#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kfv s GLU 2 N 0.00 2.47 0.31 1.61 2.02 -1.26 -4.87 118.70 118.98 1kfv s GLU 2 Ca 0.00 -1.59 0.06 0.00 0.02 0.00 0.00 54.97 53.46 1kfv s GLU 2 Cb 0.00 -2.30 0.85 0.00 0.10 0.00 0.00 34.13 32.79 1kfv s GLU 2 CO 0.00 -0.16 1.60 1.25 0.02 0.00 0.00 175.26 177.97 1kfv h LEU 3 N 1.13 -0.15 0.16 1.80 6.46 -1.73 -0.87 115.31 122.11 1kfv h LEU 3 Ca -0.42 0.25 0.01 0.00 -0.12 0.00 0.00 57.88 57.59 1kfv h LEU 3 Cb 1.26 0.37 -0.02 0.00 -0.73 0.00 0.00 40.66 41.54 1kfv h LEU 3 CO 0.60 -0.30 -0.19 -0.65 -0.62 0.00 0.00 178.44 177.28 1kfv h PRO 4 N 0.08 -0.38 -0.80 5.25 0.11 -1.85 -0.53 132.00 133.89 1kfv h PRO 4 Ca 0.63 0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.75 1kfv h PRO 4 Cb 1.38 0.09 -0.04 0.00 0.11 0.00 0.00 31.00 32.54 1kfv h PRO 4 CO -0.80 -0.25 0.45 0.93 -0.21 0.00 0.00 178.00 178.12 1kfv h GLU 5 N -0.39 1.09 -0.46 1.05 3.07 -1.52 -1.99 114.58 115.43 1kfv h GLU 5 Ca 0.01 -0.11 -0.12 0.00 -0.50 0.00 0.00 59.36 58.63 1kfv h GLU 5 Cb 0.38 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 1kfv h GLU 5 CO -0.06 0.79 -0.19 0.28 -1.40 0.00 0.00 179.01 178.43 1kfv h VAL 6 N 1.11 1.27 -0.24 3.13 2.07 -1.05 -2.37 116.25 120.17 1kfv h VAL 6 Ca 0.28 -1.34 -0.06 0.00 0.82 0.00 0.00 66.70 66.41 1kfv h VAL 6 Cb 0.00 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 1kfv h VAL 6 CO -0.05 0.46 -0.11 -0.08 0.02 0.00 0.00 177.57 177.81 1kfv h GLU 7 N 0.78 0.39 -0.31 1.57 4.57 -0.81 -0.65 114.58 120.12 1kfv h GLU 7 Ca 0.11 -0.10 -0.11 0.00 -1.18 0.00 0.00 59.36 58.09 1kfv h GLU 7 Cb 0.75 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 1kfv h GLU 7 CO 0.06 0.50 -0.25 1.15 -1.18 0.00 0.00 179.01 179.30 1kfv h THR 8 N 0.36 1.27 -0.11 0.32 2.02 -1.14 -2.32 112.91 113.30 1kfv h THR 8 Ca 0.07 -1.31 -0.18 0.00 0.77 0.00 0.00 66.41 65.76 1kfv h THR 8 Cb 0.42 1.30 -0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1kfv h THR 8 CO 0.02 0.43 -0.69 0.58 0.37 0.00 0.00 175.52 176.22 1kfv h VAL 9 N 0.53 1.35 -0.40 3.16 2.07 -0.88 -2.49 116.25 119.59 1kfv h VAL 9 Ca 0.07 -2.03 0.01 0.00 0.82 0.00 0.00 66.70 65.57 1kfv h VAL 9 Cb 0.71 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1kfv h VAL 9 CO 0.05 0.62 0.26 -0.09 0.02 0.00 0.00 177.57 178.44 1kfv h ARG 10 N 0.35 0.52 -0.34 1.57 2.43 -0.79 -0.92 114.38 117.20 1kfv h ARG 10 Ca -0.02 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.04 1kfv h ARG 10 Cb 1.27 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 1kfv h ARG 10 CO 0.13 0.35 -0.09 0.00 -1.51 0.00 0.00 179.97 178.84 1kfv h ARG 11 N 0.54 0.67 0.44 0.20 3.08 -1.44 0.74 114.38 118.61 1kfv h ARG 11 Ca 0.15 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1kfv h ARG 11 Cb -0.06 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 1kfv h ARG 11 CO -0.04 0.84 -0.50 1.49 -1.07 0.00 0.00 179.97 180.69 1kfv h GLU 12 N 0.46 -0.92 0.20 0.04 4.57 -1.22 0.08 114.58 117.78 1kfv h GLU 12 Ca 0.09 0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.34 1kfv h GLU 12 Cb 0.60 0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 29.35 1kfv h GLU 12 CO 0.04 -0.61 -0.51 -0.07 -1.18 0.00 0.00 179.01 176.67 1kfv h LEU 13 N -0.96 -1.52 -0.07 1.64 3.38 -1.13 -2.69 115.31 113.96 1kfv h LEU 13 Ca -0.05 0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.08 1kfv h LEU 13 Cb 0.85 0.55 -0.01 0.00 0.09 0.00 0.00 40.66 42.14 1kfv h LEU 13 CO -0.10 -0.58 -0.04 1.21 0.09 0.00 0.00 178.44 179.03 1kfv n GLU 14 N -5.50 -0.03 -1.42 1.13 4.07 0.26 -0.68 120.64 118.46 1kfv n GLU 14 Ca -0.09 0.29 -0.34 0.00 -0.06 0.00 0.00 57.16 56.95 1kfv n GLU 14 Cb 0.42 -0.42 -0.05 0.00 -0.06 0.00 0.00 31.44 31.33 1kfv n GLU 14 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1kfv n LYS 15 N -2.80 3.57 0.00 5.31 4.76 -0.05 -3.19 118.16 125.76 1kfv n LYS 15 Ca 0.00 -2.30 0.00 0.00 -2.87 0.00 0.00 58.31 53.14 1kfv n LYS 15 Cb 0.02 -2.60 0.00 0.00 -1.84 0.00 0.00 35.03 30.60 1kfv n LYS 15 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1kfv n ARG 16 N 2.85 0.00 0.00 1.97 0.63 0.15 -5.00 116.66 117.26 1kfv n ARG 16 Ca 0.68 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.61 1kfv n ARG 16 Cb 0.36 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.27 1kfv n ARG 16 CO 0.00 0.00 0.00 0.44 -2.51 0.00 0.00 177.63 175.56 1kfv n ILE 17 N 0.00 0.00 -1.68 5.15 -5.35 -0.93 -4.90 119.36 111.65 1kfv n ILE 17 Ca 0.00 0.00 -0.46 0.00 -0.27 0.00 0.00 62.75 62.02 1kfv n ILE 17 Cb 0.00 0.14 -0.04 0.00 -1.74 0.00 0.00 39.64 38.00 1kfv n ILE 17 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 1kfv n VAL 18 N -0.73 0.41 0.00 7.28 0.31 -1.19 -0.26 118.33 124.15 1kfv n VAL 18 Ca 0.00 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1kfv n VAL 18 Cb 0.03 -1.90 0.00 0.00 -0.91 0.00 0.00 33.84 31.06 1kfv n VAL 18 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1kfv n GLY 19 N 4.14 2.87 3.15 2.92 0.00 1.33 -4.92 105.19 114.68 1kfv n GLY 19 Ca 0.20 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 1kfv n GLY 19 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1kfv n GLN 20 N 0.00 -0.21 -4.19 1.61 -0.06 0.65 -3.85 117.38 111.33 1kfv n GLN 20 Ca 0.00 -0.05 -0.35 0.00 -2.00 0.00 0.00 57.00 54.60 1kfv n GLN 20 Cb 0.00 -1.32 -0.09 0.00 -4.06 0.00 0.00 30.24 24.77 1kfv n GLN 20 CO 0.00 0.00 0.00 0.21 -0.20 0.00 0.00 177.06 177.07 1kfv s LYS 21 N -2.61 3.38 -0.83 3.69 2.20 -1.26 -1.37 119.74 122.93 1kfv s LYS 21 Ca 0.46 -0.35 -0.23 0.00 -0.36 0.00 0.00 55.97 55.49 1kfv s LYS 21 Cb -0.15 -2.98 0.07 0.00 -1.51 0.00 0.00 37.83 33.25 1kfv s LYS 21 CO 0.75 0.57 1.20 0.42 -0.36 0.00 0.00 175.35 177.94 1kfv s ILE 22 N -0.49 4.16 0.04 5.43 1.01 0.44 -3.96 121.20 127.83 1kfv s ILE 22 Ca 0.10 -0.55 -0.30 0.00 0.00 0.00 0.00 60.65 59.90 1kfv s ILE 22 Cb -0.12 -4.86 -0.17 0.00 0.01 0.00 0.00 42.46 37.32 1kfv s ILE 22 CO 0.02 -1.69 1.42 0.40 0.00 0.00 0.00 174.94 175.09 1kfv h ILE 23 N 6.17 0.37 -3.16 2.92 1.08 -1.68 2.83 117.51 126.05 1kfv h ILE 23 Ca -0.06 -0.22 0.03 0.00 -0.39 0.00 0.00 64.86 64.22 1kfv h ILE 23 Cb 1.04 0.45 -0.07 0.00 -3.07 0.00 0.00 36.82 35.17 1kfv h ILE 23 CO 1.25 0.03 0.14 -0.94 -0.69 0.00 0.00 178.15 177.94 1kfv s SER 24 N -4.59 -0.26 -0.18 1.72 1.04 -1.25 -3.48 113.70 106.70 1kfv s SER 24 Ca -0.16 -0.59 -0.01 0.00 0.48 0.00 0.00 55.95 55.67 1kfv s SER 24 Cb 0.03 0.67 0.05 0.00 0.10 0.00 0.00 66.02 66.87 1kfv s SER 24 CO 0.56 -1.24 -0.03 -0.63 0.98 0.00 0.00 173.24 172.88 1kfv s ILE 25 N -3.92 1.02 -0.04 -1.02 1.01 -1.26 -2.16 121.20 114.84 1kfv s ILE 25 Ca 0.12 -0.66 -0.02 0.00 0.00 0.00 0.00 60.65 60.09 1kfv s ILE 25 Cb -0.04 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 1kfv s ILE 25 CO 0.04 0.04 0.10 -1.61 0.00 0.00 0.00 174.94 173.51 1kfv s GLU 26 N 1.66 3.19 -0.02 2.79 2.02 -0.57 -4.96 118.70 122.81 1kfv s GLU 26 Ca -0.00 -0.38 0.00 0.00 0.02 0.00 0.00 54.97 54.61 1kfv s GLU 26 Cb -0.16 -2.95 0.02 0.00 0.10 0.00 0.00 34.13 31.14 1kfv s GLU 26 CO -0.07 0.68 0.01 0.00 0.02 0.00 0.00 175.26 175.90 1kfv s ALA 27 N -1.15 0.12 -0.43 5.21 0.00 -1.26 -0.93 121.76 123.33 1kfv s ALA 27 Ca 0.21 0.17 0.15 0.00 0.00 0.00 0.00 51.96 52.49 1kfv s ALA 27 Cb -0.12 -0.18 -0.20 0.00 0.00 0.00 0.00 23.12 22.62 1kfv s ALA 27 CO 0.11 -0.06 0.52 0.25 0.00 0.00 0.00 175.76 176.58 1kfv n THR 28 N 3.80 0.00 -2.71 0.00 -2.24 -0.27 -4.53 114.28 108.34 1kfv n THR 28 Ca -0.23 -0.23 -0.15 0.00 -2.27 0.00 0.00 64.05 61.17 1kfv n THR 28 Cb 0.53 0.64 0.01 0.00 -2.10 0.00 0.00 70.33 69.41 1kfv n THR 28 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1kfv n TYR 29 N -1.65 1.68 -0.42 4.78 -0.00 -1.12 -4.99 117.16 115.43 1kfv n TYR 29 Ca 0.00 -3.07 0.34 0.00 -0.00 0.00 0.00 57.90 55.18 1kfv n TYR 29 Cb 0.31 -0.32 0.63 0.00 -0.00 0.00 0.00 39.34 39.96 1kfv n TYR 29 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.86 175.86 1kfv h PRO 30 N 2.90 0.14 -3.30 2.98 0.13 -1.80 -3.40 132.00 129.65 1kfv h PRO 30 Ca 0.03 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1kfv h PRO 30 Cb 1.06 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1kfv h PRO 30 CO 0.60 0.09 0.57 2.89 -0.23 0.00 0.00 178.00 181.91 1kfv n ARG 31 N -4.62 0.00 -0.79 0.86 1.85 -1.26 -4.32 116.66 108.38 1kfv n ARG 31 Ca 0.34 -0.13 0.00 0.00 -1.00 0.00 0.00 57.85 57.06 1kfv n ARG 31 Cb 1.33 -1.52 0.00 0.00 -1.05 0.00 0.00 32.46 31.22 1kfv n ARG 31 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1kfv n VAL 33 N 3.37 -0.27 0.05 8.89 0.31 -1.26 -4.87 118.33 124.55 1kfv n VAL 33 Ca 0.00 0.05 0.21 0.00 -0.01 0.00 0.00 64.34 64.59 1kfv n VAL 33 Cb 0.00 -0.45 0.74 0.00 -0.91 0.00 0.00 33.84 33.21 1kfv n VAL 33 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1kfv h LEU 34 N 1.77 0.00 -3.42 7.52 4.07 -1.29 -1.70 115.31 122.26 1kfv h LEU 34 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1kfv h LEU 34 Cb 0.11 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.85 1kfv h LEU 34 CO 0.00 0.00 0.00 0.35 -1.08 0.00 0.00 178.44 177.71 1kfv n THR 35 N -3.90 2.56 -0.94 0.22 -2.24 -1.25 -4.99 114.28 103.73 1kfv n THR 35 Ca 0.09 -1.33 0.00 0.00 -2.27 0.00 0.00 64.05 60.54 1kfv n THR 35 Cb 0.64 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 1kfv n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1kfv n GLY 36 N 0.68 -2.04 0.36 3.38 0.00 -0.64 -4.64 105.19 102.29 1kfv n GLY 36 Ca 0.27 -0.59 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 1kfv n GLY 36 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1kfv h PHE 37 N 0.00 1.11 0.41 1.61 3.57 -1.75 0.14 116.94 122.03 1kfv h PHE 37 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1kfv h PHE 37 Cb 0.00 -0.37 -0.02 0.00 2.79 0.00 0.00 35.95 38.36 1kfv h PHE 37 CO 0.00 0.73 -0.36 1.49 -2.23 0.00 0.00 178.31 177.94 1kfv h GLU 38 N 1.17 -0.75 -0.79 1.11 4.57 -1.93 0.67 114.58 118.62 1kfv h GLU 38 Ca 0.31 0.05 0.12 0.00 -1.18 0.00 0.00 59.36 58.66 1kfv h GLU 38 Cb -0.06 0.17 -0.08 0.00 -0.16 0.00 0.00 28.75 28.61 1kfv h GLU 38 CO -0.06 -0.50 0.40 0.37 -1.18 0.00 0.00 179.01 178.04 1kfv h GLN 39 N -0.78 0.60 0.00 1.92 4.15 -1.77 -0.10 115.11 119.13 1kfv h GLN 39 Ca -0.03 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.30 1kfv h GLN 39 Cb 0.68 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 1kfv h GLN 39 CO -0.04 0.39 -0.23 1.25 -1.93 0.00 0.00 178.83 178.28 1kfv h LEU 40 N 0.61 0.00 0.21 -2.39 6.46 0.24 -2.93 115.31 117.51 1kfv h LEU 40 Ca 0.41 0.00 -0.32 0.00 -0.12 0.00 0.00 57.88 57.85 1kfv h LEU 40 Cb 0.53 0.00 0.03 0.00 -0.73 0.00 0.00 40.66 40.48 1kfv h LEU 40 CO -0.33 0.23 -1.44 0.50 -0.62 0.00 0.00 178.44 176.79 1kfv h LYS 41 N 0.00 0.45 0.00 1.25 3.64 0.21 -2.65 116.57 119.47 1kfv h LYS 41 Ca -0.00 -0.76 -0.01 0.00 -1.27 0.00 0.00 60.65 58.60 1kfv h LYS 41 Cb 0.54 0.28 -0.00 0.00 -0.41 0.00 0.00 32.23 32.64 1kfv h LYS 41 CO 0.03 1.36 -0.05 -0.22 -2.27 0.00 0.00 179.45 178.30 1kfv h LYS 42 N 0.12 0.00 0.00 1.90 3.64 -1.06 -2.69 116.57 118.48 1kfv h LYS 42 Ca -0.23 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 58.77 1kfv h LYS 42 Cb 2.11 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 33.86 1kfv h LYS 42 CO 0.25 0.05 -2.44 0.39 -2.27 0.00 0.00 179.45 175.43 1kfv n GLU 43 N -4.00 0.67 0.11 1.90 1.02 -1.15 -4.59 120.64 114.62 1kfv n GLU 43 Ca -0.03 0.08 0.12 0.00 -0.02 0.00 0.00 57.16 57.31 1kfv n GLU 43 Cb 0.14 -1.52 0.10 0.00 -0.02 0.00 0.00 31.44 30.14 1kfv n GLU 43 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1kfv h LEU 44 N 0.00 0.00 -9.59 -4.62 3.38 -1.50 -3.47 115.31 99.51 1kfv h LEU 44 Ca -0.56 -0.06 -0.53 0.00 0.09 0.00 0.00 57.88 56.82 1kfv h LEU 44 Cb 2.05 0.00 0.04 0.00 0.09 0.00 0.00 40.66 42.84 1kfv h LEU 44 CO -0.04 0.03 0.86 -0.89 0.09 0.00 0.00 178.44 178.49 1kfv s THR 45 N -3.27 2.74 -0.13 0.22 2.01 -1.02 -2.41 115.64 113.79 1kfv s THR 45 Ca 0.03 0.53 -0.00 0.00 0.31 0.00 0.00 61.69 62.56 1kfv s THR 45 Cb 0.10 -3.34 0.00 0.00 0.01 0.00 0.00 72.50 69.27 1kfv s THR 45 CO 0.74 0.04 0.01 0.61 -0.69 0.00 0.00 174.62 175.33 1kfv n GLY 46 N 3.72 0.37 3.08 4.40 0.00 0.95 -5.01 105.19 112.70 1kfv n GLY 46 Ca 0.13 -0.80 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 1kfv n GLY 46 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1kfv n LYS 47 N -1.12 0.87 -5.03 1.61 4.76 -1.01 -4.81 118.16 113.43 1kfv n LYS 47 Ca -0.02 -2.89 -0.28 0.00 -2.87 0.00 0.00 58.31 52.26 1kfv n LYS 47 Cb 0.51 0.45 -0.15 0.00 -1.84 0.00 0.00 35.03 34.00 1kfv n LYS 47 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1kfv s THR 48 N -2.32 1.73 -0.97 -0.18 2.01 -1.26 0.17 115.64 114.82 1kfv s THR 48 Ca 0.18 -0.97 -0.23 0.00 0.31 0.00 0.00 61.69 60.98 1kfv s THR 48 Cb -0.01 -1.44 0.06 0.00 0.01 0.00 0.00 72.50 71.11 1kfv s THR 48 CO 0.11 0.46 1.39 -0.63 -0.69 0.00 0.00 174.62 175.26 1kfv s ILE 49 N -0.55 3.98 0.06 1.82 -1.09 -0.47 -3.24 121.20 121.71 1kfv s ILE 49 Ca 0.08 -0.69 -0.38 0.00 -2.23 0.00 0.00 60.65 57.44 1kfv s ILE 49 Cb -0.08 -5.01 -0.21 0.00 -1.58 0.00 0.00 42.46 35.58 1kfv s ILE 49 CO -0.00 -1.88 1.57 1.56 -1.23 0.00 0.00 174.94 174.96 1kfv h GLN 50 N 9.73 -1.31 -2.85 2.79 4.20 -0.89 4.03 115.11 130.80 1kfv h GLN 50 Ca 0.13 0.09 0.04 0.00 0.06 0.00 0.00 58.65 58.97 1kfv h GLN 50 Cb 1.02 0.30 -0.10 0.00 0.30 0.00 0.00 27.48 29.00 1kfv h GLN 50 CO 1.37 -0.87 0.28 0.20 -0.67 0.00 0.00 178.83 179.14 1kfv s GLY 51 N -1.99 -0.40 -0.33 3.46 0.00 -1.00 -4.51 107.32 102.56 1kfv s GLY 51 Ca -0.20 0.27 0.02 0.00 0.00 0.00 0.00 44.72 44.81 1kfv s GLY 51 CO 0.60 0.09 0.06 -0.42 0.00 0.00 0.00 173.10 173.42 1kfv s ILE 52 N -3.68 1.80 0.56 0.90 -1.09 -1.26 0.60 121.20 119.03 1kfv s ILE 52 Ca 0.06 -1.99 0.08 0.00 -2.23 0.00 0.00 60.65 56.57 1kfv s ILE 52 Cb -0.03 -2.32 0.07 0.00 -1.58 0.00 0.00 42.46 38.60 1kfv s ILE 52 CO -0.05 -0.60 0.66 -0.94 -1.23 0.00 0.00 174.94 172.78 1kfv s SER 53 N 1.15 4.96 0.01 3.58 1.04 -0.70 -4.90 113.70 118.85 1kfv s SER 53 Ca 0.10 -0.97 -0.03 0.00 0.48 0.00 0.00 55.95 55.53 1kfv s SER 53 Cb -0.18 0.31 -0.01 0.00 0.10 0.00 0.00 66.02 66.24 1kfv s SER 53 CO -0.13 -1.25 0.04 -0.60 0.98 0.00 0.00 173.24 172.28 1kfv s ARG 54 N -4.53 0.38 -0.28 4.02 3.52 -1.26 -0.91 118.95 119.88 1kfv s ARG 54 Ca 0.52 -0.50 -0.01 0.00 -0.13 0.00 0.00 55.73 55.61 1kfv s ARG 54 Cb -0.05 0.15 0.13 0.00 -1.56 0.00 0.00 34.95 33.61 1kfv s ARG 54 CO 0.33 -0.08 0.26 0.50 -0.81 0.00 0.00 175.30 175.50 1kfv s ARG 55 N -1.38 0.29 6.48 5.12 6.06 -0.65 -4.99 118.95 129.87 1kfv s ARG 55 Ca -0.15 -0.19 0.00 0.00 -2.50 0.00 0.00 55.73 52.89 1kfv s ARG 55 Cb -0.09 -0.80 0.00 0.00 0.06 0.00 0.00 34.95 34.13 1kfv s ARG 55 CO 0.00 -1.00 0.00 0.41 -2.50 0.00 0.00 175.30 172.21 1kfv n GLY 56 N 5.30 1.50 1.06 8.12 0.00 -1.26 -2.23 105.19 117.68 1kfv n GLY 56 Ca -0.03 -0.51 0.09 0.00 0.00 0.00 0.00 46.02 45.57 1kfv n GLY 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1kfv n LYS 57 N 12.74 2.35 -3.59 1.61 5.02 -1.26 -4.64 118.16 130.40 1kfv n LYS 57 Ca 0.00 -2.07 -0.36 0.00 -2.02 0.00 0.00 58.31 53.86 1kfv n LYS 57 Cb 0.00 -1.45 -0.08 0.00 -0.02 0.00 0.00 35.03 33.48 1kfv n LYS 57 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1kfv s TYR 58 N -1.25 3.41 0.16 2.13 2.02 -0.95 -4.49 117.35 118.39 1kfv s TYR 58 Ca 0.38 0.47 -0.19 0.00 -0.37 0.00 0.00 57.07 57.36 1kfv s TYR 58 Cb 0.20 -2.30 -0.08 0.00 -0.40 0.00 0.00 41.96 39.38 1kfv s TYR 58 CO 0.26 0.19 0.65 -0.51 -1.57 0.00 0.00 175.55 174.58 1kfv s LEU 59 N 0.63 4.42 -0.27 -1.29 1.43 0.25 -1.64 118.68 122.21 1kfv s LEU 59 Ca 0.13 1.33 -0.00 0.00 -1.03 0.00 0.00 54.13 54.56 1kfv s LEU 59 Cb -0.13 -3.31 0.08 0.00 0.03 0.00 0.00 46.19 42.87 1kfv s LEU 59 CO 0.03 0.13 0.04 -0.63 0.23 0.00 0.00 176.35 176.15 1kfv s ILE 60 N -1.36 1.16 -0.10 -0.59 1.01 -0.09 0.12 121.20 121.35 1kfv s ILE 60 Ca 0.37 -1.31 -0.27 0.00 0.00 0.00 0.00 60.65 59.44 1kfv s ILE 60 Cb -0.18 -1.71 -0.02 0.00 0.01 0.00 0.00 42.46 40.56 1kfv s ILE 60 CO 0.21 -0.42 0.91 -0.36 0.00 0.00 0.00 174.94 175.27 1kfv s PHE 61 N 1.51 3.52 -0.46 3.97 0.08 0.73 -1.72 117.98 125.62 1kfv s PHE 61 Ca 0.04 1.46 -0.13 0.00 0.12 0.00 0.00 56.93 58.42 1kfv s PHE 61 Cb -0.18 -3.07 0.08 0.00 -0.57 0.00 0.00 43.02 39.28 1kfv s PHE 61 CO -0.15 -0.15 0.35 -1.21 -0.10 0.00 0.00 175.22 173.96 1kfv s GLU 62 N 1.72 2.82 -0.28 0.44 2.02 0.20 0.92 118.70 126.54 1kfv s GLU 62 Ca 0.44 -1.42 0.03 0.00 0.02 0.00 0.00 54.97 54.04 1kfv s GLU 62 Cb -0.18 -4.00 0.07 0.00 0.10 0.00 0.00 34.13 30.12 1kfv s GLU 62 CO 0.18 -1.02 -0.07 0.42 0.02 0.00 0.00 175.26 174.79 1kfv s ILE 63 N 1.55 2.22 0.18 -1.63 -1.09 -1.12 -0.15 121.20 121.16 1kfv s ILE 63 Ca 0.04 -1.78 0.00 0.00 -2.23 0.00 0.00 60.65 56.68 1kfv s ILE 63 Cb -0.24 -2.38 0.00 0.00 -1.58 0.00 0.00 42.46 38.26 1kfv s ILE 63 CO 0.04 -0.15 0.00 0.61 -1.23 0.00 0.00 174.94 174.21 1kfv n GLY 64 N 4.40 -4.57 1.11 6.18 0.00 -1.20 -3.76 105.19 107.34 1kfv n GLY 64 Ca -0.10 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1kfv n GLY 64 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1kfv n ASP 65 N 0.67 0.26 0.00 1.61 5.75 -1.26 -2.02 116.55 121.55 1kfv n ASP 65 Ca 0.00 -0.27 0.00 0.00 -0.01 0.00 0.00 54.79 54.51 1kfv n ASP 65 Cb 0.00 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.04 1kfv n ASP 65 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1kfv n ASP 66 N 1.08 4.37 -4.11 -1.12 8.00 -1.26 -4.87 116.55 118.65 1kfv n ASP 66 Ca 0.00 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.31 1kfv n ASP 66 Cb 0.04 0.32 -0.13 0.00 -0.02 0.00 0.00 41.12 41.33 1kfv n ASP 66 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1kfv s PHE 67 N -1.93 1.07 -0.04 1.24 0.08 -0.86 -2.49 117.98 115.06 1kfv s PHE 67 Ca 0.00 -0.32 0.06 0.00 0.12 0.00 0.00 56.93 56.79 1kfv s PHE 67 Cb 0.00 -0.65 -0.01 0.00 -0.57 0.00 0.00 43.02 41.79 1kfv s PHE 67 CO 0.00 0.01 -0.23 1.03 -0.10 0.00 0.00 175.22 175.93 1kfv s ARG 68 N -0.96 2.14 -0.48 0.44 3.00 0.14 -2.78 118.95 120.45 1kfv s ARG 68 Ca 0.01 -0.82 -0.15 0.00 0.00 0.00 0.00 55.73 54.77 1kfv s ARG 68 Cb -0.07 -1.91 0.09 0.00 0.00 0.00 0.00 34.95 33.06 1kfv s ARG 68 CO 0.01 0.40 0.40 -1.17 0.00 0.00 0.00 175.30 174.94 1kfv s LEU 69 N -0.27 5.70 -0.37 2.53 2.96 0.26 -1.29 118.68 128.20 1kfv s LEU 69 Ca 0.01 -1.46 -0.29 0.00 -0.22 0.00 0.00 54.13 52.17 1kfv s LEU 69 Cb -0.11 -2.16 0.02 0.00 0.50 0.00 0.00 46.19 44.43 1kfv s LEU 69 CO 0.02 -0.68 1.17 -0.63 -1.32 0.00 0.00 176.35 174.90 1kfv s ILE 70 N 1.60 4.30 -0.11 6.68 -1.09 -0.62 -0.19 121.20 131.77 1kfv s ILE 70 Ca 0.04 1.43 0.00 0.00 -2.23 0.00 0.00 60.65 59.89 1kfv s ILE 70 Cb -0.25 -4.41 -0.02 0.00 -1.58 0.00 0.00 42.46 36.20 1kfv s ILE 70 CO 0.05 -0.66 -0.11 -0.55 -1.23 0.00 0.00 174.94 172.44 1kfv s SER 71 N 2.29 4.25 -0.10 3.58 0.15 0.33 -2.30 113.70 121.92 1kfv s SER 71 Ca 0.50 -0.22 0.01 0.00 0.70 0.00 0.00 55.95 56.94 1kfv s SER 71 Cb -0.12 -1.42 0.02 0.00 -1.71 0.00 0.00 66.02 62.79 1kfv s SER 71 CO 0.23 0.23 -0.13 -2.28 1.20 0.00 0.00 173.24 172.50 1kfv s HIS 72 N -0.05 1.70 -1.21 3.44 2.46 -0.75 0.83 115.29 121.71 1kfv s HIS 72 Ca -0.02 -0.76 0.28 0.00 0.47 0.00 0.00 55.06 55.03 1kfv s HIS 72 Cb -0.14 -1.27 1.02 0.00 -0.13 0.00 0.00 32.58 32.07 1kfv s HIS 72 CO 0.04 -0.42 1.76 1.28 -2.47 0.00 0.00 174.74 174.92 1kfv n LEU 73 N 4.24 0.30 0.00 8.88 4.32 -1.26 -1.53 117.00 131.95 1kfv n LEU 73 Ca -0.19 0.19 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1kfv n LEU 73 Cb 0.51 -0.32 0.00 0.00 -1.62 0.00 0.00 43.42 41.99 1kfv n LEU 73 CO 0.23 0.06 0.00 0.54 -1.22 0.00 0.00 177.39 177.00 1kfv n ARG 74 N -1.32 0.00 0.00 3.23 5.12 -1.26 0.00 116.66 122.43 1kfv n ARG 74 Ca 0.09 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.01 1kfv n ARG 74 Cb 0.32 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.62 1kfv n ARG 74 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1kfv n GLU 76 N 0.00 0.13 -1.85 5.56 1.02 -1.26 -4.34 120.64 119.91 1kfv n GLU 76 Ca 0.00 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.76 1kfv n GLU 76 Cb 0.00 -1.25 0.04 0.00 -0.02 0.00 0.00 31.44 30.21 1kfv n GLU 76 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1kfv s GLY 77 N 0.04 2.86 -0.23 0.62 0.00 0.10 -4.56 107.32 106.16 1kfv s GLY 77 Ca 0.00 1.24 -0.13 0.00 0.00 0.00 0.00 44.72 45.84 1kfv s GLY 77 CO 0.00 1.73 0.56 -1.59 0.00 0.00 0.00 173.10 173.80 1kfv s LYS 78 N -3.00 0.56 0.25 2.90 -2.85 0.11 -4.90 119.74 112.81 1kfv s LYS 78 Ca 0.73 1.04 -0.02 0.00 -1.00 0.00 0.00 55.97 56.72 1kfv s LYS 78 Cb -0.38 0.08 -0.04 0.00 -2.06 0.00 0.00 37.83 35.43 1kfv s LYS 78 CO 0.44 -0.16 0.47 0.71 0.10 0.00 0.00 175.35 176.91 1kfv s TYR 79 N 1.56 3.48 -0.26 1.78 2.02 -1.26 -0.81 117.35 123.87 1kfv s TYR 79 Ca -0.10 0.45 -0.25 0.00 -0.37 0.00 0.00 57.07 56.80 1kfv s TYR 79 Cb -0.07 -1.95 0.10 0.00 -0.40 0.00 0.00 41.96 39.64 1kfv s TYR 79 CO -0.17 0.27 0.87 -0.98 -1.57 0.00 0.00 175.55 173.98 1kfv s ARG 80 N -3.53 0.69 -0.17 -0.62 1.70 -0.72 -4.99 118.95 111.31 1kfv s ARG 80 Ca 0.41 0.76 -0.09 0.00 -0.47 0.00 0.00 55.73 56.34 1kfv s ARG 80 Cb -0.11 0.34 -0.05 0.00 -0.57 0.00 0.00 34.95 34.56 1kfv s ARG 80 CO 0.30 -0.09 0.11 -0.51 -1.08 0.00 0.00 175.30 174.03 1kfv s LEU 81 N 0.20 4.15 0.32 -1.89 1.02 -1.26 -0.79 118.68 120.43 1kfv s LEU 81 Ca 0.01 0.25 0.00 0.00 0.02 0.00 0.00 54.13 54.41 1kfv s LEU 81 Cb -0.05 -2.05 -0.01 0.00 0.02 0.00 0.00 46.19 44.10 1kfv s LEU 81 CO -0.02 0.24 0.37 0.00 0.02 0.00 0.00 176.35 176.96 1kfv s ALA 82 N 0.01 1.12 0.65 4.21 0.00 -1.09 -5.01 121.76 121.65 1kfv s ALA 82 Ca 0.09 -1.69 -0.18 0.00 0.00 0.00 0.00 51.96 50.18 1kfv s ALA 82 Cb -0.11 1.28 -0.01 0.00 0.00 0.00 0.00 23.12 24.28 1kfv s ALA 82 CO -0.00 -0.73 1.30 0.99 0.00 0.00 0.00 175.76 177.31 1kfv s THR 83 N -3.35 2.03 0.56 0.00 2.01 -1.26 -2.95 115.64 112.68 1kfv s THR 83 Ca 0.34 0.02 0.24 0.00 0.31 0.00 0.00 61.69 62.60 1kfv s THR 83 Cb 0.01 -3.01 0.32 0.00 0.01 0.00 0.00 72.50 69.84 1kfv s THR 83 CO 0.21 -0.00 2.21 -0.07 -0.69 0.00 0.00 174.62 176.28 1kfv h LEU 84 N 0.54 0.00 -2.48 4.42 3.38 -1.88 -0.98 115.31 118.31 1kfv h LEU 84 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1kfv h LEU 84 Cb 1.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1kfv h LEU 84 CO 0.53 0.01 0.00 -0.90 0.09 0.00 0.00 178.44 178.17 1kfv n ASP 85 N -4.11 2.98 -4.60 -0.43 5.68 -1.26 -5.01 116.55 109.81 1kfv n ASP 85 Ca -0.03 -1.90 -0.43 0.00 -0.50 0.00 0.00 54.79 51.93 1kfv n ASP 85 Cb 0.09 -0.23 -0.01 0.00 -1.14 0.00 0.00 41.12 39.84 1kfv n ASP 85 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1kfv n ALA 86 N 0.88 0.01 -1.57 2.12 0.00 -0.37 -4.92 120.51 116.66 1kfv n ALA 86 Ca 0.14 0.33 -0.33 0.00 0.00 0.00 0.00 53.44 53.58 1kfv n ALA 86 Cb 0.46 -2.05 0.04 0.00 0.00 0.00 0.00 19.45 17.89 1kfv n ALA 86 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1kfv s PRO 87 N -1.72 2.94 -0.49 0.00 0.04 -1.26 -4.99 135.00 129.52 1kfv s PRO 87 Ca 0.60 1.41 -0.24 0.00 0.04 0.00 0.00 61.00 62.81 1kfv s PRO 87 Cb -0.64 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 31.97 1kfv s PRO 87 CO 0.59 -1.14 0.85 0.50 0.04 0.00 0.00 177.00 177.85 1kfv s ARG 88 N -3.96 3.38 0.78 4.56 3.00 -1.26 -5.04 118.95 120.41 1kfv s ARG 88 Ca 0.68 -0.18 -0.11 0.00 -1.00 0.00 0.00 55.73 55.12 1kfv s ARG 88 Cb -0.21 -3.99 0.06 0.00 0.00 0.00 0.00 34.95 30.81 1kfv s ARG 88 CO 0.39 -1.28 1.09 -1.21 0.00 0.00 0.00 175.30 174.29 1kfv s GLU 89 N 3.56 2.22 0.29 5.12 2.02 -1.26 -4.96 118.70 125.70 1kfv s GLU 89 Ca 0.30 1.18 -0.01 0.00 0.02 0.00 0.00 54.97 56.47 1kfv s GLU 89 Cb -0.12 -1.89 0.66 0.00 0.10 0.00 0.00 34.13 32.87 1kfv s GLU 89 CO 0.21 -1.67 1.60 -0.22 0.02 0.00 0.00 175.26 175.20 1kfv h LYS 90 N -1.14 0.06 -0.50 1.61 3.64 -2.05 -2.72 116.57 115.47 1kfv h LYS 90 Ca -0.44 -0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 58.69 1kfv h LYS 90 Cb 1.23 -0.01 -0.15 0.00 -0.41 0.00 0.00 32.23 32.89 1kfv h LYS 90 CO 0.51 0.04 0.08 0.72 -2.27 0.00 0.00 179.45 178.53 1kfv n HIS 91 N -5.42 1.54 -2.93 1.91 8.25 -1.26 -4.98 115.22 112.33 1kfv n HIS 91 Ca 0.20 -1.65 -0.40 0.00 -0.26 0.00 0.00 57.72 55.61 1kfv n HIS 91 Cb 0.67 -0.59 -0.06 0.00 1.12 0.00 0.00 29.99 31.13 1kfv n HIS 91 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1kfv s ASP 92 N -2.25 7.38 0.00 0.41 1.11 -1.03 -1.30 116.67 121.00 1kfv s ASP 92 Ca 0.47 1.64 0.00 0.00 0.18 0.00 0.00 52.55 54.85 1kfv s ASP 92 Cb 0.42 -2.51 0.00 0.00 1.07 0.00 0.00 42.92 41.90 1kfv s ASP 92 CO 0.02 0.13 0.00 1.41 1.18 0.00 0.00 175.17 177.91 1kfv n HIS 93 N 2.02 0.00 -3.98 4.23 8.25 -0.65 -4.72 115.22 120.36 1kfv n HIS 93 Ca -0.04 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.34 1kfv n HIS 93 Cb 0.49 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.50 1kfv n HIS 93 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1kfv s LEU 94 N -3.22 2.13 0.00 2.41 1.43 -1.08 -1.11 118.68 119.24 1kfv s LEU 94 Ca 0.00 -0.59 0.00 0.00 -1.03 0.00 0.00 54.13 52.51 1kfv s LEU 94 Cb 0.00 0.29 0.00 0.00 0.03 0.00 0.00 46.19 46.51 1kfv s LEU 94 CO 0.00 -0.42 0.00 1.07 0.23 0.00 0.00 176.35 177.23 1kfv n THR 95 N 1.08 0.00 -3.67 5.49 5.66 -0.11 -0.29 114.28 122.44 1kfv n THR 95 Ca -0.21 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.70 1kfv n THR 95 Cb 0.57 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.26 1kfv n THR 95 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1kfv s LYS 97 N -0.18 0.54 0.47 1.09 1.02 -0.92 -1.51 119.74 120.25 1kfv s LYS 97 Ca 0.00 0.94 0.07 0.00 0.02 0.00 0.00 55.97 57.01 1kfv s LYS 97 Cb 0.00 0.08 0.01 0.00 -0.52 0.00 0.00 37.83 37.39 1kfv s LYS 97 CO 0.00 -0.14 0.43 -0.06 -0.92 0.00 0.00 175.35 174.65 1kfv s PHE 98 N 1.34 2.27 0.36 3.18 0.08 0.95 -1.91 117.98 124.25 1kfv s PHE 98 Ca -0.08 -0.61 0.07 0.00 0.12 0.00 0.00 56.93 56.42 1kfv s PHE 98 Cb -0.07 -2.10 0.69 0.00 -0.57 0.00 0.00 43.02 40.98 1kfv s PHE 98 CO -0.14 -0.32 1.88 0.00 -0.10 0.00 0.00 175.22 176.55 1kfv h ALA 99 N 0.87 1.43 0.00 5.36 0.00 -1.99 -3.23 119.26 121.69 1kfv h ALA 99 Ca -0.39 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1kfv h ALA 99 Cb 1.28 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1kfv h ALA 99 CO 0.56 0.40 0.00 -0.40 0.00 0.00 0.00 179.25 179.81 1kfv n ASP 100 N -4.26 1.44 -0.53 0.00 5.68 -1.26 -5.10 116.55 112.52 1kfv n ASP 100 Ca -0.00 -1.66 0.00 0.00 -0.50 0.00 0.00 54.79 52.63 1kfv n ASP 100 Cb 0.27 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.25 1kfv n ASP 100 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1kfv n GLY 101 N -0.33 0.66 3.15 6.12 0.00 -1.22 -4.84 105.19 108.73 1kfv n GLY 101 Ca 0.00 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 1kfv n GLY 101 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1kfv s GLN 102 N -0.60 0.44 -0.34 1.61 -2.07 -1.15 0.32 119.66 117.87 1kfv s GLN 102 Ca 0.00 -0.04 -0.13 0.00 -1.82 0.00 0.00 55.36 53.38 1kfv s GLN 102 Cb 0.00 0.20 -0.01 0.00 -1.09 0.00 0.00 33.01 32.10 1kfv s GLN 102 CO 0.00 -0.10 0.23 -1.17 -1.32 0.00 0.00 175.29 172.93 1kfv s LEU 103 N -0.73 4.50 -0.21 2.60 0.20 -1.26 -2.66 118.68 121.13 1kfv s LEU 103 Ca -0.08 -0.47 -0.07 0.00 0.69 0.00 0.00 54.13 54.20 1kfv s LEU 103 Cb -0.05 -2.12 -0.04 0.00 -0.43 0.00 0.00 46.19 43.56 1kfv s LEU 103 CO 0.02 -0.24 0.06 -0.63 -0.29 0.00 0.00 176.35 175.27 1kfv s ILE 104 N 1.70 4.58 -0.21 6.68 1.01 0.03 -4.19 121.20 130.81 1kfv s ILE 104 Ca 0.06 -0.10 -0.10 0.00 0.00 0.00 0.00 60.65 60.51 1kfv s ILE 104 Cb -0.17 -3.09 -0.05 0.00 0.01 0.00 0.00 42.46 39.15 1kfv s ILE 104 CO 0.10 0.41 0.13 -0.47 0.00 0.00 0.00 174.94 175.11 1kfv s TYR 105 N 0.86 3.36 0.15 3.97 5.04 0.60 -1.75 117.35 129.58 1kfv s TYR 105 Ca 0.04 0.26 0.06 0.00 -2.44 0.00 0.00 57.07 54.99 1kfv s TYR 105 Cb -0.14 -2.19 -0.04 0.00 0.35 0.00 0.00 41.96 39.94 1kfv s TYR 105 CO 0.02 0.19 -0.14 0.00 -1.34 0.00 0.00 175.55 174.29 1kfv s ALA 106 N 0.60 1.64 0.00 3.97 0.00 0.01 -1.64 121.76 126.35 1kfv s ALA 106 Ca 0.07 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.62 1kfv s ALA 106 Cb -0.12 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 22.93 1kfv s ALA 106 CO 0.00 0.08 0.00 -3.47 0.00 0.00 0.00 175.76 172.38 1kfv n ASP 107 N 0.24 0.00 0.00 0.00 2.03 -0.42 0.07 116.55 118.47 1kfv n ASP 107 Ca -0.13 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.18 1kfv n ASP 107 Cb 0.58 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.98 1kfv n ASP 107 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1kfv n VAL 108 N 0.00 0.00 1.30 5.18 0.31 -1.26 -4.71 118.33 119.14 1kfv n VAL 108 Ca 0.00 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.46 1kfv n VAL 108 Cb 0.00 0.00 0.43 0.00 -0.91 0.00 0.00 33.84 33.36 1kfv n VAL 108 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1kfv n ARG 109 N 0.00 0.90 -3.00 5.55 1.74 -1.26 -4.95 116.66 115.63 1kfv n ARG 109 Ca 0.00 -0.49 -0.22 0.00 -0.77 0.00 0.00 57.85 56.37 1kfv n ARG 109 Cb 0.00 -1.49 0.02 0.00 -1.02 0.00 0.00 32.46 29.97 1kfv n ARG 109 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1kfv n LYS 110 N -0.62 -3.94 0.03 5.56 5.02 -1.26 -4.87 118.16 118.07 1kfv n LYS 110 Ca 0.13 0.77 -0.13 0.00 -2.02 0.00 0.00 58.31 57.06 1kfv n LYS 110 Cb 0.34 -5.55 -0.14 0.00 -0.02 0.00 0.00 35.03 29.66 1kfv n LYS 110 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1kfv h PHE 111 N -1.02 0.25 -3.61 2.13 -1.00 -1.92 -3.47 116.94 108.30 1kfv h PHE 111 Ca -0.48 -0.18 -0.57 0.00 2.81 0.00 0.00 57.97 59.55 1kfv h PHE 111 Cb 1.33 -0.01 0.16 0.00 3.61 0.00 0.00 35.95 41.04 1kfv h PHE 111 CO 0.59 1.26 0.22 0.41 -1.61 0.00 0.00 178.31 179.18 1kfv n GLY 112 N 1.62 -0.10 3.11 -1.45 0.00 -1.26 -4.79 105.19 102.33 1kfv n GLY 112 Ca -0.16 -0.08 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 1kfv n GLY 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1kfv s THR 113 N -1.44 0.63 -0.05 2.61 -4.23 -0.58 -4.91 115.64 107.67 1kfv s THR 113 Ca 0.74 -1.45 0.03 0.00 -1.18 0.00 0.00 61.69 59.83 1kfv s THR 113 Cb -0.43 -1.07 0.01 0.00 1.34 0.00 0.00 72.50 72.34 1kfv s THR 113 CO 0.48 -0.58 -0.12 0.26 -0.54 0.00 0.00 174.62 174.12 1kfv s TRP 114 N -2.30 1.40 -0.03 3.99 0.52 -1.26 -1.81 118.94 119.45 1kfv s TRP 114 Ca -0.01 -0.47 0.01 0.00 0.02 0.00 0.00 56.10 55.65 1kfv s TRP 114 Cb -0.04 -1.01 0.02 0.00 -1.15 0.00 0.00 33.47 31.29 1kfv s TRP 114 CO -0.02 -0.23 -0.01 -1.21 0.02 0.00 0.00 176.95 175.51 1kfv s GLU 115 N 0.49 0.33 -0.14 4.98 2.02 -0.97 -0.90 118.70 124.51 1kfv s GLU 115 Ca -0.11 0.03 -0.16 0.00 0.02 0.00 0.00 54.97 54.75 1kfv s GLU 115 Cb -0.14 -0.47 -0.04 0.00 0.10 0.00 0.00 34.13 33.58 1kfv s GLU 115 CO 0.03 -0.10 0.38 -1.17 0.02 0.00 0.00 175.26 174.42 1kfv s LEU 116 N 0.84 4.25 0.03 1.80 2.96 -1.26 -1.59 118.68 125.71 1kfv s LEU 116 Ca -0.09 0.64 0.03 0.00 -0.22 0.00 0.00 54.13 54.49 1kfv s LEU 116 Cb -0.12 -2.52 -0.02 0.00 0.50 0.00 0.00 46.19 44.03 1kfv s LEU 116 CO -0.01 0.05 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.35 1kfv s ILE 117 N 0.57 0.67 0.36 6.68 1.09 -0.41 -4.93 121.20 125.22 1kfv s ILE 117 Ca 0.21 -0.81 -0.25 0.00 -1.10 0.00 0.00 60.65 58.69 1kfv s ILE 117 Cb -0.14 -0.65 -0.09 0.00 -1.06 0.00 0.00 42.46 40.52 1kfv s ILE 117 CO 0.07 -0.13 1.02 -0.94 -0.10 0.00 0.00 174.94 174.86 1kfv s SER 118 N -1.04 7.01 0.24 3.58 1.04 -1.26 0.24 113.70 123.51 1kfv s SER 118 Ca -0.03 2.01 -0.08 0.00 0.48 0.00 0.00 55.95 58.33 1kfv s SER 118 Cb -0.07 -2.59 0.41 0.00 0.10 0.00 0.00 66.02 63.87 1kfv s SER 118 CO 0.00 -0.31 1.64 0.74 0.98 0.00 0.00 173.24 176.29 1kfv h THR 119 N 2.44 0.37 0.00 2.02 2.02 -1.82 0.41 112.91 118.35 1kfv h THR 119 Ca -0.48 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1kfv h THR 119 Cb 1.21 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1kfv h THR 119 CO 0.64 0.02 0.00 -0.90 0.37 0.00 0.00 175.52 175.65 1kfv n ASP 120 N -5.33 0.00 -0.18 4.18 5.75 -1.26 -1.21 116.55 118.49 1kfv n ASP 120 Ca 0.13 -0.18 0.02 0.00 -0.01 0.00 0.00 54.79 54.76 1kfv n ASP 120 Cb 0.45 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.56 1kfv n ASP 120 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1kfv n GLN 121 N -0.78 -0.05 0.00 0.11 6.02 0.14 -4.70 117.38 118.12 1kfv n GLN 121 Ca 0.02 -0.75 0.00 0.00 -0.01 0.00 0.00 57.00 56.26 1kfv n GLN 121 Cb 0.01 -1.07 0.00 0.00 1.02 0.00 0.00 30.24 30.19 1kfv n GLN 121 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1kfv n VAL 122 N 0.21 0.00 -0.11 5.09 0.31 -0.35 -1.46 118.33 122.02 1kfv n VAL 122 Ca 0.03 1.41 -0.06 0.00 -0.01 0.00 0.00 64.34 65.71 1kfv n VAL 122 Cb 0.12 -2.31 0.01 0.00 -0.91 0.00 0.00 33.84 30.74 1kfv n VAL 122 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1kfv h LEU 123 N 0.00 -0.75 -2.59 7.52 3.38 -1.86 0.27 115.31 121.28 1kfv h LEU 123 Ca 0.00 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1kfv h LEU 123 Cb 0.00 0.39 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1kfv h LEU 123 CO 0.00 -0.25 0.03 1.55 0.09 0.00 0.00 178.44 179.86 1kfv h PRO 124 N -0.16 0.00 0.34 1.13 0.13 -1.84 0.45 132.00 132.05 1kfv h PRO 124 Ca 0.19 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.30 1kfv h PRO 124 Cb 0.45 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.59 1kfv h PRO 124 CO -0.49 0.00 -0.16 -0.92 -0.23 0.00 0.00 178.00 176.20 1kfv h TYR 125 N 0.00 -0.43 -0.42 1.56 3.20 0.68 -1.08 116.97 120.49 1kfv h TYR 125 Ca 0.00 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.74 1kfv h TYR 125 Cb 0.06 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 1kfv h TYR 125 CO 0.00 -0.11 -0.20 0.74 -1.64 0.00 0.00 178.16 176.94 1kfv h PHE 126 N -0.99 0.94 0.00 -3.82 0.04 -0.81 -1.84 116.94 110.47 1kfv h PHE 126 Ca -0.05 -0.21 -0.06 0.00 2.80 0.00 0.00 57.97 60.45 1kfv h PHE 126 Cb 0.50 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.42 1kfv h PHE 126 CO 0.03 0.96 -0.30 -0.07 -0.60 0.00 0.00 178.31 178.34 1kfv h LEU 127 N 0.73 0.00 -0.15 1.54 3.38 -0.24 -0.27 115.31 120.30 1kfv h LEU 127 Ca 0.10 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1kfv h LEU 127 Cb 0.73 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1kfv h LEU 127 CO 0.06 0.30 -0.30 0.50 0.09 0.00 0.00 178.44 179.09 1kfv h LYS 128 N 0.00 0.00 -0.02 1.13 3.64 -0.78 -2.99 116.57 117.55 1kfv h LYS 128 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1kfv h LYS 128 Cb 0.59 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1kfv h LYS 128 CO 0.04 0.30 -0.07 1.63 -2.27 0.00 0.00 179.45 179.07 1kfv n LYS 129 N -3.20 1.67 -3.00 1.90 5.02 -0.54 -4.96 118.16 115.06 1kfv n LYS 129 Ca 0.02 -1.12 -0.22 0.00 -2.02 0.00 0.00 58.31 54.96 1kfv n LYS 129 Cb 0.63 -1.48 0.03 0.00 -0.02 0.00 0.00 35.03 34.19 1kfv n LYS 129 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1kfv n LYS 130 N 0.32 -4.78 -2.26 1.97 5.02 -0.22 -4.94 118.16 113.26 1kfv n LYS 130 Ca 0.16 0.92 -0.42 0.00 -2.02 0.00 0.00 58.31 56.95 1kfv n LYS 130 Cb 0.42 -5.78 -0.03 0.00 -0.02 0.00 0.00 35.03 29.62 1kfv n LYS 130 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1kfv s ILE 131 N -3.18 3.74 0.68 -0.18 -1.09 -0.95 -4.36 121.20 115.88 1kfv s ILE 131 Ca 0.29 1.16 -0.11 0.00 -2.23 0.00 0.00 60.65 59.76 1kfv s ILE 131 Cb -0.13 -3.75 0.17 0.00 -1.58 0.00 0.00 42.46 37.17 1kfv s ILE 131 CO 0.36 0.02 0.63 0.61 -1.23 0.00 0.00 174.94 175.34 1kfv n GLY 132 N 3.54 -2.50 3.77 6.18 0.00 0.19 -4.88 105.19 111.48 1kfv n GLY 132 Ca 0.12 -1.50 -0.36 0.00 0.00 0.00 0.00 46.02 44.29 1kfv n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1kfv s PRO 133 N -4.43 3.47 0.77 1.61 0.04 -1.26 -4.23 135.00 130.97 1kfv s PRO 133 Ca 0.41 1.70 -0.15 0.00 0.04 0.00 0.00 61.00 63.00 1kfv s PRO 133 Cb -0.04 -2.15 0.05 0.00 0.04 0.00 0.00 34.50 32.40 1kfv s PRO 133 CO 0.31 -0.77 1.11 -1.91 0.04 0.00 0.00 177.00 175.78 1kfv n GLU 134 N -1.01 0.36 -1.71 4.56 4.07 -1.26 -1.48 120.64 124.16 1kfv n GLU 134 Ca 0.10 0.19 -0.41 0.00 -0.06 0.00 0.00 57.16 56.98 1kfv n GLU 134 Cb 0.50 -2.36 -0.01 0.00 -0.06 0.00 0.00 31.44 29.51 1kfv n GLU 134 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1kfv n PRO 135 N -2.67 3.15 -4.25 5.31 -0.04 -1.26 -3.59 135.00 131.66 1kfv n PRO 135 Ca 0.13 -2.63 -0.18 0.00 -0.04 0.00 0.00 63.50 60.79 1kfv n PRO 135 Cb 0.50 -3.13 -0.11 0.00 -0.04 0.00 0.00 33.50 30.72 1kfv n PRO 135 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1kfv s THR 136 N 2.60 1.35 0.52 0.52 -4.23 -1.26 -4.55 115.64 110.58 1kfv s THR 136 Ca 0.51 -1.79 0.35 0.00 -1.18 0.00 0.00 61.69 59.59 1kfv s THR 136 Cb 0.15 -1.60 0.38 0.00 1.34 0.00 0.00 72.50 72.76 1kfv s THR 136 CO -0.07 -0.46 2.23 1.88 -0.54 0.00 0.00 174.62 177.65 1kfv h TYR 137 N 3.37 0.00 0.12 3.99 0.05 -1.90 0.16 116.97 122.76 1kfv h TYR 137 Ca -0.39 0.00 -0.22 0.00 0.05 0.00 0.00 58.73 58.17 1kfv h TYR 137 Cb 1.20 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.95 1kfv h TYR 137 CO 0.66 0.03 -1.03 1.05 -1.05 0.00 0.00 178.16 177.82 1kfv h GLU 138 N 0.00 0.26 0.00 4.88 9.09 -1.95 -3.40 114.58 123.46 1kfv h GLU 138 Ca -0.00 -0.45 -0.28 0.00 0.05 0.00 0.00 59.36 58.68 1kfv h GLU 138 Cb 0.14 0.17 -0.05 0.00 -1.65 0.00 0.00 28.75 27.36 1kfv h GLU 138 CO 0.00 1.21 -1.79 -0.25 0.05 0.00 0.00 179.01 178.24 1kfv n ASP 139 N -4.07 0.70 -4.19 3.06 8.00 -1.13 -4.63 116.55 114.29 1kfv n ASP 139 Ca -0.18 0.33 -0.43 0.00 0.71 0.00 0.00 54.79 55.22 1kfv n ASP 139 Cb 0.84 0.20 0.00 0.00 -0.02 0.00 0.00 41.12 42.14 1kfv n ASP 139 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1kfv n PHE 140 N -2.95 4.11 -1.73 1.24 -0.00 0.54 -4.77 117.46 113.89 1kfv n PHE 140 Ca -0.18 -2.96 -0.42 0.00 -0.00 0.00 0.00 57.45 53.88 1kfv n PHE 140 Cb 1.03 -2.44 -0.03 0.00 -0.00 0.00 0.00 39.48 38.04 1kfv n PHE 140 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1kfv s ASP 141 N 3.17 6.48 0.28 -2.13 -1.08 -1.26 -4.81 116.67 117.32 1kfv s ASP 141 Ca 0.48 2.60 -0.00 0.00 -0.52 0.00 0.00 52.55 55.11 1kfv s ASP 141 Cb 0.07 -2.53 0.42 0.00 -1.46 0.00 0.00 42.92 39.41 1kfv s ASP 141 CO 0.00 -1.03 1.81 -0.08 0.52 0.00 0.00 175.17 176.39 1kfv h GLU 142 N 10.35 0.74 0.22 4.34 4.81 -1.93 -2.40 114.58 130.72 1kfv h GLU 142 Ca -0.48 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 58.57 1kfv h GLU 142 Cb 1.23 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1kfv h GLU 142 CO 0.94 0.73 -0.11 -0.22 -0.73 0.00 0.00 179.01 179.62 1kfv h LYS 143 N 0.71 -0.29 -0.73 1.92 3.64 -1.99 0.53 116.57 120.36 1kfv h LYS 143 Ca 0.15 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.64 1kfv h LYS 143 Cb 0.37 0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 32.19 1kfv h LYS 143 CO 0.01 -0.09 0.39 1.25 -2.27 0.00 0.00 179.45 178.74 1kfv h LEU 144 N -0.44 0.53 0.03 5.20 6.46 -1.96 0.28 115.31 125.41 1kfv h LEU 144 Ca -0.03 0.05 0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1kfv h LEU 144 Cb 0.33 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.20 1kfv h LEU 144 CO 0.05 0.31 -0.13 0.15 -0.62 0.00 0.00 178.44 178.20 1kfv h PHE 145 N 0.66 -0.33 -0.43 1.25 -0.00 -0.95 -0.53 116.94 116.61 1kfv h PHE 145 Ca 0.35 0.01 0.02 0.00 -0.00 0.00 0.00 57.97 58.35 1kfv h PHE 145 Cb 0.34 0.14 -0.03 0.00 -0.00 0.00 0.00 35.95 36.40 1kfv h PHE 145 CO -0.09 -0.19 0.26 -0.09 -0.00 0.00 0.00 178.31 178.20 1kfv h ARG 146 N -0.23 0.51 0.04 1.11 2.43 0.11 -1.70 114.38 116.65 1kfv h ARG 146 Ca 0.03 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1kfv h ARG 146 Cb 0.27 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 1kfv h ARG 146 CO -0.10 0.34 -0.21 0.93 -1.51 0.00 0.00 179.97 179.42 1kfv h GLU 147 N 0.53 -0.34 -0.78 0.20 5.08 -0.12 -2.16 114.58 116.98 1kfv h GLU 147 Ca 0.17 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.58 1kfv h GLU 147 Cb -0.00 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 1kfv h GLU 147 CO -0.07 -0.23 0.51 0.87 -1.00 0.00 0.00 179.01 179.10 1kfv h LYS 148 N -0.35 0.95 -0.13 2.33 1.57 -0.91 -2.85 116.57 117.17 1kfv h LYS 148 Ca 0.05 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 1kfv h LYS 148 Cb 0.41 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1kfv h LYS 148 CO -0.16 0.63 -0.30 -0.07 -0.57 0.00 0.00 179.45 178.97 1kfv h LEU 149 N 0.98 0.25 0.00 2.94 3.38 -0.77 -2.97 115.31 119.12 1kfv h LEU 149 Ca 0.30 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1kfv h LEU 149 Cb 0.01 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1kfv h LEU 149 CO -0.08 0.55 -0.42 -1.14 0.09 0.00 0.00 178.44 177.43 1kfv n ARG 150 N -4.12 0.22 0.00 1.13 0.63 -0.86 -1.80 116.66 111.85 1kfv n ARG 150 Ca -0.01 0.09 0.13 0.00 -0.92 0.00 0.00 57.85 57.14 1kfv n ARG 150 Cb 0.40 -1.67 0.46 0.00 0.45 0.00 0.00 32.46 32.11 1kfv n ARG 150 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1kfv n LYS 151 N -2.00 0.50 -4.44 -0.14 4.81 -1.10 -4.60 118.16 111.20 1kfv n LYS 151 Ca 0.04 -0.23 -0.25 0.00 -0.87 0.00 0.00 58.31 57.01 1kfv n LYS 151 Cb 0.41 -1.50 -0.11 0.00 0.02 0.00 0.00 35.03 33.86 1kfv n LYS 151 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1kfv s SER 152 N -2.66 3.42 0.00 3.14 0.15 -1.21 -5.02 113.70 111.52 1kfv s SER 152 Ca 0.22 -0.96 0.09 0.00 0.70 0.00 0.00 55.95 56.00 1kfv s SER 152 Cb 0.19 -0.26 0.13 0.00 -1.71 0.00 0.00 66.02 64.37 1kfv s SER 152 CO 0.54 0.06 0.93 0.35 1.20 0.00 0.00 173.24 176.32 1kfv n THR 153 N -0.20 0.36 -1.24 6.45 -2.24 -1.26 -1.49 114.28 114.66 1kfv n THR 153 Ca -0.09 -0.68 -0.34 0.00 -2.27 0.00 0.00 64.05 60.67 1kfv n THR 153 Cb 0.58 0.94 0.12 0.00 -2.10 0.00 0.00 70.33 69.87 1kfv n THR 153 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1kfv s LYS 154 N -0.83 1.81 0.39 -0.78 1.02 -1.26 -4.66 119.74 115.43 1kfv s LYS 154 Ca 0.13 1.84 -0.24 0.00 0.02 0.00 0.00 55.97 57.73 1kfv s LYS 154 Cb 0.08 -1.79 -0.10 0.00 -0.52 0.00 0.00 37.83 35.51 1kfv s LYS 154 CO 0.12 -2.10 0.99 0.15 -0.92 0.00 0.00 175.35 173.58 1kfv s LYS 155 N -3.96 4.30 0.09 1.68 1.02 -1.26 -2.26 119.74 119.35 1kfv s LYS 155 Ca 0.76 1.33 -0.34 0.00 0.02 0.00 0.00 55.97 57.74 1kfv s LYS 155 Cb -0.31 -2.51 -0.15 0.00 -0.52 0.00 0.00 37.83 34.34 1kfv s LYS 155 CO 0.48 0.01 1.53 0.97 -0.92 0.00 0.00 175.35 177.43 1kfv h ILE 156 N 2.22 0.00 0.17 2.17 6.09 -0.91 -1.18 117.51 126.07 1kfv h ILE 156 Ca -0.48 0.00 0.01 0.00 -1.37 0.00 0.00 64.86 63.02 1kfv h ILE 156 Cb 1.20 0.00 -0.04 0.00 0.47 0.00 0.00 36.82 38.44 1kfv h ILE 156 CO 0.63 0.00 -0.49 0.50 -3.07 0.00 0.00 178.15 175.71 1kfv h LYS 157 N -0.86 -0.73 -0.47 2.19 3.64 -1.66 0.34 116.57 119.02 1kfv h LYS 157 Ca -0.04 0.05 0.10 0.00 -1.27 0.00 0.00 60.65 59.49 1kfv h LYS 157 Cb 0.79 0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 32.69 1kfv h LYS 157 CO -0.16 -0.49 -0.17 -1.35 -2.27 0.00 0.00 179.45 175.02 1kfv h PRO 158 N -0.76 -0.06 -0.88 1.90 0.11 -1.77 -1.47 132.00 129.06 1kfv h PRO 158 Ca -0.00 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.19 1kfv h PRO 158 Cb 0.76 0.01 -0.07 0.00 0.11 0.00 0.00 31.00 31.81 1kfv h PRO 158 CO -0.25 -0.04 0.54 -0.92 -0.21 0.00 0.00 178.00 177.13 1kfv h TYR 159 N -0.06 1.00 -0.45 0.65 5.03 -0.55 -0.99 116.97 121.61 1kfv h TYR 159 Ca 0.23 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.50 1kfv h TYR 159 Cb 0.41 -0.32 -0.02 0.00 1.55 0.00 0.00 36.73 38.35 1kfv h TYR 159 CO -0.44 0.48 0.02 -0.07 -1.32 0.00 0.00 178.16 176.82 1kfv h LEU 160 N 0.96 0.68 -2.06 2.82 3.38 -0.15 -2.53 115.31 118.41 1kfv h LEU 160 Ca 0.40 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1kfv h LEU 160 Cb 0.24 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1kfv h LEU 160 CO -0.20 0.74 0.00 -0.07 0.09 0.00 0.00 178.44 179.00 1kfv h LEU 161 N 0.68 0.00 -1.61 1.67 4.07 -0.18 -2.96 115.31 116.97 1kfv h LEU 161 Ca 0.14 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.10 1kfv h LEU 161 Cb 0.39 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.13 1kfv h LEU 161 CO 0.01 0.00 0.00 -0.33 -1.08 0.00 0.00 178.44 177.04 1kfv h GLU 162 N 0.00 0.00 0.00 1.13 5.08 -1.27 -3.47 114.58 116.05 1kfv h GLU 162 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1kfv h GLU 162 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1kfv h GLU 162 CO 0.00 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.05 1kfv n GLN 163 N -2.84 -0.05 -0.06 2.33 1.13 -1.12 -4.89 117.38 111.88 1kfv n GLN 163 Ca 0.00 0.01 -0.16 0.00 -1.94 0.00 0.00 57.00 54.92 1kfv n GLN 163 Cb 0.22 -2.99 -0.13 0.00 0.11 0.00 0.00 30.24 27.45 1kfv n GLN 163 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 1kfv h THR 164 N 0.00 1.67 0.00 5.09 1.35 -1.82 0.53 112.91 119.72 1kfv h THR 164 Ca 0.00 -2.36 -0.03 0.00 -0.55 0.00 0.00 66.41 63.47 1kfv h THR 164 Cb 0.03 3.25 -0.00 0.00 -1.73 0.00 0.00 68.15 69.70 1kfv h THR 164 CO 0.00 0.60 -0.16 -0.07 -0.25 0.00 0.00 175.52 175.64 1kfv h LEU 165 N -0.91 0.00 -7.00 3.87 4.07 -1.88 -3.32 115.31 110.15 1kfv h LEU 165 Ca -0.06 0.00 0.19 0.00 0.08 0.00 0.00 57.88 58.09 1kfv h LEU 165 Cb 1.13 0.00 -0.23 0.00 1.08 0.00 0.00 40.66 42.64 1kfv h LEU 165 CO 0.00 0.16 0.76 0.54 -1.08 0.00 0.00 178.44 178.82 1kfv s VAL 166 N -3.65 0.00 0.03 1.22 0.11 -1.26 -4.60 120.40 112.25 1kfv s VAL 166 Ca 0.01 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.07 1kfv s VAL 166 Cb 0.10 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.91 1kfv s VAL 166 CO 0.61 0.00 0.07 0.00 -3.33 0.00 0.00 175.10 172.45 1kfv s ALA 167 N -1.58 3.54 0.00 1.54 0.00 -0.55 -4.02 121.76 120.68 1kfv s ALA 167 Ca 0.05 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.08 1kfv s ALA 167 Cb -0.01 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.62 1kfv s ALA 167 CO -0.04 0.71 0.00 0.41 0.00 0.00 0.00 175.76 176.84 1kfv n GLY 168 N 0.93 2.69 3.70 0.00 0.00 -1.26 -4.12 105.19 107.13 1kfv n GLY 168 Ca -0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1kfv n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1kfv s LEU 169 N 0.00 4.31 0.00 0.99 1.43 -1.26 -2.34 118.68 121.81 1kfv s LEU 169 Ca 0.00 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 55.00 1kfv s LEU 169 Cb 0.00 -3.56 -0.00 0.00 0.03 0.00 0.00 46.19 42.66 1kfv s LEU 169 CO 0.00 -0.56 0.00 0.61 0.23 0.00 0.00 176.35 176.63 1kfv n GLY 170 N 3.35 4.07 0.36 -3.19 0.00 -1.26 -4.66 105.19 103.85 1kfv n GLY 170 Ca 0.11 -2.21 0.03 0.00 0.00 0.00 0.00 46.02 43.95 1kfv n GLY 170 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1kfv h ASN 171 N 0.24 0.99 0.69 1.61 -1.24 -1.97 -1.63 115.58 114.28 1kfv h ASN 171 Ca -0.08 0.02 -0.03 0.00 0.71 0.00 0.00 56.30 56.92 1kfv h ASN 171 Cb 0.24 -0.19 0.01 0.00 0.73 0.00 0.00 38.32 39.11 1kfv h ASN 171 CO 0.13 0.61 -0.33 0.40 -1.29 0.00 0.00 177.43 176.94 1kfv h ILE 172 N 1.11 0.03 0.00 2.57 2.04 -1.96 -3.09 117.51 118.20 1kfv h ILE 172 Ca 0.44 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.99 1kfv h ILE 172 Cb 0.24 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 1kfv h ILE 172 CO -0.20 0.00 0.00 1.88 0.00 0.00 0.00 178.15 179.84 1kfv h TYR 173 N -1.24 0.00 0.06 1.37 -1.99 -1.94 -2.04 116.97 111.20 1kfv h TYR 173 Ca -0.09 0.00 -0.29 0.00 2.00 0.00 0.00 58.73 60.35 1kfv h TYR 173 Cb 0.72 0.00 0.03 0.00 2.00 0.00 0.00 36.73 39.47 1kfv h TYR 173 CO 0.00 0.00 -1.15 -0.24 -0.00 0.00 0.00 178.16 176.77 1kfv h VAL 174 N 0.00 1.28 -0.52 -2.88 3.04 -1.36 -0.05 116.25 115.75 1kfv h VAL 174 Ca 0.00 -2.36 -0.10 0.00 -1.01 0.00 0.00 66.70 63.24 1kfv h VAL 174 Cb 0.35 2.55 -0.02 0.00 -2.01 0.00 0.00 31.29 32.16 1kfv h VAL 174 CO 0.00 0.72 -0.06 0.44 -1.01 0.00 0.00 177.57 177.66 1kfv h ASP 175 N 0.33 0.91 0.00 3.17 5.19 -1.38 0.11 116.42 124.76 1kfv h ASP 175 Ca -0.16 -0.27 -0.00 0.00 -0.62 0.00 0.00 57.03 55.98 1kfv h ASP 175 Cb 1.82 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 41.08 1kfv h ASP 175 CO 0.22 1.00 -0.00 -0.33 -3.12 0.00 0.00 179.24 177.02 1kfv h GLU 176 N 0.84 -0.00 0.26 3.56 4.39 -1.37 -2.43 114.58 119.83 1kfv h GLU 176 Ca 0.14 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.85 1kfv h GLU 176 Cb 0.58 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.21 1kfv h GLU 176 CO 0.04 0.36 -0.32 0.28 -1.16 0.00 0.00 179.01 178.20 1kfv h VAL 177 N -0.36 0.33 -0.34 3.13 2.07 -0.87 -0.52 116.25 119.69 1kfv h VAL 177 Ca -0.00 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 1kfv h VAL 177 Cb 0.36 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1kfv h VAL 177 CO 0.00 0.00 0.24 -0.07 0.02 0.00 0.00 177.57 177.76 1kfv h LEU 178 N -0.63 0.09 0.00 2.57 3.38 -0.81 -0.22 115.31 119.68 1kfv h LEU 178 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1kfv h LEU 178 Cb 0.60 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1kfv h LEU 178 CO -0.10 0.06 -0.16 -0.25 0.09 0.00 0.00 178.44 178.08 1kfv h TRP 179 N 0.10 0.16 -0.13 1.13 7.01 -1.11 0.14 115.95 123.25 1kfv h TRP 179 Ca 0.16 -0.09 0.04 0.00 2.11 0.00 0.00 58.89 61.11 1kfv h TRP 179 Cb 0.50 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.53 1kfv h TRP 179 CO -0.00 0.89 0.19 1.25 -2.79 0.00 0.00 178.44 177.99 1kfv h LEU 180 N -0.62 0.00 -2.45 0.65 5.85 -0.09 0.22 115.31 118.87 1kfv h LEU 180 Ca -0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1kfv h LEU 180 Cb 0.94 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.97 1kfv h LEU 180 CO 0.03 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.13 1kfv n ALA 181 N -2.23 2.36 -2.68 1.25 0.00 -0.19 -4.97 120.51 114.06 1kfv n ALA 181 Ca 0.00 -1.05 -0.19 0.00 0.00 0.00 0.00 53.44 52.20 1kfv n ALA 181 Cb 0.30 -0.71 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1kfv n ALA 181 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1kfv n LYS 182 N 1.18 -2.84 -4.32 0.00 5.02 0.77 -4.89 118.16 113.08 1kfv n LYS 182 Ca 0.17 0.82 -0.34 0.00 -2.02 0.00 0.00 58.31 56.94 1kfv n LYS 182 Cb 0.53 -5.53 -0.11 0.00 -0.02 0.00 0.00 35.03 29.90 1kfv n LYS 182 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1kfv s ILE 183 N -2.96 4.12 0.07 -0.18 1.01 0.46 -4.17 121.20 119.56 1kfv s ILE 183 Ca 0.12 -0.28 -0.31 0.00 0.00 0.00 0.00 60.65 60.19 1kfv s ILE 183 Cb -0.06 -2.81 -0.06 0.00 0.01 0.00 0.00 42.46 39.54 1kfv s ILE 183 CO 0.15 0.50 1.23 -2.28 0.00 0.00 0.00 174.94 174.54 1kfv s HIS 184 N 0.25 3.41 0.66 3.97 5.65 -1.26 -4.44 115.29 123.52 1kfv s HIS 184 Ca -0.01 1.25 0.26 0.00 0.25 0.00 0.00 55.06 56.80 1kfv s HIS 184 Cb -0.13 -3.46 1.39 0.00 -1.18 0.00 0.00 32.58 29.19 1kfv s HIS 184 CO 0.02 -1.46 1.79 -1.00 -0.65 0.00 0.00 174.74 173.44 1kfv h PRO 185 N 6.78 0.00 -0.07 2.88 0.13 -1.92 0.83 132.00 140.63 1kfv h PRO 185 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1kfv h PRO 185 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1kfv h PRO 185 CO 0.82 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.98 1kfv n GLU 186 N -2.93 2.34 -1.77 0.86 1.02 -1.26 -1.84 120.64 117.06 1kfv n GLU 186 Ca -0.00 -1.97 -0.42 0.00 -0.02 0.00 0.00 57.16 54.75 1kfv n GLU 186 Cb 0.51 -1.46 -0.03 0.00 -0.02 0.00 0.00 31.44 30.44 1kfv n GLU 186 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1kfv s LYS 187 N -1.94 4.14 -0.13 3.49 2.47 0.28 -4.60 119.74 123.45 1kfv s LYS 187 Ca 0.29 2.57 -0.29 0.00 -1.56 0.00 0.00 55.97 56.97 1kfv s LYS 187 Cb 0.20 -3.08 -0.01 0.00 -1.46 0.00 0.00 37.83 33.48 1kfv s LYS 187 CO 0.30 -0.71 1.13 -1.21 0.16 0.00 0.00 175.35 175.02 1kfv s GLU 188 N 0.87 4.33 0.39 4.03 2.02 -1.26 -0.64 118.70 128.43 1kfv s GLU 188 Ca 0.72 1.53 0.21 0.00 0.02 0.00 0.00 54.97 57.45 1kfv s GLU 188 Cb -0.48 -3.61 1.22 0.00 0.10 0.00 0.00 34.13 31.36 1kfv s GLU 188 CO 0.35 -0.50 1.66 1.79 0.02 0.00 0.00 175.26 178.58 1kfv h THR 189 N 5.22 0.26 0.00 3.63 1.35 -1.63 0.90 112.91 122.64 1kfv h THR 189 Ca -0.29 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1kfv h THR 189 Cb 1.12 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 1kfv h THR 189 CO 0.91 0.04 0.00 -0.46 -0.25 0.00 0.00 175.52 175.76 1kfv n ASN 190 N -4.87 0.00 -0.01 5.36 6.94 -0.55 -2.36 115.26 119.77 1kfv n ASN 190 Ca 0.33 -0.10 0.10 0.00 -0.02 0.00 0.00 54.58 54.88 1kfv n ASN 190 Cb 1.14 -0.18 -0.14 0.00 -2.36 0.00 0.00 39.78 38.23 1kfv n ASN 190 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1kfv n GLN 191 N -1.18 0.63 -1.68 -3.83 6.02 0.31 -4.88 117.38 112.76 1kfv n GLN 191 Ca 0.08 -0.15 -0.45 0.00 -0.01 0.00 0.00 57.00 56.48 1kfv n GLN 191 Cb 0.09 -1.44 -0.03 0.00 1.02 0.00 0.00 30.24 29.87 1kfv n GLN 191 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1kfv n LEU 192 N -2.04 3.35 -4.84 1.08 4.77 -0.99 -4.98 117.00 113.34 1kfv n LEU 192 Ca -0.02 1.10 -0.32 0.00 -0.03 0.00 0.00 56.01 56.74 1kfv n LEU 192 Cb 0.46 -1.46 -0.04 0.00 -2.33 0.00 0.00 43.42 40.05 1kfv n LEU 192 CO 0.40 -0.23 0.62 -0.63 -1.33 0.00 0.00 177.39 176.22 1kfv s ILE 193 N 0.63 4.55 0.17 -0.08 -1.09 -1.26 -4.85 121.20 119.26 1kfv s ILE 193 Ca 0.74 1.18 -0.17 0.00 -2.23 0.00 0.00 60.65 60.17 1kfv s ILE 193 Cb -0.63 -3.69 0.10 0.00 -1.58 0.00 0.00 42.46 36.66 1kfv s ILE 193 CO 0.41 -0.55 1.67 -0.33 -1.23 0.00 0.00 174.94 174.90 1kfv h GLU 194 N 1.27 -0.00 -0.71 2.79 4.39 -1.99 0.22 114.58 120.55 1kfv h GLU 194 Ca -0.47 0.00 0.18 0.00 0.34 0.00 0.00 59.36 59.41 1kfv h GLU 194 Cb 1.18 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.80 1kfv h GLU 194 CO 0.62 -0.00 0.49 0.66 -1.16 0.00 0.00 179.01 179.62 1kfv h SER 195 N -0.00 0.15 -0.02 1.42 4.64 -1.98 0.55 113.55 118.30 1kfv h SER 195 Ca 0.20 0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.51 1kfv h SER 195 Cb 0.30 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1kfv h SER 195 CO -0.42 0.07 -0.05 0.28 -0.87 0.00 0.00 176.83 175.84 1kfv h SER 196 N 0.15 0.07 -0.32 4.97 0.02 -1.01 -2.05 113.55 115.38 1kfv h SER 196 Ca 0.34 -0.62 0.05 0.00 -0.84 0.00 0.00 61.79 60.72 1kfv h SER 196 Cb 1.14 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.61 1kfv h SER 196 CO -0.05 0.67 0.05 0.40 -1.14 0.00 0.00 176.83 176.76 1kfv h ILE 197 N -0.53 0.83 -0.73 3.27 2.04 0.84 0.32 117.51 123.55 1kfv h ILE 197 Ca -0.00 -0.06 0.04 0.00 1.00 0.00 0.00 64.86 65.85 1kfv h ILE 197 Cb 0.67 0.66 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 1kfv h ILE 197 CO 0.01 0.03 0.44 -0.74 0.00 0.00 0.00 178.15 177.89 1kfv h HIS 198 N 0.16 0.83 -0.40 1.37 2.76 -0.10 0.24 115.15 120.01 1kfv h HIS 198 Ca 0.15 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.22 1kfv h HIS 198 Cb 0.17 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 1kfv h HIS 198 CO -0.19 0.44 -0.26 1.25 -1.30 0.00 0.00 177.93 177.87 1kfv h LEU 199 N 0.84 0.87 0.20 0.26 6.46 -0.57 -2.06 115.31 121.31 1kfv h LEU 199 Ca 0.31 -0.34 -0.01 0.00 -0.12 0.00 0.00 57.88 57.72 1kfv h LEU 199 Cb 0.09 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 39.79 1kfv h LEU 199 CO -0.14 1.08 -0.10 0.25 -0.62 0.00 0.00 178.44 178.91 1kfv h LEU 200 N 0.72 -0.23 -0.56 2.25 5.85 0.37 0.92 115.31 124.63 1kfv h LEU 200 Ca 0.09 -0.14 0.10 0.00 0.84 0.00 0.00 57.88 58.77 1kfv h LEU 200 Cb 0.80 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.81 1kfv h LEU 200 CO 0.07 0.01 0.11 -0.74 -0.34 0.00 0.00 178.44 177.55 1kfv h HIS 201 N -0.47 0.17 -0.33 1.25 2.76 -0.51 0.13 115.15 118.16 1kfv h HIS 201 Ca -0.03 0.03 -0.16 0.00 -2.20 0.00 0.00 60.37 58.02 1kfv h HIS 201 Cb 0.36 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.32 1kfv h HIS 201 CO -0.01 -0.03 -0.42 -0.44 -1.30 0.00 0.00 177.93 175.74 1kfv h ASP 202 N 0.24 0.87 -0.07 3.26 3.45 -1.28 -2.91 116.42 119.99 1kfv h ASP 202 Ca 0.29 -0.41 -0.05 0.00 0.43 0.00 0.00 57.03 57.29 1kfv h ASP 202 Cb 0.42 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.93 1kfv h ASP 202 CO -0.38 1.17 -0.08 0.28 -1.57 0.00 0.00 179.24 178.66 1kfv h SER 203 N 0.66 0.33 0.67 6.45 0.02 -0.04 0.40 113.55 122.04 1kfv h SER 203 Ca 0.05 -0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1kfv h SER 203 Cb 0.98 -0.09 0.01 0.00 0.14 0.00 0.00 62.40 63.45 1kfv h SER 203 CO 0.09 0.46 -0.32 0.40 -1.14 0.00 0.00 176.83 176.32 1kfv h ILE 204 N 0.33 0.00 -0.69 3.27 2.04 -0.85 0.86 117.51 122.48 1kfv h ILE 204 Ca 0.07 -0.05 0.11 0.00 1.00 0.00 0.00 64.86 65.99 1kfv h ILE 204 Cb 0.36 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.36 1kfv h ILE 204 CO 0.02 0.00 0.30 0.40 0.00 0.00 0.00 178.15 178.86 1kfv h ILE 205 N -0.95 0.77 0.84 -0.67 2.04 -1.40 -1.88 117.51 116.25 1kfv h ILE 205 Ca -0.09 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 1kfv h ILE 205 Cb 0.69 0.23 0.01 0.00 -0.74 0.00 0.00 36.82 37.01 1kfv h ILE 205 CO 0.15 0.09 -0.41 -0.08 0.00 0.00 0.00 178.15 177.90 1kfv h GLU 206 N 0.49 -1.09 -0.75 2.37 4.81 -0.85 -1.59 114.58 117.97 1kfv h GLU 206 Ca 0.35 0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.62 1kfv h GLU 206 Cb 0.44 0.25 -0.03 0.00 0.63 0.00 0.00 28.75 30.04 1kfv h GLU 206 CO -0.32 -0.73 0.33 0.82 -0.73 0.00 0.00 179.01 178.38 1kfv h ILE 207 N -1.14 1.24 0.00 2.32 2.04 -0.66 0.12 117.51 121.44 1kfv h ILE 207 Ca -0.11 -0.72 -0.10 0.00 1.00 0.00 0.00 64.86 64.93 1kfv h ILE 207 Cb 0.87 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 1kfv h ILE 207 CO 0.18 0.30 -0.47 -0.07 0.00 0.00 0.00 178.15 178.09 1kfv h LEU 208 N 1.07 0.00 0.13 1.44 3.38 -1.38 -0.30 115.31 119.65 1kfv h LEU 208 Ca 0.26 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.93 1kfv h LEU 208 Cb 0.15 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.93 1kfv h LEU 208 CO -0.03 0.47 -1.25 -0.61 0.09 0.00 0.00 178.44 177.11 1kfv h GLN 209 N 0.00 0.62 -0.68 1.13 5.75 -0.79 -2.19 115.11 118.96 1kfv h GLN 209 Ca -0.00 -0.84 -0.02 0.00 -0.15 0.00 0.00 58.65 57.63 1kfv h GLN 209 Cb 0.93 0.28 -0.03 0.00 1.07 0.00 0.00 27.48 29.72 1kfv h GLN 209 CO 0.06 1.38 0.33 -0.22 -2.65 0.00 0.00 178.83 177.73 1kfv h LYS 210 N 0.26 0.96 -0.56 1.69 3.64 -0.51 -2.24 116.57 119.81 1kfv h LYS 210 Ca -0.19 -0.12 -0.11 0.00 -1.27 0.00 0.00 60.65 58.95 1kfv h LYS 210 Cb 1.92 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 33.54 1kfv h LYS 210 CO 0.24 0.74 -0.08 0.00 -2.27 0.00 0.00 179.45 178.07 1kfv h ALA 211 N 1.41 0.77 -0.10 5.00 0.00 -1.02 -2.48 119.26 122.84 1kfv h ALA 211 Ca 0.24 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.82 1kfv h ALA 211 Cb 0.09 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1kfv h ALA 211 CO -0.03 0.67 -0.01 0.82 0.00 0.00 0.00 179.25 180.69 1kfv h ILE 212 N 0.94 0.91 0.00 0.00 2.04 -0.81 0.16 117.51 120.75 1kfv h ILE 212 Ca 0.15 -0.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.97 1kfv h ILE 212 Cb 0.65 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1kfv h ILE 212 CO 0.05 0.00 -0.16 0.07 0.00 0.00 0.00 178.15 178.11 1kfv h LYS 213 N 0.01 0.00 -0.38 2.37 2.10 -1.37 -1.78 116.57 117.53 1kfv h LYS 213 Ca 0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.70 1kfv h LYS 213 Cb 0.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.40 1kfv h LYS 213 CO -0.09 0.16 0.00 1.28 -2.00 0.00 0.00 179.45 178.79 1kfv n LEU 214 N -3.80 1.82 -0.13 7.07 4.77 -0.94 -4.87 117.00 120.93 1kfv n LEU 214 Ca -0.02 -0.91 -0.02 0.00 -0.03 0.00 0.00 56.01 55.03 1kfv n LEU 214 Cb 0.26 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.09 1kfv n LEU 214 CO 0.32 0.41 -0.02 0.61 -1.33 0.00 0.00 177.39 177.39 1kfv n GLY 215 N 0.90 0.50 0.16 -0.72 0.00 -0.67 -0.38 105.19 104.98 1kfv n GLY 215 Ca 0.10 -0.23 0.02 0.00 0.00 0.00 0.00 46.02 45.91 1kfv n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kfv n GLY 216 N -2.01 -2.21 3.44 -0.02 0.00 0.53 -4.46 105.19 100.45 1kfv n GLY 216 Ca -0.02 -1.44 -0.44 0.00 0.00 0.00 0.00 46.02 44.12 1kfv n GLY 216 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1kfv n SER 217 N -2.57 5.28 0.00 1.61 7.64 -1.26 -3.04 113.62 121.27 1kfv n SER 217 Ca -0.01 -2.99 0.00 0.00 1.01 0.00 0.00 58.87 56.88 1kfv n SER 217 Cb 0.07 -1.54 0.00 0.00 -1.01 0.00 0.00 64.21 61.74 1kfv n SER 217 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1kfv n GLY 229 N 3.84 0.94 2.66 0.23 0.00 -1.26 -4.77 105.19 106.82 1kfv n GLY 229 Ca 0.35 -1.78 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 1kfv n GLY 229 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1kfv n LYS 230 N 0.94 1.73 0.00 1.61 4.76 0.49 -4.93 118.16 122.76 1kfv n LYS 230 Ca 0.00 -4.28 0.00 0.00 -2.87 0.00 0.00 58.31 51.16 1kfv n LYS 230 Cb 0.00 -2.13 0.00 0.00 -1.84 0.00 0.00 35.03 31.06 1kfv n LYS 230 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1kfv n GLN 232 N 1.74 0.00 0.00 1.97 0.00 -1.26 -4.20 117.38 115.63 1kfv n GLN 232 Ca 0.24 0.00 0.14 0.00 0.00 0.00 0.00 57.00 57.38 1kfv n GLN 232 Cb 0.40 0.00 0.56 0.00 0.00 0.00 0.00 30.24 31.19 1kfv n GLN 232 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1kfv n ASN 233 N 0.00 0.09 -0.67 2.61 3.02 -1.26 -3.76 115.26 115.29 1kfv n ASN 233 Ca 0.00 0.37 0.06 0.00 -0.03 0.00 0.00 54.58 54.98 1kfv n ASN 233 Cb 0.00 -0.37 0.17 0.00 -0.61 0.00 0.00 39.78 38.96 1kfv n ASN 233 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1kfv n GLU 234 N -1.51 1.29 -2.98 3.52 1.02 -1.26 -5.03 120.64 115.69 1kfv n GLU 234 Ca 0.07 -2.98 -0.40 0.00 -0.02 0.00 0.00 57.16 53.82 1kfv n GLU 234 Cb 0.34 -1.35 -0.05 0.00 -0.02 0.00 0.00 31.44 30.37 1kfv n GLU 234 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1kfv s LEU 235 N -2.65 4.25 0.11 -4.62 1.43 -1.25 -4.96 118.68 110.99 1kfv s LEU 235 Ca 0.36 1.17 0.21 0.00 -1.03 0.00 0.00 54.13 54.84 1kfv s LEU 235 Cb 0.35 -3.14 -0.11 0.00 0.03 0.00 0.00 46.19 43.33 1kfv s LEU 235 CO -0.07 -0.23 0.84 0.00 0.23 0.00 0.00 176.35 177.12 1kfv n GLN 236 N 4.41 0.62 0.00 1.70 1.13 -1.26 -4.76 117.38 119.23 1kfv n GLN 236 Ca 0.01 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.13 1kfv n GLN 236 Cb 0.50 -1.74 0.00 0.00 0.11 0.00 0.00 30.24 29.11 1kfv n GLN 236 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 1kfv n VAL 237 N -2.62 0.00 -1.85 5.09 0.24 -1.26 -4.77 118.33 113.16 1kfv n VAL 237 Ca -0.04 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.84 1kfv n VAL 237 Cb 0.63 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.97 1kfv n VAL 237 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1kfv s TYR 238 N -0.39 1.64 0.00 6.34 5.04 -1.26 -1.97 117.35 126.74 1kfv s TYR 238 Ca 0.00 0.11 0.00 0.00 -2.44 0.00 0.00 57.07 54.74 1kfv s TYR 238 Cb 0.00 -4.05 0.00 0.00 0.35 0.00 0.00 41.96 38.26 1kfv s TYR 238 CO 0.00 -4.25 0.00 0.41 -1.34 0.00 0.00 175.55 170.37 1kfv n GLY 239 N 4.67 0.75 1.26 8.97 0.00 -1.26 -4.87 105.19 114.71 1kfv n GLY 239 Ca 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.18 1kfv n GLY 239 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1kfv n LYS 240 N -2.00 1.76 -1.65 1.61 4.76 -0.83 -4.94 118.16 116.87 1kfv n LYS 240 Ca 0.00 -1.05 -0.56 0.00 -2.87 0.00 0.00 58.31 53.83 1kfv n LYS 240 Cb 0.00 -1.53 -0.07 0.00 -1.84 0.00 0.00 35.03 31.59 1kfv n LYS 240 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1kfv n THR 241 N 0.04 0.14 0.00 -0.18 -1.04 -1.26 -0.42 114.28 111.55 1kfv n THR 241 Ca 0.17 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 1kfv n THR 241 Cb 0.79 -0.93 0.00 0.00 -1.82 0.00 0.00 70.33 68.37 1kfv n THR 241 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1kfv n GLY 242 N 3.30 1.77 3.93 3.41 0.00 0.47 -4.97 105.19 113.10 1kfv n GLY 242 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 1kfv n GLY 242 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1kfv s GLU 243 N -0.53 3.43 0.42 1.61 2.02 0.44 -4.62 118.70 121.46 1kfv s GLU 243 Ca 0.00 -0.13 -0.22 0.00 0.02 0.00 0.00 54.97 54.64 1kfv s GLU 243 Cb 0.00 -2.52 -0.11 0.00 0.10 0.00 0.00 34.13 31.61 1kfv s GLU 243 CO 0.00 -0.08 0.96 0.15 0.02 0.00 0.00 175.26 176.31 1kfv s LYS 244 N -4.55 4.23 0.15 1.61 1.02 -1.26 0.21 119.74 121.16 1kfv s LYS 244 Ca 0.45 1.19 -0.31 0.00 0.02 0.00 0.00 55.97 57.32 1kfv s LYS 244 Cb -0.10 -2.27 -0.08 0.00 -0.52 0.00 0.00 37.83 34.87 1kfv s LYS 244 CO 0.40 -0.03 1.32 0.00 -0.92 0.00 0.00 175.35 176.12 1kfv h SER 246 N 6.14 0.37 0.00 0.00 0.87 -1.89 -0.31 113.55 118.73 1kfv h SER 246 Ca -0.43 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 1kfv h SER 246 Cb 1.21 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 1kfv h SER 246 CO 0.81 -0.01 0.00 0.54 -0.53 0.00 0.00 176.83 177.64 1kfv n ARG 247 N -4.65 0.00 0.00 2.24 1.74 -1.26 -4.69 116.66 110.04 1kfv n ARG 247 Ca 0.29 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.47 1kfv n ARG 247 Cb 1.06 -0.38 0.55 0.00 -1.02 0.00 0.00 32.46 32.67 1kfv n ARG 247 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1kfv n GLY 249 N 0.40 1.80 3.91 0.00 0.00 -0.13 -4.88 105.19 106.29 1kfv n GLY 249 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 1kfv n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kfv s ALA 250 N -2.79 3.38 -0.16 4.61 0.00 -1.26 -4.31 121.76 121.23 1kfv s ALA 250 Ca 0.00 -0.55 -0.29 0.00 0.00 0.00 0.00 51.96 51.11 1kfv s ALA 250 Cb 0.00 -2.59 -0.01 0.00 0.00 0.00 0.00 23.12 20.51 1kfv s ALA 250 CO 0.00 -0.47 1.26 -1.21 0.00 0.00 0.00 175.76 175.34 1kfv s GLU 251 N -4.81 4.24 0.20 0.00 2.02 -1.26 0.21 118.70 119.30 1kfv s GLU 251 Ca 0.49 1.67 -0.32 0.00 0.02 0.00 0.00 54.97 56.82 1kfv s GLU 251 Cb -0.10 -3.76 -0.12 0.00 0.10 0.00 0.00 34.13 30.24 1kfv s GLU 251 CO 0.45 -0.70 1.69 -0.89 0.02 0.00 0.00 175.26 175.84 1kfv n ILE 252 N 5.35 0.01 -4.09 -1.63 2.08 0.58 -4.65 119.36 117.01 1kfv n ILE 252 Ca 0.14 -0.00 -0.26 0.00 0.56 0.00 0.00 62.75 63.18 1kfv n ILE 252 Cb 0.45 -1.89 -0.06 0.00 -0.75 0.00 0.00 39.64 37.39 1kfv n ILE 252 CO 0.00 0.00 0.00 -1.10 0.56 0.00 0.00 176.55 176.01 1kfv s GLN 253 N 1.10 2.88 -0.09 0.38 -0.21 -0.60 -0.39 119.66 122.73 1kfv s GLN 253 Ca 0.76 -0.87 0.04 0.00 0.02 0.00 0.00 55.36 55.30 1kfv s GLN 253 Cb -0.54 -2.64 0.00 0.00 1.00 0.00 0.00 33.01 30.84 1kfv s GLN 253 CO 0.33 0.49 -0.20 0.21 -2.12 0.00 0.00 175.29 174.00 1kfv s LYS 254 N -3.07 2.62 0.25 2.91 2.20 -1.26 -2.15 119.74 121.24 1kfv s LYS 254 Ca 0.31 -0.74 -0.00 0.00 -0.36 0.00 0.00 55.97 55.18 1kfv s LYS 254 Cb -0.10 -2.02 -0.03 0.00 -1.51 0.00 0.00 37.83 34.17 1kfv s LYS 254 CO 0.23 0.14 0.23 0.96 -0.36 0.00 0.00 175.35 176.55 1kfv s ILE 255 N 0.42 0.00 -0.19 5.43 -4.36 -0.19 -4.95 121.20 117.36 1kfv s ILE 255 Ca -0.17 -1.91 -0.06 0.00 -0.26 0.00 0.00 60.65 58.24 1kfv s ILE 255 Cb -0.17 -2.48 -0.03 0.00 1.25 0.00 0.00 42.46 41.02 1kfv s ILE 255 CO 0.07 0.00 0.03 -0.54 0.24 0.00 0.00 174.94 174.74 1kfv s LYS 256 N -3.88 3.77 -0.10 0.37 -0.14 -1.26 -0.08 119.74 118.42 1kfv s LYS 256 Ca 0.37 -0.45 0.01 0.00 -1.36 0.00 0.00 55.97 54.54 1kfv s LYS 256 Cb 0.05 -3.15 0.02 0.00 -1.68 0.00 0.00 37.83 33.07 1kfv s LYS 256 CO 0.16 0.11 -0.10 0.08 -0.76 0.00 0.00 175.35 174.84 1kfv s VAL 257 N 0.77 1.14 -1.28 3.17 1.01 -1.00 -4.73 120.40 119.48 1kfv s VAL 257 Ca 0.02 -0.40 -0.11 0.00 0.00 0.00 0.00 61.98 61.49 1kfv s VAL 257 Cb -0.14 -1.10 0.09 0.00 0.00 0.00 0.00 36.38 35.23 1kfv s VAL 257 CO 0.02 0.38 0.49 0.00 0.00 0.00 0.00 175.10 175.99 1kfv n ALA 258 N 4.50 -1.08 -1.02 5.51 0.00 -1.26 -0.50 120.51 126.66 1kfv n ALA 258 Ca -0.17 0.05 -0.01 0.00 0.00 0.00 0.00 53.44 53.31 1kfv n ALA 258 Cb 0.51 -2.67 -0.00 0.00 0.00 0.00 0.00 19.45 17.28 1kfv n ALA 258 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kfv n GLY 259 N -1.14 0.47 3.41 0.00 0.00 -1.26 -5.03 105.19 101.65 1kfv n GLY 259 Ca 0.00 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 1kfv n GLY 259 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1kfv s ARG 260 N -0.77 2.44 0.19 1.61 1.81 0.35 -5.07 118.95 119.50 1kfv s ARG 260 Ca 0.00 -0.77 -0.32 0.00 -1.72 0.00 0.00 55.73 52.91 1kfv s ARG 260 Cb 0.00 -2.28 -0.12 0.00 -0.45 0.00 0.00 34.95 32.09 1kfv s ARG 260 CO 0.00 0.57 1.70 0.41 -0.68 0.00 0.00 175.30 177.30 1kfv n GLY 261 N 2.44 1.44 2.93 -3.53 0.00 -1.26 -2.37 105.19 104.84 1kfv n GLY 261 Ca -0.17 0.64 -0.26 0.00 0.00 0.00 0.00 46.02 46.22 1kfv n GLY 261 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kfv s THR 262 N 1.22 1.07 -0.14 2.61 2.01 0.88 -4.92 115.64 118.38 1kfv s THR 262 Ca 0.77 -0.34 -0.03 0.00 0.31 0.00 0.00 61.69 62.40 1kfv s THR 262 Cb -0.55 -1.06 -0.03 0.00 0.01 0.00 0.00 72.50 70.87 1kfv s THR 262 CO 0.34 0.37 -0.05 -1.00 -0.69 0.00 0.00 174.62 173.59 1kfv s HIS 263 N 1.49 3.00 0.37 4.92 3.76 -1.26 -1.02 115.29 126.55 1kfv s HIS 263 Ca 0.01 -0.28 -0.14 0.00 -0.15 0.00 0.00 55.06 54.51 1kfv s HIS 263 Cb -0.13 -1.91 0.04 0.00 1.11 0.00 0.00 32.58 31.69 1kfv s HIS 263 CO -0.06 0.01 0.73 -0.59 -0.85 0.00 0.00 174.74 173.98 1kfv s PHE 264 N 0.18 0.27 -0.16 1.40 -0.12 -0.91 -4.80 117.98 113.83 1kfv s PHE 264 Ca -0.02 -0.86 -0.01 0.00 -0.05 0.00 0.00 56.93 55.99 1kfv s PHE 264 Cb -0.14 0.68 -0.01 0.00 -0.63 0.00 0.00 43.02 42.92 1kfv s PHE 264 CO 0.03 -1.48 -0.11 0.00 -0.05 0.00 0.00 175.22 173.61 1kfv h PRO 266 N 7.27 0.63 0.00 0.00 0.11 -1.82 -1.03 132.00 137.16 1kfv h PRO 266 Ca -0.33 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 65.57 1kfv h PRO 266 Cb 1.19 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 1kfv h PRO 266 CO 0.58 0.42 -1.03 0.28 -0.21 0.00 0.00 178.00 178.04 1kfv h VAL 267 N 0.65 0.79 -0.43 3.15 2.07 -1.95 -3.40 116.25 117.14 1kfv h VAL 267 Ca 0.49 -1.96 -0.07 0.00 0.82 0.00 0.00 66.70 65.98 1kfv h VAL 267 Cb 0.87 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 32.48 1kfv h VAL 267 CO -0.24 0.27 -0.00 0.00 0.02 0.00 0.00 177.57 177.61 1kfv s GLN 269 N -4.97 3.32 0.00 0.00 -0.21 -0.39 -4.53 119.66 112.88 1kfv s GLN 269 Ca -0.09 -2.31 0.00 0.00 0.02 0.00 0.00 55.36 52.99 1kfv s GLN 269 Cb 0.15 -4.30 0.00 0.00 1.00 0.00 0.00 33.01 29.86 1kfv s GLN 269 CO 0.79 -1.28 0.05 0.00 -2.12 0.00 0.00 175.29 172.74 1kfv n GLN 270 N 4.18 0.00 -0.12 2.91 -0.00 -1.26 -4.51 117.38 118.59 1kfv n GLN 270 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.07 1kfv n GLN 270 Cb 0.44 -0.53 0.00 0.00 -0.00 0.00 0.00 30.24 30.16 1kfv n GLN 270 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42