 7.63 0.00 -0.57 -3.56 3.38 -1.28 -2.79 115.31 118.12 1ggk h LEU 296 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1ggk h LEU 296 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1ggk h LEU 296 CO 0.86 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.39 1ggk n ALA 297 N -2.07 2.62 0.00 1.53 0.00 -1.26 -4.89 120.51 116.44 1ggk n ALA 297 Ca 0.03 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1ggk n ALA 297 Cb 0.44 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.58 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 1.10 -0.47 3.60 0.00 0.00 -1.05 -3.54 105.19 104.82 1ggk n GLY 298 Ca 0.21 -1.79 -0.36 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.23 3.94 -0.05 1.61 1.02 -1.26 -4.17 119.74 119.60 1ggk s LYS 299 Ca 0.00 -0.34 -0.16 0.00 0.02 0.00 0.00 55.97 55.50 1ggk s LYS 299 Cb 0.00 -3.46 0.03 0.00 -0.52 0.00 0.00 37.83 33.88 1ggk s LYS 299 CO 0.00 -0.00 0.36 0.00 -0.92 0.00 0.00 175.35 174.79 1ggk s ALA 300 N 1.19 -0.91 0.24 5.17 0.00 -0.67 -4.83 121.76 121.95 1ggk s ALA 300 Ca 0.06 0.60 0.02 0.00 0.00 0.00 0.00 51.96 52.64 1ggk s ALA 300 Cb -0.14 -0.11 -0.05 0.00 0.00 0.00 0.00 23.12 22.82 1ggk s ALA 300 CO 0.05 -0.25 0.06 -1.12 0.00 0.00 0.00 175.76 174.50 1ggk s SER 301 N -0.93 1.29 0.68 0.00 0.01 -1.26 -2.00 113.70 111.49 1ggk s SER 301 Ca -0.10 -1.31 -0.02 0.00 1.31 0.00 0.00 55.95 55.82 1ggk s SER 301 Cb -0.04 0.13 0.09 0.00 0.21 0.00 0.00 66.02 66.41 1ggk s SER 301 CO 0.04 -0.67 0.59 0.18 0.41 0.00 0.00 173.24 173.79 1ggk n LEU 302 N -0.41 0.00 -4.52 2.44 4.77 -0.32 -4.64 117.00 114.33 1ggk n LEU 302 Ca -0.02 -1.06 -0.29 0.00 -0.03 0.00 0.00 56.01 54.61 1ggk n LEU 302 Cb 0.65 -0.40 -0.11 0.00 -2.33 0.00 0.00 43.42 41.23 1ggk n LEU 302 CO 0.37 -0.83 -0.47 0.68 -1.33 0.00 0.00 177.39 175.81 1ggk s VAL 303 N -1.82 2.99 0.09 4.08 -7.23 -1.26 -4.93 120.40 112.31 1ggk s VAL 303 Ca 0.37 -1.47 -0.19 0.00 -1.81 0.00 0.00 61.98 58.88 1ggk s VAL 303 Cb -0.02 -2.39 -0.05 0.00 0.56 0.00 0.00 36.38 34.48 1ggk s VAL 303 CO 0.25 0.08 1.33 -0.25 -0.31 0.00 0.00 175.10 176.20 1ggk h TRP 304 N 3.61 -1.09 -1.00 2.82 2.91 -1.98 -1.18 115.95 120.04 1ggk h TRP 304 Ca -0.49 0.06 0.28 0.00 1.13 0.00 0.00 58.89 59.87 1ggk h TRP 304 Cb 1.17 0.53 -0.14 0.00 -0.51 0.00 0.00 29.16 30.22 1ggk h TRP 304 CO 0.61 -0.26 0.57 0.22 -1.03 0.00 0.00 178.44 178.55 1ggk h ASP 305 N -0.12 0.58 -0.17 2.65 -0.00 -2.00 -1.54 116.42 115.83 1ggk h ASP 305 Ca 0.07 0.16 -0.07 0.00 -0.00 0.00 0.00 57.03 57.19 1ggk h ASP 305 Cb 0.30 0.09 -0.00 0.00 -0.00 0.00 0.00 39.33 39.72 1ggk h ASP 305 CO -0.47 -0.02 -0.17 -0.08 -0.00 0.00 0.00 179.24 178.50 1ggk h GLU 306 N 0.45 0.41 0.18 0.28 4.81 -1.70 -2.67 114.58 116.33 1ggk h GLU 306 Ca 0.68 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.68 1ggk h GLU 306 Cb 1.43 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.82 1ggk h GLU 306 CO -0.54 0.79 -0.09 0.00 -0.73 0.00 0.00 179.01 178.44 1ggk h ALA 307 N 0.62 -0.24 -0.70 2.92 0.00 -0.36 -1.71 119.26 119.78 1ggk h ALA 307 Ca 0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1ggk h ALA 307 Cb 0.72 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1ggk h ALA 307 CO 0.04 -0.60 0.36 0.37 0.00 0.00 0.00 179.25 179.42 1ggk h GLN 308 N -0.30 0.98 -0.08 0.00 4.15 -1.42 -2.71 115.11 115.74 1ggk h GLN 308 Ca -0.02 -0.13 -0.06 0.00 0.77 0.00 0.00 58.65 59.21 1ggk h GLN 308 Cb 0.23 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 1ggk h GLN 308 CO 0.04 0.75 -0.24 -0.22 -1.93 0.00 0.00 178.83 177.23 1ggk h LYS 309 N 0.96 0.13 0.00 1.69 3.64 -1.41 -2.46 116.57 119.12 1ggk h LYS 309 Ca 0.24 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.49 1ggk h LYS 309 Cb 0.07 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1ggk h LYS 309 CO -0.04 0.37 -0.45 1.25 -2.27 0.00 0.00 179.45 178.32 1ggk h LEU 310 N 0.12 0.00 -1.90 5.20 5.85 -1.02 -1.92 115.31 121.63 1ggk h LEU 310 Ca 0.02 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1ggk h LEU 310 Cb 0.50 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1ggk h LEU 310 CO 0.04 0.45 0.14 0.71 -0.34 0.00 0.00 178.44 179.43 1ggk h THR 311 N 0.00 0.97 0.05 1.05 1.35 -1.13 0.53 112.91 115.73 1ggk h THR 311 Ca -0.00 -0.04 -0.21 0.00 -0.55 0.00 0.00 66.41 65.61 1ggk h THR 311 Cb 0.86 0.83 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 1ggk h THR 311 CO 0.06 0.02 -1.08 1.23 -0.25 0.00 0.00 175.52 175.50 1ggk h GLY 312 N 0.12 0.13 0.99 5.82 0.00 -1.48 -3.22 103.07 105.43 1ggk h GLY 312 Ca 0.09 -0.34 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 1ggk h GLY 312 CO -0.01 0.29 -0.17 3.21 0.00 0.00 0.00 176.54 179.86 1ggk h ARG 313 N -0.67 0.77 -1.79 4.80 2.47 -1.17 -3.40 114.38 115.39 1ggk h ARG 313 Ca -0.26 -0.33 -0.35 0.00 -1.26 0.00 0.00 59.98 57.78 1ggk h ARG 313 Cb 1.46 -0.02 -0.29 0.00 -1.65 0.00 0.00 29.97 29.47 1ggk h ARG 313 CO -0.04 0.95 -0.69 0.34 0.56 0.00 0.00 179.97 181.10 1ggk s ASP 314 N -6.47 0.58 0.66 7.04 2.15 0.16 -5.01 116.67 115.78 1ggk s ASP 314 Ca -0.12 -1.79 0.41 0.00 0.43 0.00 0.00 52.55 51.48 1ggk s ASP 314 Cb 0.10 0.72 2.24 0.00 -0.30 0.00 0.00 42.92 45.68 1ggk s ASP 314 CO 0.83 -0.20 2.29 1.55 -0.17 0.00 0.00 175.17 179.46 1ggk h PRO 315 N 6.51 0.00 -0.77 4.34 0.13 -1.61 -1.55 132.00 139.05 1ggk h PRO 315 Ca 0.09 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.81 1ggk h PRO 315 Cb 1.05 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.94 1ggk h PRO 315 CO 0.19 0.00 0.39 -0.25 -0.23 0.00 0.00 178.00 178.10 1ggk n ASP 316 N -3.15 3.37 -0.14 1.44 8.00 -1.26 -0.41 116.55 124.40 1ggk n ASP 316 Ca -0.03 -3.68 -0.08 0.00 0.71 0.00 0.00 54.79 51.71 1ggk n ASP 316 Cb 0.13 -0.77 0.01 0.00 -0.02 0.00 0.00 41.12 40.47 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 1.03 0.54 -0.34 1.24 3.04 -1.63 -1.96 116.94 118.86 1ggk h PHE 317 Ca 0.49 0.01 -0.14 0.00 3.98 0.00 0.00 57.97 62.31 1ggk h PHE 317 Cb 2.40 -0.18 -0.01 0.00 2.56 0.00 0.00 35.95 40.72 1ggk h PHE 317 CO 1.40 0.34 -0.37 0.45 -2.02 0.00 0.00 178.31 178.11 1ggk h HIS 318 N 0.58 0.93 -0.50 0.41 3.86 -1.87 -1.77 115.15 116.79 1ggk h HIS 318 Ca 0.16 -0.27 -0.04 0.00 -1.16 0.00 0.00 60.37 59.06 1ggk h HIS 318 Cb -0.06 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.19 1ggk h HIS 318 CO -0.05 1.03 0.15 -0.09 0.86 0.00 0.00 177.93 179.83 1ggk h ARG 319 N 0.65 0.79 -0.20 2.45 2.43 -1.92 -2.56 114.38 116.02 1ggk h ARG 319 Ca 0.06 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1ggk h ARG 319 Cb 0.92 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 1ggk h ARG 319 CO 0.08 0.74 0.09 -0.09 -1.51 0.00 0.00 179.97 179.28 1ggk h ARG 320 N 0.69 0.30 -0.67 0.20 2.43 -1.20 -2.67 114.38 113.46 1ggk h ARG 320 Ca 0.16 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 1ggk h ARG 320 Cb 0.29 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1ggk h ARG 320 CO -0.00 0.35 0.37 1.49 -1.51 0.00 0.00 179.97 180.67 1ggk h GLU 321 N 0.18 0.92 -0.29 0.20 4.22 -1.31 -0.00 114.58 118.50 1ggk h GLU 321 Ca 0.07 -0.10 -0.12 0.00 0.08 0.00 0.00 59.36 59.29 1ggk h GLU 321 Cb 0.16 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 1ggk h GLU 321 CO -0.01 0.69 -0.28 1.25 -2.18 0.00 0.00 179.01 178.48 1ggk h LEU 322 N 0.91 0.75 -0.32 1.64 5.85 -1.45 -0.21 115.31 122.48 1ggk h LEU 322 Ca 0.24 -0.47 -0.02 0.00 0.84 0.00 0.00 57.88 58.46 1ggk h LEU 322 Cb 0.02 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 1ggk h LEU 322 CO -0.04 1.06 0.10 -0.25 -0.34 0.00 0.00 178.44 178.98 1ggk h TRP 323 N 0.45 0.51 -0.33 1.25 2.91 -1.36 -2.39 115.95 117.00 1ggk h TRP 323 Ca 0.05 -0.05 -0.12 0.00 1.13 0.00 0.00 58.89 59.89 1ggk h TRP 323 Cb 0.85 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 29.34 1ggk h TRP 323 CO 0.07 0.52 -0.30 0.93 -1.03 0.00 0.00 178.44 178.62 1ggk h GLU 324 N 0.36 0.70 -0.69 2.65 5.08 -0.96 -1.87 114.58 119.86 1ggk h GLU 324 Ca 0.10 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1ggk h GLU 324 Cb 0.24 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 1ggk h GLU 324 CO -0.00 0.92 0.43 0.00 -1.00 0.00 0.00 179.01 179.36 1ggk h ALA 325 N 1.06 0.87 -0.10 3.43 0.00 -0.89 -0.32 119.26 123.31 1ggk h ALA 325 Ca 0.07 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1ggk h ALA 325 Cb 0.82 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1ggk h ALA 325 CO 0.07 0.33 -0.68 0.82 0.00 0.00 0.00 179.25 179.78 1ggk h ILE 326 N 0.93 1.36 -0.27 0.00 2.04 -1.33 0.41 117.51 120.65 1ggk h ILE 326 Ca 0.25 -2.05 -0.07 0.00 1.00 0.00 0.00 64.86 63.99 1ggk h ILE 326 Cb -0.06 2.03 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 1ggk h ILE 326 CO -0.05 0.62 -0.14 -0.33 0.00 0.00 0.00 178.15 178.25 1ggk h GLU 327 N 0.31 0.46 0.00 2.37 5.08 -0.88 -2.50 114.58 119.41 1ggk h GLU 327 Ca -0.02 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1ggk h GLU 327 Cb 1.25 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1ggk h GLU 327 CO 0.12 0.59 -0.09 0.00 -1.00 0.00 0.00 179.01 178.63 1ggk n ALA 328 N -2.48 2.40 -0.25 3.43 0.00 -0.17 -2.82 120.51 120.61 1ggk n ALA 328 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1ggk n ALA 328 Cb 0.32 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 1.34 0.87 2.54 0.00 0.00 -0.57 -4.59 105.19 104.78 1ggk n GLY 329 Ca 0.05 -0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 0.07 7.28 -4.70 1.61 10.43 0.13 -4.98 116.55 126.39 1ggk n ASP 330 Ca 0.00 -3.28 -0.55 0.00 2.57 0.00 0.00 54.79 53.53 1ggk n ASP 330 Cb 0.00 -1.26 -0.07 0.00 1.84 0.00 0.00 41.12 41.63 1ggk n ASP 330 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 1ggk n PHE 331 N 1.01 2.11 -1.67 1.24 0.99 -1.26 -4.57 117.46 115.31 1ggk n PHE 331 Ca 0.55 0.41 -0.48 0.00 -0.00 0.00 0.00 57.45 57.93 1ggk n PHE 331 Cb 0.37 -2.51 -0.05 0.00 -1.00 0.00 0.00 39.48 36.30 1ggk n PHE 331 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 1ggk n PRO 332 N 5.60 1.98 -4.48 -1.08 -0.02 -1.24 -4.78 135.00 130.98 1ggk n PRO 332 Ca 0.25 0.72 -0.22 0.00 -2.02 0.00 0.00 63.50 62.23 1ggk n PRO 332 Cb 0.17 -2.49 -0.16 0.00 -0.02 0.00 0.00 33.50 31.00 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 1.94 1.18 0.02 -0.52 2.02 -1.26 -1.67 118.70 120.40 1ggk s GLU 333 Ca 0.85 -0.36 0.00 0.00 0.02 0.00 0.00 54.97 55.48 1ggk s GLU 333 Cb -0.74 -1.07 -0.02 0.00 0.10 0.00 0.00 34.13 32.40 1ggk s GLU 333 CO 0.45 0.11 -0.03 0.71 0.02 0.00 0.00 175.26 176.52 1ggk s TYR 334 N 0.26 0.27 -0.15 1.61 2.02 -0.87 -0.85 117.35 119.64 1ggk s TYR 334 Ca -0.05 -0.49 -0.03 0.00 -0.37 0.00 0.00 57.07 56.12 1ggk s TYR 334 Cb -0.10 -0.19 -0.03 0.00 -0.40 0.00 0.00 41.96 41.24 1ggk s TYR 334 CO 0.01 -0.17 -0.04 -2.00 -1.57 0.00 0.00 175.55 171.78 1ggk s GLU 335 N -1.37 3.57 0.12 -0.62 2.12 0.56 -1.14 118.70 121.94 1ggk s GLU 335 Ca -0.15 -0.52 -0.30 0.00 0.36 0.00 0.00 54.97 54.36 1ggk s GLU 335 Cb -0.09 -2.88 -0.06 0.00 0.26 0.00 0.00 34.13 31.36 1ggk s GLU 335 CO -0.01 0.29 0.98 -1.17 -0.54 0.00 0.00 175.26 174.81 1ggk s LEU 336 N 0.22 4.50 0.04 2.70 2.96 -0.47 -0.11 118.68 128.52 1ggk s LEU 336 Ca -0.03 1.83 0.04 0.00 -0.22 0.00 0.00 54.13 55.76 1ggk s LEU 336 Cb -0.14 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 42.94 1ggk s LEU 336 CO 0.03 -0.07 -0.12 -0.83 -1.32 0.00 0.00 176.35 174.04 1ggk s GLY 337 N -0.06 0.70 -0.07 7.98 0.00 0.50 -0.67 107.32 115.70 1ggk s GLY 337 Ca 0.47 -0.80 0.03 0.00 0.00 0.00 0.00 44.72 44.41 1ggk s GLY 337 CO 0.30 -0.81 -0.14 -1.36 0.00 0.00 0.00 173.10 171.10 1ggk s PHE 338 N -1.02 2.74 -0.40 1.90 2.99 -0.32 -1.25 117.98 122.62 1ggk s PHE 338 Ca -0.02 -0.26 -0.11 0.00 0.00 0.00 0.00 56.93 56.54 1ggk s PHE 338 Cb -0.08 -1.68 0.05 0.00 0.00 0.00 0.00 43.02 41.30 1ggk s PHE 338 CO 0.01 0.11 0.24 -0.65 -0.00 0.00 0.00 175.22 174.93 1ggk s GLN 339 N -0.49 2.77 -0.14 0.44 -0.21 -0.87 -0.66 119.66 120.49 1ggk s GLN 339 Ca 0.06 -1.23 -0.04 0.00 0.02 0.00 0.00 55.36 54.18 1ggk s GLN 339 Cb -0.12 -3.79 -0.03 0.00 1.00 0.00 0.00 33.01 30.07 1ggk s GLN 339 CO 0.02 -0.82 -0.02 -0.51 -2.12 0.00 0.00 175.29 171.84 1ggk s LEU 340 N 1.52 3.40 -0.07 2.90 1.43 -1.26 -1.11 118.68 125.48 1ggk s LEU 340 Ca 0.02 -0.04 -0.00 0.00 -1.03 0.00 0.00 54.13 53.08 1ggk s LEU 340 Cb -0.21 -1.81 0.02 0.00 0.03 0.00 0.00 46.19 44.22 1ggk s LEU 340 CO 0.05 0.22 -0.04 -0.63 0.23 0.00 0.00 176.35 176.18 1ggk s ILE 341 N 0.07 0.62 0.61 -0.59 1.09 -0.76 -5.00 121.20 117.25 1ggk s ILE 341 Ca 0.01 -0.08 -0.18 0.00 -1.10 0.00 0.00 60.65 59.30 1ggk s ILE 341 Cb -0.13 -0.70 -0.04 0.00 -1.06 0.00 0.00 42.46 40.53 1ggk s ILE 341 CO 0.02 0.28 1.00 -2.65 -0.10 0.00 0.00 174.94 173.49 1ggk n PRO 342 N 4.72 0.90 -0.31 2.79 -0.02 -1.26 -2.13 135.00 139.68 1ggk n PRO 342 Ca -0.14 0.35 -0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1ggk n PRO 342 Cb 0.50 -2.21 0.18 0.00 -0.02 0.00 0.00 33.50 31.95 1ggk n PRO 342 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1ggk h GLU 343 N 0.44 1.16 0.00 -0.52 4.81 -1.96 -1.65 114.58 116.86 1ggk h GLU 343 Ca -0.49 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 1ggk h GLU 343 Cb 1.36 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1ggk h GLU 343 CO 0.51 0.77 0.00 -0.85 -0.73 0.00 0.00 179.01 178.71 1ggk n GLU 344 N -4.41 0.03 -0.47 1.92 0.00 -1.26 -2.89 120.64 113.55 1ggk n GLU 344 Ca 0.11 0.27 0.09 0.00 0.00 0.00 0.00 57.16 57.63 1ggk n GLU 344 Cb 0.05 -1.55 0.30 0.00 0.00 0.00 0.00 31.44 30.24 1ggk n GLU 344 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1ggk n ASP 345 N -1.60 3.96 -0.35 -1.84 9.92 -0.62 -4.65 116.55 121.37 1ggk n ASP 345 Ca 0.03 -2.27 0.15 0.00 -0.53 0.00 0.00 54.79 52.18 1ggk n ASP 345 Cb 0.18 -0.50 0.35 0.00 -0.64 0.00 0.00 41.12 40.51 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 3.62 0.66 -0.65 -1.24 4.81 -1.65 -1.01 114.58 119.12 1ggk h GLU 346 Ca 0.00 -0.04 -0.16 0.00 -0.13 0.00 0.00 59.36 59.03 1ggk h GLU 346 Cb 1.16 -0.15 -0.10 0.00 0.63 0.00 0.00 28.75 30.29 1ggk h GLU 346 CO 0.14 0.44 0.19 1.19 -0.73 0.00 0.00 179.01 180.23 1ggk n PHE 347 N -4.81 2.20 1.06 0.92 3.01 -1.26 -4.55 117.46 114.02 1ggk n PHE 347 Ca 0.25 -1.12 0.13 0.00 1.01 0.00 0.00 57.45 57.72 1ggk n PHE 347 Cb 0.65 -0.62 0.39 0.00 -0.01 0.00 0.00 39.48 39.89 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 -0.11 0.14 -3.18 -1.08 4.01 -0.38 -4.91 118.16 112.63 1ggk n LYS 348 Ca 0.37 -0.06 -0.20 0.00 -0.51 0.00 0.00 58.31 57.91 1ggk n LYS 348 Cb 1.30 -1.50 0.03 0.00 -0.51 0.00 0.00 35.03 34.35 1ggk n LYS 348 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 1ggk s PHE 349 N -2.91 1.98 -0.69 2.13 0.40 -1.26 -5.02 117.98 112.62 1ggk s PHE 349 Ca 0.15 -0.62 0.26 0.00 -0.60 0.00 0.00 56.93 56.11 1ggk s PHE 349 Cb 0.18 -2.22 0.84 0.00 0.51 0.00 0.00 43.02 42.33 1ggk s PHE 349 CO 0.62 -0.75 1.77 -0.25 0.70 0.00 0.00 175.22 177.31 1ggk n ASP 350 N -2.00 0.81 -4.51 1.36 10.43 -1.26 -4.84 116.55 116.53 1ggk n ASP 350 Ca 0.10 0.59 -0.24 0.00 2.57 0.00 0.00 54.79 57.82 1ggk n ASP 350 Cb 0.61 -0.80 -0.11 0.00 1.84 0.00 0.00 41.12 42.66 1ggk n ASP 350 CO 0.00 0.00 0.00 0.72 -1.07 0.00 0.00 177.20 176.85 1ggk s PHE 351 N -3.14 2.17 0.01 1.24 -0.12 -1.26 -5.05 117.98 111.83 1ggk s PHE 351 Ca 0.10 -0.85 -0.25 0.00 -0.05 0.00 0.00 56.93 55.88 1ggk s PHE 351 Cb 0.12 -1.47 -0.05 0.00 -0.63 0.00 0.00 43.02 40.99 1ggk s PHE 351 CO 0.57 0.18 0.77 0.34 -0.05 0.00 0.00 175.22 177.02 1ggk s ASP 352 N -3.57 7.16 0.53 1.98 3.68 -1.26 -4.93 116.67 120.25 1ggk s ASP 352 Ca 0.36 1.39 0.29 0.00 2.13 0.00 0.00 52.55 56.72 1ggk s ASP 352 Cb 0.09 -2.46 1.46 0.00 -1.45 0.00 0.00 42.92 40.56 1ggk s ASP 352 CO 0.16 -0.05 2.05 -0.07 0.13 0.00 0.00 175.17 177.40 1ggk h LEU 353 N 6.10 0.00 -0.40 -1.34 3.38 -1.98 -2.44 115.31 118.63 1ggk h LEU 353 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 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 0.73 0.11 -0.00 0.18 0.09 0.00 0.00 178.44 179.54 1ggk n LEU 354 N -3.47 0.62 -4.56 1.67 4.77 -1.26 -4.45 117.00 110.33 1ggk n LEU 354 Ca -0.01 -0.20 -0.42 0.00 -0.03 0.00 0.00 56.01 55.34 1ggk n LEU 354 Cb 0.26 -0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.28 1ggk n LEU 354 CO 0.29 0.10 0.35 -0.62 -1.33 0.00 0.00 177.39 176.19 1ggk s ASP 355 N -2.01 6.38 0.00 -1.43 3.68 -0.92 -4.45 116.67 117.92 1ggk s ASP 355 Ca 0.43 -0.00 0.20 0.00 2.13 0.00 0.00 52.55 55.31 1ggk s ASP 355 Cb 0.22 -2.31 1.20 0.00 -1.45 0.00 0.00 42.92 40.57 1ggk s ASP 355 CO 0.36 -0.61 1.75 -0.81 0.13 0.00 0.00 175.17 175.98 1ggk n PRO 356 N 6.03 0.96 -0.11 4.34 -0.04 -1.26 -2.05 135.00 142.87 1ggk n PRO 356 Ca -0.02 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.56 1ggk n PRO 356 Cb 0.48 -1.33 0.21 0.00 -0.04 0.00 0.00 33.50 32.83 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 -0.83 0.29 -5.01 0.52 -2.24 -1.26 -0.67 114.28 105.09 1ggk n THR 357 Ca 0.15 -0.61 -0.32 0.00 -2.27 0.00 0.00 64.05 61.00 1ggk n THR 357 Cb 0.07 1.07 -0.15 0.00 -2.10 0.00 0.00 70.33 69.22 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 -1.71 2.74 0.36 -0.78 -0.14 -0.87 -4.88 119.74 114.46 1ggk s LYS 358 Ca 0.35 -0.77 0.07 0.00 -1.36 0.00 0.00 55.97 54.26 1ggk s LYS 358 Cb 0.21 -2.36 -0.01 0.00 -1.68 0.00 0.00 37.83 33.99 1ggk s LYS 358 CO 0.31 0.43 0.42 -0.48 -0.76 0.00 0.00 175.35 175.27 1ggk s LEU 359 N -0.25 3.71 -0.30 3.17 0.05 -1.26 -4.82 118.68 118.98 1ggk s LEU 359 Ca 0.00 -0.41 -0.03 0.00 0.05 0.00 0.00 54.13 53.74 1ggk s LEU 359 Cb -0.13 -2.46 0.04 0.00 -2.05 0.00 0.00 46.19 41.59 1ggk s LEU 359 CO 0.03 -0.50 0.02 -0.63 -0.55 0.00 0.00 176.35 174.72 1ggk s ILE 360 N -2.29 3.21 0.20 1.48 1.01 -1.26 -5.07 121.20 118.48 1ggk s ILE 360 Ca 0.46 -1.21 -0.32 0.00 0.00 0.00 0.00 60.65 59.57 1ggk s ILE 360 Cb -0.07 -2.78 -0.14 0.00 0.01 0.00 0.00 42.46 39.47 1ggk s ILE 360 CO 0.29 -0.05 1.32 -2.65 0.00 0.00 0.00 174.94 173.85 1ggk n PRO 361 N 4.69 1.66 0.29 2.79 -0.02 -1.26 -4.83 135.00 138.32 1ggk n PRO 361 Ca -0.14 0.59 0.15 0.00 -2.02 0.00 0.00 63.50 62.08 1ggk n PRO 361 Cb 0.45 -2.19 0.87 0.00 -0.02 0.00 0.00 33.50 32.61 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 3.99 0.00 -0.45 -0.52 5.08 -1.98 -1.48 114.58 119.23 1ggk h GLU 362 Ca -0.44 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.91 1ggk h GLU 362 Cb 1.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 1ggk h GLU 362 CO 0.74 0.05 0.25 0.93 -1.00 0.00 0.00 179.01 179.98 1ggk h GLU 363 N 0.00 0.61 0.05 2.33 4.39 -1.96 -3.10 114.58 116.90 1ggk h GLU 363 Ca -0.00 -0.05 -0.36 0.00 0.34 0.00 0.00 59.36 59.28 1ggk h GLU 363 Cb 0.14 -0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 28.61 1ggk h GLU 363 CO 0.01 0.44 -2.16 1.28 -1.16 0.00 0.00 179.01 177.42 1ggk n LEU 364 N -4.43 2.20 -3.67 1.33 4.77 -0.64 -4.81 117.00 111.75 1ggk n LEU 364 Ca 0.04 0.10 -0.30 0.00 -0.03 0.00 0.00 56.01 55.82 1ggk n LEU 364 Cb 0.09 -0.68 -0.14 0.00 -2.33 0.00 0.00 43.42 40.36 1ggk n LEU 364 CO 0.36 0.78 -0.32 -0.69 -1.33 0.00 0.00 177.39 176.19 1ggk s VAL 365 N -2.54 0.71 0.70 4.08 1.01 -0.70 -5.07 120.40 118.58 1ggk s VAL 365 Ca -0.23 -1.49 -0.15 0.00 0.00 0.00 0.00 61.98 60.11 1ggk s VAL 365 Cb 0.08 -1.54 0.02 0.00 0.00 0.00 0.00 36.38 34.94 1ggk s VAL 365 CO 0.73 -0.75 1.18 -2.16 0.00 0.00 0.00 175.10 174.10 1ggk s PRO 366 N 1.46 2.40 -0.10 2.72 0.04 -1.18 -4.31 135.00 136.04 1ggk s PRO 366 Ca 0.12 1.68 -0.25 0.00 0.04 0.00 0.00 61.00 62.59 1ggk s PRO 366 Cb -0.19 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 1ggk s PRO 366 CO -0.21 -1.61 0.79 0.08 0.04 0.00 0.00 177.00 176.09 1ggk s VAL 367 N -2.02 4.96 -0.24 -0.36 1.01 -1.26 -4.54 120.40 117.95 1ggk s VAL 367 Ca 0.73 1.60 -0.15 0.00 0.00 0.00 0.00 61.98 64.16 1ggk s VAL 367 Cb -0.27 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 1ggk s VAL 367 CO 0.43 0.15 0.38 -1.58 0.00 0.00 0.00 175.10 174.48 1ggk s GLN 368 N 1.39 4.08 0.21 2.72 0.74 0.16 -4.84 119.66 124.12 1ggk s GLN 368 Ca 0.40 0.11 -0.30 0.00 0.05 0.00 0.00 55.36 55.62 1ggk s GLN 368 Cb -0.18 -3.60 -0.09 0.00 1.10 0.00 0.00 33.01 30.24 1ggk s GLN 368 CO 0.17 -0.18 1.23 -0.98 -0.55 0.00 0.00 175.29 174.98 1ggk s ARG 369 N 1.76 4.46 0.00 1.67 1.70 -1.26 -1.18 118.95 126.10 1ggk s ARG 369 Ca 0.17 1.95 0.00 0.00 -0.47 0.00 0.00 55.73 57.38 1ggk s ARG 369 Cb -0.15 -3.21 0.00 0.00 -0.57 0.00 0.00 34.95 31.02 1ggk s ARG 369 CO 0.09 -0.11 0.00 0.28 -1.08 0.00 0.00 175.30 174.47 1ggk n VAL 370 N 2.24 0.00 0.00 4.99 0.31 0.15 -4.93 118.33 121.10 1ggk n VAL 370 Ca 0.04 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1ggk n VAL 370 Cb 0.44 0.48 0.00 0.00 -0.91 0.00 0.00 33.84 33.85 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 0.79 -0.76 3.08 2.92 0.00 -1.23 -0.24 105.19 109.74 1ggk n GLY 371 Ca 0.00 -0.98 -0.19 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.00 0.82 -0.07 1.61 2.20 -0.66 -1.37 119.74 120.26 1ggk s LYS 372 Ca 0.00 -0.53 0.04 0.00 -0.36 0.00 0.00 55.97 55.12 1ggk s LYS 372 Cb 0.00 -0.78 -0.00 0.00 -1.51 0.00 0.00 37.83 35.54 1ggk s LYS 372 CO 0.00 0.20 -0.21 1.41 -0.36 0.00 0.00 175.35 176.40 1ggk s MET 373 N -0.69 2.41 -0.06 4.03 -2.45 -0.29 -1.20 119.30 121.05 1ggk s MET 373 Ca 0.02 -0.74 0.04 0.00 -1.25 0.00 0.00 55.69 53.76 1ggk s MET 373 Cb -0.06 -1.94 -0.00 0.00 1.25 0.00 0.00 34.83 34.08 1ggk s MET 373 CO 0.00 0.21 -0.19 0.08 1.05 0.00 0.00 175.02 176.17 1ggk s VAL 374 N 0.22 1.63 -0.43 10.11 1.01 -0.23 -2.06 120.40 130.65 1ggk s VAL 374 Ca -0.11 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 1ggk s VAL 374 Cb -0.15 -1.41 0.06 0.00 0.00 0.00 0.00 36.38 34.88 1ggk s VAL 374 CO 0.05 0.46 0.30 -0.76 0.00 0.00 0.00 175.10 175.16 1ggk s LEU 375 N 0.17 5.25 -0.03 3.92 1.02 -0.67 -0.81 118.68 127.53 1ggk s LEU 375 Ca -0.09 -1.29 0.04 0.00 0.02 0.00 0.00 54.13 52.81 1ggk s LEU 375 Cb -0.14 -2.08 0.06 0.00 0.02 0.00 0.00 46.19 44.05 1ggk s LEU 375 CO 0.04 -0.54 0.98 -0.46 0.02 0.00 0.00 176.35 176.39 1ggk n ASN 376 N 5.06 1.78 -3.71 2.29 0.23 -0.99 -3.66 115.26 116.27 1ggk n ASN 376 Ca -0.11 -2.12 -0.11 0.00 -0.53 0.00 0.00 54.58 51.70 1ggk n ASN 376 Cb 0.44 -0.10 -0.10 0.00 -2.08 0.00 0.00 39.78 37.94 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 -1.26 0.43 0.49 -3.83 3.52 -1.01 -5.00 118.95 112.29 1ggk s ARG 377 Ca 0.07 0.71 -0.15 0.00 -0.13 0.00 0.00 55.73 56.23 1ggk s ARG 377 Cb 0.06 0.08 -0.08 0.00 -1.56 0.00 0.00 34.95 33.45 1ggk s ARG 377 CO 0.01 -0.12 0.93 -0.80 -0.81 0.00 0.00 175.30 174.51 1ggk s ASN 378 N 0.96 6.60 1.11 -2.12 0.01 -1.26 0.22 114.94 120.46 1ggk s ASN 378 Ca -0.06 1.47 -0.14 0.00 -0.71 0.00 0.00 52.86 53.42 1ggk s ASN 378 Cb -0.06 -2.47 0.25 0.00 0.41 0.00 0.00 41.25 39.38 1ggk s ASN 378 CO -0.08 -0.54 1.06 -2.84 -1.51 0.00 0.00 177.10 173.19 1ggk s PRO 379 N -4.01 -0.51 -0.22 -0.60 0.02 -1.26 -3.76 135.00 124.66 1ggk s PRO 379 Ca 0.57 0.54 -0.13 0.00 0.02 0.00 0.00 61.00 62.00 1ggk s PRO 379 Cb -0.10 -1.63 -0.18 0.00 0.02 0.00 0.00 34.50 32.61 1ggk s PRO 379 CO 0.31 -3.37 0.00 -0.25 -0.33 0.00 0.00 177.00 173.37 1ggk n ASP 380 N -4.62 1.96 -4.02 2.53 9.92 -1.26 -1.95 116.55 119.10 1ggk n ASP 380 Ca 0.05 0.27 -0.29 0.00 -0.53 0.00 0.00 54.79 54.29 1ggk n ASP 380 Cb 0.57 -0.82 -0.17 0.00 -0.64 0.00 0.00 41.12 40.06 1ggk n ASP 380 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1ggk s ASN 381 N -7.03 2.52 0.12 -2.24 3.84 -1.26 -4.71 114.94 106.17 1ggk s ASN 381 Ca -0.32 -0.44 -0.21 0.00 0.21 0.00 0.00 52.86 52.10 1ggk s ASN 381 Cb 0.09 -1.10 -0.07 0.00 -0.55 0.00 0.00 41.25 39.62 1ggk s ASN 381 CO 0.60 -0.03 1.71 0.15 -2.79 0.00 0.00 177.10 176.74 1ggk h PHE 382 N 7.77 -0.11 0.38 0.43 3.57 -1.99 -2.26 116.94 124.74 1ggk h PHE 382 Ca -0.34 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.15 1ggk h PHE 382 Cb 1.15 0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.96 1ggk h PHE 382 CO 0.47 -0.08 -0.21 0.35 -2.23 0.00 0.00 178.31 176.62 1ggk h PHE 383 N -0.03 -0.54 -0.83 0.41 3.04 -1.96 0.12 116.94 117.15 1ggk h PHE 383 Ca 0.06 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 61.98 1ggk h PHE 383 Cb 0.12 0.18 -0.04 0.00 2.56 0.00 0.00 35.95 38.78 1ggk h PHE 383 CO -0.17 -0.33 0.44 0.00 -2.02 0.00 0.00 178.31 176.23 1ggk h ALA 384 N 0.06 1.07 0.02 2.41 0.00 -1.97 -2.64 119.26 118.21 1ggk h ALA 384 Ca -0.05 -0.14 -0.33 0.00 0.00 0.00 0.00 54.91 54.39 1ggk h ALA 384 Cb 0.43 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1ggk h ALA 384 CO 0.07 0.59 -1.85 0.39 0.00 0.00 0.00 179.25 178.45 1ggk n GLU 385 N -4.37 0.61 -0.06 0.00 1.02 -0.85 -4.36 120.64 112.62 1ggk n GLU 385 Ca 0.08 0.40 -0.06 0.00 -0.02 0.00 0.00 57.16 57.56 1ggk n GLU 385 Cb 0.11 -1.65 -0.04 0.00 -0.02 0.00 0.00 31.44 29.83 1ggk n GLU 385 CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 1ggk h ASN 386 N -0.72 0.00 -0.53 1.62 -0.73 -0.90 -3.26 115.58 111.06 1ggk h ASN 386 Ca -0.48 -0.27 0.03 0.00 1.87 0.00 0.00 56.30 57.44 1ggk h ASN 386 Cb 1.57 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 40.13 1ggk h ASN 386 CO -0.21 0.77 0.31 -0.08 -0.37 0.00 0.00 177.43 177.85 1ggk h GLU 387 N -1.00 0.59 -0.00 6.67 4.57 -1.16 -2.64 114.58 121.61 1ggk h GLU 387 Ca -0.04 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1ggk h GLU 387 Cb 0.47 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.93 1ggk h GLU 387 CO -0.02 0.39 -0.01 1.04 -1.18 0.00 0.00 179.01 179.23 1ggk n GLN 388 N -4.80 0.46 -1.92 1.92 6.02 -1.02 -4.89 117.38 113.15 1ggk n GLN 388 Ca 0.04 -0.02 -0.39 0.00 -0.01 0.00 0.00 57.00 56.62 1ggk n GLN 388 Cb 0.09 -1.50 0.01 0.00 1.02 0.00 0.00 30.24 29.86 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 -2.55 3.09 -0.11 -1.58 0.00 -1.00 -4.90 121.76 114.71 1ggk s ALA 389 Ca 0.29 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.55 1ggk s ALA 389 Cb 0.20 -3.53 0.02 0.00 0.00 0.00 0.00 23.12 19.82 1ggk s ALA 389 CO 0.46 -1.08 -0.10 0.00 0.00 0.00 0.00 175.76 175.04 1ggk s ALA 390 N -1.29 1.45 0.01 0.00 0.00 -1.26 -5.06 121.76 115.60 1ggk s ALA 390 Ca 0.63 -0.61 0.05 0.00 0.00 0.00 0.00 51.96 52.03 1ggk s ALA 390 Cb -0.39 -0.89 -0.03 0.00 0.00 0.00 0.00 23.12 21.81 1ggk s ALA 390 CO 0.49 -0.31 -0.13 -0.06 0.00 0.00 0.00 175.76 175.74 1ggk s PHE 391 N 1.47 2.70 -0.18 0.00 0.08 -1.26 -5.00 117.98 115.78 1ggk s PHE 391 Ca 0.02 -0.16 -0.10 0.00 0.12 0.00 0.00 56.93 56.80 1ggk s PHE 391 Cb -0.13 -1.55 0.06 0.00 -0.57 0.00 0.00 43.02 40.83 1ggk s PHE 391 CO -0.07 0.28 0.44 -1.58 -0.10 0.00 0.00 175.22 174.19 1ggk s HIS 392 N -0.91 -0.66 -0.97 0.36 5.65 -1.26 -4.99 115.29 112.52 1ggk s HIS 392 Ca 0.15 1.39 0.13 0.00 0.25 0.00 0.00 55.06 56.98 1ggk s HIS 392 Cb -0.11 0.31 0.55 0.00 -1.18 0.00 0.00 32.58 32.15 1ggk s HIS 392 CO 0.05 -0.37 1.41 -0.35 -0.65 0.00 0.00 174.74 174.83 1ggk n PRO 393 N 4.31 0.01 0.07 2.88 -0.04 -1.26 -1.79 135.00 139.18 1ggk n PRO 393 Ca -0.22 0.30 0.13 0.00 -0.04 0.00 0.00 63.50 63.67 1ggk n PRO 393 Cb 0.55 -1.52 0.42 0.00 -0.04 0.00 0.00 33.50 32.91 1ggk n PRO 393 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ggk n GLY 394 N -0.24 -1.61 3.56 0.55 0.00 -1.26 -4.58 105.19 101.61 1ggk n GLY 394 Ca 0.03 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.08 2.02 0.46 1.61 3.76 -0.74 -4.97 115.29 114.34 1ggk s HIS 395 Ca 0.11 0.20 0.04 0.00 -0.15 0.00 0.00 55.06 55.26 1ggk s HIS 395 Cb 0.14 -4.25 -0.05 0.00 1.11 0.00 0.00 32.58 29.53 1ggk s HIS 395 CO 0.60 -1.84 0.01 0.96 -0.85 0.00 0.00 174.74 173.62 1ggk s ILE 396 N 8.46 1.63 0.22 0.60 -4.36 -1.26 -2.50 121.20 123.99 1ggk s ILE 396 Ca 0.62 -1.99 0.07 0.00 -0.26 0.00 0.00 60.65 59.09 1ggk s ILE 396 Cb -0.05 -2.62 -0.05 0.00 1.25 0.00 0.00 42.46 40.99 1ggk s ILE 396 CO -0.02 0.00 -0.10 0.68 0.24 0.00 0.00 174.94 175.74 1ggk s VAL 397 N -2.78 1.56 0.22 8.37 -7.23 -1.26 -4.85 120.40 114.42 1ggk s VAL 397 Ca 0.22 -2.15 -0.32 0.00 -1.81 0.00 0.00 61.98 57.93 1ggk s VAL 397 Cb 0.06 -2.18 -0.14 0.00 0.56 0.00 0.00 36.38 34.68 1ggk s VAL 397 CO 0.11 -0.49 1.31 -2.65 -0.31 0.00 0.00 175.10 173.07 1ggk n PRO 398 N -0.43 1.70 0.00 4.82 -0.02 -1.26 -1.51 135.00 138.31 1ggk n PRO 398 Ca -0.07 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1ggk n PRO 398 Cb 0.62 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 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 2.06 1.57 3.36 -1.23 0.00 -1.26 -3.49 105.19 106.20 1ggk n GLY 399 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.95 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 2.55 0.18 0.99 1.43 -0.57 0.04 118.68 123.30 1ggk s LEU 400 Ca 0.00 -1.00 -0.24 0.00 -1.03 0.00 0.00 54.13 51.86 1ggk s LEU 400 Cb 0.00 -0.75 0.05 0.00 0.03 0.00 0.00 46.19 45.53 1ggk s LEU 400 CO 0.00 -0.13 0.83 -0.62 0.23 0.00 0.00 176.35 176.67 1ggk s ASP 401 N -3.26 -0.27 0.53 2.29 3.68 -0.86 -4.79 116.67 113.99 1ggk s ASP 401 Ca 0.23 -0.38 0.02 0.00 2.13 0.00 0.00 52.55 54.54 1ggk s ASP 401 Cb -0.02 0.57 0.08 0.00 -1.45 0.00 0.00 42.92 42.10 1ggk s ASP 401 CO 0.08 -1.02 0.60 0.49 0.13 0.00 0.00 175.17 175.44 1ggk n PHE 402 N -0.43 -2.92 -4.24 -5.34 3.01 -1.26 -1.34 117.46 104.93 1ggk n PHE 402 Ca -0.07 -1.20 -0.14 0.00 1.01 0.00 0.00 57.45 57.05 1ggk n PHE 402 Cb 0.61 -0.43 -0.10 0.00 -0.01 0.00 0.00 39.48 39.55 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 -1.69 0.10 -1.38 4.37 -4.23 -1.26 -4.45 115.64 107.09 1ggk s THR 403 Ca 0.41 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.92 1ggk s THR 403 Cb -0.03 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.29 1ggk s THR 403 CO 0.27 0.00 0.58 0.59 -0.54 0.00 0.00 174.62 175.52 1ggk n ASN 404 N -0.52 0.52 -4.67 3.99 3.02 -1.26 -4.69 115.26 111.65 1ggk n ASN 404 Ca 0.02 -1.68 -0.53 0.00 -0.03 0.00 0.00 54.58 52.37 1ggk n ASN 404 Cb 0.65 -0.26 -0.06 0.00 -0.61 0.00 0.00 39.78 39.51 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 -0.14 2.82 0.27 6.41 -0.08 -1.26 -4.84 116.55 119.72 1ggk n ASP 405 Ca 0.00 0.95 0.11 0.00 -1.51 0.00 0.00 54.79 54.34 1ggk n ASP 405 Cb 0.13 -1.25 0.74 0.00 2.34 0.00 0.00 41.12 43.08 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 8.76 0.00 -0.00 -0.67 0.13 -1.78 -0.25 132.00 138.19 1ggk h PRO 406 Ca -0.45 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.66 1ggk h PRO 406 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1ggk h PRO 406 CO 0.96 0.07 -0.09 1.25 -0.23 0.00 0.00 178.00 179.96 1ggk h LEU 407 N 0.00 0.09 -0.10 1.56 5.85 -1.80 -3.20 115.31 117.71 1ggk h LEU 407 Ca -0.00 -0.77 0.04 0.00 0.84 0.00 0.00 57.88 57.99 1ggk h LEU 407 Cb 0.15 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 1ggk h LEU 407 CO 0.01 0.84 -0.18 0.25 -0.34 0.00 0.00 178.44 179.02 1ggk h LEU 408 N -0.66 -0.56 -0.84 2.25 5.85 -1.85 -0.92 115.31 118.57 1ggk h LEU 408 Ca -0.01 0.09 0.18 0.00 0.84 0.00 0.00 57.88 58.98 1ggk h LEU 408 Cb 0.85 0.25 -0.11 0.00 0.37 0.00 0.00 40.66 42.03 1ggk h LEU 408 CO 0.02 -0.23 0.37 1.56 -0.34 0.00 0.00 178.44 179.82 1ggk h GLN 409 N -0.25 0.46 0.00 1.25 1.08 -1.16 -0.25 115.11 116.24 1ggk h GLN 409 Ca 0.09 -0.03 -0.15 0.00 -1.45 0.00 0.00 58.65 57.11 1ggk h GLN 409 Cb 0.37 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 1ggk h GLN 409 CO -0.24 0.30 -0.72 0.78 -0.95 0.00 0.00 178.83 178.00 1ggk h GLY 410 N 0.47 0.00 1.02 3.46 0.00 -1.41 -3.06 103.07 103.56 1ggk h GLY 410 Ca 0.49 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.83 1ggk h GLY 410 CO -0.45 0.00 0.65 3.21 0.00 0.00 0.00 176.54 179.96 1ggk h ARG 411 N 0.00 1.31 -0.80 4.80 3.08 0.32 -2.59 114.38 120.49 1ggk h ARG 411 Ca -0.01 -0.08 0.21 0.00 0.07 0.00 0.00 59.98 60.17 1ggk h ARG 411 Cb 1.31 -0.29 -0.04 0.00 0.08 0.00 0.00 29.97 31.03 1ggk h ARG 411 CO 0.09 0.87 0.56 -0.07 -1.07 0.00 0.00 179.97 180.35 1ggk h LEU 412 N 1.35 0.18 -0.06 3.04 3.38 -1.33 -2.31 115.31 119.55 1ggk h LEU 412 Ca 0.36 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 58.20 1ggk h LEU 412 Cb -0.15 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.59 1ggk h LEU 412 CO -0.08 0.07 -0.55 0.15 0.09 0.00 0.00 178.44 178.13 1ggk h PHE 413 N 0.18 0.66 -0.43 1.13 3.57 -1.63 -3.41 116.94 117.01 1ggk h PHE 413 Ca 0.40 -0.32 -0.09 0.00 3.53 0.00 0.00 57.97 61.49 1ggk h PHE 413 Cb 1.29 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 1ggk h PHE 413 CO -0.00 1.11 -0.08 1.03 -2.23 0.00 0.00 178.31 178.14 1ggk h SER 414 N 0.02 0.82 -0.40 0.41 0.87 -1.45 -3.23 113.55 110.60 1ggk h SER 414 Ca -0.05 -0.35 -0.08 0.00 -1.23 0.00 0.00 61.79 60.08 1ggk h SER 414 Cb 1.22 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.93 1ggk h SER 414 CO 0.11 0.98 -0.03 1.88 -0.53 0.00 0.00 176.83 179.24 1ggk h TYR 415 N 0.65 0.86 0.49 2.24 0.05 -1.78 -1.68 116.97 117.80 1ggk h TYR 415 Ca 0.11 -0.13 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 1ggk h TYR 415 Cb 0.61 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 38.12 1ggk h TYR 415 CO 0.05 0.81 -0.23 1.15 -1.05 0.00 0.00 178.16 178.89 1ggk h THR 416 N 0.74 0.49 -0.49 -2.88 2.02 -1.82 -3.17 112.91 107.80 1ggk h THR 416 Ca 0.14 -0.23 0.10 0.00 0.77 0.00 0.00 66.41 67.18 1ggk h THR 416 Cb 0.50 0.59 -0.09 0.00 -1.74 0.00 0.00 68.15 67.41 1ggk h THR 416 CO 0.03 0.04 -0.07 -0.78 0.37 0.00 0.00 175.52 175.10 1ggk h ASP 417 N -0.80 -0.35 0.99 4.18 3.58 -1.55 -2.41 116.42 120.06 1ggk h ASP 417 Ca -0.07 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.52 1ggk h ASP 417 Cb 0.57 0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.88 1ggk h ASP 417 CO 0.11 -0.13 0.00 0.00 -2.88 0.00 0.00 179.24 176.34 1ggk h THR 418 N 0.04 0.00 0.00 2.25 1.03 -1.36 -3.09 112.91 111.79 1ggk h THR 418 Ca 0.24 -0.48 -0.14 0.00 -0.01 0.00 0.00 66.41 66.01 1ggk h THR 418 Cb 0.37 1.46 -0.02 0.00 -1.07 0.00 0.00 68.15 68.88 1ggk h THR 418 CO -0.46 0.00 -0.68 1.56 -0.01 0.00 0.00 175.52 175.92 1ggk h GLN 419 N 0.00 0.00 -0.91 0.00 4.20 -1.40 -1.89 115.11 115.11 1ggk h GLN 419 Ca 0.00 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.82 1ggk h GLN 419 Cb 0.50 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.21 1ggk h GLN 419 CO 0.00 0.68 0.58 0.82 -0.67 0.00 0.00 178.83 180.25 1ggk h ILE 420 N 0.00 0.92 0.05 2.54 1.08 -1.55 0.16 117.51 120.70 1ggk h ILE 420 Ca -0.01 -0.29 -0.35 0.00 -0.39 0.00 0.00 64.86 63.82 1ggk h ILE 420 Cb 1.36 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 35.07 1ggk h ILE 420 CO 0.09 0.15 -2.01 -1.54 -0.69 0.00 0.00 178.15 174.16 1ggk n SER 421 N -4.55 2.00 -0.17 1.72 3.41 -1.19 -1.30 113.62 113.54 1ggk n SER 421 Ca 0.16 0.21 -0.03 0.00 -0.26 0.00 0.00 58.87 58.96 1ggk n SER 421 Cb 0.37 -0.79 0.07 0.00 -0.26 0.00 0.00 64.21 63.60 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 -0.39 0.37 -0.56 4.33 2.43 -1.16 -2.94 114.38 116.46 1ggk h ARG 422 Ca -0.49 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 1ggk h ARG 422 Cb 1.75 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 31.22 1ggk h ARG 422 CO -0.11 0.25 0.00 1.28 -1.51 0.00 0.00 179.97 179.88 1ggk n LEU 423 N -4.98 3.56 0.00 3.80 4.77 0.53 -4.46 117.00 120.21 1ggk n LEU 423 Ca 0.06 -2.03 0.00 0.00 -0.03 0.00 0.00 56.01 54.01 1ggk n LEU 423 Cb 0.20 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1ggk n LEU 423 CO 0.25 0.87 0.00 0.61 -1.33 0.00 0.00 177.39 177.79 1ggk n GLY 424 N 1.13 1.12 0.00 -0.72 0.00 -1.11 -4.83 105.19 100.77 1ggk n GLY 424 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.00 -1.49 0.28 -0.02 0.00 -0.42 -4.81 105.19 96.72 1ggk n GLY 425 Ca 0.00 -1.22 0.15 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.07 1.37 -1.06 1.61 -0.04 -1.26 -3.92 135.00 131.64 1ggk n PRO 426 Ca 0.00 -0.56 -0.19 0.00 -0.04 0.00 0.00 63.50 62.71 1ggk n PRO 426 Cb 0.00 -1.49 0.18 0.00 -0.04 0.00 0.00 33.50 32.15 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 -0.32 3.79 0.29 3.54 3.02 -1.26 -4.61 115.26 119.71 1ggk n ASN 427 Ca 0.21 -3.36 0.17 0.00 -0.03 0.00 0.00 54.58 51.56 1ggk n ASN 427 Cb 0.26 -0.79 0.90 0.00 -0.61 0.00 0.00 39.78 39.54 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 1.10 0.00 0.00 3.10 -5.15 -1.89 -0.30 116.94 113.81 1ggk h PHE 428 Ca 0.51 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.28 1ggk h PHE 428 Cb 2.58 0.00 0.00 0.00 0.22 0.00 0.00 35.95 38.75 1ggk h PHE 428 CO 1.37 0.05 0.00 -2.39 -2.00 0.00 0.00 178.31 175.33 1ggk n HIS 429 N -3.47 0.00 1.11 6.09 1.44 -1.26 -1.77 115.22 117.36 1ggk n HIS 429 Ca -0.02 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.81 1ggk n HIS 429 Cb 0.17 -0.47 0.26 0.00 0.12 0.00 0.00 29.99 30.07 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 -1.47 0.49 -2.03 -1.40 1.02 -0.12 -3.40 120.64 113.73 1ggk n GLU 430 Ca 0.04 -0.31 -0.42 0.00 -0.02 0.00 0.00 57.16 56.45 1ggk n GLU 430 Cb 0.15 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.05 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 -2.73 3.06 0.23 -3.67 1.01 -0.73 -4.87 121.20 113.50 1ggk s ILE 431 Ca 0.18 0.66 -0.17 0.00 0.00 0.00 0.00 60.65 61.32 1ggk s ILE 431 Cb 0.18 -3.42 0.24 0.00 0.01 0.00 0.00 42.46 39.47 1ggk s ILE 431 CO 0.62 0.03 1.56 -0.65 0.00 0.00 0.00 174.94 176.49 1ggk h PRO 432 N 7.41 -0.02 -0.45 2.79 0.11 -1.89 0.56 132.00 140.50 1ggk h PRO 432 Ca -0.42 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.73 1ggk h PRO 432 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1ggk h PRO 432 CO 0.91 -0.01 0.30 0.97 -0.21 0.00 0.00 178.00 179.95 1ggk h ILE 433 N -0.02 1.02 0.00 4.15 6.09 -1.91 -2.50 117.51 124.33 1ggk h ILE 433 Ca 0.34 -0.16 0.00 0.00 -1.37 0.00 0.00 64.86 63.68 1ggk h ILE 433 Cb 0.60 0.52 0.00 0.00 0.47 0.00 0.00 36.82 38.41 1ggk h ILE 433 CO -0.95 0.08 -0.19 0.59 -3.07 0.00 0.00 178.15 174.62 1ggk n ASN 434 N -4.48 0.41 -4.73 2.19 3.02 0.16 -4.91 115.26 106.92 1ggk n ASN 434 Ca 0.05 0.32 -0.42 0.00 -0.03 0.00 0.00 54.58 54.51 1ggk n ASN 434 Cb 0.18 -0.34 -0.03 0.00 -0.61 0.00 0.00 39.78 38.99 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 -3.05 4.24 0.66 3.52 0.52 -0.94 -4.89 118.95 119.00 1ggk s ARG 435 Ca 0.11 2.33 -0.17 0.00 -0.52 0.00 0.00 55.73 57.48 1ggk s ARG 435 Cb 0.16 -3.14 -0.00 0.00 0.52 0.00 0.00 34.95 32.49 1ggk s ARG 435 CO 0.61 -0.53 1.27 -2.14 0.02 0.00 0.00 175.30 174.53 1ggk s PRO 436 N 0.50 2.48 0.06 3.54 0.02 -1.26 -4.93 135.00 135.41 1ggk s PRO 436 Ca 0.65 1.98 0.23 0.00 0.02 0.00 0.00 61.00 63.88 1ggk s PRO 436 Cb -0.43 -1.85 -0.02 0.00 0.02 0.00 0.00 34.50 32.23 1ggk s PRO 436 CO 0.36 -1.63 0.95 0.25 -0.33 0.00 0.00 177.00 176.61 1ggk n THR 437 N -2.07 0.20 -2.41 0.99 -2.24 -1.26 -4.88 114.28 102.61 1ggk n THR 437 Ca 0.15 -0.30 -0.24 0.00 -2.27 0.00 0.00 64.05 61.39 1ggk n THR 437 Cb 0.49 0.14 0.07 0.00 -2.10 0.00 0.00 70.33 68.93 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 -5.08 3.82 -0.05 0.00 0.04 -1.26 -5.06 135.00 127.41 1ggk s PRO 439 Ca 0.61 1.67 -0.02 0.00 0.04 0.00 0.00 61.00 63.29 1ggk s PRO 439 Cb -0.09 -2.38 0.03 0.00 0.04 0.00 0.00 34.50 32.10 1ggk s PRO 439 CO 0.43 -0.48 0.07 1.52 0.04 0.00 0.00 177.00 178.59 1ggk s TYR 440 N -1.63 0.04 -0.02 0.56 1.13 -1.26 -5.01 117.35 111.16 1ggk s TYR 440 Ca 0.63 0.27 0.02 0.00 -1.41 0.00 0.00 57.07 56.58 1ggk s TYR 440 Cb -0.26 -0.46 0.00 0.00 -1.10 0.00 0.00 41.96 40.14 1ggk s TYR 440 CO 0.31 -0.22 -0.07 -1.01 -2.51 0.00 0.00 175.55 172.05 1ggk s HIS 441 N 2.18 0.75 0.10 -3.49 3.76 -1.26 -5.15 115.29 112.18 1ggk s HIS 441 Ca 0.05 -0.16 -0.06 0.00 -0.15 0.00 0.00 55.06 54.74 1ggk s HIS 441 Cb -0.12 -0.53 0.02 0.00 1.11 0.00 0.00 32.58 33.06 1ggk s HIS 441 CO -0.04 -0.06 0.28 0.27 -0.85 0.00 0.00 174.74 174.34 1ggk n ASN 442 N 3.20 -0.66 -1.26 1.40 0.23 -1.26 -4.98 115.26 111.94 1ggk n ASN 442 Ca -0.17 -1.41 0.11 0.00 -0.53 0.00 0.00 54.58 52.58 1ggk n ASN 442 Cb 0.55 1.08 0.30 0.00 -2.08 0.00 0.00 39.78 39.64 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 -0.19 0.90 -2.34 -2.53 3.01 -1.26 -4.95 117.46 110.10 1ggk n PHE 443 Ca -0.02 -0.45 -0.40 0.00 1.01 0.00 0.00 57.45 57.60 1ggk n PHE 443 Cb 0.19 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.63 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 -1.10 4.37 0.16 -1.08 -0.21 -1.26 -4.72 119.66 115.81 1ggk s GLN 444 Ca 0.46 1.90 -0.02 0.00 0.02 0.00 0.00 55.36 57.71 1ggk s GLN 444 Cb 0.24 -2.97 -0.03 0.00 1.00 0.00 0.00 33.01 31.24 1ggk s GLN 444 CO 0.31 -0.06 0.12 1.03 -2.12 0.00 0.00 175.29 174.57 1ggk s ARG 445 N -1.85 1.06 2.89 2.91 1.81 -1.26 -5.09 118.95 119.42 1ggk s ARG 445 Ca 0.50 -1.46 0.00 0.00 -1.72 0.00 0.00 55.73 53.05 1ggk s ARG 445 Cb -0.33 0.28 0.00 0.00 -0.45 0.00 0.00 34.95 34.45 1ggk s ARG 445 CO 0.42 -0.33 0.00 -0.25 -0.68 0.00 0.00 175.30 174.46 1ggk n ASP 446 N -0.17 -1.77 0.00 0.23 9.92 -1.26 -5.07 116.55 118.42 1ggk n ASP 446 Ca -0.03 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.23 1ggk n ASP 446 Cb 0.64 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.12 1ggk n ASP 446 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ggk n GLY 447 N 0.00 0.99 3.68 0.44 0.00 -1.26 -4.70 105.19 104.34 1ggk n GLY 447 Ca 0.00 -1.74 -0.44 0.00 0.00 0.00 0.00 46.02 43.84 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 1.03 2.16 -3.59 1.61 1.56 -1.26 -2.78 117.12 115.85 1ggk n MET 448 Ca 0.00 0.77 -0.20 0.00 -0.27 0.00 0.00 57.70 58.00 1ggk n MET 448 Cb 0.00 -2.45 0.06 0.00 2.15 0.00 0.00 33.22 32.98 1ggk n MET 448 CO 0.00 0.00 0.00 1.58 -0.73 0.00 0.00 175.97 176.82 1ggk n HIS 449 N 1.96 -2.13 -2.09 1.12 -0.00 -1.26 -4.46 115.22 108.37 1ggk n HIS 449 Ca 0.11 0.90 -0.42 0.00 -0.00 0.00 0.00 57.72 58.31 1ggk n HIS 449 Cb 0.32 -4.72 -0.03 0.00 -0.00 0.00 0.00 29.99 25.56 1ggk n HIS 449 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 1ggk s ARG 450 N -5.77 4.21 -0.20 1.57 6.06 -1.12 -4.92 118.95 118.79 1ggk s ARG 450 Ca 0.08 2.11 -0.19 0.00 -2.50 0.00 0.00 55.73 55.24 1ggk s ARG 450 Cb -0.04 -3.79 -0.15 0.00 0.06 0.00 0.00 34.95 31.03 1ggk s ARG 450 CO 0.77 -0.74 0.10 -1.33 -2.50 0.00 0.00 175.30 171.60 1ggk n MET 451 N 6.36 0.54 -1.97 5.12 2.81 -1.26 -4.94 117.12 123.78 1ggk n MET 451 Ca 0.16 0.55 -0.41 0.00 -1.81 0.00 0.00 57.70 56.19 1ggk n MET 451 Cb 0.43 -1.72 -0.02 0.00 -0.71 0.00 0.00 33.22 31.19 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 -4.75 2.50 -0.47 3.03 0.00 -1.26 -4.99 107.32 101.37 1ggk s GLY 452 Ca -0.26 1.38 -0.08 0.00 0.00 0.00 0.00 44.72 45.76 1ggk s GLY 452 CO 0.51 2.25 0.34 -0.42 0.00 0.00 0.00 173.10 175.77 1ggk s ILE 453 N -0.36 4.08 0.06 0.90 1.01 -1.26 -5.00 121.20 120.62 1ggk s ILE 453 Ca 0.57 -1.89 -0.31 0.00 0.00 0.00 0.00 60.65 59.03 1ggk s ILE 453 Cb -0.43 -3.70 -0.06 0.00 0.01 0.00 0.00 42.46 38.28 1ggk s ILE 453 CO 0.48 -0.77 1.24 -1.81 0.00 0.00 0.00 174.94 174.08 1ggk s ASP 454 N 2.47 7.02 -0.00 3.58 1.11 -1.26 -4.94 116.67 124.65 1ggk s ASP 454 Ca 0.07 2.06 0.21 0.00 0.18 0.00 0.00 52.55 55.07 1ggk s ASP 454 Cb -0.25 -2.58 -0.15 0.00 1.07 0.00 0.00 42.92 41.01 1ggk s ASP 454 CO -0.02 -0.53 0.95 0.35 1.18 0.00 0.00 175.17 177.11 1ggk n THR 455 N 4.03 0.00 -1.67 -1.27 -2.24 -1.26 -4.96 114.28 106.91 1ggk n THR 455 Ca 0.10 -0.01 -0.46 0.00 -2.27 0.00 0.00 64.05 61.41 1ggk n THR 455 Cb 0.45 0.90 -0.04 0.00 -2.10 0.00 0.00 70.33 69.54 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 -1.52 3.08 0.23 3.42 2.85 -1.26 -4.87 115.26 117.19 1ggk n ASN 456 Ca 0.04 1.09 0.10 0.00 -0.11 0.00 0.00 54.58 55.70 1ggk n ASN 456 Cb 0.34 -1.43 0.56 0.00 1.24 0.00 0.00 39.78 40.48 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 5.64 0.00 -5.96 1.20 0.11 -1.92 -3.42 132.00 127.64 1ggk h PRO 457 Ca -0.45 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.04 1ggk h PRO 457 Cb 1.26 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.32 1ggk h PRO 457 CO 0.87 0.21 -0.51 0.00 -0.21 0.00 0.00 178.00 178.35 1ggk s ALA 458 N -3.93 3.94 -0.07 -0.75 0.00 -1.26 -5.00 121.76 114.69 1ggk s ALA 458 Ca -0.01 -0.88 0.11 0.00 0.00 0.00 0.00 51.96 51.18 1ggk s ALA 458 Cb 0.12 -1.77 0.21 0.00 0.00 0.00 0.00 23.12 21.68 1ggk s ALA 458 CO 0.63 0.80 1.10 0.27 0.00 0.00 0.00 175.76 178.56 1ggk n ASN 459 N 0.26 1.11 -3.83 0.00 2.04 -1.26 -5.01 115.26 108.58 1ggk n ASN 459 Ca -0.06 -2.58 -0.09 0.00 -0.44 0.00 0.00 54.58 51.41 1ggk n ASN 459 Cb 0.51 -0.33 -0.06 0.00 -2.53 0.00 0.00 39.78 37.37 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 -1.31 0.12 -0.04 -2.53 -0.85 -1.26 -4.82 117.35 106.67 1ggk s TYR 460 Ca 0.20 -0.50 -0.11 0.00 -0.52 0.00 0.00 57.07 56.14 1ggk s TYR 460 Cb 0.19 0.06 0.02 0.00 0.38 0.00 0.00 41.96 42.61 1ggk s TYR 460 CO -0.02 -0.67 0.25 -1.83 -1.52 0.00 0.00 175.55 171.76 1ggk s GLU 461 N -3.88 0.49 0.60 -3.49 4.04 -1.26 -4.17 118.70 111.02 1ggk s GLU 461 Ca 0.09 -0.03 -0.17 0.00 0.04 0.00 0.00 54.97 54.89 1ggk s GLU 461 Cb 0.03 0.22 -0.03 0.00 0.02 0.00 0.00 34.13 34.37 1ggk s GLU 461 CO -0.07 -0.11 1.11 -1.25 -1.84 0.00 0.00 175.26 173.10 1ggk s PRO 462 N -0.79 3.10 0.02 -4.83 0.04 -1.26 -5.20 135.00 126.09 1ggk s PRO 462 Ca -0.09 1.46 0.00 0.00 0.04 0.00 0.00 61.00 62.42 1ggk s PRO 462 Cb -0.05 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 1ggk s PRO 462 CO 0.02 -1.02 -0.03 0.54 0.04 0.00 0.00 177.00 176.55 1ggk s ASN 463 N -2.25 0.29 -0.10 6.66 2.20 -1.26 -5.05 114.94 115.44 1ggk s ASN 463 Ca 0.69 -0.37 0.20 0.00 -0.94 0.00 0.00 52.86 52.44 1ggk s ASN 463 Cb -0.21 0.06 -0.30 0.00 -2.00 0.00 0.00 41.25 38.79 1ggk s ASN 463 CO 0.34 -0.20 0.32 -1.54 -2.94 0.00 0.00 177.10 173.09 1ggk n SER 464 N 2.00 0.01 0.27 3.54 3.41 -1.26 -1.25 113.62 120.33 1ggk n SER 464 Ca -0.20 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.59 1ggk n SER 464 Cb 0.56 1.59 0.89 0.00 -0.26 0.00 0.00 64.21 66.99 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 0.00 0.00 -1.33 3.07 -1.99 -1.77 117.51 115.49 1ggk h ILE 465 Ca -0.22 -0.15 -0.00 0.00 1.55 0.00 0.00 64.86 66.04 1ggk h ILE 465 Cb 1.50 1.01 -0.01 0.00 -0.27 0.00 0.00 36.82 39.05 1ggk h ILE 465 CO 0.01 0.00 -0.17 -3.20 -1.05 0.00 0.00 178.15 173.74 1ggk n ASN 466 N -2.82 1.68 -3.75 2.16 5.15 -1.26 -4.91 115.26 111.51 1ggk n ASN 466 Ca -0.01 -2.82 -0.27 0.00 -0.60 0.00 0.00 54.58 50.88 1ggk n ASN 466 Cb 0.14 -0.37 0.05 0.00 -0.53 0.00 0.00 39.78 39.07 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 -1.01 -5.18 -1.14 1.20 -0.08 -0.67 -2.12 116.55 107.54 1ggk n ASP 467 Ca 0.12 -0.68 -0.15 0.00 -1.51 0.00 0.00 54.79 52.57 1ggk n ASP 467 Cb 0.67 -4.43 -0.06 0.00 2.34 0.00 0.00 41.12 39.64 1ggk n ASP 467 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1ggk n ASN 468 N -2.94 -5.42 -4.84 1.67 5.15 -0.38 -5.01 115.26 103.50 1ggk n ASN 468 Ca -0.00 0.37 -0.36 0.00 -0.60 0.00 0.00 54.58 53.99 1ggk n ASN 468 Cb 0.55 -4.23 -0.06 0.00 -0.53 0.00 0.00 39.78 35.51 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 -2.34 3.64 0.46 1.20 0.52 -0.90 -3.83 118.94 117.68 1ggk s TRP 469 Ca 0.00 1.08 -0.21 0.00 0.02 0.00 0.00 56.10 56.99 1ggk s TRP 469 Cb 0.00 -2.38 -0.09 0.00 -1.15 0.00 0.00 33.47 29.86 1ggk s TRP 469 CO 0.00 0.47 1.04 -1.25 0.02 0.00 0.00 176.95 177.23 1ggk s PRO 470 N -1.79 3.91 0.20 4.98 0.04 -1.26 -4.88 135.00 136.20 1ggk s PRO 470 Ca 0.36 1.41 0.07 0.00 0.04 0.00 0.00 61.00 62.88 1ggk s PRO 470 Cb -0.16 -2.23 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 1ggk s PRO 470 CO 0.19 -0.35 0.10 1.03 0.04 0.00 0.00 177.00 178.01 1ggk s ARG 471 N -3.00 2.72 0.69 4.56 0.52 -1.25 -5.04 118.95 118.15 1ggk s ARG 471 Ca 0.64 -1.04 -0.16 0.00 -0.52 0.00 0.00 55.73 54.66 1ggk s ARG 471 Cb -0.18 -2.50 0.02 0.00 0.52 0.00 0.00 34.95 32.81 1ggk s ARG 471 CO 0.22 0.44 1.19 -1.21 0.02 0.00 0.00 175.30 175.96 1ggk s GLU 472 N -3.34 2.40 -0.10 3.54 2.02 -1.26 -5.03 118.70 116.93 1ggk s GLU 472 Ca 0.31 1.71 0.01 0.00 0.02 0.00 0.00 54.97 57.01 1ggk s GLU 472 Cb -0.09 -1.87 0.02 0.00 0.10 0.00 0.00 34.13 32.29 1ggk s GLU 472 CO 0.22 -1.62 -0.11 0.99 0.02 0.00 0.00 175.26 174.76 1ggk s THR 473 N -1.97 1.21 0.73 3.63 2.01 -1.26 -5.07 115.64 114.91 1ggk s THR 473 Ca 0.74 -0.44 -0.15 0.00 0.31 0.00 0.00 61.69 62.15 1ggk s THR 473 Cb -0.28 -1.15 0.04 0.00 0.01 0.00 0.00 72.50 71.11 1ggk s THR 473 CO 0.42 0.39 1.18 -2.16 -0.69 0.00 0.00 174.62 173.76 1ggk s PRO 474 N 1.28 2.21 0.72 4.92 0.04 -1.26 -1.57 135.00 141.34 1ggk s PRO 474 Ca -0.02 1.66 -0.16 0.00 0.04 0.00 0.00 61.00 62.52 1ggk s PRO 474 Cb -0.14 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.58 1ggk s PRO 474 CO -0.04 -1.75 1.23 -1.25 0.04 0.00 0.00 177.00 175.22 1ggk s PRO 475 N -4.01 2.16 0.15 0.56 0.05 -1.26 -1.90 135.00 130.74 1ggk s PRO 475 Ca 0.72 1.85 -0.23 0.00 0.05 0.00 0.00 61.00 63.38 1ggk s PRO 475 Cb -0.27 -1.83 0.08 0.00 0.05 0.00 0.00 34.50 32.54 1ggk s PRO 475 CO 0.45 -1.84 1.08 0.20 0.05 0.00 0.00 177.00 176.94 1ggk s GLY 476 N -1.87 0.04 0.42 0.56 0.00 -1.26 -4.82 107.32 100.38 1ggk s GLY 476 Ca 0.76 -0.21 0.16 0.00 0.00 0.00 0.00 44.72 45.43 1ggk s GLY 476 CO 0.45 2.60 1.91 -0.56 0.00 0.00 0.00 173.10 177.50 1ggk h PRO 477 N 2.00 0.00 -2.53 2.90 0.13 -1.96 -3.40 132.00 129.14 1ggk h PRO 477 Ca -0.27 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.77 1ggk h PRO 477 Cb 1.21 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.13 1ggk h PRO 477 CO 0.34 0.27 -0.08 -1.59 -0.23 0.00 0.00 178.00 176.71 1ggk s LYS 478 N -4.28 0.74 -1.66 0.86 0.00 -1.26 -4.86 119.74 109.28 1ggk s LYS 478 Ca -0.03 0.33 0.00 0.00 0.00 0.00 0.00 55.97 56.27 1ggk s LYS 478 Cb 0.14 0.35 0.00 0.00 0.00 0.00 0.00 37.83 38.32 1ggk s LYS 478 CO 0.69 -0.17 0.00 0.54 0.00 0.00 0.00 175.35 176.41 1ggk n ARG 479 N 1.86 -1.74 -3.00 1.78 5.12 -1.26 -4.99 116.66 114.44 1ggk n ARG 479 Ca -0.17 0.94 -0.17 0.00 -1.93 0.00 0.00 57.85 56.51 1ggk n ARG 479 Cb 0.56 -5.51 0.01 0.00 -1.16 0.00 0.00 32.46 26.37 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 -2.17 1.93 0.94 -0.13 0.00 -1.26 -4.96 107.32 101.67 1ggk s GLY 480 Ca 0.00 -1.69 -0.12 0.00 0.00 0.00 0.00 44.72 42.92 1ggk s GLY 480 CO 0.00 -1.49 1.09 -0.32 0.00 0.00 0.00 173.10 172.38 1ggk s GLY 481 N -4.37 1.61 0.01 0.20 0.00 -0.61 -4.78 107.32 99.38 1ggk s GLY 481 Ca 0.56 0.00 -0.27 0.00 0.00 0.00 0.00 44.72 45.00 1ggk s GLY 481 CO 0.34 0.51 0.87 -0.12 0.00 0.00 0.00 173.10 174.70 1ggk s PHE 482 N -2.84 3.68 -0.02 1.90 5.36 -1.26 -4.18 117.98 120.62 1ggk s PHE 482 Ca 0.64 1.56 0.02 0.00 -0.96 0.00 0.00 56.93 58.20 1ggk s PHE 482 Cb -0.19 -2.98 0.00 0.00 -0.34 0.00 0.00 43.02 39.51 1ggk s PHE 482 CO 0.58 0.10 -0.08 -2.00 -1.46 0.00 0.00 175.22 172.37 1ggk s GLU 483 N 0.59 0.84 0.35 10.12 2.12 -1.26 -5.00 118.70 126.46 1ggk s GLU 483 Ca 0.45 -0.27 -0.26 0.00 0.36 0.00 0.00 54.97 55.25 1ggk s GLU 483 Cb -0.20 -0.80 -0.09 0.00 0.26 0.00 0.00 34.13 33.29 1ggk s GLU 483 CO 0.25 0.10 1.05 -1.12 -0.54 0.00 0.00 175.26 175.00 1ggk s SER 484 N 0.18 7.00 0.31 -1.70 0.01 -1.26 -4.98 113.70 113.26 1ggk s SER 484 Ca -0.03 2.08 -0.30 0.00 1.31 0.00 0.00 55.95 59.01 1ggk s SER 484 Cb -0.08 -2.60 -0.12 0.00 0.21 0.00 0.00 66.02 63.44 1ggk s SER 484 CO 0.00 -0.32 1.59 0.00 0.41 0.00 0.00 173.24 174.91 1ggk n TYR 485 N 0.41 2.89 -1.27 2.43 9.36 -1.26 -4.83 117.16 124.89 1ggk n TYR 485 Ca 0.03 0.28 -0.37 0.00 3.32 0.00 0.00 57.90 61.16 1ggk n TYR 485 Cb 0.48 -2.59 -0.03 0.00 -0.63 0.00 0.00 39.34 36.57 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 1.90 3.55 -1.63 2.98 6.02 -1.26 -4.92 117.38 124.02 1ggk n GLN 486 Ca 0.07 -2.11 -0.37 0.00 -0.01 0.00 0.00 57.00 54.58 1ggk n GLN 486 Cb 0.37 -2.75 0.07 0.00 1.02 0.00 0.00 30.24 28.95 1ggk n GLN 486 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1ggk n GLU 487 N 3.57 0.93 -2.89 -1.09 2.13 -1.26 -4.94 120.64 117.09 1ggk n GLU 487 Ca 0.76 0.37 -0.41 0.00 0.66 0.00 0.00 57.16 58.53 1ggk n GLU 487 Cb 0.25 -2.38 -0.04 0.00 0.27 0.00 0.00 31.44 29.54 1ggk n GLU 487 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1ggk s ARG 488 N -3.21 4.29 -0.17 5.31 6.06 -1.26 -5.05 118.95 124.92 1ggk s ARG 488 Ca 0.80 1.01 -0.01 0.00 -2.50 0.00 0.00 55.73 55.02 1ggk s ARG 488 Cb -0.38 -3.58 -0.01 0.00 0.06 0.00 0.00 34.95 31.04 1ggk s ARG 488 CO 0.44 -0.35 -0.11 0.08 -2.50 0.00 0.00 175.30 172.86 1ggk s VAL 489 N 2.21 3.00 -0.14 7.11 1.01 -1.26 -5.11 120.40 127.22 1ggk s VAL 489 Ca 0.38 -0.65 -0.08 0.00 0.00 0.00 0.00 61.98 61.63 1ggk s VAL 489 Cb -0.16 -2.30 0.05 0.00 0.00 0.00 0.00 36.38 33.97 1ggk s VAL 489 CO 0.12 0.49 0.35 -0.70 0.00 0.00 0.00 175.10 175.36 1ggk s GLU 490 N 0.88 0.33 0.00 2.72 2.12 -1.26 -5.14 118.70 118.35 1ggk s GLU 490 Ca -0.03 0.68 0.00 0.00 0.36 0.00 0.00 54.97 55.98 1ggk s GLU 490 Cb -0.15 -0.05 0.00 0.00 0.26 0.00 0.00 34.13 34.19 1ggk s GLU 490 CO -0.00 -0.15 0.00 0.41 -0.54 0.00 0.00 175.26 174.97 1ggk n GLY 491 N 4.18 0.57 3.95 -1.50 0.00 -1.26 -5.14 105.19 105.99 1ggk n GLY 491 Ca -0.24 -1.54 -0.24 0.00 0.00 0.00 0.00 46.02 44.00 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 5.86 -0.45 1.61 0.01 -1.26 -5.01 114.94 115.71 1ggk s ASN 492 Ca 0.00 0.37 -0.28 0.00 -0.71 0.00 0.00 52.86 52.24 1ggk s ASN 492 Cb 0.00 -1.62 -0.00 0.00 0.41 0.00 0.00 41.25 40.04 1ggk s ASN 492 CO 0.00 -0.70 1.61 -0.54 -1.51 0.00 0.00 177.10 175.96 1ggk s LYS 493 N -4.59 3.28 0.08 -0.60 1.02 -1.26 -4.96 119.74 112.70 1ggk s LYS 493 Ca 0.48 0.93 0.04 0.00 0.02 0.00 0.00 55.97 57.45 1ggk s LYS 493 Cb -0.10 -4.16 -0.03 0.00 -0.52 0.00 0.00 37.83 33.01 1ggk s LYS 493 CO 0.39 -1.94 -0.12 0.14 -0.92 0.00 0.00 175.35 172.90 1ggk s VAL 494 N 6.66 1.02 -0.73 3.17 -7.23 -1.26 -5.08 120.40 116.95 1ggk s VAL 494 Ca 0.66 -1.42 -0.07 0.00 -1.81 0.00 0.00 61.98 59.34 1ggk s VAL 494 Cb -0.16 -1.15 0.19 0.00 0.56 0.00 0.00 36.38 35.82 1ggk s VAL 494 CO 0.29 -0.36 0.60 -0.13 -0.31 0.00 0.00 175.10 175.19 1ggk s ARG 495 N -2.13 3.05 -0.10 4.82 0.52 -1.26 -5.02 118.95 118.83 1ggk s ARG 495 Ca 0.00 -2.56 -0.18 0.00 -0.52 0.00 0.00 55.73 52.48 1ggk s ARG 495 Cb -0.07 -4.04 0.04 0.00 0.52 0.00 0.00 34.95 31.40 1ggk s ARG 495 CO 0.01 -1.23 0.44 -2.00 0.02 0.00 0.00 175.30 172.54 1ggk s GLU 496 N -0.06 0.65 0.22 3.54 2.12 -1.26 -5.15 118.70 118.76 1ggk s GLU 496 Ca 0.18 0.29 -0.26 0.00 0.36 0.00 0.00 54.97 55.54 1ggk s GLU 496 Cb -0.15 0.31 -0.09 0.00 0.26 0.00 0.00 34.13 34.46 1ggk s GLU 496 CO -0.06 -0.14 0.85 0.50 -0.54 0.00 0.00 175.26 175.87 1ggk s ARG 497 N -0.51 4.63 0.29 4.30 6.06 -1.26 -5.03 118.95 127.44 1ggk s ARG 497 Ca -0.06 1.26 -0.29 0.00 -2.50 0.00 0.00 55.73 54.14 1ggk s ARG 497 Cb -0.03 -3.15 -0.10 0.00 0.06 0.00 0.00 34.95 31.72 1ggk s ARG 497 CO 0.03 0.49 1.22 0.45 -2.50 0.00 0.00 175.30 175.00 1ggk s SER 498 N -1.28 6.99 0.52 -2.12 0.15 -1.26 -4.91 113.70 111.78 1ggk s SER 498 Ca 0.40 2.47 0.24 0.00 0.70 0.00 0.00 55.95 59.77 1ggk s SER 498 Cb -0.23 -2.63 1.42 0.00 -1.71 0.00 0.00 66.02 62.87 1ggk s SER 498 CO 0.27 -0.38 2.10 -0.65 1.20 0.00 0.00 173.24 175.79 1ggk h PRO 499 N 3.87 0.00 0.00 5.44 0.11 -2.00 0.74 132.00 140.17 1ggk h PRO 499 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1ggk h PRO 499 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ggk h PRO 499 CO 0.68 0.10 -0.07 0.66 -0.21 0.00 0.00 178.00 179.16 1ggk h SER 500 N 0.00 0.00 0.75 -2.05 4.64 -2.03 -2.62 113.55 112.24 1ggk h SER 500 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ggk h SER 500 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1ggk h SER 500 CO 0.01 0.07 -0.29 0.49 -0.87 0.00 0.00 176.83 176.24 1ggk n PHE 501 N -3.48 0.05 -0.74 4.77 3.01 0.25 -4.43 117.46 116.90 1ggk n PHE 501 Ca -0.02 0.02 -0.07 0.00 1.01 0.00 0.00 57.45 58.39 1ggk n PHE 501 Cb 0.20 -0.39 -0.10 0.00 -0.01 0.00 0.00 39.48 39.18 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 2.61 2.84 1.37 0.00 -0.99 -4.81 105.19 107.69 1ggk n GLY 502 Ca 0.06 -0.71 -0.17 0.00 0.00 0.00 0.00 46.02 45.20 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 0.88 0.39 0.00 1.61 -6.30 -1.26 -5.07 118.70 108.95 1ggk s GLU 503 Ca 0.39 0.03 0.00 0.00 -2.50 0.00 0.00 54.97 52.90 1ggk s GLU 503 Cb 0.19 -0.53 0.00 0.00 0.00 0.00 0.00 34.13 33.79 1ggk s GLU 503 CO 0.00 -0.11 0.03 0.66 0.02 0.00 0.00 175.26 175.85 1ggk n TYR 504 N 4.06 0.00 0.22 5.30 4.01 -1.26 -4.87 117.16 124.62 1ggk n TYR 504 Ca -0.26 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.50 1ggk n TYR 504 Cb 0.51 0.00 -0.03 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 -0.93 0.00 -0.02 -0.72 4.01 -1.26 -4.62 117.16 113.61 1ggk n TYR 505 Ca 0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.58 1ggk n TYR 505 Cb 0.00 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 38.96 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 0.90 -0.33 7.72 4.64 -1.89 -2.84 113.55 121.75 1ggk h SER 506 Ca 0.00 -0.57 -0.02 0.00 -0.47 0.00 0.00 61.79 60.74 1ggk h SER 506 Cb 0.14 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 1ggk h SER 506 CO 0.00 1.36 0.15 0.45 -0.87 0.00 0.00 176.83 177.92 1ggk h HIS 507 N 0.54 0.48 -0.88 4.77 3.86 -1.91 -0.37 115.15 121.64 1ggk h HIS 507 Ca -0.04 -0.03 0.09 0.00 -1.16 0.00 0.00 60.37 59.23 1ggk h HIS 507 Cb 1.35 -0.15 -0.07 0.00 1.06 0.00 0.00 27.41 29.60 1ggk h HIS 507 CO 0.08 0.44 0.53 -1.35 0.86 0.00 0.00 177.93 178.49 1ggk h PRO 508 N 0.39 0.87 -0.55 2.45 0.11 -1.82 -0.93 132.00 132.52 1ggk h PRO 508 Ca 0.11 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.13 1ggk h PRO 508 Cb 0.15 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.04 1ggk h PRO 508 CO -0.01 0.58 0.17 -0.09 -0.21 0.00 0.00 178.00 178.44 1ggk h ARG 509 N 0.90 0.85 -0.82 1.05 2.43 -1.24 -1.51 114.38 116.04 1ggk h ARG 509 Ca 0.42 -0.18 0.04 0.00 -0.81 0.00 0.00 59.98 59.44 1ggk h ARG 509 Cb 0.34 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 29.71 1ggk h ARG 509 CO -0.23 0.77 0.52 1.25 -1.51 0.00 0.00 179.97 180.77 1ggk h LEU 510 N 0.76 0.84 -0.06 3.80 5.85 -0.22 -1.59 115.31 124.69 1ggk h LEU 510 Ca 0.18 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.91 1ggk h LEU 510 Cb 0.28 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1ggk h LEU 510 CO -0.01 0.57 0.01 0.15 -0.34 0.00 0.00 178.44 178.82 1ggk h PHE 511 N 0.99 0.01 -0.60 1.25 3.04 -0.63 -1.62 116.94 119.38 1ggk h PHE 511 Ca 0.33 0.00 -0.08 0.00 3.98 0.00 0.00 57.97 62.21 1ggk h PHE 511 Cb 0.05 0.01 -0.02 0.00 2.56 0.00 0.00 35.95 38.54 1ggk h PHE 511 CO -0.03 0.00 0.06 2.35 -2.02 0.00 0.00 178.31 178.68 1ggk h TRP 512 N 0.03 1.09 0.00 0.41 2.91 -1.06 -3.00 115.95 116.33 1ggk h TRP 512 Ca 0.03 -0.16 -0.05 0.00 1.13 0.00 0.00 58.89 59.83 1ggk h TRP 512 Cb 0.03 -0.29 -0.01 0.00 -0.51 0.00 0.00 29.16 28.38 1ggk h TRP 512 CO -0.11 0.95 -0.25 -0.07 -1.03 0.00 0.00 178.44 177.94 1ggk h LEU 513 N 0.92 0.00 -0.14 0.65 3.38 -1.17 -2.84 115.31 116.11 1ggk h LEU 513 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1ggk h LEU 513 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1ggk h LEU 513 CO 0.02 0.25 -0.03 -1.20 0.09 0.00 0.00 178.44 177.57 1ggk n SER 514 N -3.42 0.24 -4.94 -0.43 7.64 -0.62 -4.82 113.62 107.27 1ggk n SER 514 Ca 0.00 -0.72 -0.24 0.00 1.01 0.00 0.00 58.87 58.92 1ggk n SER 514 Cb 0.44 -0.09 -0.01 0.00 -1.01 0.00 0.00 64.21 63.53 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 -2.26 3.50 0.90 1.43 -1.52 -1.07 -4.27 119.66 116.35 1ggk s GLN 515 Ca 0.37 -0.30 -0.12 0.00 -1.95 0.00 0.00 55.36 53.36 1ggk s GLN 515 Cb 0.21 -2.66 0.13 0.00 -0.22 0.00 0.00 33.01 30.47 1ggk s GLN 515 CO 0.42 0.15 1.12 0.95 -0.25 0.00 0.00 175.29 177.67 1ggk s THR 516 N -2.30 2.34 0.25 -0.19 -4.23 -1.26 -4.79 115.64 105.45 1ggk s THR 516 Ca 0.40 0.11 -0.05 0.00 -1.18 0.00 0.00 61.69 60.98 1ggk s THR 516 Cb -0.10 -2.79 0.16 0.00 1.34 0.00 0.00 72.50 71.11 1ggk s THR 516 CO 0.36 -0.14 1.80 -0.65 -0.54 0.00 0.00 174.62 175.45 1ggk h PRO 517 N -1.47 1.03 0.00 3.99 0.11 -1.98 0.44 132.00 134.12 1ggk h PRO 517 Ca -0.50 -0.20 -0.14 0.00 0.11 0.00 0.00 66.00 65.27 1ggk h PRO 517 Cb 1.31 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 1ggk h PRO 517 CO 0.60 0.87 -0.69 0.27 -0.21 0.00 0.00 178.00 178.84 1ggk h PHE 518 N 1.00 0.00 -0.29 0.65 -0.00 -1.98 -2.11 116.94 114.22 1ggk h PHE 518 Ca 0.23 0.00 -0.15 0.00 -0.00 0.00 0.00 57.97 58.05 1ggk h PHE 518 Cb 0.25 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.19 1ggk h PHE 518 CO 0.02 0.69 -0.41 0.93 -0.00 0.00 0.00 178.31 179.53 1ggk h GLU 519 N 0.00 0.70 -0.59 6.09 5.08 -1.82 -1.97 114.58 122.08 1ggk h GLU 519 Ca -0.01 -0.37 -0.06 0.00 -1.00 0.00 0.00 59.36 57.92 1ggk h GLU 519 Cb 1.28 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 1ggk h GLU 519 CO 0.09 0.98 0.11 1.96 -1.00 0.00 0.00 179.01 181.15 1ggk h GLN 520 N 0.57 0.94 -0.49 2.33 4.20 -0.66 -2.48 115.11 119.51 1ggk h GLN 520 Ca 0.04 -0.22 0.02 0.00 0.06 0.00 0.00 58.65 58.55 1ggk h GLN 520 Cb 0.95 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.58 1ggk h GLN 520 CO 0.09 0.86 0.30 -0.09 -0.67 0.00 0.00 178.83 179.32 1ggk h ARG 521 N 0.89 0.59 -0.32 1.46 9.65 -1.08 -0.02 114.38 125.56 1ggk h ARG 521 Ca 0.18 -0.04 -0.08 0.00 -1.10 0.00 0.00 59.98 58.95 1ggk h ARG 521 Cb 0.37 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.80 1ggk h ARG 521 CO 0.01 0.39 -0.15 0.45 2.80 0.00 0.00 179.97 183.47 1ggk h HIS 522 N 0.61 0.61 0.60 2.20 3.86 -1.10 -1.93 115.15 120.01 1ggk h HIS 522 Ca 0.19 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 1ggk h HIS 522 Cb -0.01 -0.16 0.01 0.00 1.06 0.00 0.00 27.41 28.31 1ggk h HIS 522 CO -0.06 0.69 -0.29 0.82 0.86 0.00 0.00 177.93 179.95 1ggk h ILE 523 N 0.51 0.37 -0.77 2.45 2.04 -0.96 -0.28 117.51 120.87 1ggk h ILE 523 Ca 0.09 -0.16 0.15 0.00 1.00 0.00 0.00 64.86 65.94 1ggk h ILE 523 Cb 0.56 0.43 -0.15 0.00 -0.74 0.00 0.00 36.82 36.92 1ggk h ILE 523 CO 0.04 0.02 -0.23 0.58 0.00 0.00 0.00 178.15 178.56 1ggk h VAL 524 N -0.92 0.19 0.00 1.67 2.07 -0.77 0.21 116.25 118.71 1ggk h VAL 524 Ca -0.08 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 1ggk h VAL 524 Cb 0.66 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1ggk h VAL 524 CO 0.14 0.00 -0.25 0.44 0.02 0.00 0.00 177.57 177.91 1ggk h ASP 525 N -0.02 0.00 -0.12 0.57 3.45 -1.19 -1.26 116.42 117.85 1ggk h ASP 525 Ca 0.36 0.00 -0.05 0.00 0.43 0.00 0.00 57.03 57.77 1ggk h ASP 525 Cb 0.57 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.34 1ggk h ASP 525 CO -0.80 0.25 -0.11 1.23 -1.57 0.00 0.00 179.24 178.24 1ggk h GLY 526 N 1.17 0.30 1.01 2.75 0.00 0.12 0.21 103.07 108.63 1ggk h GLY 526 Ca -0.00 -0.30 0.01 0.00 0.00 0.00 0.00 47.33 47.03 1ggk h GLY 526 CO 0.03 0.27 0.49 0.74 0.00 0.00 0.00 176.54 178.08 1ggk h PHE 527 N -0.11 0.93 -0.35 5.60 0.04 -1.17 -2.41 116.94 119.47 1ggk h PHE 527 Ca 0.02 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.76 1ggk h PHE 527 Cb 0.62 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 38.44 1ggk h PHE 527 CO 0.08 0.58 0.01 0.77 -0.60 0.00 0.00 178.31 179.16 1ggk h SER 528 N 1.00 0.60 0.02 2.17 0.02 -1.08 -0.88 113.55 115.41 1ggk h SER 528 Ca 0.27 -0.30 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1ggk h SER 528 Cb -0.11 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.26 1ggk h SER 528 CO -0.06 0.75 -0.01 0.15 -1.14 0.00 0.00 176.83 176.52 1ggk h PHE 529 N 0.43 -0.03 -0.47 3.45 3.04 -0.78 -2.57 116.94 120.01 1ggk h PHE 529 Ca 0.10 -0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.06 1ggk h PHE 529 Cb 0.43 0.01 -0.02 0.00 2.56 0.00 0.00 35.95 38.93 1ggk h PHE 529 CO 0.03 0.15 0.31 0.93 -2.02 0.00 0.00 178.31 177.71 1ggk h GLU 530 N -0.19 0.61 0.00 1.11 4.39 -1.35 -2.33 114.58 116.82 1ggk h GLU 530 Ca -0.00 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 1ggk h GLU 530 Cb 0.18 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1ggk h GLU 530 CO 0.00 0.40 -0.05 -0.07 -1.16 0.00 0.00 179.01 178.14 1ggk h LEU 531 N 0.63 0.00 -1.86 1.33 -0.00 -1.21 -2.21 115.31 111.99 1ggk h LEU 531 Ca 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.04 1ggk h LEU 531 Cb -0.07 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.59 1ggk h LEU 531 CO -0.04 0.05 -0.08 0.28 -0.00 0.00 0.00 178.44 178.65 1ggk h SER 532 N 0.00 0.00 -0.09 -0.43 0.02 -0.99 -2.15 113.55 109.91 1ggk h SER 532 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ggk h SER 532 Cb 0.62 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1ggk h SER 532 CO 0.01 0.08 0.00 0.29 -1.14 0.00 0.00 176.83 176.06 1ggk n LYS 533 N -3.34 1.94 -2.91 3.45 4.76 -0.83 -4.86 118.16 116.37 1ggk n LYS 533 Ca -0.01 -1.38 -0.42 0.00 -2.87 0.00 0.00 58.31 53.64 1ggk n LYS 533 Cb 0.26 -1.46 -0.04 0.00 -1.84 0.00 0.00 35.03 31.94 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 -1.90 4.86 0.15 -0.18 1.01 -0.81 -4.59 120.40 118.94 1ggk s VAL 534 Ca 0.34 1.54 -0.05 0.00 0.00 0.00 0.00 61.98 63.81 1ggk s VAL 534 Cb 0.20 -4.10 -0.12 0.00 0.00 0.00 0.00 36.38 32.36 1ggk s VAL 534 CO 0.31 -0.03 1.40 0.58 0.00 0.00 0.00 175.10 177.35 1ggk h VAL 535 N 5.36 1.34 -3.30 2.92 2.07 -1.89 -3.41 116.25 119.34 1ggk h VAL 535 Ca -0.25 -2.04 -0.62 0.00 0.82 0.00 0.00 66.70 64.61 1ggk h VAL 535 Cb 1.11 2.02 -0.13 0.00 -1.52 0.00 0.00 31.29 32.77 1ggk h VAL 535 CO 0.85 0.63 0.50 -0.13 0.02 0.00 0.00 177.57 179.44 1ggk s ARG 536 N -3.71 3.34 0.39 1.57 0.52 -1.26 -4.93 118.95 114.88 1ggk s ARG 536 Ca -0.07 -0.26 0.15 0.00 -0.52 0.00 0.00 55.73 55.03 1ggk s ARG 536 Cb 0.10 -4.03 1.00 0.00 0.52 0.00 0.00 34.95 32.54 1ggk s ARG 536 CO 0.86 -1.40 1.84 -1.35 0.02 0.00 0.00 175.30 175.27 1ggk h PRO 537 N 9.23 0.48 0.00 3.54 0.11 -1.99 -0.33 132.00 143.04 1ggk h PRO 537 Ca -0.26 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 1ggk h PRO 537 Cb 1.08 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 1ggk h PRO 537 CO 1.06 0.32 -0.05 0.10 -0.21 0.00 0.00 178.00 179.22 1ggk h TYR 538 N 0.50 0.00 -0.21 0.65 -0.00 -1.97 -2.06 116.97 113.87 1ggk h TYR 538 Ca 0.49 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 59.13 1ggk h TYR 538 Cb 1.10 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.83 1ggk h TYR 538 CO -0.00 0.05 -0.24 0.82 -0.00 0.00 0.00 178.16 178.79 1ggk h ILE 539 N 0.00 1.33 -0.85 -0.90 2.04 -1.46 -0.61 117.51 117.06 1ggk h ILE 539 Ca -0.00 -1.41 0.13 0.00 1.00 0.00 0.00 64.86 64.58 1ggk h ILE 539 Cb 0.11 1.76 -0.09 0.00 -0.74 0.00 0.00 36.82 37.86 1ggk h ILE 539 CO 0.01 0.43 0.46 0.03 0.00 0.00 0.00 178.15 179.08 1ggk h ARG 540 N 0.21 0.67 -0.27 2.37 3.08 -1.43 -2.06 114.38 116.95 1ggk h ARG 540 Ca 0.03 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 1ggk h ARG 540 Cb 0.79 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 1ggk h ARG 540 CO 0.06 0.45 -0.25 0.93 -1.07 0.00 0.00 179.97 180.09 1ggk h GLU 541 N 0.69 0.65 0.00 0.04 5.08 -1.41 -2.45 114.58 117.19 1ggk h GLU 541 Ca 0.45 -0.33 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1ggk h GLU 541 Cb 0.57 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 1ggk h GLU 541 CO -0.32 0.93 -0.14 0.00 -1.00 0.00 0.00 179.01 178.49 1ggk h ARG 542 N 0.38 0.00 -0.09 2.33 3.08 -0.66 -1.81 114.38 117.61 1ggk h ARG 542 Ca 0.05 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.02 1ggk h ARG 542 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1ggk h ARG 542 CO 0.06 0.14 -0.25 0.28 -1.07 0.00 0.00 179.97 179.13 1ggk h VAL 543 N 0.00 1.41 -0.57 2.04 2.07 -1.32 -3.09 116.25 116.80 1ggk h VAL 543 Ca -0.00 -1.60 0.02 0.00 0.82 0.00 0.00 66.70 65.94 1ggk h VAL 543 Cb 0.25 2.21 -0.03 0.00 -1.52 0.00 0.00 31.29 32.20 1ggk h VAL 543 CO 0.02 0.46 0.37 0.58 0.02 0.00 0.00 177.57 179.02 1ggk h VAL 544 N -0.14 1.10 -0.81 2.57 2.07 -1.13 0.84 116.25 120.75 1ggk h VAL 544 Ca -0.01 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1ggk h VAL 544 Cb 0.87 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 1ggk h VAL 544 CO 0.05 0.13 0.41 -0.78 0.02 0.00 0.00 177.57 177.40 1ggk h ASP 545 N 0.70 1.04 -0.44 0.57 1.82 -1.33 -2.57 116.42 116.22 1ggk h ASP 545 Ca 0.22 -0.11 -0.08 0.00 -0.39 0.00 0.00 57.03 56.67 1ggk h ASP 545 Cb 0.01 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 39.74 1ggk h ASP 545 CO -0.05 0.86 -0.02 1.56 -1.61 0.00 0.00 179.24 179.98 1ggk h GLN 546 N 1.15 0.79 -0.88 0.28 1.08 -0.80 -2.95 115.11 113.78 1ggk h GLN 546 Ca 0.28 -0.26 0.09 0.00 -1.45 0.00 0.00 58.65 57.31 1ggk h GLN 546 Cb 0.08 -0.07 -0.06 0.00 -0.05 0.00 0.00 27.48 27.39 1ggk h GLN 546 CO -0.04 0.86 0.57 -0.07 -0.95 0.00 0.00 178.83 179.20 1ggk h LEU 547 N 0.62 0.81 -2.20 1.46 3.38 -0.89 -1.02 115.31 117.48 1ggk h LEU 547 Ca 0.12 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1ggk h LEU 547 Cb 0.52 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1ggk h LEU 547 CO 0.03 0.49 0.00 0.00 0.09 0.00 0.00 178.44 179.04 1ggk h ALA 548 N 1.55 1.00 -0.00 1.53 0.00 -1.28 0.19 119.26 122.25 1ggk h ALA 548 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1ggk h ALA 548 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1ggk h ALA 548 CO -0.16 0.00 -0.05 0.72 0.00 0.00 0.00 179.25 179.76 1ggk n HIS 549 N -3.01 0.00 -0.12 0.00 8.25 -0.39 -3.90 115.22 116.05 1ggk n HIS 549 Ca -0.01 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.22 1ggk n HIS 549 Cb 0.17 -0.46 -0.09 0.00 1.12 0.00 0.00 29.99 30.74 1ggk n HIS 549 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1ggk n ILE 550 N -1.48 1.52 -3.44 1.59 5.41 0.00 -4.27 119.36 118.69 1ggk n ILE 550 Ca 0.07 -0.18 0.01 0.00 1.00 0.00 0.00 62.75 63.66 1ggk n ILE 550 Cb 0.33 -2.03 -0.05 0.00 -0.71 0.00 0.00 39.64 37.18 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 -6.97 -0.37 0.42 4.38 -1.08 -0.89 -4.65 116.67 107.51 1ggk s ASP 551 Ca -0.33 0.54 0.10 0.00 -0.52 0.00 0.00 52.55 52.33 1ggk s ASP 551 Cb 0.10 1.33 0.91 0.00 -1.46 0.00 0.00 42.92 43.80 1ggk s ASP 551 CO 0.48 -0.08 2.01 0.25 0.52 0.00 0.00 175.17 178.35 1ggk h LEU 552 N 6.72 0.26 -0.22 -1.34 7.12 -1.82 -2.47 115.31 123.56 1ggk h LEU 552 Ca -0.19 -0.03 -0.01 0.00 0.13 0.00 0.00 57.88 57.78 1ggk h LEU 552 Cb 1.14 -0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 41.19 1ggk h LEU 552 CO 0.13 0.29 0.12 0.74 -0.13 0.00 0.00 178.44 179.58 1ggk h THR 553 N 0.28 1.13 -0.34 1.05 2.02 -1.97 -1.48 112.91 113.61 1ggk h THR 553 Ca 0.07 -0.35 0.03 0.00 0.77 0.00 0.00 66.41 66.92 1ggk h THR 553 Cb 0.16 0.95 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1ggk h THR 553 CO 0.00 0.12 0.16 0.25 0.37 0.00 0.00 175.52 176.42 1ggk h LEU 554 N 0.24 0.23 0.40 2.58 5.85 -1.88 -1.98 115.31 120.75 1ggk h LEU 554 Ca 0.08 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1ggk h LEU 554 Cb 0.09 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 1ggk h LEU 554 CO -0.01 0.17 -0.24 0.00 -0.34 0.00 0.00 178.44 178.02 1ggk h ALA 555 N 1.18 -0.60 -0.88 1.25 0.00 -1.26 -2.02 119.26 116.93 1ggk h ALA 555 Ca 0.14 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1ggk h ALA 555 Cb 0.07 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1ggk h ALA 555 CO -0.11 -0.85 0.57 1.96 0.00 0.00 0.00 179.25 180.83 1ggk h GLN 556 N -0.60 1.07 -0.34 0.00 4.20 -1.24 0.39 115.11 118.59 1ggk h GLN 556 Ca -0.05 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 1ggk h GLN 556 Cb 0.49 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1ggk h GLN 556 CO 0.05 0.71 0.07 0.00 -0.67 0.00 0.00 178.83 178.99 1ggk h ALA 557 N 1.37 1.49 0.09 3.87 0.00 -1.20 -0.95 119.26 123.93 1ggk h ALA 557 Ca 0.36 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 1ggk h ALA 557 Cb 0.02 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 17.68 1ggk h ALA 557 CO -0.12 0.38 -0.62 0.28 0.00 0.00 0.00 179.25 179.16 1ggk h VAL 558 N 0.49 1.54 -0.17 0.00 2.07 -1.02 -3.25 116.25 115.91 1ggk h VAL 558 Ca 0.12 -2.38 -0.01 0.00 0.82 0.00 0.00 66.70 65.24 1ggk h VAL 558 Cb 0.21 3.09 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 1ggk h VAL 558 CO -0.00 0.67 0.05 0.00 0.02 0.00 0.00 177.57 178.30 1ggk h ALA 559 N 0.13 1.77 -0.12 1.67 0.00 -0.82 -1.96 119.26 119.92 1ggk h ALA 559 Ca -0.10 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 1ggk h ALA 559 Cb 1.45 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1ggk h ALA 559 CO 0.12 0.18 -0.61 -0.22 0.00 0.00 0.00 179.25 178.72 1ggk h LYS 560 N 0.23 0.43 0.00 0.00 3.64 -1.27 0.17 116.57 119.77 1ggk h LYS 560 Ca 0.06 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 1ggk h LYS 560 Cb 0.09 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1ggk h LYS 560 CO -0.00 0.91 0.00 -0.91 -2.27 0.00 0.00 179.45 177.18 1ggk h ASN 561 N 0.32 0.00 -0.01 4.20 2.35 -1.39 -2.44 115.58 118.61 1ggk h ASN 561 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1ggk h ASN 561 Cb 1.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.52 1ggk h ASN 561 CO 0.11 0.00 -0.47 0.18 -1.65 0.00 0.00 177.43 175.60 1ggk n LEU 562 N -3.08 1.79 -2.13 1.61 4.77 -1.10 -5.00 117.00 113.86 1ggk n LEU 562 Ca 0.01 -0.74 -0.13 0.00 -0.03 0.00 0.00 56.01 55.12 1ggk n LEU 562 Cb 0.32 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.45 1ggk n LEU 562 CO 0.27 0.34 0.11 0.61 -1.33 0.00 0.00 177.39 177.39 1ggk n GLY 563 N 1.33 0.10 3.55 -0.72 0.00 -0.31 -5.03 105.19 104.11 1ggk n GLY 563 Ca 0.08 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.11 3.21 -0.13 -0.61 1.01 0.43 -5.03 121.20 116.96 1ggk s ILE 564 Ca 0.29 -1.31 0.02 0.00 0.00 0.00 0.00 60.65 59.66 1ggk s ILE 564 Cb -0.13 -2.48 0.01 0.00 0.01 0.00 0.00 42.46 39.86 1ggk s ILE 564 CO 0.36 0.13 -0.21 -0.70 0.00 0.00 0.00 174.94 174.52 1ggk s GLU 565 N -2.13 3.06 0.73 2.79 2.12 -1.26 -4.24 118.70 119.77 1ggk s GLU 565 Ca 0.20 -0.84 -0.13 0.00 0.36 0.00 0.00 54.97 54.55 1ggk s GLU 565 Cb -0.11 -2.44 0.04 0.00 0.26 0.00 0.00 34.13 31.89 1ggk s GLU 565 CO 0.12 0.04 1.13 -0.51 -0.54 0.00 0.00 175.26 175.50 1ggk s LEU 566 N 0.70 3.22 0.00 2.70 1.43 -1.26 -5.05 118.68 120.42 1ggk s LEU 566 Ca -0.09 2.05 -0.10 0.00 -1.03 0.00 0.00 54.13 54.95 1ggk s LEU 566 Cb -0.16 -4.55 0.14 0.00 0.03 0.00 0.00 46.19 41.65 1ggk s LEU 566 CO 0.01 -2.04 0.79 0.35 0.23 0.00 0.00 176.35 175.70 1ggk n THR 567 N -2.98 0.00 0.11 5.49 -2.24 -1.26 -4.94 114.28 108.46 1ggk n THR 567 Ca 0.11 -0.56 0.09 0.00 -2.27 0.00 0.00 64.05 61.41 1ggk n THR 567 Cb 0.52 -1.64 0.01 0.00 -2.10 0.00 0.00 70.33 67.12 1ggk n THR 567 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1ggk h ASP 568 N -1.17 0.00 -0.01 3.42 3.32 -2.00 -3.15 116.42 116.83 1ggk h ASP 568 Ca -0.26 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.64 1ggk h ASP 568 Cb 0.72 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 1ggk h ASP 568 CO 0.18 0.15 -0.48 0.44 -1.72 0.00 0.00 179.24 177.82 1ggk h ASP 569 N 0.00 0.61 -0.94 6.45 3.45 -1.99 -3.02 116.42 120.98 1ggk h ASP 569 Ca -0.03 -0.30 0.03 0.00 0.43 0.00 0.00 57.03 57.16 1ggk h ASP 569 Cb 1.15 -0.17 -0.05 0.00 -0.56 0.00 0.00 39.33 39.69 1ggk h ASP 569 CO 0.01 0.99 0.62 1.56 -1.57 0.00 0.00 179.24 180.85 1ggk h GLN 570 N 0.45 1.16 0.00 3.56 4.20 -1.91 -1.44 115.11 121.12 1ggk h GLN 570 Ca 0.02 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1ggk h GLN 570 Cb 1.00 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.52 1ggk h GLN 570 CO 0.09 0.77 0.00 1.28 -0.67 0.00 0.00 178.83 180.30 1ggk n LEU 571 N -4.44 0.58 -1.22 1.46 7.99 -1.15 -3.04 117.00 117.19 1ggk n LEU 571 Ca 0.12 0.61 0.12 0.00 -0.01 0.00 0.00 56.01 56.85 1ggk n LEU 571 Cb 0.09 -0.50 0.27 0.00 -0.11 0.00 0.00 43.42 43.18 1ggk n LEU 571 CO 0.35 -0.39 0.74 0.59 -1.51 0.00 0.00 177.39 177.17 1ggk n ASN 572 N -2.11 3.59 -4.68 -1.43 5.03 -0.55 -4.96 115.26 110.15 1ggk n ASN 572 Ca 0.03 -1.99 -0.42 0.00 0.87 0.00 0.00 54.58 53.07 1ggk n ASN 572 Cb 0.28 -0.35 -0.03 0.00 -1.02 0.00 0.00 39.78 38.66 1ggk n ASN 572 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1ggk s ILE 573 N -1.29 3.33 -0.05 2.41 1.01 -1.17 -4.93 121.20 120.51 1ggk s ILE 573 Ca 0.43 0.68 -0.30 0.00 0.00 0.00 0.00 60.65 61.46 1ggk s ILE 573 Cb 0.24 -3.43 -0.05 0.00 0.01 0.00 0.00 42.46 39.22 1ggk s ILE 573 CO 0.32 -0.02 1.54 -0.89 0.00 0.00 0.00 174.94 175.90 1ggk s THR 574 N 2.97 3.68 0.75 2.92 2.01 -1.26 -4.97 115.64 121.74 1ggk s THR 574 Ca 0.72 0.90 -0.15 0.00 0.31 0.00 0.00 61.69 63.46 1ggk s THR 574 Cb -0.36 -3.58 0.03 0.00 0.01 0.00 0.00 72.50 68.60 1ggk s THR 574 CO 0.30 -0.06 1.05 -0.81 -0.69 0.00 0.00 174.62 174.42 1ggk n PRO 575 N 6.61 0.44 -1.35 4.92 -0.04 -1.26 -4.97 135.00 139.35 1ggk n PRO 575 Ca 0.16 0.21 -0.30 0.00 -0.04 0.00 0.00 63.50 63.53 1ggk n PRO 575 Cb 0.43 -2.31 0.10 0.00 -0.04 0.00 0.00 33.50 31.69 1ggk n PRO 575 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1ggk s PRO 576 N -3.59 1.97 0.83 0.54 0.04 -1.26 -5.03 135.00 128.50 1ggk s PRO 576 Ca 0.74 0.91 -0.11 0.00 0.04 0.00 0.00 61.00 62.57 1ggk s PRO 576 Cb -0.33 -1.88 0.09 0.00 0.04 0.00 0.00 34.50 32.42 1ggk s PRO 576 CO 0.50 -1.77 1.09 -1.25 0.04 0.00 0.00 177.00 175.61 1ggk s PRO 577 N -4.99 1.79 0.93 0.56 0.04 -1.26 -4.98 135.00 127.10 1ggk s PRO 577 Ca 0.61 0.94 -0.12 0.00 0.04 0.00 0.00 61.00 62.47 1ggk s PRO 577 Cb -0.16 -1.86 0.15 0.00 0.04 0.00 0.00 34.50 32.66 1ggk s PRO 577 CO 0.56 -1.90 1.11 0.16 0.04 0.00 0.00 177.00 176.96 1ggk s ASP 578 N -3.48 3.24 -0.45 6.66 1.47 -1.26 -4.71 116.67 118.14 1ggk s ASP 578 Ca 0.62 1.19 -0.16 0.00 1.18 0.00 0.00 52.55 55.38 1ggk s ASP 578 Cb -0.17 -1.84 0.05 0.00 -0.34 0.00 0.00 42.92 40.61 1ggk s ASP 578 CO 0.56 -2.75 0.39 -0.69 0.68 0.00 0.00 175.17 173.37 1ggk s VAL 579 N -3.07 5.19 -1.52 2.11 1.01 -1.22 -4.50 120.40 118.39 1ggk s VAL 579 Ca 0.64 -0.76 -0.15 0.00 0.00 0.00 0.00 61.98 61.72 1ggk s VAL 579 Cb -0.17 -4.06 0.12 0.00 0.00 0.00 0.00 36.38 32.27 1ggk s VAL 579 CO 0.56 -0.48 0.73 0.59 0.00 0.00 0.00 175.10 176.49 1ggk n ASN 580 N 5.35 -3.75 0.00 3.32 4.13 -1.26 -1.41 115.26 121.63 1ggk n ASN 580 Ca -0.11 -0.75 0.00 0.00 1.68 0.00 0.00 54.58 55.41 1ggk n ASN 580 Cb 0.46 -3.06 0.00 0.00 -1.54 0.00 0.00 39.78 35.63 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 -1.37 1.33 3.82 7.41 0.00 -1.26 -5.07 105.19 110.05 1ggk n GLY 581 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 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 4.19 -0.00 0.99 1.43 -0.50 -4.96 118.68 119.82 1ggk s LEU 582 Ca 0.00 1.52 0.10 0.00 -1.03 0.00 0.00 54.13 54.72 1ggk s LEU 582 Cb 0.00 -3.98 -0.12 0.00 0.03 0.00 0.00 46.19 42.11 1ggk s LEU 582 CO 0.00 -0.12 0.36 0.29 0.23 0.00 0.00 176.35 177.11 1ggk n LYS 583 N 0.15 2.65 -3.54 1.70 5.02 -1.26 -3.39 118.16 119.48 1ggk n LYS 583 Ca 0.02 -0.03 -0.09 0.00 -2.02 0.00 0.00 58.31 56.19 1ggk n LYS 583 Cb 0.52 -1.06 -0.02 0.00 -0.02 0.00 0.00 35.03 34.45 1ggk n LYS 583 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1ggk s LYS 584 N -2.18 1.19 -0.28 1.97 -2.85 -1.26 -4.59 119.74 111.73 1ggk s LYS 584 Ca 0.01 -0.50 0.01 0.00 -1.00 0.00 0.00 55.97 54.49 1ggk s LYS 584 Cb 0.07 0.51 0.15 0.00 -2.06 0.00 0.00 37.83 36.50 1ggk s LYS 584 CO 0.41 -0.53 0.36 0.34 0.10 0.00 0.00 175.35 176.03 1ggk s ASP 585 N -2.71 0.88 0.00 0.03 3.68 -1.26 -4.99 116.67 112.30 1ggk s ASP 585 Ca 0.05 -0.46 0.09 0.00 2.13 0.00 0.00 52.55 54.35 1ggk s ASP 585 Cb -0.02 0.87 0.37 0.00 -1.45 0.00 0.00 42.92 42.69 1ggk s ASP 585 CO -0.08 -0.36 1.28 -0.81 0.13 0.00 0.00 175.17 175.33 1ggk n PRO 586 N 5.34 0.00 0.06 4.34 -0.04 -1.26 -1.73 135.00 141.70 1ggk n PRO 586 Ca -0.01 0.35 0.08 0.00 -0.04 0.00 0.00 63.50 63.88 1ggk n PRO 586 Cb 0.48 -1.50 0.36 0.00 -0.04 0.00 0.00 33.50 32.80 1ggk n PRO 586 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1ggk n SER 587 N -1.50 0.27 0.09 3.54 3.41 -1.26 -2.32 113.62 115.85 1ggk n SER 587 Ca 0.02 0.58 0.12 0.00 -0.26 0.00 0.00 58.87 59.33 1ggk n SER 587 Cb 0.10 -0.63 0.28 0.00 -0.26 0.00 0.00 64.21 63.70 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 0.00-10.21 1.04 3.38 -1.66 -3.47 115.31 104.39 1ggk h LEU 588 Ca 0.00 -0.09 -0.50 0.00 0.09 0.00 0.00 57.88 57.38 1ggk h LEU 588 Cb 0.24 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.01 1ggk h LEU 588 CO 0.00 0.04 0.09 -0.55 0.09 0.00 0.00 178.44 178.11 1ggk s SER 589 N -4.53 6.40 0.04 -0.43 0.15 -0.98 -4.95 113.70 109.41 1ggk s SER 589 Ca 0.08 1.00 -0.07 0.00 0.70 0.00 0.00 55.95 57.67 1ggk s SER 589 Cb 0.12 -2.27 -0.30 0.00 -1.71 0.00 0.00 66.02 61.86 1ggk s SER 589 CO 0.66 -0.46 1.00 -0.07 1.20 0.00 0.00 173.24 175.57 1ggk h LEU 590 N 0.86 0.51 -1.83 3.45 3.38 -1.90 -3.42 115.31 116.36 1ggk h LEU 590 Ca -0.47 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 56.90 1ggk h LEU 590 Cb 1.19 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1ggk h LEU 590 CO 0.63 1.48 0.00 -1.22 0.09 0.00 0.00 178.44 179.42 1ggk n TYR 591 N -3.55 0.00 0.36 1.13 4.01 -1.26 -4.80 117.16 113.05 1ggk n TYR 591 Ca -0.13 -0.22 -0.17 0.00 -0.16 0.00 0.00 57.90 57.21 1ggk n TYR 591 Cb 1.05 -0.02 -0.09 0.00 -0.31 0.00 0.00 39.34 39.97 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 -0.90 -2.34 -0.72 0.00 -1.86 -3.33 119.26 110.11 1ggk h ALA 592 Ca 0.00 -0.21 -0.74 0.00 0.00 0.00 0.00 54.91 53.96 1ggk h ALA 592 Cb 0.30 0.35 -0.23 0.00 0.00 0.00 0.00 17.79 18.21 1ggk h ALA 592 CO 0.00 -0.96 -0.34 0.42 0.00 0.00 0.00 179.25 178.37 1ggk s ILE 593 N -5.61 5.19 0.49 0.00 1.09 -1.26 -5.07 121.20 116.03 1ggk s ILE 593 Ca -0.17 -1.06 -0.21 0.00 -1.10 0.00 0.00 60.65 58.11 1ggk s ILE 593 Cb 0.03 -4.09 -0.07 0.00 -1.06 0.00 0.00 42.46 37.27 1ggk s ILE 593 CO 0.57 -0.56 1.14 -2.16 -0.10 0.00 0.00 174.94 173.83 1ggk s PRO 594 N 1.63 3.60 0.00 2.79 0.04 -1.25 -4.96 135.00 136.85 1ggk s PRO 594 Ca 0.04 1.67 0.00 0.00 0.04 0.00 0.00 61.00 62.75 1ggk s PRO 594 Cb -0.24 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.08 1ggk s PRO 594 CO 0.07 -0.65 0.61 -0.40 0.04 0.00 0.00 177.00 176.67 1ggk n ASP 595 N -0.85 0.00 -4.76 6.66 3.85 -1.26 -5.11 116.55 115.08 1ggk n ASP 595 Ca 0.09 -1.38 -0.41 0.00 -0.71 0.00 0.00 54.79 52.38 1ggk n ASP 595 Cb 0.50 -0.08 -0.00 0.00 -1.35 0.00 0.00 41.12 40.19 1ggk n ASP 595 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ggk n GLY 596 N 0.00 1.12 3.23 6.12 0.00 -1.26 -4.21 105.19 110.19 1ggk n GLY 596 Ca 0.00 0.32 -0.28 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.11 2.58 0.17 1.61 3.68 -1.23 -4.91 116.67 118.46 1ggk s ASP 597 Ca 0.54 -0.41 0.24 0.00 2.13 0.00 0.00 52.55 55.06 1ggk s ASP 597 Cb -0.49 -0.40 0.35 0.00 -1.45 0.00 0.00 42.92 40.93 1ggk s ASP 597 CO 0.63 0.25 1.36 -0.37 0.13 0.00 0.00 175.17 177.17 1ggk h VAL 598 N 4.74 0.00 -2.00 1.11 -1.51 -1.89 -3.46 116.25 113.23 1ggk h VAL 598 Ca -0.38 -0.62 -0.63 0.00 -1.23 0.00 0.00 66.70 63.84 1ggk h VAL 598 Cb 1.14 1.28 0.03 0.00 -2.13 0.00 0.00 31.29 31.62 1ggk h VAL 598 CO 0.48 0.00 0.99 1.17 -1.23 0.00 0.00 177.57 178.98 1ggk n LYS 599 N -2.32 2.01 0.00 5.19 3.00 -1.26 -1.35 118.16 123.43 1ggk n LYS 599 Ca 0.03 0.73 0.00 0.00 -0.00 0.00 0.00 58.31 59.07 1ggk n LYS 599 Cb 0.47 -2.54 0.00 0.00 0.00 0.00 0.00 35.03 32.96 1ggk n LYS 599 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1ggk n GLY 600 N 4.11 1.88 3.70 3.14 0.00 -0.70 -5.01 105.19 112.31 1ggk n GLY 600 Ca 0.22 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.99 0.90 0.09 1.61 1.81 -0.46 -4.81 118.95 117.11 1ggk s ARG 601 Ca 0.00 0.73 0.07 0.00 -1.72 0.00 0.00 55.73 54.81 1ggk s ARG 601 Cb 0.00 -1.77 -0.03 0.00 -0.45 0.00 0.00 34.95 32.69 1ggk s ARG 601 CO 0.00 -2.46 -0.18 0.08 -0.68 0.00 0.00 175.30 172.06 1ggk s VAL 602 N -2.92 1.46 -0.02 3.52 1.01 -1.26 -2.18 120.40 120.01 1ggk s VAL 602 Ca 0.64 -1.45 0.05 0.00 0.00 0.00 0.00 61.98 61.22 1ggk s VAL 602 Cb -0.18 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 1ggk s VAL 602 CO 0.57 -0.13 -0.17 -0.69 0.00 0.00 0.00 175.10 174.68 1ggk s VAL 603 N -1.22 1.36 0.01 2.92 1.01 0.85 -1.03 120.40 124.30 1ggk s VAL 603 Ca 0.03 -0.72 -0.19 0.00 0.00 0.00 0.00 61.98 61.10 1ggk s VAL 603 Cb -0.10 -1.15 -0.06 0.00 0.00 0.00 0.00 36.38 35.08 1ggk s VAL 603 CO 0.03 0.39 0.54 0.00 0.00 0.00 0.00 175.10 176.06 1ggk s ALA 604 N -0.25 3.56 -0.25 5.51 0.00 -0.23 -1.58 121.76 128.52 1ggk s ALA 604 Ca 0.03 -0.04 0.02 0.00 0.00 0.00 0.00 51.96 51.97 1ggk s ALA 604 Cb -0.08 -2.63 0.05 0.00 0.00 0.00 0.00 23.12 20.45 1ggk s ALA 604 CO 0.00 0.28 -0.11 0.42 0.00 0.00 0.00 175.76 176.35 1ggk s ILE 605 N -0.56 2.28 -0.63 0.00 1.01 -0.26 -1.07 121.20 121.96 1ggk s ILE 605 Ca 0.28 -1.44 -0.26 0.00 0.00 0.00 0.00 60.65 59.24 1ggk s ILE 605 Cb -0.18 -2.26 0.04 0.00 0.01 0.00 0.00 42.46 40.08 1ggk s ILE 605 CO 0.16 0.09 1.09 -0.76 0.00 0.00 0.00 174.94 175.52 1ggk s LEU 606 N 1.17 3.76 0.90 2.97 1.02 -0.18 -1.93 118.68 126.38 1ggk s LEU 606 Ca -0.05 -0.40 -0.12 0.00 0.02 0.00 0.00 54.13 53.57 1ggk s LEU 606 Cb -0.18 -2.76 0.13 0.00 0.02 0.00 0.00 46.19 43.40 1ggk s LEU 606 CO -0.06 -1.49 1.15 -0.76 0.02 0.00 0.00 176.35 175.21 1ggk s LEU 607 N 4.67 2.08 0.22 1.79 1.43 -0.53 -4.33 118.68 124.01 1ggk s LEU 607 Ca 0.33 0.91 -0.03 0.00 -1.03 0.00 0.00 54.13 54.31 1ggk s LEU 607 Cb -0.11 -3.24 -0.03 0.00 0.03 0.00 0.00 46.19 42.84 1ggk s LEU 607 CO 0.18 -2.49 0.22 0.54 0.23 0.00 0.00 176.35 175.03 1ggk s ASN 608 N -4.14 0.22 0.00 2.29 2.20 -1.26 -4.81 114.94 109.44 1ggk s ASN 608 Ca 0.64 -1.32 0.20 0.00 -0.94 0.00 0.00 52.86 51.43 1ggk s ASN 608 Cb -0.14 0.44 1.09 0.00 -2.00 0.00 0.00 41.25 40.64 1ggk s ASN 608 CO 0.53 -0.93 1.58 -0.90 -2.94 0.00 0.00 177.10 174.44 1ggk n ASP 609 N -0.41 0.00 -2.98 3.54 3.85 -1.26 -3.78 116.55 115.51 1ggk n ASP 609 Ca 0.02 -0.34 -0.15 0.00 -0.71 0.00 0.00 54.79 53.61 1ggk n ASP 609 Cb 0.65 -0.13 0.01 0.00 -1.35 0.00 0.00 41.12 40.30 1ggk n ASP 609 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.20 177.40 1ggk n GLU 610 N -1.13 0.92 -1.99 0.11 4.07 -1.26 -4.46 120.64 116.91 1ggk n GLU 610 Ca 0.12 -2.65 -0.40 0.00 -0.06 0.00 0.00 57.16 54.17 1ggk n GLU 610 Cb 0.11 -1.37 -0.01 0.00 -0.06 0.00 0.00 31.44 30.10 1ggk n GLU 610 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1ggk s VAL 611 N -0.92 2.45 -0.59 6.31 1.01 -1.25 -2.74 120.40 124.67 1ggk s VAL 611 Ca 0.32 0.43 -0.28 0.00 0.00 0.00 0.00 61.98 62.46 1ggk s VAL 611 Cb 0.29 -3.27 0.02 0.00 0.00 0.00 0.00 36.38 33.42 1ggk s VAL 611 CO -0.10 0.09 1.32 -0.60 0.00 0.00 0.00 175.10 175.82 1ggk s ARG 612 N -2.07 3.35 0.41 2.72 6.06 -1.10 -1.30 118.95 127.02 1ggk s ARG 612 Ca 0.53 0.29 0.23 0.00 -2.50 0.00 0.00 55.73 54.29 1ggk s ARG 612 Cb -0.41 -4.10 1.25 0.00 0.06 0.00 0.00 34.95 31.75 1ggk s ARG 612 CO 0.55 -1.89 1.69 0.77 -2.50 0.00 0.00 175.30 173.92 1ggk h SER 613 N 10.44 0.36 1.67 -2.12 0.02 -1.92 0.23 113.55 122.23 1ggk h SER 613 Ca -0.26 0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.81 1ggk h SER 613 Cb 1.07 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.70 1ggk h SER 613 CO 1.19 -0.07 -0.02 0.00 -1.14 0.00 0.00 176.83 176.80 1ggk h ALA 614 N 1.64 0.99 -0.03 3.77 0.00 -2.00 -2.73 119.26 120.90 1ggk h ALA 614 Ca 0.72 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.58 1ggk h ALA 614 Cb 2.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.81 1ggk h ALA 614 CO -0.39 0.02 -0.12 -0.44 0.00 0.00 0.00 179.25 178.32 1ggk h ASP 615 N 0.00 0.16 0.40 0.00 3.45 -0.86 -3.14 116.42 116.44 1ggk h ASP 615 Ca -0.00 -0.63 -0.01 0.00 0.43 0.00 0.00 57.03 56.82 1ggk h ASP 615 Cb 0.86 -0.05 -0.03 0.00 -0.56 0.00 0.00 39.33 39.55 1ggk h ASP 615 CO 0.00 0.76 -0.49 -0.07 -1.57 0.00 0.00 179.24 177.88 1ggk h LEU 616 N -0.43 -1.37 -0.70 1.55 3.38 -1.49 -1.06 115.31 115.19 1ggk h LEU 616 Ca -0.01 0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.15 1ggk h LEU 616 Cb 0.75 0.46 -0.06 0.00 0.09 0.00 0.00 40.66 41.91 1ggk h LEU 616 CO 0.02 -0.61 0.39 -0.07 0.09 0.00 0.00 178.44 178.26 1ggk h LEU 617 N -0.91 0.58 -0.29 1.67 4.07 -1.65 0.22 115.31 119.00 1ggk h LEU 617 Ca -0.05 0.03 0.04 0.00 0.08 0.00 0.00 57.88 57.98 1ggk h LEU 617 Cb 0.81 -0.08 -0.04 0.00 1.08 0.00 0.00 40.66 42.43 1ggk h LEU 617 CO -0.11 0.37 0.07 0.00 -1.08 0.00 0.00 178.44 177.69 1ggk h ALA 618 N 1.37 0.31 0.53 1.53 0.00 -1.46 -0.41 119.26 121.11 1ggk h ALA 618 Ca 0.32 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.25 1ggk h ALA 618 Cb 0.21 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.05 1ggk h ALA 618 CO -0.19 -0.34 -0.25 0.82 0.00 0.00 0.00 179.25 179.29 1ggk h ILE 619 N 0.18 0.46 -0.31 0.00 2.04 -0.33 -3.04 117.51 116.51 1ggk h ILE 619 Ca 0.13 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 65.84 1ggk h ILE 619 Cb 0.13 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 1ggk h ILE 619 CO -0.16 0.03 0.20 -0.07 0.00 0.00 0.00 178.15 178.15 1ggk h LEU 620 N -0.82 0.28 -0.26 1.44 3.38 -0.52 -2.03 115.31 116.79 1ggk h LEU 620 Ca -0.07 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 1ggk h LEU 620 Cb 0.59 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1ggk h LEU 620 CO 0.12 0.19 -0.10 0.50 0.09 0.00 0.00 178.44 179.24 1ggk h LYS 621 N 0.32 0.52 -0.29 1.13 3.64 -1.08 -2.70 116.57 118.11 1ggk h LYS 621 Ca 0.12 -0.22 -0.14 0.00 -1.27 0.00 0.00 60.65 59.15 1ggk h LYS 621 Cb 0.10 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1ggk h LYS 621 CO -0.03 0.76 -0.36 0.00 -2.27 0.00 0.00 179.45 177.55 1ggk h ALA 622 N 0.74 0.43 0.16 5.00 0.00 -1.35 -1.86 119.26 122.38 1ggk h ALA 622 Ca 0.06 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1ggk h ALA 622 Cb 0.59 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1ggk h ALA 622 CO 0.03 0.51 -0.14 -0.07 0.00 0.00 0.00 179.25 179.58 1ggk h LEU 623 N 0.51 -0.38 -0.83 0.00 3.38 -1.44 -2.11 115.31 114.45 1ggk h LEU 623 Ca 0.04 0.04 0.18 0.00 0.09 0.00 0.00 57.88 58.22 1ggk h LEU 623 Cb 0.95 0.13 -0.11 0.00 0.09 0.00 0.00 40.66 41.72 1ggk h LEU 623 CO 0.09 -0.22 0.34 0.50 0.09 0.00 0.00 178.44 179.24 1ggk h LYS 624 N -0.32 0.43 -0.85 1.13 3.64 -1.50 -0.11 116.57 118.99 1ggk h LYS 624 Ca 0.00 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1ggk h LYS 624 Cb 0.30 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 31.97 1ggk h LYS 624 CO -0.03 0.28 0.54 0.00 -2.27 0.00 0.00 179.45 177.97 1ggk h ALA 625 N 1.62 1.12 -0.32 5.00 0.00 -0.65 -2.51 119.26 123.53 1ggk h ALA 625 Ca 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1ggk h ALA 625 Cb 0.81 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ggk h ALA 625 CO -0.46 0.37 0.00 1.63 0.00 0.00 0.00 179.25 180.79 1ggk n LYS 626 N -4.56 1.94 -2.47 0.00 4.76 -0.15 -4.94 118.16 112.74 1ggk n LYS 626 Ca 0.11 -1.45 -0.13 0.00 -2.87 0.00 0.00 58.31 53.97 1ggk n LYS 626 Cb 0.10 -1.38 0.01 0.00 -1.84 0.00 0.00 35.03 31.91 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 1.20 -0.08 3.75 0.72 0.00 -0.62 -4.06 105.19 106.09 1ggk n GLY 627 Ca 0.16 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.76 5.34 0.46 1.61 1.01 -0.94 -1.71 120.40 123.41 1ggk s VAL 628 Ca 0.09 0.42 -0.03 0.00 0.00 0.00 0.00 61.98 62.46 1ggk s VAL 628 Cb -0.04 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 1ggk s VAL 628 CO 0.11 0.44 0.73 -1.00 0.00 0.00 0.00 175.10 175.38 1ggk s HIS 629 N 0.16 3.45 0.16 5.22 3.76 -0.93 -3.98 115.29 123.13 1ggk s HIS 629 Ca 0.14 0.58 0.07 0.00 -0.15 0.00 0.00 55.06 55.70 1ggk s HIS 629 Cb -0.13 -2.27 -0.04 0.00 1.11 0.00 0.00 32.58 31.25 1ggk s HIS 629 CO 0.03 -0.28 -0.15 0.00 -0.85 0.00 0.00 174.74 173.50 1ggk s ALA 630 N -2.65 1.77 -0.19 -1.40 0.00 -1.26 -0.11 121.76 117.93 1ggk s ALA 630 Ca 0.47 -1.48 -0.01 0.00 0.00 0.00 0.00 51.96 50.93 1ggk s ALA 630 Cb -0.10 -0.09 0.05 0.00 0.00 0.00 0.00 23.12 22.98 1ggk s ALA 630 CO 0.42 0.09 -0.03 0.15 0.00 0.00 0.00 175.76 176.39 1ggk s LYS 631 N -3.17 1.22 -0.46 0.00 1.02 -0.62 -4.89 119.74 112.85 1ggk s LYS 631 Ca 0.16 -0.58 -0.26 0.00 0.02 0.00 0.00 55.97 55.31 1ggk s LYS 631 Cb -0.03 -2.14 0.03 0.00 -0.52 0.00 0.00 37.83 35.18 1ggk s LYS 631 CO 0.05 -0.53 0.94 -0.51 -0.92 0.00 0.00 175.35 174.38 1ggk s LEU 632 N 1.65 3.98 0.11 3.17 1.43 -1.26 -1.10 118.68 126.67 1ggk s LEU 632 Ca -0.01 0.15 0.05 0.00 -1.03 0.00 0.00 54.13 53.28 1ggk s LEU 632 Cb -0.17 -3.22 -0.04 0.00 0.03 0.00 0.00 46.19 42.80 1ggk s LEU 632 CO -0.07 -1.06 0.04 -0.76 0.23 0.00 0.00 176.35 174.73 1ggk s LEU 633 N 3.80 3.58 0.37 1.79 1.02 -0.81 -0.61 118.68 127.81 1ggk s LEU 633 Ca 0.38 -0.16 -0.05 0.00 0.02 0.00 0.00 54.13 54.31 1ggk s LEU 633 Cb -0.10 -2.26 0.02 0.00 0.02 0.00 0.00 46.19 43.87 1ggk s LEU 633 CO 0.27 0.14 0.58 -0.47 0.02 0.00 0.00 176.35 176.89 1ggk s TYR 634 N -1.46 0.85 -1.26 0.29 5.04 -1.16 -1.46 117.35 118.19 1ggk s TYR 634 Ca 0.28 -1.21 0.26 0.00 -2.44 0.00 0.00 57.07 53.96 1ggk s TYR 634 Cb -0.11 0.18 1.22 0.00 0.35 0.00 0.00 41.96 43.60 1ggk s TYR 634 CO 0.20 -1.30 1.85 -1.13 -1.34 0.00 0.00 175.55 173.83 1ggk n SER 635 N -1.56 0.00 -2.47 4.32 3.41 -1.26 -2.44 113.62 113.62 1ggk n SER 635 Ca -0.02 0.15 -0.09 0.00 -0.26 0.00 0.00 58.87 58.65 1ggk n SER 635 Cb 0.61 -0.37 -0.00 0.00 -0.26 0.00 0.00 64.21 64.18 1ggk n SER 635 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1ggk n ARG 636 N -1.37 0.68 -3.46 4.33 1.85 -1.26 -4.89 116.66 112.54 1ggk n ARG 636 Ca 0.10 -1.98 -0.23 0.00 -1.00 0.00 0.00 57.85 54.74 1ggk n ARG 636 Cb 0.24 2.11 0.03 0.00 -1.05 0.00 0.00 32.46 33.79 1ggk n ARG 636 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 1ggk s MET 637 N -2.39 2.24 0.00 2.89 -1.94 -1.26 -4.73 119.30 114.11 1ggk s MET 637 Ca 0.18 -1.87 0.00 0.00 -1.71 0.00 0.00 55.69 52.29 1ggk s MET 637 Cb -0.02 -2.36 0.00 0.00 2.01 0.00 0.00 34.83 34.46 1ggk s MET 637 CO 0.13 -0.80 0.00 0.41 -0.01 0.00 0.00 175.02 174.75 1ggk n GLY 638 N -2.05 0.64 3.07 -0.03 0.00 -1.26 -5.00 105.19 100.55 1ggk n GLY 638 Ca 0.07 -1.60 -0.08 0.00 0.00 0.00 0.00 46.02 44.42 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 0.54 0.29 1.61 2.02 -1.26 -0.98 118.70 120.92 1ggk s GLU 639 Ca 0.00 -1.01 0.11 0.00 0.02 0.00 0.00 54.97 54.09 1ggk s GLU 639 Cb 0.00 0.19 -0.05 0.00 0.10 0.00 0.00 34.13 34.37 1ggk s GLU 639 CO 0.00 -0.10 -0.15 0.14 0.02 0.00 0.00 175.26 175.17 1ggk s VAL 640 N -3.17 2.57 -0.16 2.63 -7.23 0.12 -4.92 120.40 110.24 1ggk s VAL 640 Ca -0.00 -2.29 0.00 0.00 -1.81 0.00 0.00 61.98 57.88 1ggk s VAL 640 Cb 0.02 -2.46 0.00 0.00 0.56 0.00 0.00 36.38 34.51 1ggk s VAL 640 CO -0.07 -0.35 -0.16 -0.89 -0.31 0.00 0.00 175.10 173.32 1ggk s THR 641 N -2.50 2.57 1.41 5.32 2.01 -1.26 0.14 115.64 123.32 1ggk s THR 641 Ca 0.31 -0.80 -0.23 0.00 0.31 0.00 0.00 61.69 61.28 1ggk s THR 641 Cb -0.04 -2.09 0.36 0.00 0.01 0.00 0.00 72.50 70.75 1ggk s THR 641 CO 0.16 0.52 0.96 0.00 -0.69 0.00 0.00 174.62 175.57 1ggk s ALA 642 N 0.92 -0.50 0.24 7.40 0.00 -0.54 -4.30 121.76 124.98 1ggk s ALA 642 Ca -0.03 -0.91 0.09 0.00 0.00 0.00 0.00 51.96 51.10 1ggk s ALA 642 Cb -0.15 -2.90 0.22 0.00 0.00 0.00 0.00 23.12 20.29 1ggk s ALA 642 CO -0.02 -4.49 1.53 0.38 0.00 0.00 0.00 175.76 173.17 1ggk h ASP 643 N -3.35 0.03 -0.31 0.00 3.04 -1.46 -2.72 116.42 111.65 1ggk h ASP 643 Ca -0.42 -0.02 0.00 0.00 -3.24 0.00 0.00 57.03 53.35 1ggk h ASP 643 Cb 1.33 -0.01 0.00 0.00 -1.04 0.00 0.00 39.33 39.61 1ggk h ASP 643 CO 0.27 0.73 0.00 -0.90 -2.04 0.00 0.00 179.24 177.29 1ggk n ASP 644 N -3.72 2.23 0.00 4.15 3.85 -1.26 -4.89 116.55 116.92 1ggk n ASP 644 Ca -0.01 -2.14 0.00 0.00 -0.71 0.00 0.00 54.79 51.93 1ggk n ASP 644 Cb 0.69 -0.34 0.00 0.00 -1.35 0.00 0.00 41.12 40.12 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 0.79 1.18 3.59 6.12 0.00 -1.03 -5.01 105.19 110.84 1ggk n GLY 645 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -3.13 3.52 -0.05 2.61 2.01 -1.26 -4.65 115.64 114.69 1ggk s THR 646 Ca 0.00 0.51 -0.30 0.00 0.31 0.00 0.00 61.69 62.21 1ggk s THR 646 Cb 0.00 -3.75 -0.08 0.00 0.01 0.00 0.00 72.50 68.67 1ggk s THR 646 CO 0.00 -0.52 2.04 0.52 -0.69 0.00 0.00 174.62 175.97 1ggk n VAL 647 N 7.35 0.63 -4.23 3.82 0.31 -1.26 -1.47 118.33 123.48 1ggk n VAL 647 Ca 0.22 -0.22 -0.34 0.00 -0.01 0.00 0.00 64.34 63.99 1ggk n VAL 647 Cb 0.48 -2.32 -0.14 0.00 -0.91 0.00 0.00 33.84 30.94 1ggk n VAL 647 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1ggk s LEU 648 N 5.49 2.72 0.29 7.52 1.02 0.36 -4.96 118.68 131.12 1ggk s LEU 648 Ca 0.93 -0.41 -0.19 0.00 0.02 0.00 0.00 54.13 54.48 1ggk s LEU 648 Cb -0.45 -1.66 -0.09 0.00 0.02 0.00 0.00 46.19 44.02 1ggk s LEU 648 CO 0.42 0.05 0.79 -2.16 0.02 0.00 0.00 176.35 175.46 1ggk s PRO 649 N 1.06 4.23 -0.19 1.29 0.04 -1.26 0.16 135.00 140.33 1ggk s PRO 649 Ca 0.00 0.91 -0.09 0.00 0.04 0.00 0.00 61.00 61.86 1ggk s PRO 649 Cb -0.15 -2.66 -0.05 0.00 0.04 0.00 0.00 34.50 31.69 1ggk s PRO 649 CO -0.02 0.26 0.11 0.42 0.04 0.00 0.00 177.00 177.82 1ggk s ILE 650 N -1.74 5.27 -0.01 0.56 1.01 -0.15 -4.84 121.20 121.31 1ggk s ILE 650 Ca 0.49 0.14 -0.19 0.00 0.00 0.00 0.00 60.65 61.10 1ggk s ILE 650 Cb -0.14 -3.40 -0.34 0.00 0.01 0.00 0.00 42.46 38.59 1ggk s ILE 650 CO 0.19 0.45 0.95 0.00 0.00 0.00 0.00 174.94 176.54 1ggk h ALA 651 N 6.60 -0.13 -3.00 9.38 0.00 -1.20 -3.42 119.26 127.49 1ggk h ALA 651 Ca -0.41 -0.79 0.05 0.00 0.00 0.00 0.00 54.91 53.77 1ggk h ALA 651 Cb 1.16 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.05 1ggk h ALA 651 CO 0.74 0.55 0.23 0.00 0.00 0.00 0.00 179.25 180.77 1ggk s ALA 652 N -2.52 -1.11 0.60 0.00 0.00 -1.24 -5.04 121.76 112.45 1ggk s ALA 652 Ca -0.11 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.45 1ggk s ALA 652 Cb 0.03 0.82 0.06 0.00 0.00 0.00 0.00 23.12 24.02 1ggk s ALA 652 CO 0.89 -1.03 0.84 0.95 0.00 0.00 0.00 175.76 177.42 1ggk s THR 653 N -3.61 2.52 0.41 0.00 -4.23 -1.26 -2.99 115.64 106.48 1ggk s THR 653 Ca 0.12 -0.62 0.11 0.00 -1.18 0.00 0.00 61.69 60.13 1ggk s THR 653 Cb -0.06 -2.90 0.32 0.00 1.34 0.00 0.00 72.50 71.20 1ggk s THR 653 CO 0.08 0.00 1.98 -0.26 -0.54 0.00 0.00 174.62 175.87 1ggk h PHE 654 N -0.11 0.53 0.17 3.99 0.05 -1.81 -1.89 116.94 117.87 1ggk h PHE 654 Ca -0.41 0.01 -0.25 0.00 3.82 0.00 0.00 57.97 61.14 1ggk h PHE 654 Cb 1.29 -0.17 0.03 0.00 2.00 0.00 0.00 35.95 39.10 1ggk h PHE 654 CO 0.26 0.26 -1.09 0.00 -0.18 0.00 0.00 178.31 177.55 1ggk h ALA 655 N 1.68 -0.10 0.00 2.45 0.00 -1.93 -3.34 119.26 118.01 1ggk h ALA 655 Ca 0.28 -0.76 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1ggk h ALA 655 Cb 0.45 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ggk h ALA 655 CO -0.09 0.52 -0.10 0.78 0.00 0.00 0.00 179.25 180.36 1ggk h GLY 656 N -0.09 0.00 -6.24 0.00 0.00 -1.86 -3.34 103.07 91.54 1ggk h GLY 656 Ca -0.19 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.58 1ggk h GLY 656 CO 0.21 0.00 -0.98 0.00 0.00 0.00 0.00 176.54 175.77 1ggk n ALA 657 N -2.51 2.57 -0.63 3.60 0.00 -0.74 -4.87 120.51 117.93 1ggk n ALA 657 Ca -0.03 -3.06 -0.30 0.00 0.00 0.00 0.00 53.44 50.05 1ggk n ALA 657 Cb 0.18 -0.79 0.20 0.00 0.00 0.00 0.00 19.45 19.03 1ggk n ALA 657 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1ggk s PRO 658 N -0.11 0.36 0.57 0.00 0.02 -1.25 -4.85 135.00 129.74 1ggk s PRO 658 Ca 0.33 1.34 0.27 0.00 0.02 0.00 0.00 61.00 62.97 1ggk s PRO 658 Cb 0.06 -1.67 1.55 0.00 0.02 0.00 0.00 34.50 34.46 1ggk s PRO 658 CO -0.18 -3.01 2.04 0.66 -0.33 0.00 0.00 177.00 176.18 1ggk h SER 659 N -2.14 0.00 -0.76 2.53 4.64 -1.87 -0.88 113.55 115.07 1ggk h SER 659 Ca -0.49 0.00 0.21 0.00 -0.47 0.00 0.00 61.79 61.04 1ggk h SER 659 Cb 1.29 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.34 1ggk h SER 659 CO 0.44 0.00 0.54 -0.07 -0.87 0.00 0.00 176.83 176.87 1ggk h LEU 660 N 0.00 0.09 -1.38 5.97 4.07 -1.94 -2.90 115.31 119.22 1ggk h LEU 660 Ca 0.14 0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.11 1ggk h LEU 660 Cb 0.70 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.43 1ggk h LEU 660 CO -0.00 0.04 -0.03 0.35 -1.08 0.00 0.00 178.44 177.72 1ggk n THR 661 N -4.36 0.00 -4.48 0.22 -2.24 -0.33 -4.95 114.28 98.13 1ggk n THR 661 Ca 0.15 -0.36 -0.23 0.00 -2.27 0.00 0.00 64.05 61.34 1ggk n THR 661 Cb 0.77 0.97 -0.10 0.00 -2.10 0.00 0.00 70.33 69.87 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 -2.04 1.92 -0.31 2.28 -7.23 -1.09 -4.94 120.40 109.00 1ggk s VAL 662 Ca 0.32 -2.16 0.23 0.00 -1.81 0.00 0.00 61.98 58.55 1ggk s VAL 662 Cb 0.20 -2.55 -0.11 0.00 0.56 0.00 0.00 36.38 34.49 1ggk s VAL 662 CO 0.34 -0.25 0.92 0.47 -0.31 0.00 0.00 175.10 176.26 1ggk n ASP 663 N -0.68 0.58 -3.79 4.85 9.92 -0.20 -5.00 116.55 122.23 1ggk n ASP 663 Ca -0.05 0.10 -0.08 0.00 -0.53 0.00 0.00 54.79 54.22 1ggk n ASP 663 Cb 0.63 0.89 -0.03 0.00 -0.64 0.00 0.00 41.12 41.98 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 -3.35 -1.09 -0.05 2.24 0.00 -1.23 -4.39 121.76 113.89 1ggk s ALA 664 Ca -0.01 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.71 1ggk s ALA 664 Cb 0.12 0.88 0.02 0.00 0.00 0.00 0.00 23.12 24.15 1ggk s ALA 664 CO 0.82 -0.93 -0.06 0.08 0.00 0.00 0.00 175.76 175.67 1ggk s VAL 665 N -3.90 0.69 -0.06 0.00 1.01 -0.98 -1.06 120.40 116.10 1ggk s VAL 665 Ca 0.11 -0.20 0.05 0.00 0.00 0.00 0.00 61.98 61.94 1ggk s VAL 665 Cb -0.04 -0.70 -0.01 0.00 0.00 0.00 0.00 36.38 35.64 1ggk s VAL 665 CO 0.03 0.27 -0.21 -0.63 0.00 0.00 0.00 175.10 174.55 1ggk s ILE 666 N 0.97 1.77 -0.33 2.22 1.01 -0.24 -0.53 121.20 126.07 1ggk s ILE 666 Ca -0.10 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.68 1ggk s ILE 666 Cb -0.14 -1.51 0.10 0.00 0.01 0.00 0.00 42.46 40.91 1ggk s ILE 666 CO 0.00 0.50 0.05 -0.69 0.00 0.00 0.00 174.94 174.80 1ggk s VAL 667 N 0.02 1.90 0.82 2.92 1.01 -0.37 -1.01 120.40 125.69 1ggk s VAL 667 Ca -0.06 -2.04 -0.12 0.00 0.00 0.00 0.00 61.98 59.75 1ggk s VAL 667 Cb -0.14 -2.38 0.10 0.00 0.00 0.00 0.00 36.38 33.96 1ggk s VAL 667 CO 0.04 -0.58 1.19 -2.16 0.00 0.00 0.00 175.10 173.59 1ggk s PRO 668 N 1.11 1.79 0.64 2.72 0.04 -1.26 -1.97 135.00 138.07 1ggk s PRO 668 Ca 0.09 0.01 -0.10 0.00 0.04 0.00 0.00 61.00 61.04 1ggk s PRO 668 Cb -0.19 -1.95 0.15 0.00 0.04 0.00 0.00 34.50 32.55 1ggk s PRO 668 CO -0.12 -1.69 0.87 0.00 0.04 0.00 0.00 177.00 176.11 1ggk n GLY 670 N -0.78 0.68 3.56 0.00 0.00 -1.26 -2.71 105.19 104.68 1ggk n GLY 670 Ca 0.11 -1.84 -0.28 0.00 0.00 0.00 0.00 46.02 44.01 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 2.91 0.29 1.61 4.05 -1.11 -4.72 115.26 118.29 1ggk n ASN 671 Ca 0.00 -2.68 0.16 0.00 0.45 0.00 0.00 54.58 52.51 1ggk n ASN 671 Cb 0.00 -1.71 0.86 0.00 1.23 0.00 0.00 39.78 40.16 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 6.12 0.37 0.00 -1.44 1.08 -1.92 -1.72 117.51 120.00 1ggk h ILE 672 Ca 0.21 -0.33 -0.01 0.00 -0.39 0.00 0.00 64.86 64.34 1ggk h ILE 672 Cb 0.93 1.23 -0.00 0.00 -3.07 0.00 0.00 36.82 35.91 1ggk h ILE 672 CO 1.24 0.06 -0.07 0.00 -0.69 0.00 0.00 178.15 178.69 1ggk h ALA 673 N 1.94 1.20 -0.57 1.87 0.00 -1.98 -0.98 119.26 120.74 1ggk h ALA 673 Ca -0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1ggk h ALA 673 Cb 0.23 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1ggk h ALA 673 CO 0.01 0.08 0.12 0.22 0.00 0.00 0.00 179.25 179.68 1ggk h ASP 674 N 0.00 0.84 -0.00 0.00 -0.00 -1.71 -3.30 116.42 112.24 1ggk h ASP 674 Ca -0.00 -0.16 0.00 0.00 -0.00 0.00 0.00 57.03 56.86 1ggk h ASP 674 Cb 0.27 -0.22 0.00 0.00 -0.00 0.00 0.00 39.33 39.38 1ggk h ASP 674 CO 0.01 0.83 -0.34 2.30 -0.00 0.00 0.00 179.24 182.04 1ggk n ILE 675 N -4.25 0.00 -0.20 2.25 -5.35 -0.94 -4.71 119.36 106.15 1ggk n ILE 675 Ca 0.04 -0.33 0.01 0.00 -0.27 0.00 0.00 62.75 62.19 1ggk n ILE 675 Cb 0.25 1.04 0.11 0.00 -1.74 0.00 0.00 39.64 39.30 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 1.38 0.75 -0.54 -1.28 0.00 -1.28 -1.60 119.26 116.69 1ggk h ALA 676 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ggk h ALA 676 Cb 0.25 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ggk h ALA 676 CO 0.00 -0.27 0.00 -0.25 0.00 0.00 0.00 179.25 178.73 1ggk n ASP 677 N -5.08 4.01 -4.65 0.00 10.43 -1.26 -4.88 116.55 115.12 1ggk n ASP 677 Ca 0.09 -2.36 -0.41 0.00 2.57 0.00 0.00 54.79 54.68 1ggk n ASP 677 Cb 0.31 -0.52 -0.05 0.00 1.84 0.00 0.00 41.12 42.70 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 -0.83 6.77 0.15 -2.24 3.84 -0.60 -4.98 114.94 117.05 1ggk s ASN 678 Ca 0.42 0.95 -0.18 0.00 0.21 0.00 0.00 52.86 54.26 1ggk s ASN 678 Cb 0.27 -2.39 0.03 0.00 -0.55 0.00 0.00 41.25 38.61 1ggk s ASN 678 CO 0.21 -0.38 1.71 1.23 -2.79 0.00 0.00 177.10 177.08 1ggk h GLY 679 N 8.58 0.29 1.42 1.21 0.00 -1.91 -1.44 103.07 111.22 1ggk h GLY 679 Ca -0.28 0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 1ggk h GLY 679 CO 0.81 -0.05 0.16 -0.55 0.00 0.00 0.00 176.54 176.91 1ggk h ASP 680 N 0.10 0.68 -0.23 0.19 3.45 -1.96 0.13 116.42 118.78 1ggk h ASP 680 Ca 0.14 -0.10 -0.05 0.00 0.43 0.00 0.00 57.03 57.45 1ggk h ASP 680 Cb 0.18 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.77 1ggk h ASP 680 CO -0.23 0.65 -0.07 0.00 -1.57 0.00 0.00 179.24 178.02 1ggk h ALA 681 N 1.45 0.32 -0.34 3.45 0.00 -1.79 0.49 119.26 122.84 1ggk h ALA 681 Ca 0.17 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1ggk h ALA 681 Cb 0.21 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1ggk h ALA 681 CO -0.01 0.12 0.01 -0.91 0.00 0.00 0.00 179.25 178.46 1ggk h ASN 682 N 0.18 0.58 -0.71 0.00 2.35 -0.90 -3.10 115.58 113.98 1ggk h ASN 682 Ca 0.06 -0.30 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1ggk h ASN 682 Cb 0.54 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.72 1ggk h ASN 682 CO 0.03 0.74 0.45 0.22 -1.65 0.00 0.00 177.43 177.22 1ggk h TYR 683 N 0.40 0.91 -0.53 1.19 5.03 -0.68 -2.73 116.97 120.56 1ggk h TYR 683 Ca 0.10 0.01 0.09 0.00 2.58 0.00 0.00 58.73 61.51 1ggk h TYR 683 Cb 0.44 -0.31 -0.11 0.00 1.55 0.00 0.00 36.73 38.31 1ggk h TYR 683 CO 0.03 0.59 -0.37 -0.92 -1.32 0.00 0.00 178.16 176.18 1ggk h TYR 684 N 0.97 -1.03 -0.49 -3.82 5.03 -0.81 -0.14 116.97 116.67 1ggk h TYR 684 Ca 0.26 0.07 -0.06 0.00 2.58 0.00 0.00 58.73 61.58 1ggk h TYR 684 Cb -0.08 0.53 -0.02 0.00 1.55 0.00 0.00 36.73 38.71 1ggk h TYR 684 CO 0.00 -0.40 0.04 -0.07 -1.32 0.00 0.00 178.16 176.42 1ggk h LEU 685 N -0.21 0.75 -0.38 2.82 4.07 -1.56 -1.39 115.31 119.40 1ggk h LEU 685 Ca 0.20 -0.16 -0.08 0.00 0.08 0.00 0.00 57.88 57.91 1ggk h LEU 685 Cb 0.56 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 1ggk h LEU 685 CO -0.65 0.79 -0.09 0.24 -1.08 0.00 0.00 178.44 177.65 1ggk h MET 686 N 0.75 0.73 0.39 1.13 2.86 -0.88 -0.03 114.93 119.87 1ggk h MET 686 Ca 0.15 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1ggk h MET 686 Cb 0.39 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 1ggk h MET 686 CO 0.01 0.87 -0.23 1.49 1.06 0.00 0.00 176.91 180.12 1ggk h GLU 687 N 0.53 -0.56 -0.05 1.72 4.81 -0.98 -0.78 114.58 119.27 1ggk h GLU 687 Ca 0.10 0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 1ggk h GLU 687 Cb 0.60 0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.11 1ggk h GLU 687 CO 0.04 -0.37 0.00 0.00 -0.73 0.00 0.00 179.01 177.94 1ggk h ALA 688 N 0.01 1.91 -0.21 2.92 0.00 -1.21 -1.05 119.26 121.62 1ggk h ALA 688 Ca -0.04 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1ggk h ALA 688 Cb 0.47 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1ggk h ALA 688 CO 0.05 0.08 -0.19 -0.92 0.00 0.00 0.00 179.25 178.27 1ggk h TYR 689 N 0.07 0.60 0.00 0.00 3.20 -0.49 -2.27 116.97 118.09 1ggk h TYR 689 Ca 0.02 -0.17 -0.06 0.00 3.14 0.00 0.00 58.73 61.65 1ggk h TYR 689 Cb 0.05 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 1ggk h TYR 689 CO 0.00 0.84 -0.28 -0.22 -1.64 0.00 0.00 178.16 176.86 1ggk h LYS 690 N 0.19 0.00 -0.26 1.82 3.64 -0.56 -2.35 116.57 119.05 1ggk h LYS 690 Ca 0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1ggk h LYS 690 Cb 0.73 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1ggk h LYS 690 CO 0.05 0.28 0.00 0.72 -2.27 0.00 0.00 179.45 178.23 1ggk n HIS 691 N -4.14 0.34 -2.38 1.91 8.25 -0.45 -4.91 115.22 113.84 1ggk n HIS 691 Ca -0.02 -0.17 -0.14 0.00 -0.26 0.00 0.00 57.72 57.13 1ggk n HIS 691 Cb 0.33 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.44 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 0.25 -1.79 -4.90 2.41 4.77 -0.89 -4.90 117.00 111.95 1ggk n LEU 692 Ca 0.09 -0.06 -0.31 0.00 -0.03 0.00 0.00 56.01 55.71 1ggk n LEU 692 Cb 0.22 -2.12 -0.04 0.00 -2.33 0.00 0.00 43.42 39.15 1ggk n LEU 692 CO 0.06 -0.07 0.02 -0.54 -1.33 0.00 0.00 177.39 175.53 1ggk s LYS 693 N -4.84 3.60 0.32 3.23 1.02 -0.86 -0.59 119.74 121.62 1ggk s LYS 693 Ca 0.05 -0.14 -0.29 0.00 0.02 0.00 0.00 55.97 55.61 1ggk s LYS 693 Cb -0.02 -2.85 -0.11 0.00 -0.52 0.00 0.00 37.83 34.32 1ggk s LYS 693 CO 0.06 0.46 1.56 -2.14 -0.92 0.00 0.00 175.35 174.37 1ggk s PRO 694 N -2.75 4.12 -0.05 -1.68 0.02 -1.26 -4.69 135.00 128.70 1ggk s PRO 694 Ca 0.40 2.58 0.04 0.00 0.02 0.00 0.00 61.00 64.04 1ggk s PRO 694 Cb -0.12 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.40 1ggk s PRO 694 CO 0.25 -0.60 -0.15 0.42 -0.33 0.00 0.00 177.00 176.59 1ggk s ILE 695 N -0.39 1.29 -0.10 2.83 1.01 -1.11 -2.32 121.20 122.41 1ggk s ILE 695 Ca 0.60 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.61 1ggk s ILE 695 Cb -0.47 -1.12 0.03 0.00 0.01 0.00 0.00 42.46 40.90 1ggk s ILE 695 CO 0.53 0.38 -0.04 0.00 0.00 0.00 0.00 174.94 175.81 1ggk s ALA 696 N 0.18 1.07 -0.17 9.38 0.00 0.31 -1.24 121.76 131.28 1ggk s ALA 696 Ca -0.06 -0.37 -0.00 0.00 0.00 0.00 0.00 51.96 51.53 1ggk s ALA 696 Cb -0.12 -0.84 -0.00 0.00 0.00 0.00 0.00 23.12 22.16 1ggk s ALA 696 CO 0.02 -0.43 -0.14 -0.51 0.00 0.00 0.00 175.76 174.70 1ggk s LEU 697 N 1.81 2.50 -0.16 0.00 1.43 0.83 -1.23 118.68 123.86 1ggk s LEU 697 Ca 0.05 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.63 1ggk s LEU 697 Cb -0.12 -1.58 -0.03 0.00 0.03 0.00 0.00 46.19 44.49 1ggk s LEU 697 CO -0.07 0.06 -0.03 0.00 0.23 0.00 0.00 176.35 176.55 1ggk s ALA 698 N 0.95 3.03 0.00 4.21 0.00 -0.83 -2.66 121.76 126.45 1ggk s ALA 698 Ca -0.03 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1ggk s ALA 698 Cb -0.15 -1.61 0.00 0.00 0.00 0.00 0.00 23.12 21.36 1ggk s ALA 698 CO -0.02 0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.31 1ggk n GLY 699 N 3.64 4.16 0.07 0.00 0.00 0.16 -1.70 105.19 111.52 1ggk n GLY 699 Ca -0.17 0.18 0.10 0.00 0.00 0.00 0.00 46.02 46.13 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 8.89 0.37 0.03 1.61 10.43 -1.26 -1.86 116.55 134.76 1ggk n ASP 700 Ca 0.00 0.59 0.03 0.00 2.57 0.00 0.00 54.79 57.98 1ggk n ASP 700 Cb 0.00 -0.67 0.13 0.00 1.84 0.00 0.00 41.12 42.42 1ggk n ASP 700 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1ggk n ALA 701 N -1.65 1.10 0.27 2.24 0.00 -0.69 -1.07 120.51 120.71 1ggk n ALA 701 Ca 0.03 0.02 0.16 0.00 0.00 0.00 0.00 53.44 53.65 1ggk n ALA 701 Cb 0.21 -1.08 0.67 0.00 0.00 0.00 0.00 19.45 19.25 1ggk n ALA 701 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ggk h ARG 702 N 0.00 0.00 -0.42 0.00 3.08 -1.56 -2.54 114.38 112.94 1ggk h ARG 702 Ca 0.00 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.12 1ggk h ARG 702 Cb 0.04 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1ggk h ARG 702 CO 0.00 0.04 0.28 0.87 -1.07 0.00 0.00 179.97 180.09 1ggk h LYS 703 N 0.00 0.27 0.00 0.04 1.57 -1.33 -0.89 116.57 116.23 1ggk h LYS 703 Ca -0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1ggk h LYS 703 Cb 0.53 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1ggk h LYS 703 CO 0.00 0.18 0.00 1.19 -0.57 0.00 0.00 179.45 180.25 1ggk n PHE 704 N -4.47 0.00 0.24 -1.35 3.01 -0.96 -2.73 117.46 111.21 1ggk n PHE 704 Ca 0.06 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.60 1ggk n PHE 704 Cb 0.29 -0.34 0.61 0.00 -0.01 0.00 0.00 39.48 40.02 1ggk n PHE 704 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1ggk h LYS 705 N 0.00 0.00 -0.61 -1.08 1.57 -1.37 -2.42 116.57 112.65 1ggk h LYS 705 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1ggk h LYS 705 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1ggk h LYS 705 CO 0.00 0.15 0.05 0.00 -0.57 0.00 0.00 179.45 179.09 1ggk h ALA 706 N 1.85 0.93 -0.53 3.86 0.00 -1.75 -0.44 119.26 123.18 1ggk h ALA 706 Ca -0.00 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 1ggk h ALA 706 Cb 0.31 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1ggk h ALA 706 CO 0.02 0.65 0.11 0.00 0.00 0.00 0.00 179.25 180.03 1ggk h THR 707 N 0.96 1.23 -0.62 0.00 1.03 -1.65 -2.60 112.91 111.26 1ggk h THR 707 Ca 0.18 -0.84 0.00 0.00 -0.01 0.00 0.00 66.41 65.74 1ggk h THR 707 Cb 0.48 0.70 0.00 0.00 -1.07 0.00 0.00 68.15 68.26 1ggk h THR 707 CO 0.02 0.31 0.00 2.30 -0.01 0.00 0.00 175.52 178.14 1ggk n ILE 708 N -4.27 2.25 -3.65 0.00 -5.35 -1.12 -4.99 119.36 102.24 1ggk n ILE 708 Ca 0.04 -1.30 -0.23 0.00 -0.27 0.00 0.00 62.75 61.00 1ggk n ILE 708 Cb 0.24 -0.05 0.01 0.00 -1.74 0.00 0.00 39.64 38.10 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 0.92 -1.31 -4.47 6.28 4.01 -0.27 -4.99 118.16 118.33 1ggk n LYS 709 Ca 0.27 0.80 -0.34 0.00 -0.51 0.00 0.00 58.31 58.53 1ggk n LYS 709 Cb 1.03 -3.33 -0.10 0.00 -0.51 0.00 0.00 35.03 32.12 1ggk n LYS 709 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1ggk s ILE 710 N -3.12 4.06 0.65 -0.18 -1.09 -0.64 -5.03 121.20 115.84 1ggk s ILE 710 Ca 0.12 -0.37 -0.18 0.00 -2.23 0.00 0.00 60.65 57.99 1ggk s ILE 710 Cb -0.05 -2.70 -0.01 0.00 -1.58 0.00 0.00 42.46 38.12 1ggk s ILE 710 CO 0.87 0.58 1.27 0.00 -1.23 0.00 0.00 174.94 176.43 1ggk s ALA 711 N -0.87 2.38 0.18 9.38 0.00 -1.26 -4.82 121.76 126.75 1ggk s ALA 711 Ca 0.13 1.14 -0.20 0.00 0.00 0.00 0.00 51.96 53.03 1ggk s ALA 711 Cb -0.11 -3.53 0.12 0.00 0.00 0.00 0.00 23.12 19.60 1ggk s ALA 711 CO 0.03 -1.54 1.60 -0.44 0.00 0.00 0.00 175.76 175.40 1ggk h ASP 712 N 0.52 -1.03 0.01 0.00 3.32 -2.00 -1.49 116.42 115.75 1ggk h ASP 712 Ca -0.51 0.21 0.03 0.00 0.02 0.00 0.00 57.03 56.78 1ggk h ASP 712 Cb 1.33 0.52 -0.05 0.00 0.22 0.00 0.00 39.33 41.35 1ggk h ASP 712 CO 0.53 -0.29 -0.33 0.06 -1.72 0.00 0.00 179.24 177.49 1ggk h GLN 713 N -0.17 -0.47 0.00 3.56 3.07 -2.06 -3.49 115.11 115.56 1ggk h GLN 713 Ca 0.22 0.03 0.00 0.00 0.09 0.00 0.00 58.65 59.00 1ggk h GLN 713 Cb 0.53 0.11 0.00 0.00 0.08 0.00 0.00 27.48 28.20 1ggk h GLN 713 CO -0.63 -0.31 0.00 0.41 0.09 0.00 0.00 178.83 178.39 1ggk n GLY 714 N -1.42 0.98 3.37 0.06 0.00 -0.56 -5.12 105.19 102.49 1ggk n GLY 714 Ca -0.05 -2.22 -0.14 0.00 0.00 0.00 0.00 46.02 43.61 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 -1.03 0.64 0.24 1.61 -1.05 -1.26 -4.77 118.70 113.07 1ggk s GLU 715 Ca 0.00 0.46 -0.31 0.00 -0.15 0.00 0.00 54.97 54.96 1ggk s GLU 715 Cb 0.00 0.30 -0.12 0.00 -0.44 0.00 0.00 34.13 33.87 1ggk s GLU 715 CO 0.00 -0.12 1.61 0.39 0.95 0.00 0.00 175.26 178.09 1ggk n GLU 716 N 2.31 2.58 0.00 -4.83 -0.58 -1.26 -1.48 120.64 117.38 1ggk n GLU 716 Ca -0.16 0.92 0.00 0.00 -0.42 0.00 0.00 57.16 57.51 1ggk n GLU 716 Cb 0.57 -2.71 0.00 0.00 -0.57 0.00 0.00 31.44 28.73 1ggk n GLU 716 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ggk n GLY 717 N 2.86 2.16 3.24 0.62 0.00 -1.26 -4.87 105.19 107.94 1ggk n GLY 717 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.23 3.34 -0.22 -0.61 -1.09 -0.55 -2.75 121.20 117.09 1ggk s ILE 718 Ca 0.00 -1.08 -0.20 0.00 -2.23 0.00 0.00 60.65 57.14 1ggk s ILE 718 Cb 0.00 -2.81 -0.02 0.00 -1.58 0.00 0.00 42.46 38.05 1ggk s ILE 718 CO 0.00 0.00 0.62 -0.69 -1.23 0.00 0.00 174.94 173.65 1ggk s VAL 719 N 1.36 5.01 0.07 2.92 1.01 -0.37 -4.73 120.40 125.66 1ggk s VAL 719 Ca -0.01 1.14 0.03 0.00 0.00 0.00 0.00 61.98 63.14 1ggk s VAL 719 Cb -0.18 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 1ggk s VAL 719 CO -0.00 0.08 -0.10 -1.83 0.00 0.00 0.00 175.10 173.24 1ggk s GLU 720 N 2.15 0.73 -0.25 2.72 -1.05 -1.26 -0.12 118.70 121.62 1ggk s GLU 720 Ca 0.27 -0.98 -0.37 0.00 -0.15 0.00 0.00 54.97 53.74 1ggk s GLU 720 Cb -0.16 -0.51 0.16 0.00 -0.44 0.00 0.00 34.13 33.18 1ggk s GLU 720 CO 0.09 0.09 1.39 0.00 0.95 0.00 0.00 175.26 177.79 1ggk s ALA 721 N -1.84 -2.26 0.14 -0.84 0.00 -1.09 -4.99 121.76 110.89 1ggk s ALA 721 Ca -0.01 1.71 -0.17 0.00 0.00 0.00 0.00 51.96 53.49 1ggk s ALA 721 Cb -0.07 -0.26 -0.00 0.00 0.00 0.00 0.00 23.12 22.78 1ggk s ALA 721 CO 0.00 -0.65 1.76 -0.44 0.00 0.00 0.00 175.76 176.44 1ggk h ASP 722 N 2.00 0.46 -4.88 0.00 3.32 -1.92 0.44 116.42 115.84 1ggk h ASP 722 Ca -0.08 -0.06 -0.19 0.00 0.02 0.00 0.00 57.03 56.72 1ggk h ASP 722 Cb 1.14 -0.12 -0.16 0.00 0.22 0.00 0.00 39.33 40.42 1ggk h ASP 722 CO 0.21 0.39 -0.69 -0.94 -1.72 0.00 0.00 179.24 176.48 1ggk s SER 723 N -5.63 0.82 -0.66 6.45 1.04 -1.26 -2.42 113.70 112.05 1ggk s SER 723 Ca -0.13 -0.93 -0.26 0.00 0.48 0.00 0.00 55.95 55.10 1ggk s SER 723 Cb 0.10 0.13 -0.01 0.00 0.10 0.00 0.00 66.02 66.34 1ggk s SER 723 CO 0.73 -0.48 1.77 0.00 0.98 0.00 0.00 173.24 176.23 1ggk s ALA 724 N -3.40 2.24 0.00 5.32 0.00 -1.26 -4.68 121.76 119.98 1ggk s ALA 724 Ca 0.06 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.18 1ggk s ALA 724 Cb 0.04 -4.32 0.00 0.00 0.00 0.00 0.00 23.12 18.84 1ggk s ALA 724 CO -0.06 -3.85 0.00 -3.47 0.00 0.00 0.00 175.76 168.38 1ggk n ASP 725 N 12.23 -1.87 0.00 0.00 2.03 -1.26 -4.67 116.55 123.02 1ggk n ASP 725 Ca 0.19 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.50 1ggk n ASP 725 Cb 0.51 0.97 0.00 0.00 -0.72 0.00 0.00 41.12 41.88 1ggk n ASP 725 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ggk n GLY 726 N -0.44 -0.30 0.64 0.27 0.00 -1.26 -4.83 105.19 99.27 1ggk n GLY 726 Ca 0.00 0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.25 1ggk n GLY 726 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ggk n SER 727 N -0.58 2.30 -0.02 1.61 3.41 -1.26 -4.59 113.62 114.50 1ggk n SER 727 Ca 0.00 -1.65 -0.10 0.00 -0.26 0.00 0.00 58.87 56.86 1ggk n SER 727 Cb 0.00 0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 1ggk n SER 727 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1ggk h PHE 728 N 3.14 -0.79 0.00 7.33 3.04 -1.91 -1.85 116.94 125.90 1ggk h PHE 728 Ca 0.00 0.04 -0.14 0.00 3.98 0.00 0.00 57.97 61.84 1ggk h PHE 728 Cb 0.74 0.37 -0.02 0.00 2.56 0.00 0.00 35.95 39.60 1ggk h PHE 728 CO 0.00 -0.37 -0.69 0.52 -2.02 0.00 0.00 178.31 175.76 1ggk h MET 729 N -0.34 0.00 -0.14 1.11 2.86 -1.93 -2.79 114.93 113.70 1ggk h MET 729 Ca 0.11 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.64 1ggk h MET 729 Cb 0.51 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 1ggk h MET 729 CO -0.36 0.69 -0.41 -0.44 1.06 0.00 0.00 176.91 177.45 1ggk h ASP 730 N 0.00 0.32 -0.37 1.22 3.32 -1.78 -0.97 116.42 118.17 1ggk h ASP 730 Ca -0.01 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 56.80 1ggk h ASP 730 Cb 1.29 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.74 1ggk h ASP 730 CO 0.09 0.70 -0.18 -0.08 -1.72 0.00 0.00 179.24 178.04 1ggk h GLU 731 N 0.25 0.78 -0.01 3.56 4.81 -1.32 -1.16 114.58 121.49 1ggk h GLU 731 Ca 0.02 -0.34 -0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1ggk h GLU 731 Cb 0.83 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.19 1ggk h GLU 731 CO 0.07 0.96 -0.01 1.25 -0.73 0.00 0.00 179.01 180.55 1ggk h LEU 732 N 0.57 0.03 -1.78 1.64 6.46 -1.39 -2.70 115.31 118.13 1ggk h LEU 732 Ca 0.08 -0.47 -0.03 0.00 -0.12 0.00 0.00 57.88 57.34 1ggk h LEU 732 Cb 0.73 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.65 1ggk h LEU 732 CO 0.06 0.50 -0.15 -0.07 -0.62 0.00 0.00 178.44 178.16 1ggk h LEU 733 N -0.44 0.00 -0.24 2.25 4.07 -1.21 -1.62 115.31 118.12 1ggk h LEU 733 Ca 0.00 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.82 1ggk h LEU 733 Cb 0.49 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.23 1ggk h LEU 733 CO 0.00 0.15 -0.40 0.74 -1.08 0.00 0.00 178.44 177.86 1ggk h THR 734 N 0.00 1.31 -0.25 0.22 2.02 -1.15 -3.00 112.91 112.07 1ggk h THR 734 Ca -0.00 -1.60 -0.01 0.00 0.77 0.00 0.00 66.41 65.57 1ggk h THR 734 Cb 0.39 1.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 1ggk h THR 734 CO 0.02 0.51 0.11 -0.07 0.37 0.00 0.00 175.52 176.45 1ggk h LEU 735 N 0.42 0.33 -1.78 2.58 3.38 -1.04 -2.76 115.31 116.44 1ggk h LEU 735 Ca 0.02 -0.15 0.21 0.00 0.09 0.00 0.00 57.88 58.05 1ggk h LEU 735 Cb 0.99 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 1ggk h LEU 735 CO 0.09 0.39 0.58 0.24 0.09 0.00 0.00 178.44 179.83 1ggk h MET 736 N 0.25 0.18 0.00 1.13 2.86 -1.31 0.32 114.93 118.36 1ggk h MET 736 Ca 0.08 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1ggk h MET 736 Cb 0.16 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1ggk h MET 736 CO -0.01 0.12 -0.17 0.00 1.06 0.00 0.00 176.91 177.91 1ggk h ALA 737 N 1.61 1.59 -0.12 6.32 0.00 -1.34 -2.07 119.26 125.25 1ggk h ALA 737 Ca 0.41 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1ggk h ALA 737 Cb 1.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ggk h ALA 737 CO -0.08 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.38 1ggk n ALA 738 N -2.45 2.54 0.00 0.00 0.00 0.11 -4.25 120.51 116.46 1ggk n ALA 738 Ca -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1ggk n ALA 738 Cb 0.25 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.57 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 0.23 0.00 -4.12 0.00 -0.00 -0.78 -4.81 115.22 105.74 1ggk n HIS 739 Ca 0.17 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.77 1ggk n HIS 739 Cb 0.33 0.00 -0.11 0.00 -0.00 0.00 0.00 29.99 30.21 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 0.71 -1.08 1.57 1.81 -1.26 -4.83 118.95 115.86 1ggk s ARG 740 Ca 0.00 -1.09 -0.17 0.00 -1.72 0.00 0.00 55.73 52.76 1ggk s ARG 740 Cb 0.00 -0.25 0.14 0.00 -0.45 0.00 0.00 34.95 34.39 1ggk s ARG 740 CO 0.00 0.01 1.32 0.08 -0.68 0.00 0.00 175.30 176.04 1ggk s VAL 741 N -2.64 4.77 0.55 3.52 1.01 0.25 -4.87 120.40 122.99 1ggk s VAL 741 Ca 0.02 -2.01 0.30 0.00 0.00 0.00 0.00 61.98 60.30 1ggk s VAL 741 Cb -0.01 -4.88 0.35 0.00 0.00 0.00 0.00 36.38 31.83 1ggk s VAL 741 CO -0.02 -1.62 2.22 -0.50 0.00 0.00 0.00 175.10 175.18 1ggk h TRP 742 N 8.08 0.00 0.00 5.22 4.06 -1.93 -2.79 115.95 128.58 1ggk h TRP 742 Ca 0.25 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.20 1ggk h TRP 742 Cb 0.95 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.11 1ggk h TRP 742 CO 1.16 0.03 0.00 -1.13 -3.56 0.00 0.00 178.44 174.94 1ggk n SER 743 N -3.74 0.28 -0.11 -3.49 3.41 -1.26 -2.90 113.62 105.81 1ggk n SER 743 Ca -0.03 0.55 0.14 0.00 -0.26 0.00 0.00 58.87 59.27 1ggk n SER 743 Cb 0.12 -0.61 0.65 0.00 -0.26 0.00 0.00 64.21 64.10 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 -1.78 0.72 0.09 4.33 0.63 -1.05 -4.35 116.66 115.24 1ggk n ARG 744 Ca 0.05 -0.22 -0.13 0.00 -0.92 0.00 0.00 57.85 56.63 1ggk n ARG 744 Cb 0.29 -1.50 -0.06 0.00 0.45 0.00 0.00 32.46 31.64 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 0.54 0.23 -1.20 5.15 2.04 -1.73 -1.08 117.51 121.46 1ggk h ILE 745 Ca 0.00 0.00 0.35 0.00 1.00 0.00 0.00 64.86 66.21 1ggk h ILE 745 Cb 0.33 0.23 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 1ggk h ILE 745 CO 0.00 0.00 0.86 1.55 0.00 0.00 0.00 178.15 180.56 1ggk h PRO 746 N -0.56 0.01 0.00 2.37 0.13 -1.87 -0.99 132.00 131.08 1ggk h PRO 746 Ca 0.04 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1ggk h PRO 746 Cb 0.62 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.75 1ggk h PRO 746 CO -0.26 0.00 -0.40 1.63 -0.23 0.00 0.00 178.00 178.75 1ggk n LYS 747 N -4.18 0.07 0.17 0.86 5.02 -0.41 -4.44 118.16 115.25 1ggk n LYS 747 Ca 0.26 0.02 0.03 0.00 -2.02 0.00 0.00 58.31 56.60 1ggk n LYS 747 Cb 1.25 -1.55 0.31 0.00 -0.02 0.00 0.00 35.03 35.03 1ggk n LYS 747 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 1ggk h ILE 748 N 0.00 1.16 -0.98 -0.18 3.07 -1.15 -3.26 117.51 116.17 1ggk h ILE 748 Ca 0.00 -1.59 0.24 0.00 1.55 0.00 0.00 64.86 65.06 1ggk h ILE 748 Cb 0.56 1.89 -0.12 0.00 -0.27 0.00 0.00 36.82 38.88 1ggk h ILE 748 CO 0.00 0.43 0.56 0.44 -1.05 0.00 0.00 178.15 178.53 1ggk h ASP 749 N 0.00 0.62 -0.24 2.16 3.32 -1.78 -1.84 116.42 118.67 1ggk h ASP 749 Ca -0.00 0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1ggk h ASP 749 Cb 0.86 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.45 1ggk h ASP 749 CO 0.06 0.10 0.00 0.29 -1.72 0.00 0.00 179.24 177.97 1ggk n LYS 750 N -4.90 1.64 -4.06 3.56 4.01 -1.23 -4.85 118.16 112.33 1ggk n LYS 750 Ca 0.26 -0.99 -0.35 0.00 -0.51 0.00 0.00 58.31 56.72 1ggk n LYS 750 Cb 0.72 -1.27 -0.13 0.00 -0.51 0.00 0.00 35.03 33.84 1ggk n LYS 750 CO 0.00 0.00 0.00 -1.50 -1.11 0.00 0.00 177.40 174.79 1ggk s ILE 751 N -1.69 3.97 -1.13 -0.18 1.10 -0.69 -5.04 121.20 117.54 1ggk s ILE 751 Ca 0.23 -0.31 -0.20 0.00 -0.51 0.00 0.00 60.65 59.87 1ggk s ILE 751 Cb 0.12 -2.80 0.08 0.00 0.15 0.00 0.00 42.46 40.01 1ggk s ILE 751 CO 0.17 0.42 1.52 -2.16 -2.11 0.00 0.00 174.94 172.79 1ggk s PRO 752 N 1.02 3.79 0.00 3.50 0.04 -1.26 -5.05 135.00 137.04 1ggk s PRO 752 Ca 0.02 -1.67 0.00 0.00 0.04 0.00 0.00 61.00 59.39 1ggk s PRO 752 Cb -0.14 -5.35 0.00 0.00 0.04 0.00 0.00 34.50 29.05 1ggk s PRO 752 CO 0.02 -2.14 0.08 0.00 0.04 0.00 0.00 177.00 175.00