#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 -0.35 3.04 0.00 -2.03 -1.59 119.26 119.27 1z09 h ALA 2 Ca 0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1z09 h ALA 2 Cb 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1z09 h ALA 2 CO 0.00 0.53 -0.02 0.93 0.00 0.00 0.00 179.25 180.69 1z09 h GLU 3 N 1.03 0.55 -0.51 0.00 4.39 -2.05 -2.53 114.58 115.47 1z09 h GLU 3 Ca 0.25 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 1z09 h GLU 3 Cb 0.16 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1z09 h GLU 3 CO -0.03 0.59 0.27 0.28 -1.16 0.00 0.00 179.01 178.96 1z09 h VAL 4 N 0.52 1.18 -0.41 3.13 2.07 -1.72 -1.59 116.25 119.43 1z09 h VAL 4 Ca 0.11 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1z09 h VAL 4 Cb 0.36 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1z09 h VAL 4 CO 0.01 0.20 0.15 -0.33 0.02 0.00 0.00 177.57 177.62 1z09 h GLU 5 N 0.67 0.59 -0.78 1.57 5.08 -1.01 -1.38 114.58 119.32 1z09 h GLU 5 Ca 0.18 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 1z09 h GLU 5 Cb 0.07 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1z09 h GLU 5 CO -0.03 0.50 0.28 1.49 -1.00 0.00 0.00 179.01 180.25 1z09 h GLU 6 N 0.58 1.19 -0.70 2.33 4.57 -0.97 -2.45 114.58 119.13 1z09 h GLU 6 Ca 0.14 -0.23 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1z09 h GLU 6 Cb 0.14 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 1z09 h GLU 6 CO -0.01 0.98 0.45 1.15 -1.18 0.00 0.00 179.01 180.40 1z09 h THR 7 N 1.15 1.19 -0.69 0.32 2.02 -0.33 -2.20 112.91 114.37 1z09 h THR 7 Ca 0.26 -0.37 0.12 0.00 0.77 0.00 0.00 66.41 67.18 1z09 h THR 7 Cb 0.26 0.17 -0.08 0.00 -1.74 0.00 0.00 68.15 66.76 1z09 h THR 7 CO -0.02 0.19 0.27 0.25 0.37 0.00 0.00 175.52 176.58 1z09 h LEU 8 N 0.96 0.26 -1.59 2.58 5.85 -0.99 0.28 115.31 122.65 1z09 h LEU 8 Ca 0.26 0.09 0.05 0.00 0.84 0.00 0.00 57.88 59.12 1z09 h LEU 8 Cb -0.08 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1z09 h LEU 8 CO -0.05 0.13 0.35 0.11 -0.34 0.00 0.00 178.44 178.64 1z09 h LYS 9 N 0.44 0.50 0.00 1.25 1.57 -1.25 0.78 116.57 119.85 1z09 h LYS 9 Ca 0.36 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1z09 h LYS 9 Cb 0.49 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1z09 h LYS 9 CO -0.35 0.33 0.00 0.00 -0.57 0.00 0.00 179.45 178.86 1z09 h ARG 10 N 0.51 0.00 -0.00 3.15 2.47 -0.23 0.40 114.38 120.68 1z09 h ARG 10 Ca 0.23 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 1z09 h ARG 10 Cb 0.24 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.56 1z09 h ARG 10 CO -0.06 0.00 -0.12 1.28 0.56 0.00 0.00 179.97 181.63 1z09 n LEU 11 N -3.05 0.60 -0.26 3.04 4.77 0.27 -4.05 117.00 118.32 1z09 n LEU 11 Ca -0.01 -0.07 0.28 0.00 -0.03 0.00 0.00 56.01 56.19 1z09 n LEU 11 Cb 0.21 -0.15 0.67 0.00 -2.33 0.00 0.00 43.42 41.82 1z09 n LEU 11 CO 0.24 0.11 1.27 -0.61 -1.33 0.00 0.00 177.39 177.07 1z09 h GLN 12 N 0.76 0.12 -6.14 3.23 4.15 -0.69 -3.46 115.11 113.08 1z09 h GLN 12 Ca 0.00 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.38 1z09 h GLN 12 Cb 0.37 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.04 1z09 h GLN 12 CO 0.00 0.08 -1.01 -1.13 -1.93 0.00 0.00 178.83 174.84 1z09 n SER 13 N -4.34 -6.78 -4.71 -0.69 3.41 -1.26 -4.80 113.62 94.45 1z09 n SER 13 Ca 0.22 0.55 -0.39 0.00 -0.26 0.00 0.00 58.87 58.99 1z09 n SER 13 Cb 1.01 -2.33 -0.05 0.00 -0.26 0.00 0.00 64.21 62.58 1z09 n SER 13 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1z09 s GLN 14 N -1.25 4.38 0.00 4.33 -0.44 -1.26 -3.77 119.66 121.64 1z09 s GLN 14 Ca 0.03 0.74 0.00 0.00 -2.50 0.00 0.00 55.36 53.63 1z09 s GLN 14 Cb -0.00 -3.46 0.00 0.00 -1.64 0.00 0.00 33.01 27.90 1z09 s GLN 14 CO 0.22 0.04 0.00 1.17 0.50 0.00 0.00 175.29 177.22 1z09 n LYS 15 N 3.94 0.00 0.00 1.67 4.81 -1.26 -4.86 118.16 122.46 1z09 n LYS 15 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 1z09 n LYS 15 Cb 0.51 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.56 1z09 n LYS 15 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1z09 n GLY 16 N 0.00 1.38 3.70 3.14 0.00 -1.26 -5.03 105.19 107.12 1z09 n GLY 16 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1z09 n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1z09 s VAL 17 N -1.27 2.94 -0.04 1.61 1.01 -1.25 -0.30 120.40 123.11 1z09 s VAL 17 Ca 0.00 0.53 -0.03 0.00 0.00 0.00 0.00 61.98 62.48 1z09 s VAL 17 Cb 0.00 -3.34 -0.27 0.00 0.00 0.00 0.00 36.38 32.77 1z09 s VAL 17 CO 0.00 0.02 0.69 1.56 0.00 0.00 0.00 175.10 177.37 1z09 h GLN 18 N 7.67 0.24 -1.21 2.72 4.20 -0.63 -3.45 115.11 124.65 1z09 h GLN 18 Ca -0.42 -0.42 0.17 0.00 0.06 0.00 0.00 58.65 58.04 1z09 h GLN 18 Cb 1.20 0.15 -0.30 0.00 0.30 0.00 0.00 27.48 28.84 1z09 h GLN 18 CO 0.92 1.09 0.79 0.20 -0.67 0.00 0.00 178.83 181.16 1z09 s GLY 19 N -5.14 0.14 -0.12 3.46 0.00 -1.12 -4.88 107.32 99.65 1z09 s GLY 19 Ca -0.12 3.07 0.02 0.00 0.00 0.00 0.00 44.72 47.69 1z09 s GLY 19 CO 0.83 1.64 -0.19 -0.42 0.00 0.00 0.00 173.10 174.96 1z09 s ILE 20 N -0.30 1.81 -0.22 0.90 1.01 -1.26 -0.61 121.20 122.54 1z09 s ILE 20 Ca 0.06 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.90 1z09 s ILE 20 Cb -0.04 -1.62 0.04 0.00 0.01 0.00 0.00 42.46 40.85 1z09 s ILE 20 CO -0.10 0.50 -0.15 -0.63 0.00 0.00 0.00 174.94 174.55 1z09 s ILE 21 N 0.87 2.07 -0.08 2.92 1.01 -0.87 -1.83 121.20 125.29 1z09 s ILE 21 Ca -0.07 -1.24 -0.20 0.00 0.00 0.00 0.00 60.65 59.14 1z09 s ILE 21 Cb -0.15 -2.03 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 1z09 s ILE 21 CO -0.01 0.27 0.56 -0.69 0.00 0.00 0.00 174.94 175.06 1z09 s VAL 22 N 1.22 5.10 0.11 2.92 1.01 0.47 -2.44 120.40 128.78 1z09 s VAL 22 Ca -0.01 1.13 0.06 0.00 0.00 0.00 0.00 61.98 63.16 1z09 s VAL 22 Cb -0.16 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 1z09 s VAL 22 CO -0.09 0.33 -0.16 -0.69 0.00 0.00 0.00 175.10 174.49 1z09 s VAL 23 N 0.47 1.37 0.91 2.92 1.01 -0.30 -0.92 120.40 125.86 1z09 s VAL 23 Ca 0.30 -1.59 -0.12 0.00 0.00 0.00 0.00 61.98 60.56 1z09 s VAL 23 Cb -0.16 -1.44 0.14 0.00 0.00 0.00 0.00 36.38 34.92 1z09 s VAL 23 CO 0.14 -0.30 1.13 0.20 0.00 0.00 0.00 175.10 176.27 1z09 s ASN 24 N -2.18 3.45 0.00 3.32 0.01 0.21 -1.62 114.94 118.13 1z09 s ASN 24 Ca 0.06 1.02 0.00 0.00 -0.71 0.00 0.00 52.86 53.23 1z09 s ASN 24 Cb -0.07 -1.62 0.00 0.00 0.41 0.00 0.00 41.25 39.97 1z09 s ASN 24 CO 0.03 -2.59 0.07 0.41 -1.51 0.00 0.00 177.10 173.51 1z09 n THR 25 N -3.80 0.04 -1.72 1.60 -1.04 -1.26 -2.79 114.28 105.31 1z09 n THR 25 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1z09 n THR 25 Cb 0.59 -0.27 0.00 0.00 -1.82 0.00 0.00 70.33 68.82 1z09 n THR 25 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1z09 n GLU 26 N 0.68 0.00 0.00 -2.82 0.28 -1.26 -5.04 120.64 112.49 1z09 n GLU 26 Ca 0.00 -0.06 0.00 0.00 -0.16 0.00 0.00 57.16 56.94 1z09 n GLU 26 Cb 0.03 -0.14 0.00 0.00 1.43 0.00 0.00 31.44 32.76 1z09 n GLU 26 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1z09 n GLY 27 N 0.00 1.52 3.63 -1.84 0.00 -1.12 -5.08 105.19 102.31 1z09 n GLY 27 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.43 4.15 -0.54 -0.61 -1.09 -1.26 -4.78 121.20 115.64 1z09 s ILE 28 Ca 0.00 1.29 -0.26 0.00 -2.23 0.00 0.00 60.65 59.45 1z09 s ILE 28 Cb 0.00 -4.18 0.03 0.00 -1.58 0.00 0.00 42.46 36.73 1z09 s ILE 28 CO 0.00 -0.50 1.03 -2.16 -1.23 0.00 0.00 174.94 172.09 1z09 s PRO 29 N 4.18 3.46 0.00 2.79 0.04 -1.26 0.67 135.00 144.88 1z09 s PRO 29 Ca 0.56 0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.64 1z09 s PRO 29 Cb -0.16 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.37 1z09 s PRO 29 CO 0.23 -1.49 0.00 -0.89 0.04 0.00 0.00 177.00 174.89 1z09 n ILE 30 N 6.44 0.00 -1.41 0.56 5.41 -0.10 -4.92 119.36 125.34 1z09 n ILE 30 Ca 0.06 0.00 -0.34 0.00 1.00 0.00 0.00 62.75 63.46 1z09 n ILE 30 Cb 0.48 -0.07 0.10 0.00 -0.71 0.00 0.00 39.64 39.44 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 0.54 2.10 -0.29 0.38 2.20 -1.19 -4.75 119.74 118.74 1z09 s LYS 31 Ca 0.00 1.77 -0.25 0.00 -0.36 0.00 0.00 55.97 57.13 1z09 s LYS 31 Cb 0.00 -1.83 0.16 0.00 -1.51 0.00 0.00 37.83 34.66 1z09 s LYS 31 CO 0.00 -1.87 1.27 -1.54 -0.36 0.00 0.00 175.35 172.85 1z09 s SER 32 N -2.02 -0.21 -0.09 1.43 1.04 -1.26 0.18 113.70 112.77 1z09 s SER 32 Ca 0.75 0.39 0.16 0.00 0.48 0.00 0.00 55.95 57.73 1z09 s SER 32 Cb -0.29 0.39 0.63 0.00 0.10 0.00 0.00 66.02 66.84 1z09 s SER 32 CO 0.46 -0.08 1.52 1.07 0.98 0.00 0.00 173.24 177.18 1z09 n THR 33 N 1.72 1.52 -2.17 2.02 5.66 -0.76 -4.94 114.28 117.32 1z09 n THR 33 Ca -0.11 -1.00 -0.11 0.00 -3.05 0.00 0.00 64.05 59.78 1z09 n THR 33 Cb 0.57 0.11 0.06 0.00 -1.55 0.00 0.00 70.33 69.51 1z09 n THR 33 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 1z09 n MET 34 N 1.01 0.09 0.00 1.09 2.81 -1.26 -4.79 117.12 116.07 1z09 n MET 34 Ca 0.22 -1.14 0.00 0.00 -1.81 0.00 0.00 57.70 54.97 1z09 n MET 34 Cb 0.77 -0.37 0.00 0.00 -0.71 0.00 0.00 33.22 32.91 1z09 n MET 34 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1z09 n ASP 35 N -3.06 0.00 0.00 7.83 8.00 -1.26 -4.99 116.55 123.07 1z09 n ASP 35 Ca 0.07 0.88 0.00 0.00 0.71 0.00 0.00 54.79 56.45 1z09 n ASP 35 Cb 0.26 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 1z09 n ASP 35 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1z09 n ASN 36 N -1.71 0.00 0.13 -2.24 5.03 -1.26 -4.95 115.26 110.26 1z09 n ASN 36 Ca 0.00 0.00 0.01 0.00 0.87 0.00 0.00 54.58 55.46 1z09 n ASN 36 Cb 0.00 0.00 0.31 0.00 -1.02 0.00 0.00 39.78 39.07 1z09 n ASN 36 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 1z09 h PRO 37 N 0.00 0.15 -0.48 3.52 0.13 -2.02 -1.90 132.00 131.40 1z09 h PRO 37 Ca 0.00 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 65.02 1z09 h PRO 37 Cb 0.00 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.10 1z09 h PRO 37 CO 0.00 0.47 0.07 1.15 -0.23 0.00 0.00 178.00 179.46 1z09 h THR 38 N 0.14 1.22 -0.42 1.56 2.02 -1.97 -2.47 112.91 112.98 1z09 h THR 38 Ca 0.02 -0.85 0.08 0.00 0.77 0.00 0.00 66.41 66.43 1z09 h THR 38 Cb 0.65 0.78 -0.07 0.00 -1.74 0.00 0.00 68.15 67.77 1z09 h THR 38 CO 0.05 0.31 -0.04 0.74 0.37 0.00 0.00 175.52 176.94 1z09 h THR 39 N 0.72 0.63 0.13 3.16 2.02 -1.72 -2.40 112.91 115.45 1z09 h THR 39 Ca 0.15 -0.02 -0.28 0.00 0.77 0.00 0.00 66.41 67.04 1z09 h THR 39 Cb 0.34 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 1z09 h THR 39 CO 0.01 0.01 -1.26 0.74 0.37 0.00 0.00 175.52 175.39 1z09 h THR 40 N 0.06 1.48 -0.54 3.16 2.02 -1.57 -1.51 112.91 116.01 1z09 h THR 40 Ca 0.21 -3.05 0.03 0.00 0.77 0.00 0.00 66.41 64.37 1z09 h THR 40 Cb 0.31 2.94 -0.04 0.00 -1.74 0.00 0.00 68.15 69.62 1z09 h THR 40 CO -0.39 0.89 0.31 1.56 0.37 0.00 0.00 175.52 178.26 1z09 h GLN 41 N 0.08 0.59 0.18 6.66 4.20 -1.19 -1.60 115.11 124.03 1z09 h GLN 41 Ca -0.14 -0.04 -0.33 0.00 0.06 0.00 0.00 58.65 58.20 1z09 h GLN 41 Cb 1.98 -0.13 0.01 0.00 0.30 0.00 0.00 27.48 29.64 1z09 h GLN 41 CO 0.20 0.39 -1.63 1.88 -0.67 0.00 0.00 178.83 179.00 1z09 h TYR 42 N 0.61 0.69 -0.09 2.96 -1.99 -1.55 -3.15 116.97 114.45 1z09 h TYR 42 Ca 0.22 -0.51 0.04 0.00 2.00 0.00 0.00 58.73 60.49 1z09 h TYR 42 Cb 0.06 -0.03 -0.06 0.00 2.00 0.00 0.00 36.73 38.70 1z09 h TYR 42 CO -0.07 1.64 -0.33 0.00 -0.00 0.00 0.00 178.16 179.40 1z09 h ALA 43 N 0.08 -0.42 -0.69 3.88 0.00 -1.17 0.61 119.26 121.55 1z09 h ALA 43 Ca -0.32 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1z09 h ALA 43 Cb 2.03 0.61 -0.03 0.00 0.00 0.00 0.00 17.79 20.40 1z09 h ALA 43 CO 0.17 -0.82 0.31 0.77 0.00 0.00 0.00 179.25 179.67 1z09 h SER 44 N -0.43 0.93 -0.13 0.00 0.02 -1.46 0.14 113.55 112.64 1z09 h SER 44 Ca 0.08 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.85 1z09 h SER 44 Cb 0.56 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 1z09 h SER 44 CO -0.33 0.83 -0.03 0.25 -1.14 0.00 0.00 176.83 176.41 1z09 h LEU 45 N 0.98 0.25 -0.74 5.07 6.46 -1.33 -2.88 115.31 123.11 1z09 h LEU 45 Ca 0.23 -0.37 -0.08 0.00 -0.12 0.00 0.00 57.88 57.55 1z09 h LEU 45 Cb 0.16 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.00 1z09 h LEU 45 CO -0.02 0.56 0.10 0.24 -0.62 0.00 0.00 178.44 178.69 1z09 h MET 46 N -0.07 1.06 0.09 1.25 2.86 0.28 -2.92 114.93 117.48 1z09 h MET 46 Ca 0.03 -0.28 0.02 0.00 -2.06 0.00 0.00 59.70 57.42 1z09 h MET 46 Cb 0.45 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 31.94 1z09 h MET 46 CO 0.01 0.98 -0.39 1.25 1.06 0.00 0.00 176.91 179.82 1z09 h HIS 47 N 0.99 -1.09 -0.38 -0.22 -0.00 -0.65 0.10 115.15 113.91 1z09 h HIS 47 Ca 0.20 0.03 0.08 0.00 -0.00 0.00 0.00 60.37 60.67 1z09 h HIS 47 Cb 0.44 0.47 -0.08 0.00 -0.00 0.00 0.00 27.41 28.24 1z09 h HIS 47 CO 0.03 -0.49 -0.14 0.77 -0.00 0.00 0.00 177.93 178.10 1z09 h SER 48 N -0.60 -0.49 -0.34 3.26 0.02 -1.45 -1.89 113.55 112.07 1z09 h SER 48 Ca 0.03 0.13 0.01 0.00 -0.84 0.00 0.00 61.79 61.12 1z09 h SER 48 Cb 0.65 0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 1z09 h SER 48 CO -0.25 -0.17 0.21 0.15 -1.14 0.00 0.00 176.83 175.63 1z09 h PHE 49 N -0.06 0.40 -0.27 3.45 3.04 -1.22 -1.40 116.94 120.88 1z09 h PHE 49 Ca 0.19 0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.18 1z09 h PHE 49 Cb 0.35 -0.13 -0.03 0.00 2.56 0.00 0.00 35.95 38.69 1z09 h PHE 49 CO -0.38 0.24 0.05 0.82 -2.02 0.00 0.00 178.31 177.03 1z09 h ILE 50 N 0.43 0.88 -0.89 1.41 2.04 -0.29 -0.28 117.51 120.81 1z09 h ILE 50 Ca 0.13 -0.05 0.08 0.00 1.00 0.00 0.00 64.86 66.01 1z09 h ILE 50 Cb -0.03 0.71 -0.07 0.00 -0.74 0.00 0.00 36.82 36.69 1z09 h ILE 50 CO -0.04 0.03 0.55 0.25 0.00 0.00 0.00 178.15 178.93 1z09 h LEU 51 N 0.15 0.84 -0.26 1.44 7.12 -1.10 -0.23 115.31 123.29 1z09 h LEU 51 Ca 0.12 0.03 -0.01 0.00 0.13 0.00 0.00 57.88 58.15 1z09 h LEU 51 Cb 0.13 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 40.10 1z09 h LEU 51 CO -0.16 0.51 0.13 0.11 -0.13 0.00 0.00 178.44 178.90 1z09 h LYS 52 N 0.96 0.37 0.31 1.25 1.57 -0.06 0.13 116.57 121.10 1z09 h LYS 52 Ca 0.40 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1z09 h LYS 52 Cb 0.25 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1z09 h LYS 52 CO -0.20 0.36 -0.24 0.00 -0.57 0.00 0.00 179.45 178.80 1z09 h ALA 53 N 0.99 -0.54 -0.71 3.86 0.00 -0.37 1.09 119.26 123.57 1z09 h ALA 53 Ca 0.09 -0.09 0.12 0.00 0.00 0.00 0.00 54.91 55.03 1z09 h ALA 53 Cb 0.11 0.32 -0.08 0.00 0.00 0.00 0.00 17.79 18.13 1z09 h ALA 53 CO -0.01 -0.82 0.30 -0.09 0.00 0.00 0.00 179.25 178.62 1z09 h ARG 54 N -0.55 0.46 0.54 0.00 2.43 -0.88 2.00 114.38 118.37 1z09 h ARG 54 Ca -0.02 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1z09 h ARG 54 Cb 0.48 -0.10 0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1z09 h ARG 54 CO -0.01 0.30 -0.26 0.77 -1.51 0.00 0.00 179.97 179.27 1z09 h SER 55 N 0.47 -0.61 -0.51 -3.80 0.02 0.13 0.87 113.55 110.12 1z09 h SER 55 Ca 0.38 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.37 1z09 h SER 55 Cb 0.52 0.16 -0.05 0.00 0.14 0.00 0.00 62.40 63.17 1z09 h SER 55 CO -0.35 -0.39 0.24 0.74 -1.14 0.00 0.00 176.83 175.93 1z09 h THR 56 N -0.79 0.92 -0.12 -2.27 2.02 0.23 -0.99 112.91 111.92 1z09 h THR 56 Ca -0.07 -0.16 0.03 0.00 0.77 0.00 0.00 66.41 66.98 1z09 h THR 56 Cb 0.58 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 1z09 h THR 56 CO 0.12 0.09 -0.08 0.58 0.37 0.00 0.00 175.52 176.60 1z09 h VAL 57 N 0.47 0.76 0.00 3.16 2.07 0.34 -2.09 116.25 120.95 1z09 h VAL 57 Ca 0.23 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.72 1z09 h VAL 57 Cb 0.17 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1z09 h VAL 57 CO -0.18 0.00 -0.13 0.03 0.02 0.00 0.00 177.57 177.31 1z09 h ARG 58 N -0.08 0.00 -0.98 1.57 3.08 -0.47 -3.07 114.38 114.43 1z09 h ARG 58 Ca 0.08 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.19 1z09 h ARG 58 Cb 0.19 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.17 1z09 h ARG 58 CO -0.17 0.13 0.63 0.22 -1.07 0.00 0.00 179.97 179.70 1z09 h ASP 59 N 0.00 1.00 0.70 7.04 3.58 -0.45 -1.13 116.42 127.16 1z09 h ASP 59 Ca -0.00 0.01 -0.15 0.00 0.42 0.00 0.00 57.03 57.31 1z09 h ASP 59 Cb 0.62 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.45 1z09 h ASP 59 CO 0.02 0.64 -0.70 0.40 -2.88 0.00 0.00 179.24 176.71 1z09 h ILE 60 N 1.14 1.51 -2.12 2.25 2.04 -1.58 -3.44 117.51 117.30 1z09 h ILE 60 Ca 0.42 -2.41 0.03 0.00 1.00 0.00 0.00 64.86 63.91 1z09 h ILE 60 Cb 0.18 2.30 -0.22 0.00 -0.74 0.00 0.00 36.82 38.34 1z09 h ILE 60 CO -0.18 0.69 -0.17 -0.62 0.00 0.00 0.00 178.15 177.87 1z09 s ASP 61 N -6.82 -0.93 0.45 1.72 2.15 -0.44 -5.03 116.67 107.77 1z09 s ASP 61 Ca -0.01 1.44 0.25 0.00 0.43 0.00 0.00 52.55 54.66 1z09 s ASP 61 Cb 0.12 2.00 0.90 0.00 -0.30 0.00 0.00 42.92 45.64 1z09 s ASP 61 CO 0.78 -0.22 1.81 1.55 -0.17 0.00 0.00 175.17 178.91 1z09 h PRO 62 N 7.94 0.00 -0.47 4.34 0.13 -1.82 -3.13 132.00 138.98 1z09 h PRO 62 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1z09 h PRO 62 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1z09 h PRO 62 CO 0.11 0.17 0.00 1.04 -0.23 0.00 0.00 178.00 179.09 1z09 n GLN 63 N -3.28 2.14 -3.56 0.86 6.02 -1.26 -4.92 117.38 113.38 1z09 n GLN 63 Ca 0.01 -1.77 -0.23 0.00 -0.01 0.00 0.00 57.00 55.00 1z09 n GLN 63 Cb 0.43 -1.40 0.00 0.00 1.02 0.00 0.00 30.24 30.30 1z09 n GLN 63 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1z09 s ASN 64 N -1.07 4.89 0.09 1.08 6.03 -1.18 -5.14 114.94 119.63 1z09 s ASN 64 Ca 0.34 -0.99 -0.26 0.00 -1.03 0.00 0.00 52.86 50.92 1z09 s ASN 64 Cb 0.18 0.09 0.08 0.00 -3.03 0.00 0.00 41.25 38.57 1z09 s ASN 64 CO 0.23 -1.03 0.80 -1.81 -2.03 0.00 0.00 177.10 173.26 1z09 s ASP 65 N -4.34 -0.39 -0.08 3.54 1.01 -1.26 -4.81 116.67 110.34 1z09 s ASP 65 Ca 0.45 -0.10 -0.26 0.00 0.71 0.00 0.00 52.55 53.36 1z09 s ASP 65 Cb -0.04 0.49 -0.03 0.00 1.01 0.00 0.00 42.92 44.35 1z09 s ASP 65 CO 0.28 -0.82 0.81 -0.22 0.21 0.00 0.00 175.17 175.43 1z09 s LEU 66 N -2.66 4.29 -0.03 1.23 0.20 -1.26 -4.94 118.68 115.51 1z09 s LEU 66 Ca 0.05 1.31 0.20 0.00 0.69 0.00 0.00 54.13 56.38 1z09 s LEU 66 Cb -0.01 -3.26 -0.23 0.00 -0.43 0.00 0.00 46.19 42.26 1z09 s LEU 66 CO -0.07 -0.23 0.51 0.41 -0.29 0.00 0.00 176.35 176.67 1z09 n THR 67 N 4.08 0.73 -3.20 3.68 -1.04 -1.26 -4.81 114.28 112.46 1z09 n THR 67 Ca 0.02 -0.65 0.04 0.00 -2.04 0.00 0.00 64.05 61.42 1z09 n THR 67 Cb 0.51 -0.34 -0.03 0.00 -1.82 0.00 0.00 70.33 68.64 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 -3.08 -0.23 0.37 -1.42 5.36 -1.26 -4.58 117.98 113.15 1z09 s PHE 68 Ca -0.07 0.33 -0.05 0.00 -0.96 0.00 0.00 56.93 56.18 1z09 s PHE 68 Cb 0.10 0.11 -0.05 0.00 -0.34 0.00 0.00 43.02 42.84 1z09 s PHE 68 CO 0.85 -0.12 0.66 -1.17 -1.46 0.00 0.00 175.22 173.98 1z09 s LEU 69 N 2.46 3.90 -0.29 6.12 1.98 -0.44 -4.94 118.68 127.47 1z09 s LEU 69 Ca -0.03 0.82 0.03 0.00 -2.89 0.00 0.00 54.13 52.06 1z09 s LEU 69 Cb -0.05 -3.69 0.18 0.00 0.66 0.00 0.00 46.19 43.29 1z09 s LEU 69 CO -0.13 -0.35 0.48 -0.60 -1.89 0.00 0.00 176.35 173.86 1z09 s ARG 70 N -4.02 0.47 -0.19 1.98 3.52 -1.26 -1.35 118.95 118.10 1z09 s ARG 70 Ca 0.46 0.33 -0.17 0.00 -0.13 0.00 0.00 55.73 56.22 1z09 s ARG 70 Cb -0.10 -0.07 -0.04 0.00 -1.56 0.00 0.00 34.95 33.18 1z09 s ARG 70 CO 0.35 -1.02 0.44 0.42 -0.81 0.00 0.00 175.30 174.68 1z09 s ILE 71 N 2.66 5.18 0.30 4.11 1.01 -1.15 -5.03 121.20 128.28 1z09 s ILE 71 Ca 0.10 0.80 -0.15 0.00 0.00 0.00 0.00 60.65 61.40 1z09 s ILE 71 Cb -0.12 -3.77 -0.09 0.00 0.01 0.00 0.00 42.46 38.50 1z09 s ILE 71 CO -0.28 0.24 0.72 -0.60 0.00 0.00 0.00 174.94 175.02 1z09 s ARG 72 N 1.29 4.01 -0.07 2.79 3.52 -1.26 -3.39 118.95 125.85 1z09 s ARG 72 Ca 0.21 0.66 -0.12 0.00 -0.13 0.00 0.00 55.73 56.35 1z09 s ARG 72 Cb -0.15 -2.51 0.02 0.00 -1.56 0.00 0.00 34.95 30.76 1z09 s ARG 72 CO 0.09 0.20 0.29 -1.12 -0.81 0.00 0.00 175.30 173.95 1z09 s SER 73 N -2.20 -0.24 0.21 -2.12 0.01 -0.07 -4.97 113.70 104.31 1z09 s SER 73 Ca 0.52 0.37 -0.09 0.00 1.31 0.00 0.00 55.95 58.05 1z09 s SER 73 Cb -0.11 0.48 0.23 0.00 0.21 0.00 0.00 66.02 66.83 1z09 s SER 73 CO 0.18 -0.24 1.82 0.50 0.41 0.00 0.00 173.24 175.92 1z09 h LYS 74 N 4.97 0.74 0.00 12.44 1.63 -2.05 -2.31 116.57 131.99 1z09 h LYS 74 Ca -0.28 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.48 1z09 h LYS 74 Cb 1.19 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 32.65 1z09 h LYS 74 CO 0.35 0.49 -0.33 1.17 -3.45 0.00 0.00 179.45 177.68 1z09 n LYS 75 N -4.74 0.17 -2.59 1.90 4.81 -1.26 -4.67 118.16 111.79 1z09 n LYS 75 Ca 0.08 0.09 0.01 0.00 -0.87 0.00 0.00 58.31 57.62 1z09 n LYS 75 Cb 0.15 -1.64 0.00 0.00 0.02 0.00 0.00 35.03 33.56 1z09 n LYS 75 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 1z09 n ASN 76 N -1.92 -0.43 -3.26 3.14 0.23 -0.87 -4.31 115.26 107.84 1z09 n ASN 76 Ca 0.05 -1.10 -0.05 0.00 -0.53 0.00 0.00 54.58 52.95 1z09 n ASN 76 Cb 0.40 0.67 -0.04 0.00 -2.08 0.00 0.00 39.78 38.72 1z09 n ASN 76 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1z09 s GLU 77 N -2.01 0.45 -0.23 -3.83 2.12 -1.21 -0.90 118.70 113.09 1z09 s GLU 77 Ca 0.11 0.26 -0.15 0.00 0.36 0.00 0.00 54.97 55.55 1z09 s GLU 77 Cb -0.00 -0.16 -0.04 0.00 0.26 0.00 0.00 34.13 34.19 1z09 s GLU 77 CO -0.00 -1.02 0.39 0.42 -0.54 0.00 0.00 175.26 174.51 1z09 s ILE 78 N 2.62 5.18 0.09 -3.70 1.01 -1.22 -1.93 121.20 123.26 1z09 s ILE 78 Ca 0.10 0.65 -0.02 0.00 0.00 0.00 0.00 60.65 61.38 1z09 s ILE 78 Cb -0.12 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.59 1z09 s ILE 78 CO -0.28 0.20 0.27 -0.04 0.00 0.00 0.00 174.94 175.09 1z09 s MET 79 N 1.68 3.51 -0.24 2.79 -1.94 -0.25 -2.93 119.30 121.92 1z09 s MET 79 Ca 0.17 -0.30 -0.04 0.00 -1.71 0.00 0.00 55.69 53.81 1z09 s MET 79 Cb -0.15 -2.98 0.08 0.00 2.01 0.00 0.00 34.83 33.80 1z09 s MET 79 CO 0.09 0.56 0.11 0.08 -0.01 0.00 0.00 175.02 175.85 1z09 s VAL 80 N -1.55 -0.08 -0.50 -6.03 1.01 -0.45 0.23 120.40 113.03 1z09 s VAL 80 Ca 0.37 -0.49 -0.19 0.00 0.00 0.00 0.00 61.98 61.66 1z09 s VAL 80 Cb -0.13 -0.80 0.05 0.00 0.00 0.00 0.00 36.38 35.51 1z09 s VAL 80 CO 0.26 -0.53 0.63 0.00 0.00 0.00 0.00 175.10 175.47 1z09 s ALA 81 N 2.12 3.37 0.32 5.51 0.00 -1.22 -1.33 121.76 130.54 1z09 s ALA 81 Ca 0.06 -1.65 0.02 0.00 0.00 0.00 0.00 51.96 50.40 1z09 s ALA 81 Cb -0.16 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 1z09 s ALA 81 CO -0.24 -1.98 0.50 -1.25 0.00 0.00 0.00 175.76 172.79 1z09 s PRO 82 N 2.68 3.39 -0.40 0.00 0.04 -1.26 -3.71 135.00 135.73 1z09 s PRO 82 Ca 0.16 -0.55 -0.11 0.00 0.04 0.00 0.00 61.00 60.54 1z09 s PRO 82 Cb -0.18 -2.74 0.01 0.00 0.04 0.00 0.00 34.50 31.63 1z09 s PRO 82 CO 0.13 0.18 0.51 -3.47 0.04 0.00 0.00 177.00 174.39 1z09 n ASP 83 N -1.69 -6.90 -2.60 6.66 2.03 -1.01 -4.83 116.55 108.21 1z09 n ASP 83 Ca -0.05 0.35 -0.05 0.00 0.52 0.00 0.00 54.79 55.56 1z09 n ASP 83 Cb 0.57 -4.62 0.04 0.00 -0.72 0.00 0.00 41.12 36.39 1z09 n ASP 83 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1z09 n LYS 84 N -0.59 0.61 -1.91 -0.67 4.81 -1.26 -4.87 118.16 114.28 1z09 n LYS 84 Ca 0.08 -1.09 -0.20 0.00 -0.87 0.00 0.00 58.31 56.22 1z09 n LYS 84 Cb 0.40 0.01 -0.06 0.00 0.02 0.00 0.00 35.03 35.41 1z09 n LYS 84 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1z09 n ASP 85 N -0.58 -5.59 -1.73 3.14 8.00 -1.26 -4.87 116.55 113.66 1z09 n ASP 85 Ca -0.16 0.29 -0.01 0.00 0.71 0.00 0.00 54.79 55.62 1z09 n ASP 85 Cb 0.73 -4.76 0.01 0.00 -0.02 0.00 0.00 41.12 37.07 1z09 n ASP 85 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1z09 n TYR 86 N -3.07 -0.71 -3.18 1.24 4.01 -1.26 -4.82 117.16 109.37 1z09 n TYR 86 Ca -0.22 -0.36 0.02 0.00 -0.16 0.00 0.00 57.90 57.18 1z09 n TYR 86 Cb 0.67 0.17 -0.02 0.00 -0.31 0.00 0.00 39.34 39.86 1z09 n TYR 86 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1z09 s PHE 87 N -4.47 -1.58 0.09 -0.72 0.40 -0.64 -2.40 117.98 108.67 1z09 s PHE 87 Ca 0.07 1.39 -0.02 0.00 -0.60 0.00 0.00 56.93 57.78 1z09 s PHE 87 Cb -0.01 0.41 -0.04 0.00 0.51 0.00 0.00 43.02 43.90 1z09 s PHE 87 CO 0.01 -0.93 0.04 -0.48 0.70 0.00 0.00 175.22 174.56 1z09 s LEU 88 N 2.81 2.04 -0.18 -0.37 2.34 -1.24 -1.15 118.68 122.93 1z09 s LEU 88 Ca 0.17 -1.06 -0.00 0.00 0.06 0.00 0.00 54.13 53.29 1z09 s LEU 88 Cb -0.14 0.34 0.00 0.00 -0.56 0.00 0.00 46.19 45.84 1z09 s LEU 88 CO -0.22 -0.68 -0.14 -0.63 -1.06 0.00 0.00 176.35 173.62 1z09 s ILE 89 N -3.97 2.64 -0.36 1.48 1.01 -1.02 -3.39 121.20 117.59 1z09 s ILE 89 Ca 0.15 -0.76 -0.09 0.00 0.00 0.00 0.00 60.65 59.95 1z09 s ILE 89 Cb 0.07 -2.14 0.04 0.00 0.01 0.00 0.00 42.46 40.45 1z09 s ILE 89 CO -0.05 0.50 0.16 -0.69 0.00 0.00 0.00 174.94 174.87 1z09 s VAL 90 N 1.11 4.18 -0.32 2.92 1.01 0.14 -2.05 120.40 127.37 1z09 s VAL 90 Ca 0.00 -1.04 -0.25 0.00 0.00 0.00 0.00 61.98 60.70 1z09 s VAL 90 Cb -0.14 -3.37 0.01 0.00 0.00 0.00 0.00 36.38 32.87 1z09 s VAL 90 CO -0.05 -0.23 0.85 -0.63 0.00 0.00 0.00 175.10 175.04 1z09 s ILE 91 N 1.47 4.72 -0.01 2.22 1.09 0.22 -1.09 121.20 129.82 1z09 s ILE 91 Ca 0.00 1.25 -0.03 0.00 -1.10 0.00 0.00 60.65 60.77 1z09 s ILE 91 Cb -0.20 -4.22 -0.04 0.00 -1.06 0.00 0.00 42.46 36.94 1z09 s ILE 91 CO 0.05 -0.34 0.19 -1.10 -0.10 0.00 0.00 174.94 173.64 1z09 s GLN 92 N 3.14 3.46 0.56 2.79 -0.21 -0.81 0.11 119.66 128.70 1z09 s GLN 92 Ca 0.35 -0.28 -0.21 0.00 0.02 0.00 0.00 55.36 55.24 1z09 s GLN 92 Cb -0.13 -3.09 -0.04 0.00 1.00 0.00 0.00 33.01 30.74 1z09 s GLN 92 CO 0.14 0.67 1.36 0.09 -2.12 0.00 0.00 175.29 175.43 1z09 n ASN 93 N 0.98 2.65 -3.43 5.90 3.02 0.59 -3.35 115.26 121.62 1z09 n ASN 93 Ca -0.11 0.96 -0.24 0.00 -0.03 0.00 0.00 54.58 55.16 1z09 n ASN 93 Cb 0.53 -1.58 0.19 0.00 -0.61 0.00 0.00 39.78 38.31 1z09 n ASN 93 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1z09 n PRO 94 N -1.11 -2.10 -0.91 3.52 -0.04 -1.26 -4.71 135.00 128.41 1z09 n PRO 94 Ca 0.11 -1.52 -0.01 0.00 -0.04 0.00 0.00 63.50 62.04 1z09 n PRO 94 Cb 0.45 -1.25 -0.01 0.00 -0.04 0.00 0.00 33.50 32.65 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 -4.07 0.00 -0.36 0.52 -2.24 -1.26 -5.04 114.28 101.83 1z09 n THR 95 Ca 0.13 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1z09 n THR 95 Cb 0.48 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.22 1z09 n THR 95 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88