#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z09 h ALA 2 N 0.00 0.94 -0.38 -5.12 0.00 -2.06 -2.20 119.26 110.44 1z09 h ALA 2 Ca 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1z09 h ALA 2 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1z09 h ALA 2 CO 0.00 0.67 0.05 0.93 0.00 0.00 0.00 179.25 180.90 1z09 h GLU 3 N 1.08 0.58 -0.83 0.00 5.08 -2.06 -2.15 114.58 116.28 1z09 h GLU 3 Ca 0.22 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 1z09 h GLU 3 Cb 0.38 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 1z09 h GLU 3 CO 0.00 0.57 0.46 0.28 -1.00 0.00 0.00 179.01 179.32 1z09 h VAL 4 N 0.56 1.25 -0.38 3.13 2.07 -1.86 -1.70 116.25 119.33 1z09 h VAL 4 Ca 0.13 -0.61 -0.08 0.00 0.82 0.00 0.00 66.70 66.96 1z09 h VAL 4 Cb 0.29 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 1z09 h VAL 4 CO 0.00 0.27 -0.08 -0.33 0.02 0.00 0.00 177.57 177.45 1z09 h GLU 5 N 1.16 0.64 -0.60 1.57 4.39 -1.05 -1.98 114.58 118.72 1z09 h GLU 5 Ca 0.29 -0.19 -0.04 0.00 0.34 0.00 0.00 59.36 59.77 1z09 h GLU 5 Cb 0.03 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.59 1z09 h GLU 5 CO -0.05 0.72 0.23 1.49 -1.16 0.00 0.00 179.01 180.24 1z09 h GLU 6 N 0.59 0.87 -0.87 2.33 4.57 -0.91 -2.05 114.58 119.13 1z09 h GLU 6 Ca 0.11 -0.14 0.04 0.00 -1.18 0.00 0.00 59.36 58.18 1z09 h GLU 6 Cb 0.50 -0.15 -0.05 0.00 -0.16 0.00 0.00 28.75 28.89 1z09 h GLU 6 CO 0.03 0.72 0.56 1.15 -1.18 0.00 0.00 179.01 180.29 1z09 h THR 7 N 0.86 1.13 -0.57 0.32 2.02 -0.56 -1.96 112.91 114.15 1z09 h THR 7 Ca 0.20 -0.37 0.10 0.00 0.77 0.00 0.00 66.41 67.12 1z09 h THR 7 Cb 0.19 -0.04 -0.08 0.00 -1.74 0.00 0.00 68.15 66.47 1z09 h THR 7 CO -0.02 0.20 0.13 -0.07 0.37 0.00 0.00 175.52 176.13 1z09 h LEU 8 N 1.08 0.02 -1.57 2.58 4.07 -1.18 0.16 115.31 120.47 1z09 h LEU 8 Ca 0.35 0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.41 1z09 h LEU 8 Cb 0.02 0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.87 1z09 h LEU 8 CO -0.12 0.03 0.29 0.50 -1.08 0.00 0.00 178.44 178.05 1z09 h LYS 9 N 0.27 0.58 0.00 1.13 3.64 -1.33 0.21 116.57 121.06 1z09 h LYS 9 Ca 0.30 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1z09 h LYS 9 Cb 0.42 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1z09 h LYS 9 CO -0.37 0.38 0.00 -0.09 -2.27 0.00 0.00 179.45 177.10 1z09 h ARG 10 N 0.59 0.00 0.00 1.90 9.65 -0.37 -1.03 114.38 125.13 1z09 h ARG 10 Ca 0.16 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.04 1z09 h ARG 10 Cb -0.06 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.52 1z09 h ARG 10 CO -0.03 0.00 0.00 -0.07 2.80 0.00 0.00 179.97 182.67 1z09 h LEU 11 N 0.00 0.00 -2.00 3.80 3.38 -0.02 -2.62 115.31 117.84 1z09 h LEU 11 Ca 0.00 0.00 0.34 0.00 0.09 0.00 0.00 57.88 58.31 1z09 h LEU 11 Cb 0.26 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 1z09 h LEU 11 CO 0.00 0.00 0.83 -0.61 0.09 0.00 0.00 178.44 178.75 1z09 h GLN 12 N 0.00 0.00 0.00 1.13 5.75 -1.28 -3.44 115.11 117.27 1z09 h GLN 12 Ca 0.00 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1z09 h GLN 12 Cb 0.30 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.85 1z09 h GLN 12 CO 0.00 0.00 0.00 0.45 -2.65 0.00 0.00 178.83 176.63 1z09 n SER 13 N -4.19 0.00 0.00 -0.69 2.88 -0.99 -3.91 113.62 106.72 1z09 n SER 13 Ca 0.25 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 1z09 n SER 13 Cb 1.22 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.68 1z09 n SER 13 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1z09 n GLN 14 N 0.00 0.00 0.00 -1.46 -0.00 -1.26 -5.02 117.38 109.64 1z09 n GLN 14 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1z09 n GLN 14 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.24 1z09 n GLN 14 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 1z09 n LYS 15 N -0.48 0.00 -0.29 2.61 4.81 -1.25 -4.99 118.16 118.56 1z09 n LYS 15 Ca 0.00 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 57.56 1z09 n LYS 15 Cb 0.00 0.00 0.28 0.00 0.02 0.00 0.00 35.03 35.33 1z09 n LYS 15 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 1z09 h GLY 16 N 0.00 1.38 -0.56 3.14 0.00 -1.82 -3.45 103.07 101.75 1z09 h GLY 16 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1z09 h GLY 16 CO 0.00 -0.32 0.00 -0.62 0.00 0.00 0.00 176.54 175.60 1z09 n VAL 17 N -5.16 0.00 0.27 4.60 0.31 -1.26 -4.32 118.33 112.77 1z09 n VAL 17 Ca 0.21 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.65 1z09 n VAL 17 Cb 0.65 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.55 1z09 n VAL 17 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1z09 n GLN 18 N 0.63 0.48 0.00 5.55 1.13 0.38 -4.89 117.38 120.66 1z09 n GLN 18 Ca 0.00 -0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.05 1z09 n GLN 18 Cb 0.00 -1.66 0.00 0.00 0.11 0.00 0.00 30.24 28.69 1z09 n GLN 18 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1z09 n GLY 19 N 1.28 4.13 3.23 1.08 0.00 -0.29 -4.91 105.19 109.70 1z09 n GLY 19 Ca -0.00 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 1z09 n GLY 19 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1z09 s ILE 20 N -0.28 2.45 -0.16 -0.61 1.01 -1.26 -1.48 121.20 120.86 1z09 s ILE 20 Ca 0.00 -0.85 -0.00 0.00 0.00 0.00 0.00 60.65 59.80 1z09 s ILE 20 Cb 0.00 -2.01 0.04 0.00 0.01 0.00 0.00 42.46 40.50 1z09 s ILE 20 CO 0.00 0.53 -0.07 -0.63 0.00 0.00 0.00 174.94 174.77 1z09 s ILE 21 N 0.78 1.23 -0.14 2.92 1.01 -0.98 -1.65 121.20 124.36 1z09 s ILE 21 Ca -0.07 -0.66 -0.20 0.00 0.00 0.00 0.00 60.65 59.72 1z09 s ILE 21 Cb -0.16 -1.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.93 1z09 s ILE 21 CO -0.00 0.18 0.57 -0.69 0.00 0.00 0.00 174.94 175.00 1z09 s VAL 22 N 1.59 5.10 -0.04 2.92 1.01 0.50 -1.63 120.40 129.86 1z09 s VAL 22 Ca 0.01 1.11 0.03 0.00 0.00 0.00 0.00 61.98 63.14 1z09 s VAL 22 Cb -0.15 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.33 1z09 s VAL 22 CO -0.08 0.23 -0.13 -0.69 0.00 0.00 0.00 175.10 174.42 1z09 s VAL 23 N 1.18 1.15 0.39 2.92 1.01 0.10 -0.22 120.40 126.94 1z09 s VAL 23 Ca 0.29 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 1z09 s VAL 23 Cb -0.16 -1.01 0.08 0.00 0.00 0.00 0.00 36.38 35.29 1z09 s VAL 23 CO 0.12 0.34 0.53 -0.46 0.00 0.00 0.00 175.10 175.63 1z09 n ASN 24 N 3.31 0.67 0.05 3.32 6.94 -1.23 -0.21 115.26 128.11 1z09 n ASN 24 Ca -0.19 -1.58 0.03 0.00 -0.02 0.00 0.00 54.58 52.83 1z09 n ASN 24 Cb 0.53 -0.35 0.17 0.00 -2.36 0.00 0.00 39.78 37.78 1z09 n ASN 24 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1z09 n THR 25 N -2.19 1.60 0.13 5.53 -2.24 -1.24 -1.79 114.28 114.10 1z09 n THR 25 Ca 0.09 0.57 -0.01 0.00 -2.27 0.00 0.00 64.05 62.43 1z09 n THR 25 Cb 0.31 -1.57 0.15 0.00 -2.10 0.00 0.00 70.33 67.11 1z09 n THR 25 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1z09 h GLU 26 N 0.00 0.00 0.00 -0.78 4.39 -1.92 -3.47 114.58 112.80 1z09 h GLU 26 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1z09 h GLU 26 Cb 0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1z09 h GLU 26 CO 0.00 0.63 0.00 0.41 -1.16 0.00 0.00 179.01 178.89 1z09 n GLY 27 N 0.49 3.09 3.73 -3.84 0.00 -0.74 -5.02 105.19 102.89 1z09 n GLY 27 Ca -0.01 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.69 1z09 n GLY 27 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1z09 s ILE 28 N -0.55 3.70 0.05 -0.61 1.01 -1.26 -4.76 121.20 118.77 1z09 s ILE 28 Ca 0.00 1.35 -0.30 0.00 0.00 0.00 0.00 60.65 61.69 1z09 s ILE 28 Cb 0.00 -3.86 -0.08 0.00 0.01 0.00 0.00 42.46 38.53 1z09 s ILE 28 CO 0.00 0.18 1.79 -2.16 0.00 0.00 0.00 174.94 174.75 1z09 s PRO 29 N 0.22 4.16 0.00 2.79 0.04 -1.26 -3.57 135.00 137.39 1z09 s PRO 29 Ca 0.55 2.45 0.25 0.00 0.04 0.00 0.00 61.00 64.29 1z09 s PRO 29 Cb -0.32 -3.85 1.10 0.00 0.04 0.00 0.00 34.50 31.48 1z09 s PRO 29 CO 0.34 -0.85 1.81 -0.89 0.04 0.00 0.00 177.00 177.45 1z09 n ILE 30 N 5.13 0.28 -3.55 0.56 5.41 0.70 -4.86 119.36 123.02 1z09 n ILE 30 Ca 0.18 0.07 -0.07 0.00 1.00 0.00 0.00 62.75 63.93 1z09 n ILE 30 Cb 0.41 -0.64 -0.02 0.00 -0.71 0.00 0.00 39.64 38.67 1z09 n ILE 30 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1z09 s LYS 31 N -2.91 0.59 -0.24 0.38 2.47 -1.12 -5.00 119.74 113.91 1z09 s LYS 31 Ca 0.14 -0.19 -0.27 0.00 -1.56 0.00 0.00 55.97 54.09 1z09 s LYS 31 Cb 0.16 0.27 0.15 0.00 -1.46 0.00 0.00 37.83 36.96 1z09 s LYS 31 CO 0.44 -0.25 1.16 -1.54 0.16 0.00 0.00 175.35 175.31 1z09 s SER 32 N -2.23 -0.27 0.00 1.43 1.04 -1.26 -0.37 113.70 112.04 1z09 s SER 32 Ca 0.06 0.42 0.17 0.00 0.48 0.00 0.00 55.95 57.08 1z09 s SER 32 Cb -0.01 0.38 0.47 0.00 0.10 0.00 0.00 66.02 66.97 1z09 s SER 32 CO -0.06 -0.17 1.39 0.35 0.98 0.00 0.00 173.24 175.73 1z09 n THR 33 N 1.29 0.66 -2.65 2.02 -2.24 -0.66 -4.93 114.28 107.78 1z09 n THR 33 Ca -0.09 -0.68 -0.26 0.00 -2.27 0.00 0.00 64.05 60.75 1z09 n THR 33 Cb 0.57 0.38 0.01 0.00 -2.10 0.00 0.00 70.33 69.19 1z09 n THR 33 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1z09 s MET 34 N -1.34 3.26 0.09 -0.78 -1.94 -1.26 -4.80 119.30 112.53 1z09 s MET 34 Ca 0.35 0.00 -0.30 0.00 -1.71 0.00 0.00 55.69 54.02 1z09 s MET 34 Cb 0.18 -2.38 -0.14 0.00 2.01 0.00 0.00 34.83 34.50 1z09 s MET 34 CO 0.24 -0.36 1.63 -0.44 -0.01 0.00 0.00 175.02 176.08 1z09 h ASP 35 N 0.14 -0.80 0.00 3.03 3.32 -1.98 -3.47 116.42 116.66 1z09 h ASP 35 Ca -0.46 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1z09 h ASP 35 Cb 1.23 0.26 0.00 0.00 0.22 0.00 0.00 39.33 41.04 1z09 h ASP 35 CO 0.61 -0.46 0.00 0.59 -1.72 0.00 0.00 179.24 178.26 1z09 n ASN 36 N -5.43 0.00 -0.12 6.45 4.13 -1.26 -4.97 115.26 114.06 1z09 n ASN 36 Ca -0.10 0.00 -0.04 0.00 1.68 0.00 0.00 54.58 56.12 1z09 n ASN 36 Cb 0.33 0.00 0.17 0.00 -1.54 0.00 0.00 39.78 38.74 1z09 n ASN 36 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1z09 h PRO 37 N 0.00 0.81 -0.69 3.52 0.13 -2.01 -2.06 132.00 131.71 1z09 h PRO 37 Ca 0.00 -0.19 -0.06 0.00 -0.87 0.00 0.00 66.00 64.87 1z09 h PRO 37 Cb 0.00 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 30.99 1z09 h PRO 37 CO 0.00 0.78 0.17 1.15 -0.23 0.00 0.00 178.00 179.87 1z09 h THR 38 N 0.77 1.26 -0.07 1.56 2.02 -1.95 -1.78 112.91 114.71 1z09 h THR 38 Ca 0.16 -0.94 0.04 0.00 0.77 0.00 0.00 66.41 66.44 1z09 h THR 38 Cb 0.38 0.54 -0.05 0.00 -1.74 0.00 0.00 68.15 67.29 1z09 h THR 38 CO 0.01 0.36 -0.21 0.74 0.37 0.00 0.00 175.52 176.79 1z09 h THR 39 N 1.03 0.49 -0.07 3.16 2.02 -1.72 -1.38 112.91 116.45 1z09 h THR 39 Ca 0.22 0.00 -0.25 0.00 0.77 0.00 0.00 66.41 67.15 1z09 h THR 39 Cb 0.35 0.49 0.02 0.00 -1.74 0.00 0.00 68.15 67.27 1z09 h THR 39 CO -0.00 0.00 -0.93 0.74 0.37 0.00 0.00 175.52 175.70 1z09 h THR 40 N -0.30 1.28 -0.95 3.16 2.02 -1.46 0.30 112.91 116.97 1z09 h THR 40 Ca 0.08 -2.13 0.06 0.00 0.77 0.00 0.00 66.41 65.19 1z09 h THR 40 Cb 0.41 2.20 -0.06 0.00 -1.74 0.00 0.00 68.15 68.97 1z09 h THR 40 CO -0.24 0.67 0.62 1.56 0.37 0.00 0.00 175.52 178.49 1z09 h GLN 41 N 0.46 1.09 0.04 6.66 4.20 -1.19 0.24 115.11 126.61 1z09 h GLN 41 Ca -0.09 -0.07 -0.19 0.00 0.06 0.00 0.00 58.65 58.36 1z09 h GLN 41 Cb 1.57 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 29.09 1z09 h GLN 41 CO 0.18 0.72 -1.00 1.88 -0.67 0.00 0.00 178.83 179.95 1z09 h TYR 42 N 1.12 0.16 -0.07 2.96 -1.99 -1.27 -3.12 116.97 114.77 1z09 h TYR 42 Ca 0.40 -0.12 0.04 0.00 2.00 0.00 0.00 58.73 61.05 1z09 h TYR 42 Cb 0.13 -0.01 -0.06 0.00 2.00 0.00 0.00 36.73 38.80 1z09 h TYR 42 CO -0.00 1.39 -0.30 0.00 -0.00 0.00 0.00 178.16 179.25 1z09 h ALA 43 N -0.21 -0.38 -0.66 3.88 0.00 -0.24 1.22 119.26 122.87 1z09 h ALA 43 Ca -0.24 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1z09 h ALA 43 Cb 1.39 0.55 -0.03 0.00 0.00 0.00 0.00 17.79 19.71 1z09 h ALA 43 CO -0.06 -0.79 0.35 0.77 0.00 0.00 0.00 179.25 179.52 1z09 h SER 44 N -0.41 0.83 -0.15 0.00 0.02 -1.13 0.72 113.55 113.42 1z09 h SER 44 Ca 0.08 -0.10 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 1z09 h SER 44 Cb 0.53 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 1z09 h SER 44 CO -0.30 0.69 -0.08 0.25 -1.14 0.00 0.00 176.83 176.25 1z09 h LEU 45 N 0.90 0.33 -0.51 5.07 6.46 -1.32 -3.02 115.31 123.23 1z09 h LEU 45 Ca 0.23 -0.42 -0.11 0.00 -0.12 0.00 0.00 57.88 57.46 1z09 h LEU 45 Cb 0.05 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 39.88 1z09 h LEU 45 CO -0.04 0.68 -0.13 0.24 -0.62 0.00 0.00 178.44 178.57 1z09 h MET 46 N -0.01 0.98 0.04 1.25 2.86 0.17 -2.98 114.93 117.24 1z09 h MET 46 Ca 0.03 -0.38 0.03 0.00 -2.06 0.00 0.00 59.70 57.32 1z09 h MET 46 Cb 0.55 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.11 1z09 h MET 46 CO 0.02 1.05 -0.42 1.25 1.06 0.00 0.00 176.91 179.87 1z09 h HIS 47 N 0.84 -1.20 -0.51 -0.22 -0.00 0.46 0.16 115.15 114.69 1z09 h HIS 47 Ca 0.13 0.04 0.10 0.00 -0.00 0.00 0.00 60.37 60.63 1z09 h HIS 47 Cb 0.70 0.52 -0.09 0.00 -0.00 0.00 0.00 27.41 28.54 1z09 h HIS 47 CO 0.05 -0.51 -0.03 0.77 -0.00 0.00 0.00 177.93 178.22 1z09 h SER 48 N -0.61 -0.27 -0.35 3.26 0.02 -1.55 -2.24 113.55 111.81 1z09 h SER 48 Ca 0.04 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1z09 h SER 48 Cb 0.67 0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.43 1z09 h SER 48 CO -0.29 -0.10 0.23 0.15 -1.14 0.00 0.00 176.83 175.68 1z09 h PHE 49 N 0.09 0.44 -0.43 3.45 3.04 -1.14 -3.05 116.94 119.35 1z09 h PHE 49 Ca 0.26 0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.26 1z09 h PHE 49 Cb 0.39 -0.15 -0.04 0.00 2.56 0.00 0.00 35.95 38.71 1z09 h PHE 49 CO -0.34 0.29 0.18 0.82 -2.02 0.00 0.00 178.31 177.23 1z09 h ILE 50 N 0.47 0.91 -0.29 1.41 2.04 -0.12 -0.90 117.51 121.03 1z09 h ILE 50 Ca 0.13 -0.12 0.08 0.00 1.00 0.00 0.00 64.86 65.95 1z09 h ILE 50 Cb -0.04 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 1z09 h ILE 50 CO -0.03 0.07 0.21 -0.07 0.00 0.00 0.00 178.15 178.33 1z09 h LEU 51 N 0.36 0.00 -0.78 1.44 3.38 -1.39 -1.32 115.31 117.01 1z09 h LEU 51 Ca 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 1z09 h LEU 51 Cb 0.15 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1z09 h LEU 51 CO -0.17 0.00 0.49 0.11 0.09 0.00 0.00 178.44 178.95 1z09 h LYS 52 N 0.00 1.05 0.41 1.13 1.57 -1.07 0.13 116.57 119.79 1z09 h LYS 52 Ca 0.14 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1z09 h LYS 52 Cb 0.56 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1z09 h LYS 52 CO -0.00 0.72 -0.32 0.00 -0.57 0.00 0.00 179.45 179.28 1z09 h ALA 53 N 1.26 -1.07 -0.75 3.86 0.00 -1.22 1.53 119.26 122.87 1z09 h ALA 53 Ca 0.28 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 55.16 1z09 h ALA 53 Cb -0.07 0.50 -0.08 0.00 0.00 0.00 0.00 17.79 18.14 1z09 h ALA 53 CO -0.06 -1.07 0.36 -0.09 0.00 0.00 0.00 179.25 178.40 1z09 h ARG 54 N -0.71 0.56 0.95 0.00 2.43 -1.52 1.55 114.38 117.65 1z09 h ARG 54 Ca -0.05 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.04 1z09 h ARG 54 Cb 0.59 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 30.02 1z09 h ARG 54 CO 0.01 0.37 -0.46 1.03 -1.51 0.00 0.00 179.97 179.42 1z09 h SER 55 N 0.58 -1.08 -0.53 -3.80 0.87 -0.35 0.26 113.55 109.50 1z09 h SER 55 Ca 0.39 0.04 0.07 0.00 -1.23 0.00 0.00 61.79 61.05 1z09 h SER 55 Cb 0.48 0.28 -0.06 0.00 -0.44 0.00 0.00 62.40 62.66 1z09 h SER 55 CO -0.31 -0.75 0.22 0.74 -0.53 0.00 0.00 176.83 176.19 1z09 h THR 56 N -1.32 0.86 0.12 2.23 2.02 0.27 0.33 112.91 117.42 1z09 h THR 56 Ca -0.13 -0.14 0.02 0.00 0.77 0.00 0.00 66.41 66.92 1z09 h THR 56 Cb 0.98 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 1z09 h THR 56 CO 0.21 0.08 -0.24 0.58 0.37 0.00 0.00 175.52 176.52 1z09 h VAL 57 N 0.42 0.47 0.00 3.16 2.07 0.23 -2.37 116.25 120.23 1z09 h VAL 57 Ca 0.25 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.70 1z09 h VAL 57 Cb 0.25 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1z09 h VAL 57 CO -0.23 0.00 -0.33 -0.09 0.02 0.00 0.00 177.57 176.94 1z09 h ARG 58 N -0.44 0.00 -0.90 1.57 2.43 -0.58 -3.08 114.38 113.37 1z09 h ARG 58 Ca 0.03 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.30 1z09 h ARG 58 Cb 0.47 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.94 1z09 h ARG 58 CO -0.13 0.33 0.54 0.22 -1.51 0.00 0.00 179.97 179.42 1z09 h ASP 59 N 0.00 0.80 0.14 -3.80 3.58 -0.38 -3.04 116.42 113.72 1z09 h ASP 59 Ca -0.00 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 1z09 h ASP 59 Cb 0.60 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.53 1z09 h ASP 59 CO 0.04 0.45 -0.07 0.40 -2.88 0.00 0.00 179.24 177.19 1z09 h ILE 60 N 0.91 0.92 -1.93 2.25 2.04 -1.51 -3.48 117.51 116.72 1z09 h ILE 60 Ca 0.43 -1.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.09 1z09 h ILE 60 Cb 0.38 1.55 -0.22 0.00 -0.74 0.00 0.00 36.82 37.78 1z09 h ILE 60 CO -0.24 0.24 0.19 -1.81 0.00 0.00 0.00 178.15 176.53 1z09 s ASP 61 N -5.52 -0.69 0.36 1.72 1.01 -1.15 -5.01 116.67 107.40 1z09 s ASP 61 Ca -0.13 1.29 0.27 0.00 0.71 0.00 0.00 52.55 54.69 1z09 s ASP 61 Cb 0.00 1.29 0.99 0.00 1.01 0.00 0.00 42.92 46.21 1z09 s ASP 61 CO 0.49 -0.26 1.80 1.55 0.21 0.00 0.00 175.17 178.96 1z09 h PRO 62 N 4.69 0.00 -0.37 8.23 0.13 -1.87 -3.19 132.00 139.62 1z09 h PRO 62 Ca -0.29 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.89 1z09 h PRO 62 Cb 1.16 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.27 1z09 h PRO 62 CO 0.09 0.00 0.25 1.96 -0.23 0.00 0.00 178.00 180.07 1z09 h GLN 63 N 0.00 0.30 -5.85 0.86 4.20 -1.95 -3.43 115.11 109.24 1z09 h GLN 63 Ca 0.00 -0.02 -0.59 0.00 0.06 0.00 0.00 58.65 58.10 1z09 h GLN 63 Cb 0.56 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.21 1z09 h GLN 63 CO 0.00 0.20 -0.35 0.54 -0.67 0.00 0.00 178.83 178.55 1z09 s ASN 64 N -6.61 4.57 0.16 1.46 2.20 -1.20 -5.15 114.94 110.37 1z09 s ASN 64 Ca -0.07 -1.25 -0.24 0.00 -0.94 0.00 0.00 52.86 50.35 1z09 s ASN 64 Cb 0.18 0.29 0.06 0.00 -2.00 0.00 0.00 41.25 39.78 1z09 s ASN 64 CO 0.72 -1.00 0.85 1.51 -2.94 0.00 0.00 177.10 176.25 1z09 s ASP 65 N -4.19 -0.27 -0.37 3.54 1.47 -1.26 -4.81 116.67 110.77 1z09 s ASP 65 Ca 0.32 -0.34 -0.22 0.00 1.18 0.00 0.00 52.55 53.48 1z09 s ASP 65 Cb -0.01 0.54 0.01 0.00 -0.34 0.00 0.00 42.92 43.12 1z09 s ASP 65 CO 0.19 -0.97 0.74 -0.22 0.68 0.00 0.00 175.17 175.60 1z09 s LEU 66 N -2.84 4.18 0.04 2.11 2.96 -1.26 -4.87 118.68 119.00 1z09 s LEU 66 Ca 0.10 0.24 0.22 0.00 -0.22 0.00 0.00 54.13 54.46 1z09 s LEU 66 Cb -0.02 -2.95 -0.21 0.00 0.50 0.00 0.00 46.19 43.50 1z09 s LEU 66 CO -0.00 -0.72 0.66 0.41 -1.32 0.00 0.00 176.35 175.38 1z09 n THR 67 N 5.78 0.33 -3.62 3.68 -1.04 -1.26 -4.91 114.28 113.24 1z09 n THR 67 Ca 0.02 -0.54 -0.04 0.00 -2.04 0.00 0.00 64.05 61.45 1z09 n THR 67 Cb 0.48 -0.17 -0.03 0.00 -1.82 0.00 0.00 70.33 68.79 1z09 n THR 67 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1z09 s PHE 68 N -3.39 -0.09 0.04 -1.42 2.19 -1.26 -4.76 117.98 109.29 1z09 s PHE 68 Ca -0.05 0.09 -0.12 0.00 0.33 0.00 0.00 56.93 57.18 1z09 s PHE 68 Cb 0.12 0.50 0.01 0.00 -1.31 0.00 0.00 43.02 42.34 1z09 s PHE 68 CO 0.86 -0.12 0.25 -1.17 1.83 0.00 0.00 175.22 176.88 1z09 s LEU 69 N -1.76 1.11 -0.28 6.12 2.96 -1.26 -5.06 118.68 120.52 1z09 s LEU 69 Ca 0.09 -0.27 -0.01 0.00 -0.22 0.00 0.00 54.13 53.72 1z09 s LEU 69 Cb -0.01 1.16 0.17 0.00 0.50 0.00 0.00 46.19 48.02 1z09 s LEU 69 CO -0.04 -0.59 0.53 0.00 -1.32 0.00 0.00 176.35 174.92 1z09 s ARG 70 N -2.55 0.50 -0.03 1.98 3.03 -1.26 -2.86 118.95 117.75 1z09 s ARG 70 Ca -0.05 0.78 -0.18 0.00 2.03 0.00 0.00 55.73 58.31 1z09 s ARG 70 Cb -0.01 0.19 -0.05 0.00 -1.03 0.00 0.00 34.95 34.04 1z09 s ARG 70 CO -0.04 -0.70 0.49 0.42 -1.13 0.00 0.00 175.30 174.35 1z09 s ILE 71 N 2.75 5.01 0.40 4.99 1.01 0.35 -4.93 121.20 130.78 1z09 s ILE 71 Ca 0.17 1.01 -0.22 0.00 0.00 0.00 0.00 60.65 61.60 1z09 s ILE 71 Cb -0.14 -3.81 -0.11 0.00 0.01 0.00 0.00 42.46 38.41 1z09 s ILE 71 CO -0.21 0.47 0.95 -0.60 0.00 0.00 0.00 174.94 175.55 1z09 s ARG 72 N -0.39 4.31 -0.13 2.79 6.06 -1.26 -0.87 118.95 129.45 1z09 s ARG 72 Ca 0.26 1.18 -0.11 0.00 -2.50 0.00 0.00 55.73 54.57 1z09 s ARG 72 Cb -0.17 -2.34 0.04 0.00 0.06 0.00 0.00 34.95 32.54 1z09 s ARG 72 CO 0.14 0.04 0.35 0.45 -2.50 0.00 0.00 175.30 173.78 1z09 s SER 73 N -2.02 -0.38 0.34 -2.12 0.15 -1.12 -4.83 113.70 103.73 1z09 s SER 73 Ca 0.59 0.72 0.02 0.00 0.70 0.00 0.00 55.95 57.98 1z09 s SER 73 Cb -0.12 0.70 0.63 0.00 -1.71 0.00 0.00 66.02 65.52 1z09 s SER 73 CO 0.16 -0.13 2.00 0.50 1.20 0.00 0.00 173.24 176.96 1z09 h LYS 74 N 5.89 0.85 0.00 5.44 1.63 -2.02 -2.73 116.57 125.63 1z09 h LYS 74 Ca -0.29 -0.05 -0.09 0.00 -0.85 0.00 0.00 60.65 59.37 1z09 h LYS 74 Cb 1.18 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 32.61 1z09 h LYS 74 CO 0.29 0.56 -0.59 -0.22 -3.45 0.00 0.00 179.45 176.04 1z09 h LYS 75 N 0.88 0.00 -1.73 1.90 1.63 -2.03 -3.49 116.57 113.73 1z09 h LYS 75 Ca 0.26 0.00 0.34 0.00 -0.85 0.00 0.00 60.65 60.40 1z09 h LYS 75 Cb -0.03 0.00 -0.10 0.00 -0.60 0.00 0.00 32.23 31.50 1z09 h LYS 75 CO -0.06 0.36 0.88 0.54 -3.45 0.00 0.00 179.45 177.71 1z09 s ASN 76 N -6.24 -0.02 0.05 4.20 2.20 -1.03 -5.12 114.94 108.97 1z09 s ASN 76 Ca 0.03 -0.16 -0.21 0.00 -0.94 0.00 0.00 52.86 51.59 1z09 s ASN 76 Cb 0.07 0.14 -0.06 0.00 -2.00 0.00 0.00 41.25 39.40 1z09 s ASN 76 CO 0.75 -0.27 0.61 -0.70 -2.94 0.00 0.00 177.10 174.55 1z09 s GLU 77 N -2.19 4.30 -0.21 3.55 2.12 -1.23 -2.78 118.70 122.27 1z09 s GLU 77 Ca 0.22 0.79 -0.05 0.00 0.36 0.00 0.00 54.97 56.29 1z09 s GLU 77 Cb 0.03 -3.29 -0.02 0.00 0.26 0.00 0.00 34.13 31.10 1z09 s GLU 77 CO -0.03 0.49 -0.01 0.42 -0.54 0.00 0.00 175.26 175.60 1z09 s ILE 78 N -0.64 3.83 -0.17 -3.70 1.01 -0.05 -4.15 121.20 117.33 1z09 s ILE 78 Ca 0.31 -0.35 -0.10 0.00 0.00 0.00 0.00 60.65 60.51 1z09 s ILE 78 Cb -0.19 -2.74 0.06 0.00 0.01 0.00 0.00 42.46 39.60 1z09 s ILE 78 CO 0.19 0.42 0.43 -0.32 0.00 0.00 0.00 174.94 175.66 1z09 s MET 79 N 1.11 0.42 -0.20 2.79 1.75 -1.26 0.13 119.30 124.05 1z09 s MET 79 Ca 0.02 0.80 -0.04 0.00 -1.25 0.00 0.00 55.69 55.22 1z09 s MET 79 Cb -0.14 0.00 0.07 0.00 2.84 0.00 0.00 34.83 37.60 1z09 s MET 79 CO 0.01 -0.15 0.08 0.54 -0.65 0.00 0.00 175.02 174.85 1z09 s VAL 80 N 1.33 0.16 -0.40 10.11 0.11 -1.14 0.11 120.40 130.68 1z09 s VAL 80 Ca -0.09 -0.42 -0.21 0.00 -2.93 0.00 0.00 61.98 58.33 1z09 s VAL 80 Cb -0.08 -0.82 0.02 0.00 -1.53 0.00 0.00 36.38 33.96 1z09 s VAL 80 CO -0.12 -0.32 0.68 0.00 -3.33 0.00 0.00 175.10 172.00 1z09 s ALA 81 N 2.02 3.38 -0.47 1.54 0.00 -0.98 -4.08 121.76 123.17 1z09 s ALA 81 Ca 0.02 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 50.69 1z09 s ALA 81 Cb -0.16 -3.29 0.03 0.00 0.00 0.00 0.00 23.12 19.69 1z09 s ALA 81 CO -0.12 -1.63 1.15 -1.25 0.00 0.00 0.00 175.76 173.91 1z09 s PRO 82 N 2.89 3.73 0.00 0.00 0.04 -1.26 -3.32 135.00 137.08 1z09 s PRO 82 Ca 0.25 0.60 0.00 0.00 0.04 0.00 0.00 61.00 61.89 1z09 s PRO 82 Cb -0.14 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.50 1z09 s PRO 82 CO 0.18 -1.37 0.00 -3.47 0.04 0.00 0.00 177.00 172.38 1z09 n ASP 83 N 7.85 0.00 0.00 6.66 2.03 -0.62 -4.93 116.55 127.55 1z09 n ASP 83 Ca 0.12 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1z09 n ASP 83 Cb 0.49 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 1z09 n ASP 83 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1z09 n LYS 84 N 0.00 0.00 -0.50 -0.67 5.02 -1.26 -4.46 118.16 116.28 1z09 n LYS 84 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.33 1z09 n LYS 84 Cb 0.00 0.00 0.23 0.00 -0.02 0.00 0.00 35.03 35.24 1z09 n LYS 84 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1z09 n ASP 85 N 0.00 3.64 -3.62 4.39 5.75 -1.26 -4.87 116.55 120.59 1z09 n ASP 85 Ca 0.00 -2.52 -0.15 0.00 -0.01 0.00 0.00 54.79 52.11 1z09 n ASP 85 Cb 0.00 -0.61 -0.06 0.00 -1.03 0.00 0.00 41.12 39.42 1z09 n ASP 85 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1z09 s TYR 86 N -1.98 -0.40 -0.03 2.11 2.02 -1.26 -3.59 117.35 114.21 1z09 s TYR 86 Ca 0.30 0.56 -0.20 0.00 -0.37 0.00 0.00 57.07 57.37 1z09 s TYR 86 Cb 0.23 0.28 0.04 0.00 -0.40 0.00 0.00 41.96 42.11 1z09 s TYR 86 CO 0.09 -0.56 0.43 -0.59 -1.57 0.00 0.00 175.55 173.34 1z09 s PHE 87 N -1.83 -0.34 0.01 2.71 -0.12 0.71 -1.58 117.98 117.53 1z09 s PHE 87 Ca -0.09 0.57 -0.06 0.00 -0.05 0.00 0.00 56.93 57.31 1z09 s PHE 87 Cb -0.02 0.19 -0.00 0.00 -0.63 0.00 0.00 43.02 42.56 1z09 s PHE 87 CO 0.03 -0.45 0.10 -0.48 -0.05 0.00 0.00 175.22 174.37 1z09 s LEU 88 N -1.21 1.72 -0.26 -1.99 2.34 -1.21 0.02 118.68 118.10 1z09 s LEU 88 Ca -0.12 -0.33 -0.18 0.00 0.06 0.00 0.00 54.13 53.56 1z09 s LEU 88 Cb -0.04 0.56 -0.03 0.00 -0.56 0.00 0.00 46.19 46.13 1z09 s LEU 88 CO 0.06 -0.39 0.52 -0.63 -1.06 0.00 0.00 176.35 174.85 1z09 s ILE 89 N -1.66 5.06 -0.64 1.48 1.01 -0.64 -2.32 121.20 123.48 1z09 s ILE 89 Ca -0.13 0.89 -0.12 0.00 0.00 0.00 0.00 60.65 61.29 1z09 s ILE 89 Cb -0.07 -3.84 0.16 0.00 0.01 0.00 0.00 42.46 38.73 1z09 s ILE 89 CO -0.00 0.08 0.55 -0.69 0.00 0.00 0.00 174.94 174.88 1z09 s VAL 90 N 2.33 4.94 -0.42 2.92 1.01 0.30 -2.33 120.40 129.16 1z09 s VAL 90 Ca 0.22 -2.10 -0.22 0.00 0.00 0.00 0.00 61.98 59.87 1z09 s VAL 90 Cb -0.16 -4.14 0.02 0.00 0.00 0.00 0.00 36.38 32.10 1z09 s VAL 90 CO 0.09 -0.91 0.73 -0.63 0.00 0.00 0.00 175.10 174.38 1z09 s ILE 91 N 0.82 4.74 0.02 2.22 1.09 -0.55 -3.99 121.20 125.55 1z09 s ILE 91 Ca 0.11 0.47 -0.00 0.00 -1.10 0.00 0.00 60.65 60.12 1z09 s ILE 91 Cb -0.21 -4.23 0.00 0.00 -1.06 0.00 0.00 42.46 36.96 1z09 s ILE 91 CO -0.03 -0.57 0.03 0.00 -0.10 0.00 0.00 174.94 174.27 1z09 n GLN 92 N 6.45 0.05 -3.59 2.79 10.64 -1.26 -0.47 117.38 131.99 1z09 n GLN 92 Ca 0.01 -0.13 -0.04 0.00 -1.83 0.00 0.00 57.00 55.01 1z09 n GLN 92 Cb 0.48 0.14 -0.02 0.00 -0.86 0.00 0.00 30.24 29.98 1z09 n GLN 92 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 1z09 s ASN 93 N -1.11 -0.14 -0.19 2.61 2.47 -1.26 -3.48 114.94 113.84 1z09 s ASN 93 Ca 0.01 0.00 0.03 0.00 0.42 0.00 0.00 52.86 53.32 1z09 s ASN 93 Cb -0.00 0.14 0.35 0.00 -1.45 0.00 0.00 41.25 40.29 1z09 s ASN 93 CO 0.01 -0.23 1.36 -0.81 -3.72 0.00 0.00 177.10 173.70 1z09 n PRO 94 N -0.09 1.96 -1.76 0.43 -0.04 -1.26 -3.60 135.00 130.65 1z09 n PRO 94 Ca 0.00 -1.48 -0.13 0.00 -0.04 0.00 0.00 63.50 61.85 1z09 n PRO 94 Cb 0.58 -1.66 -0.04 0.00 -0.04 0.00 0.00 33.50 32.35 1z09 n PRO 94 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1z09 n THR 95 N -0.14 -0.22 1.94 0.52 -2.24 -1.26 -5.05 114.28 107.83 1z09 n THR 95 Ca 0.25 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 62.19 1z09 n THR 95 Cb 0.98 -1.43 0.90 0.00 -2.10 0.00 0.00 70.33 68.67 1z09 n THR 95 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71