#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mka s ASP 2 N 0.00 6.38 0.28 4.52 1.11 -1.26 -4.96 116.67 122.74 1mka s ASP 2 Ca 0.00 -1.53 -0.30 0.00 0.18 0.00 0.00 52.55 50.90 1mka s ASP 2 Cb 0.00 -2.40 -0.12 0.00 1.07 0.00 0.00 42.92 41.47 1mka s ASP 2 CO 0.00 -1.23 1.49 0.29 1.18 0.00 0.00 175.17 176.90 1mka n LYS 3 N 7.02 2.38 -4.34 8.23 5.02 -1.26 -5.02 118.16 130.18 1mka n LYS 3 Ca 0.08 0.85 -0.26 0.00 -2.02 0.00 0.00 58.31 56.96 1mka n LYS 3 Cb 0.47 -2.56 -0.13 0.00 -0.02 0.00 0.00 35.03 32.79 1mka n LYS 3 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1mka s ARG 4 N -0.60 1.28 0.32 1.97 0.52 -1.26 -5.03 118.95 116.15 1mka s ARG 4 Ca 0.65 -1.29 0.26 0.00 -0.52 0.00 0.00 55.73 54.83 1mka s ARG 4 Cb -0.57 -1.63 0.87 0.00 0.52 0.00 0.00 34.95 34.14 1mka s ARG 4 CO 0.50 0.38 1.76 1.49 0.02 0.00 0.00 175.30 179.45 1mka h GLU 5 N 3.85 0.00 -3.26 3.54 4.81 -1.96 -3.45 114.58 118.11 1mka h GLU 5 Ca -0.48 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.67 1mka h GLU 5 Cb 1.18 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 30.40 1mka h GLU 5 CO 0.41 0.00 -0.19 -1.54 -0.73 0.00 0.00 179.01 176.96 1mka s SER 6 N -4.93 -0.17 -0.00 1.04 1.04 -1.26 -1.08 113.70 108.33 1mka s SER 6 Ca 0.07 -0.18 0.01 0.00 0.48 0.00 0.00 55.95 56.33 1mka s SER 6 Cb 0.10 0.39 -0.00 0.00 0.10 0.00 0.00 66.02 66.61 1mka s SER 6 CO 0.54 -0.67 -0.04 -0.31 0.98 0.00 0.00 173.24 173.74 1mka s TYR 7 N -2.77 0.36 0.66 5.02 1.51 -0.54 -5.00 117.35 116.59 1mka s TYR 7 Ca -0.03 -0.07 -0.00 0.00 -1.01 0.00 0.00 57.07 55.96 1mka s TYR 7 Cb -0.00 -0.23 0.09 0.00 -0.11 0.00 0.00 41.96 41.71 1mka s TYR 7 CO -0.05 -0.01 0.92 0.95 -1.11 0.00 0.00 175.55 176.25 1mka s THR 8 N -0.10 2.32 0.22 -0.71 -4.23 -1.26 -1.23 115.64 110.66 1mka s THR 8 Ca 0.02 -0.61 -0.08 0.00 -1.18 0.00 0.00 61.69 59.84 1mka s THR 8 Cb -0.02 -2.71 0.16 0.00 1.34 0.00 0.00 72.50 71.27 1mka s THR 8 CO -0.00 0.00 1.80 0.50 -0.54 0.00 0.00 174.62 176.37 1mka h LYS 9 N -0.31 0.64 -0.31 3.99 1.63 -1.91 -0.34 116.57 119.96 1mka h LYS 9 Ca -0.39 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.33 1mka h LYS 9 Cb 1.28 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 32.75 1mka h LYS 9 CO 0.45 0.43 -0.01 0.93 -3.45 0.00 0.00 179.45 177.80 1mka h GLU 10 N 0.66 0.47 -0.42 1.90 4.39 -1.94 -1.17 114.58 118.47 1mka h GLU 10 Ca 0.33 -0.10 -0.13 0.00 0.34 0.00 0.00 59.36 59.81 1mka h GLU 10 Cb 0.28 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 1mka h GLU 10 CO -0.22 0.51 -0.25 -0.44 -1.16 0.00 0.00 179.01 177.44 1mka h ASP 11 N 0.45 0.91 0.43 1.42 3.32 -1.47 -1.38 116.42 120.09 1mka h ASP 11 Ca 0.10 -0.35 -0.11 0.00 0.02 0.00 0.00 57.03 56.69 1mka h ASP 11 Cb 0.31 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1mka h ASP 11 CO 0.01 1.10 -0.48 -0.07 -1.72 0.00 0.00 179.24 178.08 1mka h LEU 12 N 0.76 0.07 -0.32 1.55 3.38 -0.64 -0.63 115.31 119.48 1mka h LEU 12 Ca 0.09 -0.03 -0.20 0.00 0.09 0.00 0.00 57.88 57.84 1mka h LEU 12 Cb 0.80 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1mka h LEU 12 CO 0.07 0.54 -0.73 -0.07 0.09 0.00 0.00 178.44 178.34 1mka h LEU 13 N 0.05 0.67 -0.78 1.67 3.38 -1.05 -2.09 115.31 117.17 1mka h LEU 13 Ca -0.00 -0.43 -0.11 0.00 0.09 0.00 0.00 57.88 57.43 1mka h LEU 13 Cb 0.87 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1mka h LEU 13 CO 0.07 1.19 -0.26 0.00 0.09 0.00 0.00 178.44 179.53 1mka h ALA 14 N 0.80 0.96 -0.61 1.53 0.00 -0.93 -2.69 119.26 118.31 1mka h ALA 14 Ca -0.03 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.52 1mka h ALA 14 Cb 1.32 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1mka h ALA 14 CO 0.14 0.61 0.39 1.03 0.00 0.00 0.00 179.25 181.41 1mka h SER 15 N 0.55 0.65 0.30 0.00 0.87 -0.95 -0.68 113.55 114.29 1mka h SER 15 Ca 0.07 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 1mka h SER 15 Cb 0.73 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 62.54 1mka h SER 15 CO 0.06 0.46 -0.06 1.23 -0.53 0.00 0.00 176.83 177.99 1mka h GLY 16 N 0.78 0.00 -0.45 5.77 0.00 -1.06 -1.46 103.07 106.64 1mka h GLY 16 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1mka h GLY 16 CO -0.08 0.00 -0.22 0.54 0.00 0.00 0.00 176.54 176.79 1mka n ARG 17 N -3.48 1.29 -0.88 4.80 1.74 -0.54 -4.73 116.66 114.86 1mka n ARG 17 Ca -0.02 -0.88 0.00 0.00 -0.77 0.00 0.00 57.85 56.18 1mka n ARG 17 Cb 0.18 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 1mka n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1mka n GLY 18 N 1.32 0.53 0.09 -0.13 0.00 -0.55 -4.95 105.19 101.50 1mka n GLY 18 Ca 0.13 -0.33 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 1mka n GLY 18 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1mka h GLU 19 N 0.90 0.08 0.45 1.61 5.08 -1.39 -3.22 114.58 118.10 1mka h GLU 19 Ca 0.00 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.21 1mka h GLU 19 Cb 0.00 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1mka h GLU 19 CO 0.00 0.75 -0.21 1.25 -1.00 0.00 0.00 179.01 179.79 1mka h LEU 20 N 0.02 -0.51 -3.04 1.33 5.85 -1.84 -3.22 115.31 113.91 1mka h LEU 20 Ca -0.27 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1mka h LEU 20 Cb 1.99 0.13 0.00 0.00 0.37 0.00 0.00 40.66 43.15 1mka h LEU 20 CO 0.10 -0.22 0.00 0.49 -0.34 0.00 0.00 178.44 178.47 1mka n PHE 21 N -5.27 1.30 -0.21 1.25 3.72 -1.26 -4.99 117.46 112.00 1mka n PHE 21 Ca -0.11 -0.59 0.03 0.00 -0.05 0.00 0.00 57.45 56.73 1mka n PHE 21 Cb 0.29 -0.18 -0.01 0.00 -0.94 0.00 0.00 39.48 38.65 1mka n PHE 21 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1mka n GLY 22 N 1.19 -1.97 0.35 1.37 0.00 -1.21 -3.39 105.19 101.53 1mka n GLY 22 Ca 0.25 -1.45 0.18 0.00 0.00 0.00 0.00 46.02 45.00 1mka n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mka h ALA 23 N -0.20 1.73 -0.01 4.61 0.00 -1.91 -2.53 119.26 120.94 1mka h ALA 23 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1mka h ALA 23 Cb 0.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1mka h ALA 23 CO 0.01 -0.41 -0.54 1.63 0.00 0.00 0.00 179.25 179.93 1mka n LYS 24 N -3.46 1.30 -2.49 0.00 5.02 -1.26 -4.98 118.16 112.29 1mka n LYS 24 Ca 0.02 -0.64 -0.24 0.00 -2.02 0.00 0.00 58.31 55.43 1mka n LYS 24 Cb 0.43 -1.38 0.04 0.00 -0.02 0.00 0.00 35.03 34.10 1mka n LYS 24 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1mka s GLY 25 N -2.36 1.68 0.78 0.72 0.00 -0.96 -0.57 107.32 106.62 1mka s GLY 25 Ca 0.13 -0.98 -0.11 0.00 0.00 0.00 0.00 44.72 43.76 1mka s GLY 25 CO 0.57 -0.68 1.09 2.56 0.00 0.00 0.00 173.10 176.64 1mka s PRO 26 N -4.95 2.17 0.10 2.90 0.04 -1.08 -4.63 135.00 129.55 1mka s PRO 26 Ca 0.56 1.06 0.09 0.00 0.04 0.00 0.00 61.00 62.74 1mka s PRO 26 Cb -0.10 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1mka s PRO 26 CO 0.42 -1.67 -0.20 -0.65 0.04 0.00 0.00 177.00 174.94 1mka s GLN 27 N -4.94 1.77 0.44 4.56 -0.21 -1.26 -4.78 119.66 115.24 1mka s GLN 27 Ca 0.61 -1.17 -0.04 0.00 0.02 0.00 0.00 55.36 54.78 1mka s GLN 27 Cb -0.17 -2.08 -0.04 0.00 1.00 0.00 0.00 33.01 31.73 1mka s GLN 27 CO 0.56 0.49 0.73 -0.51 -2.12 0.00 0.00 175.29 174.44 1mka s LEU 28 N -1.92 3.73 0.81 2.90 1.43 -1.23 -4.78 118.68 119.62 1mka s LEU 28 Ca 0.16 0.83 -0.11 0.00 -1.03 0.00 0.00 54.13 53.98 1mka s LEU 28 Cb -0.10 -3.75 0.08 0.00 0.03 0.00 0.00 46.19 42.44 1mka s LEU 28 CO 0.08 -0.50 1.10 -2.84 0.23 0.00 0.00 176.35 174.41 1mka s PRO 29 N -4.58 1.93 0.34 1.29 0.02 -1.26 -4.07 135.00 128.66 1mka s PRO 29 Ca 0.46 1.15 0.06 0.00 0.02 0.00 0.00 61.00 62.69 1mka s PRO 29 Cb -0.10 -1.86 -0.01 0.00 0.02 0.00 0.00 34.50 32.55 1mka s PRO 29 CO 0.42 -1.87 0.48 0.00 -0.33 0.00 0.00 177.00 175.70 1mka s ALA 30 N -2.88 4.25 0.62 -1.55 0.00 -1.26 -4.09 121.76 116.85 1mka s ALA 30 Ca 0.62 -1.46 -0.18 0.00 0.00 0.00 0.00 51.96 50.94 1mka s ALA 30 Cb -0.18 -1.69 -0.03 0.00 0.00 0.00 0.00 23.12 21.23 1mka s ALA 30 CO 0.56 -0.05 1.16 -2.30 0.00 0.00 0.00 175.76 175.13 1mka n PRO 31 N -1.66 1.05 -0.16 0.00 -0.02 -1.26 -0.62 135.00 132.34 1mka n PRO 31 Ca 0.00 0.41 0.03 0.00 -2.02 0.00 0.00 63.50 61.93 1mka n PRO 31 Cb 0.58 -2.38 0.11 0.00 -0.02 0.00 0.00 33.50 31.79 1mka n PRO 31 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1mka n ASN 32 N -1.36 1.54 0.06 2.55 5.03 -1.26 -4.83 115.26 116.99 1mka n ASN 32 Ca 0.15 -2.06 0.11 0.00 0.87 0.00 0.00 54.58 53.65 1mka n ASN 32 Cb 0.47 -0.25 0.04 0.00 -1.02 0.00 0.00 39.78 39.03 1mka n ASN 32 CO 0.00 0.00 0.00 0.23 -1.83 0.00 0.00 177.26 175.66 1mka n MET 33 N 0.19 0.43 -1.86 3.52 2.81 0.21 -4.85 117.12 117.57 1mka n MET 33 Ca 0.08 0.05 -0.42 0.00 -1.81 0.00 0.00 57.70 55.60 1mka n MET 33 Cb 0.28 -1.69 -0.03 0.00 -0.71 0.00 0.00 33.22 31.07 1mka n MET 33 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 1mka s LEU 34 N -4.54 4.23 -0.28 4.03 2.96 -0.93 -4.86 118.68 119.29 1mka s LEU 34 Ca 0.02 2.30 0.12 0.00 -0.22 0.00 0.00 54.13 56.34 1mka s LEU 34 Cb 0.12 -3.53 0.67 0.00 0.50 0.00 0.00 46.19 43.95 1mka s LEU 34 CO 0.79 -1.11 1.67 0.23 -1.32 0.00 0.00 176.35 176.61 1mka n MET 35 N 7.50 3.35 -3.88 1.98 2.81 -1.26 -4.84 117.12 122.77 1mka n MET 35 Ca 0.20 -3.06 -0.10 0.00 -1.81 0.00 0.00 57.70 52.93 1mka n MET 35 Cb 0.43 -2.08 -0.09 0.00 -0.71 0.00 0.00 33.22 30.76 1mka n MET 35 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1mka s MET 36 N -2.99 0.61 -0.06 0.03 -1.94 -1.26 -4.73 119.30 108.96 1mka s MET 36 Ca 0.51 -0.63 0.15 0.00 -1.71 0.00 0.00 55.69 54.00 1mka s MET 36 Cb 0.41 0.25 -0.22 0.00 2.01 0.00 0.00 34.83 37.28 1mka s MET 36 CO 0.11 -0.16 0.25 -0.25 -0.01 0.00 0.00 175.02 174.96 1mka n ASP 37 N 0.87 1.44 -3.47 3.03 8.00 0.13 -4.95 116.55 121.60 1mka n ASP 37 Ca -0.20 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.20 1mka n ASP 37 Cb 0.58 1.45 -0.02 0.00 -0.02 0.00 0.00 41.12 43.11 1mka n ASP 37 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mka s ARG 38 N -2.86 1.02 -0.26 -1.24 1.70 -1.09 -2.63 118.95 113.60 1mka s ARG 38 Ca -0.06 -0.37 -0.00 0.00 -0.47 0.00 0.00 55.73 54.83 1mka s ARG 38 Cb 0.08 0.47 0.04 0.00 -0.57 0.00 0.00 34.95 34.97 1mka s ARG 38 CO 0.63 -0.44 -0.07 0.08 -1.08 0.00 0.00 175.30 174.42 1mka s VAL 39 N -3.36 2.65 -0.01 4.99 1.01 -0.36 -1.53 120.40 123.79 1mka s VAL 39 Ca 0.03 -1.29 0.11 0.00 0.00 0.00 0.00 61.98 60.84 1mka s VAL 39 Cb -0.01 -2.43 -0.15 0.00 0.00 0.00 0.00 36.38 33.79 1mka s VAL 39 CO -0.10 0.08 1.11 -0.37 0.00 0.00 0.00 175.10 175.81 1mka h VAL 40 N 6.38 1.18 -2.61 2.92 -1.51 -1.23 -1.43 116.25 119.96 1mka h VAL 40 Ca -0.27 -2.83 -0.11 0.00 -1.23 0.00 0.00 66.70 62.27 1mka h VAL 40 Cb 1.08 2.56 -0.24 0.00 -2.13 0.00 0.00 31.29 32.56 1mka h VAL 40 CO 0.54 0.67 -0.19 -0.75 -1.23 0.00 0.00 177.57 176.61 1mka s LYS 41 N -2.76 0.52 -0.04 5.19 2.20 -1.06 -4.57 119.74 119.22 1mka s LYS 41 Ca -0.00 0.67 -0.02 0.00 -0.36 0.00 0.00 55.97 56.26 1mka s LYS 41 Cb 0.09 0.22 0.03 0.00 -1.51 0.00 0.00 37.83 36.66 1mka s LYS 41 CO 0.81 -0.08 0.08 -1.64 -0.36 0.00 0.00 175.35 174.15 1mka s MET 42 N 0.44 -0.03 -0.02 4.03 -1.94 -0.24 -1.13 119.30 120.40 1mka s MET 42 Ca -0.02 0.36 -0.01 0.00 -1.71 0.00 0.00 55.69 54.31 1mka s MET 42 Cb -0.04 -0.37 0.01 0.00 2.01 0.00 0.00 34.83 36.44 1mka s MET 42 CO -0.02 -0.27 0.04 0.95 -0.01 0.00 0.00 175.02 175.71 1mka s THR 43 N 1.80 -0.02 -0.77 2.05 -4.23 -0.54 -4.68 115.64 109.26 1mka s THR 43 Ca -0.00 0.07 0.25 0.00 -1.18 0.00 0.00 61.69 60.83 1mka s THR 43 Cb -0.12 -0.07 0.26 0.00 1.34 0.00 0.00 72.50 73.91 1mka s THR 43 CO -0.04 0.03 1.78 -1.84 -0.54 0.00 0.00 174.62 174.01 1mka n GLU 44 N 3.43 0.17 -1.87 3.99 0.28 -1.26 -0.98 120.64 124.41 1mka n GLU 44 Ca -0.17 0.21 -0.01 0.00 -0.16 0.00 0.00 57.16 57.02 1mka n GLU 44 Cb 0.57 -1.73 -0.00 0.00 1.43 0.00 0.00 31.44 31.71 1mka n GLU 44 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1mka n THR 45 N -2.04 0.00 -0.25 3.84 -2.24 -1.26 -2.77 114.28 109.57 1mka n THR 45 Ca 0.05 -0.11 0.03 0.00 -2.27 0.00 0.00 64.05 61.76 1mka n THR 45 Cb 0.36 -0.23 -0.01 0.00 -2.10 0.00 0.00 70.33 68.35 1mka n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mka n GLY 46 N 4.71 -1.72 0.00 3.38 0.00 -1.26 -3.66 105.19 106.64 1mka n GLY 46 Ca -0.01 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1mka n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mka n GLY 47 N -2.18 0.16 0.38 -0.02 0.00 -1.26 -1.33 105.19 100.94 1mka n GLY 47 Ca -0.00 -1.80 0.20 0.00 0.00 0.00 0.00 46.02 44.42 1mka n GLY 47 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1mka h ASN 48 N 0.00 0.00 -0.24 1.61 2.35 -1.90 -0.88 115.58 116.51 1mka h ASN 48 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1mka h ASN 48 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1mka h ASN 48 CO 0.00 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.27 1mka n PHE 49 N -4.11 0.32 -3.40 1.19 3.72 -1.26 -4.98 117.46 108.94 1mka n PHE 49 Ca 0.08 -0.46 -0.24 0.00 -0.05 0.00 0.00 57.45 56.79 1mka n PHE 49 Cb 0.59 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.11 1mka n PHE 49 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1mka n ASP 50 N 0.29 -4.13 0.00 4.37 8.00 -0.34 -4.83 116.55 119.91 1mka n ASP 50 Ca 0.08 -0.44 0.00 0.00 0.71 0.00 0.00 54.79 55.15 1mka n ASP 50 Cb 0.37 -3.39 0.00 0.00 -0.02 0.00 0.00 41.12 38.08 1mka n ASP 50 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1mka n LYS 51 N -3.88 1.14 0.00 -1.24 5.02 -1.01 -4.02 118.16 114.17 1mka n LYS 51 Ca -0.02 -0.98 0.00 0.00 -2.02 0.00 0.00 58.31 55.30 1mka n LYS 51 Cb 0.55 -0.94 0.00 0.00 -0.02 0.00 0.00 35.03 34.62 1mka n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mka n GLY 52 N -0.25 4.68 3.34 0.72 0.00 -0.44 -4.65 105.19 108.58 1mka n GLY 52 Ca 0.00 -1.10 -0.14 0.00 0.00 0.00 0.00 46.02 44.78 1mka n GLY 52 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1mka s TYR 53 N -1.79 -0.43 -0.04 1.61 5.04 -0.15 -1.65 117.35 119.94 1mka s TYR 53 Ca 0.00 0.97 -0.02 0.00 -2.44 0.00 0.00 57.07 55.58 1mka s TYR 53 Cb 0.00 0.17 0.02 0.00 0.35 0.00 0.00 41.96 42.51 1mka s TYR 53 CO 0.00 -0.31 0.08 0.54 -1.34 0.00 0.00 175.55 174.52 1mka s VAL 54 N -0.28 -0.03 -0.08 3.14 0.11 -0.74 -1.46 120.40 121.06 1mka s VAL 54 Ca -0.04 0.09 0.03 0.00 -2.93 0.00 0.00 61.98 59.13 1mka s VAL 54 Cb -0.03 -0.14 0.01 0.00 -1.53 0.00 0.00 36.38 34.69 1mka s VAL 54 CO 0.02 0.04 -0.16 -0.70 -3.33 0.00 0.00 175.10 170.97 1mka s GLU 55 N 0.56 2.15 0.22 1.54 2.12 -0.28 -0.39 118.70 124.62 1mka s GLU 55 Ca -0.04 -0.56 0.02 0.00 0.36 0.00 0.00 54.97 54.74 1mka s GLU 55 Cb -0.06 -1.73 -0.05 0.00 0.26 0.00 0.00 34.13 32.55 1mka s GLU 55 CO -0.02 0.05 0.05 0.00 -0.54 0.00 0.00 175.26 174.79 1mka s ALA 56 N 0.64 1.57 0.05 6.30 0.00 -0.40 -0.78 121.76 129.14 1mka s ALA 56 Ca -0.14 -1.74 0.00 0.00 0.00 0.00 0.00 51.96 50.08 1mka s ALA 56 Cb -0.16 0.78 -0.03 0.00 0.00 0.00 0.00 23.12 23.71 1mka s ALA 56 CO 0.04 -0.38 -0.04 -1.21 0.00 0.00 0.00 175.76 174.17 1mka s GLU 57 N -3.97 0.52 -0.08 0.00 2.02 -0.58 -0.82 118.70 115.80 1mka s GLU 57 Ca 0.31 -0.94 -0.01 0.00 0.02 0.00 0.00 54.97 54.35 1mka s GLU 57 Cb 0.07 0.02 0.03 0.00 0.10 0.00 0.00 34.13 34.34 1mka s GLU 57 CO 0.09 -0.05 -0.03 -1.17 0.02 0.00 0.00 175.26 174.12 1mka s LEU 58 N -2.18 0.92 0.11 1.80 2.96 -0.14 0.17 118.68 122.32 1mka s LEU 58 Ca -0.03 -0.16 -0.29 0.00 -0.22 0.00 0.00 54.13 53.43 1mka s LEU 58 Cb -0.02 -0.56 -0.06 0.00 0.50 0.00 0.00 46.19 46.05 1mka s LEU 58 CO -0.04 -0.14 0.92 -1.81 -1.32 0.00 0.00 176.35 173.96 1mka s ASP 59 N 1.66 7.46 -0.08 3.68 1.01 -1.26 -0.88 116.67 128.26 1mka s ASP 59 Ca 0.01 1.75 -0.03 0.00 0.71 0.00 0.00 52.55 54.99 1mka s ASP 59 Cb -0.13 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.20 1mka s ASP 59 CO -0.05 -0.03 0.06 -0.63 0.21 0.00 0.00 175.17 174.73 1mka s ILE 60 N -0.14 4.75 -0.05 0.77 -1.09 -0.28 -4.96 121.20 120.20 1mka s ILE 60 Ca 0.45 -0.14 -0.21 0.00 -2.23 0.00 0.00 60.65 58.52 1mka s ILE 60 Cb -0.23 -3.05 0.04 0.00 -1.58 0.00 0.00 42.46 37.64 1mka s ILE 60 CO 0.29 0.56 0.46 0.54 -1.23 0.00 0.00 174.94 175.56 1mka s ASN 61 N -1.08 -0.40 0.63 3.58 2.20 -1.26 -4.64 114.94 113.97 1mka s ASN 61 Ca 0.16 0.42 0.30 0.00 -0.94 0.00 0.00 52.86 52.80 1mka s ASN 61 Cb -0.12 0.48 1.64 0.00 -2.00 0.00 0.00 41.25 41.26 1mka s ASN 61 CO 0.05 -0.47 1.98 -0.65 -2.94 0.00 0.00 177.10 175.07 1mka h PRO 62 N 3.77 0.00 -0.00 3.55 0.11 -1.92 -2.65 132.00 134.85 1mka h PRO 62 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1mka h PRO 62 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1mka h PRO 62 CO 0.37 0.00 -0.09 -0.25 -0.21 0.00 0.00 178.00 177.82 1mka n ASP 63 N -3.32 0.48 -4.70 -2.05 8.00 -1.26 -4.80 116.55 108.91 1mka n ASP 63 Ca 0.02 -0.67 -0.44 0.00 0.71 0.00 0.00 54.79 54.41 1mka n ASP 63 Cb 0.43 -0.07 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 1mka n ASP 63 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1mka n LEU 64 N -0.89 3.58 -0.31 0.64 4.77 -1.00 -4.86 117.00 118.92 1mka n LEU 64 Ca 0.16 1.13 0.05 0.00 -0.03 0.00 0.00 56.01 57.32 1mka n LEU 64 Cb 0.27 -1.49 0.14 0.00 -2.33 0.00 0.00 43.42 40.00 1mka n LEU 64 CO 0.23 -0.21 0.71 4.11 -1.33 0.00 0.00 177.39 180.89 1mka h TRP 65 N 4.79 -0.40 0.00 -1.77 5.08 -1.93 -1.81 115.95 119.92 1mka h TRP 65 Ca -0.45 0.08 -0.00 0.00 1.08 0.00 0.00 58.89 59.59 1mka h TRP 65 Cb 1.25 0.31 -0.00 0.00 -3.00 0.00 0.00 29.16 27.73 1mka h TRP 65 CO 0.58 -0.38 -0.01 0.27 -1.28 0.00 0.00 178.44 177.62 1mka h PHE 66 N 0.01 0.00 0.00 0.12 -5.15 -1.97 -2.31 116.94 107.64 1mka h PHE 66 Ca 0.44 0.00 -0.09 0.00 -0.20 0.00 0.00 57.97 58.13 1mka h PHE 66 Cb 0.71 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.87 1mka h PHE 66 CO -0.65 0.01 -0.41 0.74 -2.00 0.00 0.00 178.31 176.00 1mka h PHE 67 N 0.00 0.00 0.00 6.09 0.04 -1.61 -1.59 116.94 119.87 1mka h PHE 67 Ca -0.00 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.73 1mka h PHE 67 Cb 0.05 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 1mka h PHE 67 CO 0.00 0.41 -0.19 0.78 -0.60 0.00 0.00 178.31 178.71 1mka h GLY 68 N 1.33 0.00 0.00 -1.45 0.00 -1.55 -3.36 103.07 98.05 1mka h GLY 68 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1mka h GLY 68 CO 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 176.54 176.24 1mka s HIS 70 N -1.55 2.28 0.35 0.00 5.65 -0.61 -3.96 115.29 117.44 1mka s HIS 70 Ca 0.01 -2.71 0.09 0.00 0.25 0.00 0.00 55.06 52.69 1mka s HIS 70 Cb 0.03 -1.90 -0.05 0.00 -1.18 0.00 0.00 32.58 29.48 1mka s HIS 70 CO 0.18 -0.72 0.06 -0.06 -0.65 0.00 0.00 174.74 173.56 1mka s PHE 71 N -0.34 2.60 -0.01 3.88 0.40 -0.05 -1.06 117.98 123.40 1mka s PHE 71 Ca 0.24 -0.44 -0.30 0.00 -0.60 0.00 0.00 56.93 55.84 1mka s PHE 71 Cb -0.10 -1.57 -0.07 0.00 0.51 0.00 0.00 43.02 41.79 1mka s PHE 71 CO -0.11 0.42 1.78 0.42 0.70 0.00 0.00 175.22 178.43 1mka s ILE 72 N -2.50 3.32 0.00 0.64 1.01 -1.25 -1.15 121.20 121.26 1mka s ILE 72 Ca 0.36 0.42 0.00 0.00 0.00 0.00 0.00 60.65 61.43 1mka s ILE 72 Cb -0.00 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.20 1mka s ILE 72 CO 0.20 -0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.72 1mka n GLY 73 N 4.29 0.75 2.68 6.18 0.00 -1.26 -4.87 105.19 112.95 1mka n GLY 73 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 1mka n GLY 73 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1mka n ASP 74 N 0.00 -2.30 -4.71 1.61 2.03 -0.30 -5.13 116.55 107.75 1mka n ASP 74 Ca 0.00 -3.40 -0.42 0.00 0.52 0.00 0.00 54.79 51.49 1mka n ASP 74 Cb 0.00 1.58 -0.03 0.00 -0.72 0.00 0.00 41.12 41.95 1mka n ASP 74 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1mka s PRO 75 N 0.25 4.20 -0.22 -0.67 0.04 -1.14 -0.87 135.00 136.60 1mka s PRO 75 Ca 0.29 2.38 -0.16 0.00 0.04 0.00 0.00 61.00 63.55 1mka s PRO 75 Cb 0.25 -3.30 0.06 0.00 0.04 0.00 0.00 34.50 31.56 1mka s PRO 75 CO -0.16 -0.66 0.56 0.54 0.04 0.00 0.00 177.00 177.32 1mka s VAL 76 N 1.65 -0.01 0.15 -0.36 0.11 -0.22 -4.51 120.40 117.20 1mka s VAL 76 Ca 0.72 0.03 -0.31 0.00 -2.93 0.00 0.00 61.98 59.48 1mka s VAL 76 Cb -0.43 -0.81 -0.10 0.00 -1.53 0.00 0.00 36.38 33.51 1mka s VAL 76 CO 0.32 0.01 1.61 -0.32 -3.33 0.00 0.00 175.10 173.39 1mka s MET 77 N 1.06 4.20 0.21 1.54 1.75 -0.44 -4.56 119.30 123.04 1mka s MET 77 Ca -0.06 2.39 -0.32 0.00 -1.25 0.00 0.00 55.69 56.45 1mka s MET 77 Cb -0.06 -3.26 -0.13 0.00 2.84 0.00 0.00 34.83 34.22 1mka s MET 77 CO -0.10 -0.66 1.57 -2.30 -0.65 0.00 0.00 175.02 172.88 1mka n PRO 78 N 4.39 2.32 0.23 4.11 -0.02 -1.26 -4.69 135.00 140.09 1mka n PRO 78 Ca 0.15 0.83 0.06 0.00 -2.02 0.00 0.00 63.50 62.52 1mka n PRO 78 Cb 0.39 -2.59 0.54 0.00 -0.02 0.00 0.00 33.50 31.81 1mka n PRO 78 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1mka h GLY 79 N 5.56 0.00 1.86 -1.23 0.00 -1.99 -2.47 103.07 104.80 1mka h GLY 79 Ca -0.45 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 1mka h GLY 79 CO 0.86 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 177.38 1mka h LEU 81 N 0.18 0.13 -0.71 0.00 3.38 -1.82 -1.07 115.31 115.40 1mka h LEU 81 Ca 0.04 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 1mka h LEU 81 Cb 0.16 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1mka h LEU 81 CO 0.00 0.85 -0.32 1.23 0.09 0.00 0.00 178.44 180.29 1mka h GLY 82 N 1.99 0.69 1.01 0.83 0.00 -1.44 -1.21 103.07 104.94 1mka h GLY 82 Ca -0.02 -0.64 -0.09 0.00 0.00 0.00 0.00 47.33 46.58 1mka h GLY 82 CO 0.11 0.58 -0.07 -2.00 0.00 0.00 0.00 176.54 175.15 1mka h LEU 83 N 0.54 0.84 -0.81 3.11 5.85 -1.24 -2.93 115.31 120.67 1mka h LEU 83 Ca 0.06 -0.35 -0.06 0.00 0.84 0.00 0.00 57.88 58.38 1mka h LEU 83 Cb 0.82 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1mka h LEU 83 CO 0.07 0.99 0.21 -0.78 -0.34 0.00 0.00 178.44 178.59 1mka h ASP 84 N 0.67 1.03 -0.85 1.25 3.58 -0.85 -2.20 116.42 119.06 1mka h ASP 84 Ca 0.12 -0.19 0.07 0.00 0.42 0.00 0.00 57.03 57.44 1mka h ASP 84 Cb 0.60 -0.27 -0.06 0.00 1.72 0.00 0.00 39.33 41.32 1mka h ASP 84 CO 0.04 0.97 0.55 0.00 -2.88 0.00 0.00 179.24 177.92 1mka h ALA 85 N 1.17 1.59 -0.41 -0.78 0.00 -1.10 0.29 119.26 120.02 1mka h ALA 85 Ca 0.23 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 1mka h ALA 85 Cb 0.31 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1mka h ALA 85 CO -0.01 0.28 -0.26 0.52 0.00 0.00 0.00 179.25 179.78 1mka h MET 86 N 0.92 0.90 -0.58 0.00 2.86 -1.24 -0.47 114.93 117.34 1mka h MET 86 Ca 0.37 -0.42 -0.09 0.00 -2.06 0.00 0.00 59.70 57.49 1mka h MET 86 Cb 0.24 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1mka h MET 86 CO -0.14 1.08 -0.02 -1.49 1.06 0.00 0.00 176.91 177.41 1mka h TRP 87 N 0.73 1.10 -0.83 -0.22 6.55 -0.81 -1.89 115.95 120.58 1mka h TRP 87 Ca 0.08 -0.19 0.01 0.00 0.95 0.00 0.00 58.89 59.74 1mka h TRP 87 Cb 0.84 -0.29 -0.04 0.00 -0.86 0.00 0.00 29.16 28.81 1mka h TRP 87 CO 0.06 0.98 0.55 1.96 -1.05 0.00 0.00 178.44 180.94 1mka h GLN 88 N 0.92 1.10 -0.25 0.49 4.20 -0.21 -2.02 115.11 119.34 1mka h GLN 88 Ca 0.16 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.67 1mka h GLN 88 Cb 0.56 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 1mka h GLN 88 CO 0.03 0.73 -0.39 -0.07 -0.67 0.00 0.00 178.83 178.46 1mka h LEU 89 N 1.13 0.60 -0.25 1.46 3.38 -0.81 -0.86 115.31 119.96 1mka h LEU 89 Ca 0.30 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1mka h LEU 89 Cb -0.12 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1mka h LEU 89 CO -0.06 0.93 0.04 0.58 0.09 0.00 0.00 178.44 180.01 1mka h VAL 90 N 0.47 1.23 -0.36 1.22 2.07 -1.04 -1.09 116.25 118.75 1mka h VAL 90 Ca 0.04 -0.76 -0.10 0.00 0.82 0.00 0.00 66.70 66.70 1mka h VAL 90 Cb 0.89 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1mka h VAL 90 CO 0.08 0.24 -0.18 1.23 0.02 0.00 0.00 177.57 178.96 1mka h GLY 91 N 0.23 0.73 1.04 2.17 0.00 -1.33 -2.25 103.07 103.67 1mka h GLY 91 Ca 0.08 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 1mka h GLY 91 CO 0.00 0.53 0.42 -2.75 0.00 0.00 0.00 176.54 174.75 1mka h PHE 92 N 0.60 1.23 -0.52 5.60 3.57 -0.97 -2.27 116.94 124.18 1mka h PHE 92 Ca 0.09 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.45 1mka h PHE 92 Cb 0.65 -0.38 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 1mka h PHE 92 CO 0.03 0.88 -0.04 -0.92 -2.23 0.00 0.00 178.31 176.03 1mka h TYR 93 N 1.23 1.00 -0.56 0.41 3.20 -0.81 -0.53 116.97 120.91 1mka h TYR 93 Ca 0.30 -0.17 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 1mka h TYR 93 Cb 0.10 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.09 1mka h TYR 93 CO 0.01 0.92 0.12 -0.07 -1.64 0.00 0.00 178.16 177.50 1mka h LEU 94 N 0.84 0.82 -0.80 2.82 3.38 -1.07 -1.17 115.31 120.13 1mka h LEU 94 Ca 0.15 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 1mka h LEU 94 Cb 0.55 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1mka h LEU 94 CO 0.03 0.82 -0.48 1.23 0.09 0.00 0.00 178.44 180.12 1mka h GLY 95 N 0.99 0.30 1.65 0.83 0.00 -1.09 0.04 103.07 105.79 1mka h GLY 95 Ca 0.18 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 47.12 1mka h GLY 95 CO 0.00 0.28 -0.18 -0.25 0.00 0.00 0.00 176.54 176.39 1mka h TRP 96 N 0.22 0.45 0.00 5.60 7.01 -0.31 -1.14 115.95 127.78 1mka h TRP 96 Ca 0.01 -0.08 0.00 0.00 2.11 0.00 0.00 58.89 60.93 1mka h TRP 96 Cb 0.94 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.88 1mka h TRP 96 CO 0.02 0.58 0.00 1.28 -2.79 0.00 0.00 178.44 177.53 1mka n LEU 97 N -4.18 0.00 0.00 0.65 4.77 -0.52 -4.77 117.00 112.96 1mka n LEU 97 Ca -0.00 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1mka n LEU 97 Cb 0.35 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1mka n LEU 97 CO 0.40 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1mka n GLY 98 N 0.87 0.89 3.77 -0.72 0.00 -0.43 -4.92 105.19 104.64 1mka n GLY 98 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 1mka n GLY 98 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mka s GLY 99 N -1.08 2.92 0.02 -0.02 0.00 -0.01 -4.92 107.32 104.22 1mka s GLY 99 Ca 0.00 1.22 0.04 0.00 0.00 0.00 0.00 44.72 45.99 1mka s GLY 99 CO 0.00 1.80 -0.10 -0.54 0.00 0.00 0.00 173.10 174.27 1mka s GLU 100 N -2.27 2.41 0.00 2.90 2.02 -1.26 -4.38 118.70 118.12 1mka s GLU 100 Ca 0.57 -0.81 0.00 0.00 0.02 0.00 0.00 54.97 54.76 1mka s GLU 100 Cb -0.38 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.44 1mka s GLU 100 CO 0.48 0.58 0.00 0.41 0.02 0.00 0.00 175.26 176.75 1mka n GLY 101 N 1.48 3.03 3.72 -1.39 0.00 0.26 -4.52 105.19 107.78 1mka n GLY 101 Ca -0.15 -1.90 -0.39 0.00 0.00 0.00 0.00 46.02 43.57 1mka n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mka s LYS 102 N -2.13 4.41 0.23 1.61 1.02 0.07 -2.63 119.74 122.32 1mka s LYS 102 Ca 0.00 0.78 -0.30 0.00 0.02 0.00 0.00 55.97 56.48 1mka s LYS 102 Cb 0.00 -3.43 -0.09 0.00 -0.52 0.00 0.00 37.83 33.79 1mka s LYS 102 CO 0.00 0.12 1.02 0.20 -0.92 0.00 0.00 175.35 175.77 1mka s GLY 103 N 0.64 3.04 -0.06 -3.33 0.00 -1.26 0.08 107.32 106.42 1mka s GLY 103 Ca 0.35 0.74 -0.03 0.00 0.00 0.00 0.00 44.72 45.78 1mka s GLY 103 CO 0.17 1.41 0.12 0.50 0.00 0.00 0.00 173.10 175.29 1mka s ARG 104 N -0.99 0.01 0.29 2.90 1.81 -0.70 -4.96 118.95 117.31 1mka s ARG 104 Ca 0.44 0.44 -0.29 0.00 -1.72 0.00 0.00 55.73 54.60 1mka s ARG 104 Cb -0.28 -0.30 -0.10 0.00 -0.45 0.00 0.00 34.95 33.82 1mka s ARG 104 CO 0.35 -0.26 1.26 0.00 -0.68 0.00 0.00 175.30 175.97 1mka s ALA 105 N 1.87 3.48 -0.06 2.13 0.00 -1.26 -2.08 121.76 125.84 1mka s ALA 105 Ca -0.01 1.15 0.12 0.00 0.00 0.00 0.00 51.96 53.22 1mka s ALA 105 Cb -0.12 -3.44 -0.18 0.00 0.00 0.00 0.00 23.12 19.38 1mka s ALA 105 CO -0.05 -0.51 0.18 1.28 0.00 0.00 0.00 175.76 176.66 1mka n LEU 106 N 1.24 0.00 0.00 0.00 4.77 0.27 -4.93 117.00 118.35 1mka n LEU 106 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1mka n LEU 106 Cb 0.43 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1mka n LEU 106 CO 0.58 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 1mka n GLY 107 N 1.98 -1.21 3.42 -0.72 0.00 -1.12 -4.98 105.19 102.56 1mka n GLY 107 Ca -0.10 -1.38 -0.16 0.00 0.00 0.00 0.00 46.02 44.38 1mka n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mka s VAL 108 N -2.59 0.02 -0.13 1.61 0.11 -1.26 -0.97 120.40 117.20 1mka s VAL 108 Ca 0.00 -0.17 -0.10 0.00 -2.93 0.00 0.00 61.98 58.79 1mka s VAL 108 Cb 0.00 -0.85 -0.07 0.00 -1.53 0.00 0.00 36.38 33.93 1mka s VAL 108 CO 0.00 -0.09 0.12 1.23 -3.33 0.00 0.00 175.10 173.03 1mka h GLY 109 N 3.49 0.00 -6.07 6.54 0.00 -0.44 -3.48 103.07 103.10 1mka h GLY 109 Ca -0.28 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.84 1mka h GLY 109 CO 0.37 0.00 -0.51 1.85 0.00 0.00 0.00 176.54 178.25 1mka s GLU 110 N -1.91 0.18 -0.05 4.80 2.12 -1.11 -4.97 118.70 117.75 1mka s GLU 110 Ca -0.10 0.48 0.04 0.00 0.36 0.00 0.00 54.97 55.76 1mka s GLU 110 Cb 0.00 -0.13 -0.00 0.00 0.26 0.00 0.00 34.13 34.26 1mka s GLU 110 CO 0.23 -0.16 -0.17 0.08 -0.54 0.00 0.00 175.26 174.70 1mka s VAL 111 N 1.22 1.41 -0.07 3.70 1.01 -1.26 -0.68 120.40 125.73 1mka s VAL 111 Ca -0.09 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.20 1mka s VAL 111 Cb -0.11 -1.22 0.02 0.00 0.00 0.00 0.00 36.38 35.07 1mka s VAL 111 CO -0.08 0.41 -0.09 -0.54 0.00 0.00 0.00 175.10 174.80 1mka s LYS 112 N 0.13 1.41 -0.26 2.72 1.02 -0.84 -5.01 119.74 118.91 1mka s LYS 112 Ca -0.06 -0.28 -0.06 0.00 0.02 0.00 0.00 55.97 55.59 1mka s LYS 112 Cb -0.12 -1.30 -0.00 0.00 -0.52 0.00 0.00 37.83 35.89 1mka s LYS 112 CO 0.03 -0.08 0.03 -0.06 -0.92 0.00 0.00 175.35 174.35 1mka s PHE 113 N 1.02 3.07 -0.65 3.18 0.08 -1.26 -2.22 117.98 121.20 1mka s PHE 113 Ca -0.08 -0.90 0.07 0.00 0.12 0.00 0.00 56.93 56.14 1mka s PHE 113 Cb -0.15 -2.19 -0.00 0.00 -0.57 0.00 0.00 43.02 40.11 1mka s PHE 113 CO -0.00 -0.54 0.53 0.25 -0.10 0.00 0.00 175.22 175.36 1mka n THR 114 N 4.84 0.00 -4.02 0.64 -2.24 0.77 -5.02 114.28 109.25 1mka n THR 114 Ca -0.16 -0.43 -0.11 0.00 -2.27 0.00 0.00 64.05 61.08 1mka n THR 114 Cb 0.49 1.08 -0.04 0.00 -2.10 0.00 0.00 70.33 69.77 1mka n THR 114 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1mka s GLY 115 N -1.08 0.89 0.26 3.38 0.00 -1.17 -5.02 107.32 104.58 1mka s GLY 115 Ca 0.06 -1.12 0.08 0.00 0.00 0.00 0.00 44.72 43.73 1mka s GLY 115 CO 0.17 -0.75 -0.10 -0.86 0.00 0.00 0.00 173.10 171.56 1mka s GLN 116 N -3.50 1.50 -0.32 2.90 -2.07 -1.26 -4.86 119.66 112.04 1mka s GLN 116 Ca 0.25 -1.73 -0.06 0.00 -1.82 0.00 0.00 55.36 52.01 1mka s GLN 116 Cb -0.01 -1.21 0.04 0.00 -1.09 0.00 0.00 33.01 30.73 1mka s GLN 116 CO 0.13 0.11 0.08 0.08 -1.32 0.00 0.00 175.29 174.38 1mka s VAL 117 N -2.94 3.66 0.38 3.63 1.01 -1.26 -5.00 120.40 119.88 1mka s VAL 117 Ca 0.27 -1.11 -0.00 0.00 0.00 0.00 0.00 61.98 61.14 1mka s VAL 117 Cb 0.01 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 1mka s VAL 117 CO 0.11 -0.12 0.60 -0.76 0.00 0.00 0.00 175.10 174.93 1mka s LEU 118 N 1.39 3.89 0.00 3.92 1.43 -1.26 -1.33 118.68 126.72 1mka s LEU 118 Ca -0.02 0.48 0.08 0.00 -1.03 0.00 0.00 54.13 53.64 1mka s LEU 118 Cb -0.19 -3.36 0.34 0.00 0.03 0.00 0.00 46.19 43.01 1mka s LEU 118 CO 0.02 -0.41 1.21 -0.81 0.23 0.00 0.00 176.35 176.59 1mka n PRO 119 N -1.91 0.03 0.00 1.29 -0.04 -1.26 -1.61 135.00 131.50 1mka n PRO 119 Ca -0.03 0.33 0.13 0.00 -0.04 0.00 0.00 63.50 63.89 1mka n PRO 119 Cb 0.56 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.89 1mka n PRO 119 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1mka n THR 120 N -1.45 0.00 -1.30 0.52 -2.24 -1.26 -3.59 114.28 104.96 1mka n THR 120 Ca 0.02 -0.04 -0.30 0.00 -2.27 0.00 0.00 64.05 61.46 1mka n THR 120 Cb 0.08 0.17 0.12 0.00 -2.10 0.00 0.00 70.33 68.61 1mka n THR 120 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mka s ALA 121 N -2.80 1.75 -0.11 6.98 0.00 -0.63 -5.01 121.76 121.94 1mka s ALA 121 Ca 0.17 -0.09 0.04 0.00 0.00 0.00 0.00 51.96 52.08 1mka s ALA 121 Cb 0.18 -3.17 -0.10 0.00 0.00 0.00 0.00 23.12 20.04 1mka s ALA 121 CO 0.61 -2.17 -0.05 1.63 0.00 0.00 0.00 175.76 175.77 1mka n LYS 122 N -3.76 1.19 -3.69 0.00 4.76 -1.26 -4.54 118.16 110.86 1mka n LYS 122 Ca 0.07 0.04 -0.14 0.00 -2.87 0.00 0.00 58.31 55.41 1mka n LYS 122 Cb 0.55 -1.25 -0.09 0.00 -1.84 0.00 0.00 35.03 32.41 1mka n LYS 122 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1mka s LYS 123 N -2.24 0.64 -0.11 1.97 2.20 -1.26 -1.12 119.74 119.82 1mka s LYS 123 Ca -0.12 0.52 -0.01 0.00 -0.36 0.00 0.00 55.97 56.01 1mka s LYS 123 Cb 0.04 0.31 -0.02 0.00 -1.51 0.00 0.00 37.83 36.64 1mka s LYS 123 CO 0.33 -0.11 -0.08 0.08 -0.36 0.00 0.00 175.35 175.20 1mka s VAL 124 N -0.11 3.52 -0.06 4.02 1.01 -0.06 -0.70 120.40 128.03 1mka s VAL 124 Ca -0.03 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.48 1mka s VAL 124 Cb -0.03 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 33.84 1mka s VAL 124 CO 0.02 0.54 -0.18 -0.89 0.00 0.00 0.00 175.10 174.59 1mka s THR 125 N -0.07 2.67 -0.13 3.92 2.01 0.16 -0.97 115.64 123.24 1mka s THR 125 Ca -0.00 -0.85 0.00 0.00 0.31 0.00 0.00 61.69 61.15 1mka s THR 125 Cb -0.13 -2.03 -0.01 0.00 0.01 0.00 0.00 72.50 70.33 1mka s THR 125 CO 0.03 0.57 -0.14 -0.31 -0.69 0.00 0.00 174.62 174.08 1mka s TYR 126 N -0.34 2.79 -0.14 4.92 2.02 0.00 -1.11 117.35 125.49 1mka s TYR 126 Ca 0.03 -0.65 0.01 0.00 -0.37 0.00 0.00 57.07 56.08 1mka s TYR 126 Cb -0.12 -1.83 0.02 0.00 -0.40 0.00 0.00 41.96 39.63 1mka s TYR 126 CO 0.02 -0.21 -0.14 1.03 -1.57 0.00 0.00 175.55 174.69 1mka s ARG 127 N 0.31 2.22 -0.16 -0.62 0.52 -0.50 -1.28 118.95 119.43 1mka s ARG 127 Ca -0.11 -0.53 -0.01 0.00 -0.52 0.00 0.00 55.73 54.56 1mka s ARG 127 Cb -0.16 -2.02 -0.00 0.00 0.52 0.00 0.00 34.95 33.29 1mka s ARG 127 CO 0.06 -0.20 -0.13 0.42 0.02 0.00 0.00 175.30 175.46 1mka s ILE 128 N 1.40 2.84 -0.29 1.52 -1.09 0.48 -1.31 121.20 124.75 1mka s ILE 128 Ca 0.03 -0.71 -0.03 0.00 -2.23 0.00 0.00 60.65 57.71 1mka s ILE 128 Cb -0.13 -2.22 0.04 0.00 -1.58 0.00 0.00 42.46 38.57 1mka s ILE 128 CO -0.09 0.50 0.01 -1.00 -1.23 0.00 0.00 174.94 173.13 1mka s HIS 129 N 0.88 3.20 0.23 3.97 3.76 -0.28 -1.79 115.29 125.26 1mka s HIS 129 Ca -0.03 -1.61 -0.30 0.00 -0.15 0.00 0.00 55.06 52.97 1mka s HIS 129 Cb -0.15 -2.14 -0.09 0.00 1.11 0.00 0.00 32.58 31.32 1mka s HIS 129 CO -0.01 -0.75 1.10 -0.06 -0.85 0.00 0.00 174.74 174.18 1mka s PHE 130 N 1.33 3.60 -0.19 1.40 0.40 -0.66 -1.51 117.98 122.35 1mka s PHE 130 Ca -0.02 1.66 -0.03 0.00 -0.60 0.00 0.00 56.93 57.93 1mka s PHE 130 Cb -0.19 -3.27 -0.11 0.00 0.51 0.00 0.00 43.02 39.97 1mka s PHE 130 CO -0.01 -0.55 -0.20 1.63 0.70 0.00 0.00 175.22 176.79 1mka n LYS 131 N 1.76 0.44 -3.74 0.44 5.02 -0.12 -4.15 118.16 117.81 1mka n LYS 131 Ca 0.01 0.14 -0.13 0.00 -2.02 0.00 0.00 58.31 56.31 1mka n LYS 131 Cb 0.45 -1.30 -0.11 0.00 -0.02 0.00 0.00 35.03 34.06 1mka n LYS 131 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1mka s ARG 132 N -2.36 0.40 -0.08 1.97 0.52 -1.13 -4.98 118.95 113.28 1mka s ARG 132 Ca -0.26 0.54 0.01 0.00 -0.52 0.00 0.00 55.73 55.50 1mka s ARG 132 Cb 0.08 0.14 0.02 0.00 0.52 0.00 0.00 34.95 35.72 1mka s ARG 132 CO 0.39 -0.07 -0.08 0.42 0.02 0.00 0.00 175.30 175.97 1mka s ILE 133 N 0.45 0.95 -0.37 1.52 1.01 -1.26 -1.11 121.20 122.39 1mka s ILE 133 Ca -0.02 -0.31 -0.00 0.00 0.00 0.00 0.00 60.65 60.31 1mka s ILE 133 Cb -0.04 -0.93 0.10 0.00 0.01 0.00 0.00 42.46 41.60 1mka s ILE 133 CO -0.02 0.33 0.13 -0.69 0.00 0.00 0.00 174.94 174.69 1mka s VAL 134 N 1.17 2.91 -0.38 2.92 1.01 -0.31 -4.95 120.40 122.77 1mka s VAL 134 Ca -0.06 -2.08 0.06 0.00 0.00 0.00 0.00 61.98 59.90 1mka s VAL 134 Cb -0.14 -3.00 0.50 0.00 0.00 0.00 0.00 36.38 33.74 1mka s VAL 134 CO -0.02 -0.59 1.55 -3.20 0.00 0.00 0.00 175.10 172.84 1mka n ASN 135 N 4.48 4.19 -2.45 3.32 2.85 -1.26 -0.55 115.26 125.84 1mka n ASN 135 Ca -0.01 -3.77 0.00 0.00 -0.11 0.00 0.00 54.58 50.68 1mka n ASN 135 Cb 0.42 -0.65 0.00 0.00 1.24 0.00 0.00 39.78 40.79 1mka n ASN 135 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 1mka n ARG 136 N -0.99 3.16 -2.26 1.20 1.85 -1.26 -4.83 116.66 113.54 1mka n ARG 136 Ca 0.44 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.87 1mka n ARG 136 Cb 1.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.41 1mka n ARG 136 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 1mka n ARG 137 N 0.00 4.00 0.00 2.89 3.00 -1.26 -4.08 116.66 121.21 1mka n ARG 137 Ca 0.00 -3.57 0.00 0.00 -0.00 0.00 0.00 57.85 54.28 1mka n ARG 137 Cb 0.00 -2.80 0.00 0.00 0.00 0.00 0.00 32.46 29.66 1mka n ARG 137 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1mka n LEU 138 N 3.00 0.00 -4.52 6.15 7.94 -1.26 -5.15 117.00 123.16 1mka n LEU 138 Ca 0.46 0.00 -0.41 0.00 -1.11 0.00 0.00 56.01 54.95 1mka n LEU 138 Cb 0.32 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.17 1mka n LEU 138 CO 0.77 0.00 -0.08 -0.63 -1.11 0.00 0.00 177.39 176.35 1mka s ILE 139 N 0.00 5.25 -0.00 1.96 1.01 -1.24 -4.01 121.20 124.16 1mka s ILE 139 Ca 0.00 -0.26 -0.04 0.00 0.00 0.00 0.00 60.65 60.35 1mka s ILE 139 Cb 0.00 -3.79 -0.00 0.00 0.01 0.00 0.00 42.46 38.68 1mka s ILE 139 CO 0.00 -0.10 0.07 -0.32 0.00 0.00 0.00 174.94 174.59 1mka s MET 140 N 1.78 0.32 -0.02 2.79 1.75 0.28 -1.28 119.30 124.93 1mka s MET 140 Ca 0.07 -0.31 0.03 0.00 -1.25 0.00 0.00 55.69 54.23 1mka s MET 140 Cb -0.18 0.13 -0.00 0.00 2.84 0.00 0.00 34.83 37.62 1mka s MET 140 CO 0.11 -0.07 -0.11 0.20 -0.65 0.00 0.00 175.02 174.50 1mka s GLY 141 N -1.00 0.61 -0.06 2.11 0.00 0.55 -1.16 107.32 108.37 1mka s GLY 141 Ca -0.11 -0.44 0.06 0.00 0.00 0.00 0.00 44.72 44.23 1mka s GLY 141 CO 0.00 -0.22 -0.24 -2.27 0.00 0.00 0.00 173.10 170.37 1mka s LEU 142 N 0.04 2.06 0.21 0.66 2.96 -0.27 -1.88 118.68 122.46 1mka s LEU 142 Ca -0.01 -0.50 -0.22 0.00 -0.22 0.00 0.00 54.13 53.17 1mka s LEU 142 Cb -0.08 -1.34 0.05 0.00 0.50 0.00 0.00 46.19 45.32 1mka s LEU 142 CO 0.00 0.23 0.67 0.00 -1.32 0.00 0.00 176.35 175.93 1mka s ALA 143 N -0.11 -1.45 0.05 5.97 0.00 -0.76 -0.95 121.76 124.52 1mka s ALA 143 Ca -0.05 0.16 0.05 0.00 0.00 0.00 0.00 51.96 52.11 1mka s ALA 143 Cb -0.14 0.85 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 1mka s ALA 143 CO 0.04 -0.89 -0.06 -0.51 0.00 0.00 0.00 175.76 174.35 1mka s ASP 144 N -2.82 4.69 0.08 0.00 1.01 -0.57 -0.01 116.67 119.05 1mka s ASP 144 Ca 0.06 -0.21 0.03 0.00 0.71 0.00 0.00 52.55 53.14 1mka s ASP 144 Cb -0.03 -1.06 -0.03 0.00 1.01 0.00 0.00 42.92 42.81 1mka s ASP 144 CO -0.04 0.23 -0.09 -0.83 0.21 0.00 0.00 175.17 174.65 1mka s GLY 145 N -1.85 0.75 0.01 0.21 0.00 0.58 -1.12 107.32 105.90 1mka s GLY 145 Ca 0.20 -1.12 0.02 0.00 0.00 0.00 0.00 44.72 43.82 1mka s GLY 145 CO 0.12 -1.20 -0.06 -0.54 0.00 0.00 0.00 173.10 171.43 1mka s GLU 146 N -2.74 0.42 -0.08 2.90 2.02 -0.43 -0.73 118.70 120.06 1mka s GLU 146 Ca 0.03 -0.39 0.03 0.00 0.02 0.00 0.00 54.97 54.66 1mka s GLU 146 Cb -0.03 -0.31 0.01 0.00 0.10 0.00 0.00 34.13 33.90 1mka s GLU 146 CO -0.01 0.07 -0.18 0.08 0.02 0.00 0.00 175.26 175.24 1mka s VAL 147 N -0.61 1.61 0.00 2.63 1.01 -0.35 -1.41 120.40 123.28 1mka s VAL 147 Ca -0.03 -0.76 0.07 0.00 0.00 0.00 0.00 61.98 61.26 1mka s VAL 147 Cb -0.05 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.89 1mka s VAL 147 CO -0.00 0.46 -0.22 -0.76 0.00 0.00 0.00 175.10 174.58 1mka s LEU 148 N 0.52 2.09 -0.28 3.92 1.02 -0.27 -0.78 118.68 124.90 1mka s LEU 148 Ca -0.16 -0.45 -0.01 0.00 0.02 0.00 0.00 54.13 53.53 1mka s LEU 148 Cb -0.17 -1.11 0.05 0.00 0.02 0.00 0.00 46.19 44.97 1mka s LEU 148 CO 0.06 0.24 -0.04 0.54 0.02 0.00 0.00 176.35 177.18 1mka s VAL 149 N -0.62 2.80 -1.39 -1.59 0.11 0.46 -0.66 120.40 119.51 1mka s VAL 149 Ca 0.09 -1.35 -0.07 0.00 -2.93 0.00 0.00 61.98 57.71 1mka s VAL 149 Cb -0.09 -2.57 0.03 0.00 -1.53 0.00 0.00 36.38 32.22 1mka s VAL 149 CO 0.00 -0.02 0.96 0.47 -3.33 0.00 0.00 175.10 173.18 1mka n ASP 150 N 4.60 -3.89 0.00 3.54 8.00 0.12 -1.47 116.55 127.45 1mka n ASP 150 Ca -0.14 -0.71 0.00 0.00 0.71 0.00 0.00 54.79 54.65 1mka n ASP 150 Cb 0.44 -4.36 0.00 0.00 -0.02 0.00 0.00 41.12 37.18 1mka n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mka n GLY 151 N -1.67 1.87 3.62 0.44 0.00 -1.26 -5.02 105.19 103.17 1mka n GLY 151 Ca -0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1mka n GLY 151 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1mka s ARG 152 N -0.17 4.04 -0.05 1.61 3.52 -0.54 -5.01 118.95 122.34 1mka s ARG 152 Ca 0.00 0.02 -0.30 0.00 -0.13 0.00 0.00 55.73 55.32 1mka s ARG 152 Cb 0.00 -3.63 -0.06 0.00 -1.56 0.00 0.00 34.95 29.70 1mka s ARG 152 CO 0.00 -0.22 1.65 -1.17 -0.81 0.00 0.00 175.30 174.75 1mka s LEU 153 N 1.89 4.32 0.00 -0.88 2.96 -1.26 -0.40 118.68 125.31 1mka s LEU 153 Ca 0.14 2.23 0.00 0.00 -0.22 0.00 0.00 54.13 56.29 1mka s LEU 153 Cb -0.16 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.00 1mka s LEU 153 CO 0.09 -0.92 0.00 2.30 -1.32 0.00 0.00 176.35 176.50 1mka n ILE 154 N 5.45 0.00 -4.18 6.68 -5.35 0.04 -4.83 119.36 117.17 1mka n ILE 154 Ca 0.17 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.49 1mka n ILE 154 Cb 0.43 -0.34 -0.13 0.00 -1.74 0.00 0.00 39.64 37.85 1mka n ILE 154 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1mka s TYR 155 N -1.94 0.68 0.01 4.28 2.02 -1.05 -0.16 117.35 121.18 1mka s TYR 155 Ca 0.00 -0.27 0.04 0.00 -0.37 0.00 0.00 57.07 56.47 1mka s TYR 155 Cb 0.00 -0.42 -0.01 0.00 -0.40 0.00 0.00 41.96 41.13 1mka s TYR 155 CO 0.00 -0.03 -0.12 0.95 -1.57 0.00 0.00 175.55 174.78 1mka s THR 156 N -0.65 0.98 -0.05 -0.71 -4.23 -0.94 -1.21 115.64 108.82 1mka s THR 156 Ca -0.02 -0.67 -0.01 0.00 -1.18 0.00 0.00 61.69 59.81 1mka s THR 156 Cb -0.06 -0.84 0.03 0.00 1.34 0.00 0.00 72.50 72.97 1mka s THR 156 CO 0.00 0.17 0.01 0.00 -0.54 0.00 0.00 174.62 174.26 1mka s ALA 157 N -0.48 0.52 -0.11 3.99 0.00 0.09 -2.00 121.76 123.77 1mka s ALA 157 Ca 0.03 0.01 -0.06 0.00 0.00 0.00 0.00 51.96 51.94 1mka s ALA 157 Cb -0.06 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.43 1mka s ALA 157 CO 0.00 -0.34 0.14 -1.12 0.00 0.00 0.00 175.76 174.44 1mka s SER 158 N 1.69 6.33 -1.23 0.00 0.01 0.15 -0.30 113.70 120.34 1mka s SER 158 Ca 0.00 0.44 -0.00 0.00 1.31 0.00 0.00 55.95 57.70 1mka s SER 158 Cb -0.13 -2.03 -0.00 0.00 0.21 0.00 0.00 66.02 64.07 1mka s SER 158 CO -0.03 0.40 0.90 0.47 0.41 0.00 0.00 173.24 175.38 1mka n ASP 159 N 1.89 -1.78 -4.75 2.44 8.00 -1.00 -0.15 116.55 121.20 1mka n ASP 159 Ca -0.19 -0.68 -0.41 0.00 0.71 0.00 0.00 54.79 54.21 1mka n ASP 159 Cb 0.55 -4.79 -0.02 0.00 -0.02 0.00 0.00 41.12 36.83 1mka n ASP 159 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1mka s LEU 160 N -6.45 4.40 -0.06 0.64 1.43 0.98 -2.98 118.68 116.63 1mka s LEU 160 Ca 0.00 2.59 0.01 0.00 -1.03 0.00 0.00 54.13 55.70 1mka s LEU 160 Cb -0.00 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.62 1mka s LEU 160 CO 0.76 -0.62 -0.07 -0.75 0.23 0.00 0.00 176.35 175.90 1mka s LYS 161 N -0.52 1.17 0.02 1.70 2.20 -0.14 -1.83 119.74 122.34 1mka s LYS 161 Ca 0.57 -0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.99 1mka s LYS 161 Cb -0.40 -1.14 -0.02 0.00 -1.51 0.00 0.00 37.83 34.77 1mka s LYS 161 CO 0.43 -0.10 -0.05 0.08 -0.36 0.00 0.00 175.35 175.35 1mka s VAL 162 N 1.07 0.29 0.08 4.02 1.01 -0.79 -0.56 120.40 125.53 1mka s VAL 162 Ca -0.08 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.16 1mka s VAL 162 Cb -0.14 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 1mka s VAL 162 CO -0.01 -0.31 -0.06 -0.83 0.00 0.00 0.00 175.10 173.90 1mka s GLY 163 N -1.13 0.67 -0.08 4.51 0.00 -0.88 -0.33 107.32 110.08 1mka s GLY 163 Ca -0.09 -1.24 -0.01 0.00 0.00 0.00 0.00 44.72 43.38 1mka s GLY 163 CO -0.00 -1.34 -0.03 1.08 0.00 0.00 0.00 173.10 172.81 1mka s LEU 164 N -2.81 3.42 -0.06 0.66 1.43 -0.40 -1.73 118.68 119.19 1mka s LEU 164 Ca 0.08 0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.27 1mka s LEU 164 Cb 0.04 -1.77 0.02 0.00 0.03 0.00 0.00 46.19 44.50 1mka s LEU 164 CO -0.05 0.37 -0.09 -0.36 0.23 0.00 0.00 176.35 176.45 1mka s PHE 165 N -0.86 1.15 0.02 0.29 0.08 0.11 -4.40 117.98 114.38 1mka s PHE 165 Ca 0.13 -0.40 -0.26 0.00 0.12 0.00 0.00 56.93 56.52 1mka s PHE 165 Cb -0.11 -0.90 -0.17 0.00 -0.57 0.00 0.00 43.02 41.26 1mka s PHE 165 CO 0.02 -0.25 1.35 1.96 -0.10 0.00 0.00 175.22 178.20 1mka h GLN 166 N 7.12 -0.34 -5.14 0.44 7.50 -1.86 0.23 115.11 123.06 1mka h GLN 166 Ca -0.34 0.02 -0.66 0.00 0.50 0.00 0.00 58.65 58.18 1mka h GLN 166 Cb 1.17 0.08 -0.29 0.00 0.05 0.00 0.00 27.48 28.48 1mka h GLN 166 CO 0.47 -0.04 -0.78 0.34 -1.50 0.00 0.00 178.83 177.32 1mka s ASP 167 N -5.11 3.88 0.00 1.46 2.15 -1.26 -4.79 116.67 113.00 1mka s ASP 167 Ca -0.15 -0.43 0.16 0.00 0.43 0.00 0.00 52.55 52.56 1mka s ASP 167 Cb 0.03 -1.62 0.20 0.00 -0.30 0.00 0.00 42.92 41.23 1mka s ASP 167 CO 0.58 0.06 1.10 0.35 -0.17 0.00 0.00 175.17 177.09 1mka n THR 168 N 4.24 0.25 0.69 1.71 -2.24 -1.26 -4.51 114.28 113.16 1mka n THR 168 Ca -0.19 -0.62 0.06 0.00 -2.27 0.00 0.00 64.05 61.03 1mka n THR 168 Cb 0.51 1.13 0.34 0.00 -2.10 0.00 0.00 70.33 70.22 1mka n THR 168 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1mka n SER 169 N 0.91 0.00 0.14 3.42 3.41 -1.26 -2.04 113.62 118.20 1mka n SER 169 Ca 0.11 -0.14 0.08 0.00 -0.26 0.00 0.00 58.87 58.66 1mka n SER 169 Cb 0.43 -0.15 0.05 0.00 -0.26 0.00 0.00 64.21 64.28 1mka n SER 169 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mka h ALA 170 N 2.69 0.74 -0.02 7.33 0.00 -2.03 -3.57 119.26 124.40 1mka h ALA 170 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1mka h ALA 170 Cb 0.06 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1mka h ALA 170 CO 0.00 0.31 0.00 1.19 0.00 0.00 0.00 179.25 180.75