#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p09 h ASP 6 N 0.00 0.56 -0.65 1.67 3.32 -2.01 -2.21 116.42 117.11 2p09 h ASP 6 Ca 0.00 -0.20 0.04 0.00 0.02 0.00 0.00 57.03 56.89 2p09 h ASP 6 Cb 0.00 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 2p09 h ASP 6 CO 0.00 0.82 0.43 0.44 -1.72 0.00 0.00 179.24 179.21 2p09 h ASP 7 N 0.48 0.63 -0.00 6.45 3.45 -1.95 -1.65 116.42 123.83 2p09 h ASP 7 Ca 0.07 -0.00 -0.08 0.00 0.43 0.00 0.00 57.03 57.44 2p09 h ASP 7 Cb 0.72 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 39.34 2p09 h ASP 7 CO 0.06 0.43 -0.23 0.44 -1.57 0.00 0.00 179.24 178.37 2p09 h ASP 8 N 0.73 0.38 -0.59 6.45 3.45 -1.81 -0.42 116.42 124.61 2p09 h ASP 8 Ca 0.27 -0.12 -0.01 0.00 0.43 0.00 0.00 57.03 57.60 2p09 h ASP 8 Cb 0.14 -0.10 -0.03 0.00 -0.56 0.00 0.00 39.33 38.78 2p09 h ASP 8 CO -0.08 0.62 0.32 0.11 -1.57 0.00 0.00 179.24 178.64 2p09 h LYS 9 N 0.35 0.82 0.13 3.56 1.57 -1.03 -0.12 116.57 121.86 2p09 h LYS 9 Ca 0.06 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2p09 h LYS 9 Cb 0.59 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2p09 h LYS 9 CO 0.04 0.63 -0.06 -0.22 -0.57 0.00 0.00 179.45 179.27 2p09 h LYS 10 N 0.80 -0.17 -0.54 3.15 1.63 -1.05 -1.67 116.57 118.71 2p09 h LYS 10 Ca 0.21 0.01 0.05 0.00 -0.85 0.00 0.00 60.65 60.07 2p09 h LYS 10 Cb 0.05 0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 31.67 2p09 h LYS 10 CO -0.03 0.09 0.27 1.15 -3.45 0.00 0.00 179.45 177.48 2p09 h THR 11 N -0.43 0.94 -0.78 1.00 2.02 -1.00 -0.11 112.91 114.55 2p09 h THR 11 Ca -0.02 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 2p09 h THR 11 Cb 0.35 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 2p09 h THR 11 CO 0.03 0.09 0.42 0.78 0.37 0.00 0.00 175.52 177.22 2p09 h ASN 12 N 0.52 0.97 -0.36 4.18 2.35 -1.01 -0.48 115.58 121.74 2p09 h ASN 12 Ca 0.24 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.87 2p09 h ASN 12 Cb 0.16 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 2p09 h ASN 12 CO -0.17 0.78 0.10 -0.50 -1.65 0.00 0.00 177.43 175.98 2p09 h TRP 13 N 1.09 0.61 -0.68 1.19 -0.00 -0.53 -1.91 115.95 115.70 2p09 h TRP 13 Ca 0.27 -0.07 -0.03 0.00 -0.00 0.00 0.00 58.89 59.06 2p09 h TRP 13 Cb 0.03 -0.17 -0.03 0.00 -0.00 0.00 0.00 29.16 28.99 2p09 h TRP 13 CO 0.01 0.60 0.29 -0.07 -0.00 0.00 0.00 178.44 179.26 2p09 h LEU 14 N 0.44 0.91 -0.66 -4.49 3.38 -0.42 0.20 115.31 114.67 2p09 h LEU 14 Ca 0.12 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2p09 h LEU 14 Cb 0.29 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2p09 h LEU 14 CO -0.00 0.80 0.43 0.11 0.09 0.00 0.00 178.44 179.87 2p09 h LYS 15 N 0.98 0.87 0.01 1.13 1.57 -1.02 -0.72 116.57 119.38 2p09 h LYS 15 Ca 0.23 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2p09 h LYS 15 Cb 0.16 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2p09 h LYS 15 CO -0.02 0.58 -0.00 -0.09 -0.57 0.00 0.00 179.45 179.34 2p09 h ARG 16 N 0.89 -0.01 -0.71 3.15 2.43 -0.77 -1.17 114.38 118.18 2p09 h ARG 16 Ca 0.24 0.00 0.08 0.00 -0.81 0.00 0.00 59.98 59.49 2p09 h ARG 16 Cb -0.10 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.39 2p09 h ARG 16 CO -0.05 0.23 0.38 0.82 -1.51 0.00 0.00 179.97 179.84 2p09 h ILE 17 N -0.25 0.91 -0.66 1.20 2.04 -0.49 -0.33 117.51 119.92 2p09 h ILE 17 Ca -0.00 -0.23 -0.08 0.00 1.00 0.00 0.00 64.86 65.55 2p09 h ILE 17 Cb 0.25 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.48 2p09 h ILE 17 CO 0.00 0.12 0.09 0.22 0.00 0.00 0.00 178.15 178.59 2p09 h TYR 18 N 0.67 1.18 -0.20 1.37 3.20 -1.03 -3.18 116.97 118.97 2p09 h TYR 18 Ca 0.34 -0.17 -0.10 0.00 3.14 0.00 0.00 58.73 61.94 2p09 h TYR 18 Cb 0.29 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.24 2p09 h TYR 18 CO -0.09 0.99 -0.26 -0.09 -1.64 0.00 0.00 178.16 177.07 2p09 h ARG 19 N 1.03 0.53 0.00 1.82 2.43 -0.34 -3.35 114.38 116.50 2p09 h ARG 19 Ca 0.20 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2p09 h ARG 19 Cb 0.46 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 2p09 h ARG 19 CO 0.02 0.90 -0.31 1.33 -1.51 0.00 0.00 179.97 180.39 2p09 n VAL 20 N -4.38 0.13 -3.89 0.20 0.24 -0.22 -4.53 118.33 105.89 2p09 n VAL 20 Ca -0.06 -0.08 -0.30 0.00 -2.04 0.00 0.00 64.34 61.86 2p09 n VAL 20 Cb 0.45 -0.15 -0.15 0.00 -1.47 0.00 0.00 33.84 32.52 2p09 n VAL 20 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2p09 s ARG 21 N -3.04 1.19 1.05 7.34 0.52 -1.21 -5.11 118.95 119.69 2p09 s ARG 21 Ca 0.11 -1.60 -0.16 0.00 -0.52 0.00 0.00 55.73 53.56 2p09 s ARG 21 Cb 0.17 -2.69 0.22 0.00 0.52 0.00 0.00 34.95 33.17 2p09 s ARG 21 CO 0.64 -0.98 1.18 -1.25 0.02 0.00 0.00 175.30 174.91 2p09 s PRO 22 N 1.10 0.01 -0.00 3.54 0.04 -1.26 -4.68 135.00 133.74 2p09 s PRO 22 Ca 0.11 -0.04 -0.40 0.00 0.04 0.00 0.00 61.00 60.71 2p09 s PRO 22 Cb -0.19 -1.74 -0.20 0.00 0.04 0.00 0.00 34.50 32.41 2p09 s PRO 22 CO -0.14 -2.90 1.07 0.00 0.04 0.00 0.00 177.00 175.07 2p09 h VAL 24 N 2.99 0.00 0.00 0.00 -1.51 -1.61 -0.14 116.25 115.99 2p09 h VAL 24 Ca -0.51 -0.30 -0.07 0.00 -1.23 0.00 0.00 66.70 64.60 2p09 h VAL 24 Cb 1.42 1.16 -0.01 0.00 -2.13 0.00 0.00 31.29 31.73 2p09 h VAL 24 CO 0.65 0.00 -0.91 1.17 -1.23 0.00 0.00 177.57 177.24 2p09 n LYS 25 N -2.73 0.50 0.05 5.19 3.00 -1.26 -4.59 118.16 118.32 2p09 n LYS 25 Ca 0.00 0.42 0.12 0.00 -0.00 0.00 0.00 58.31 58.86 2p09 n LYS 25 Cb 0.22 -1.61 0.13 0.00 0.00 0.00 0.00 35.03 33.76 2p09 n LYS 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2p09 n LYS 27 N -2.07 -0.84 0.00 0.00 4.76 -0.06 -4.73 118.16 115.22 2p09 n LYS 27 Ca 0.03 0.21 0.00 0.00 -2.87 0.00 0.00 58.31 55.68 2p09 n LYS 27 Cb 0.44 -3.91 0.00 0.00 -1.84 0.00 0.00 35.03 29.71 2p09 n LYS 27 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2p09 n VAL 28 N -2.43 0.00 -2.26 -0.18 0.24 -1.26 -4.82 118.33 107.62 2p09 n VAL 28 Ca 0.00 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 61.96 2p09 n VAL 28 Cb 0.21 -0.89 -0.01 0.00 -1.47 0.00 0.00 33.84 31.68 2p09 n VAL 28 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2p09 s ALA 29 N -1.90 2.76 0.72 2.33 0.00 -1.26 -4.74 121.76 119.67 2p09 s ALA 29 Ca 0.00 0.56 -0.13 0.00 0.00 0.00 0.00 51.96 52.39 2p09 s ALA 29 Cb 0.00 -3.27 0.03 0.00 0.00 0.00 0.00 23.12 19.88 2p09 s ALA 29 CO 0.00 -0.64 1.11 -1.25 0.00 0.00 0.00 175.76 174.98 2p09 s PRO 30 N -3.61 2.48 0.55 0.00 0.04 -1.26 0.16 135.00 133.36 2p09 s PRO 30 Ca 0.67 1.33 -0.18 0.00 0.04 0.00 0.00 61.00 62.86 2p09 s PRO 30 Cb -0.18 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 2p09 s PRO 30 CO 0.29 -1.49 1.07 1.03 0.04 0.00 0.00 177.00 177.94 2p09 s ARG 31 N -4.42 3.45 0.82 4.56 0.52 -1.26 -4.03 118.95 118.60 2p09 s ARG 31 Ca 0.65 1.35 -0.11 0.00 -0.52 0.00 0.00 55.73 57.10 2p09 s ARG 31 Cb -0.20 -2.04 0.09 0.00 0.52 0.00 0.00 34.95 33.32 2p09 s ARG 31 CO 0.48 -0.72 1.09 0.34 0.02 0.00 0.00 175.30 176.51 2p09 s ASP 32 N -2.30 4.11 0.22 0.23 2.15 -0.27 -4.85 116.67 115.95 2p09 s ASP 32 Ca 0.67 1.63 -0.22 0.00 0.43 0.00 0.00 52.55 55.06 2p09 s ASP 32 Cb -0.18 -2.34 0.04 0.00 -0.30 0.00 0.00 42.92 40.15 2p09 s ASP 32 CO 0.29 -2.26 0.73 -1.66 -0.17 0.00 0.00 175.17 172.10 2p09 s TRP 33 N -2.94 -0.28 0.17 -5.34 1.48 -1.26 -0.95 118.94 109.82 2p09 s TRP 33 Ca 0.62 -0.08 -0.15 0.00 -1.06 0.00 0.00 56.10 55.43 2p09 s TRP 33 Cb -0.17 0.65 0.02 0.00 -1.16 0.00 0.00 33.47 32.81 2p09 s TRP 33 CO 0.56 -1.05 0.42 -1.59 -4.06 0.00 0.00 176.95 171.23 2p09 s LYS 34 N -3.75 1.23 -0.09 3.25 -2.85 -0.36 -4.97 119.74 112.20 2p09 s LYS 34 Ca 0.08 -0.92 -0.17 0.00 -1.00 0.00 0.00 55.97 53.96 2p09 s LYS 34 Cb -0.04 0.46 -0.05 0.00 -2.06 0.00 0.00 37.83 36.15 2p09 s LYS 34 CO 0.00 -0.49 0.44 0.08 0.10 0.00 0.00 175.35 175.48 2p09 s VAL 35 N -3.88 5.16 -0.46 1.79 1.01 -1.26 -0.67 120.40 122.08 2p09 s VAL 35 Ca 0.10 0.88 0.03 0.00 0.00 0.00 0.00 61.98 62.99 2p09 s VAL 35 Cb 0.01 -3.77 0.15 0.00 0.00 0.00 0.00 36.38 32.77 2p09 s VAL 35 CO -0.04 0.40 0.29 -0.75 0.00 0.00 0.00 175.10 175.00 2p09 s LYS 36 N 0.19 1.31 6.54 2.72 2.47 0.76 -4.94 119.74 128.79 2p09 s LYS 36 Ca 0.24 -2.16 0.00 0.00 -1.56 0.00 0.00 55.97 52.49 2p09 s LYS 36 Cb -0.15 -2.21 0.00 0.00 -1.46 0.00 0.00 37.83 34.01 2p09 s LYS 36 CO 0.10 -1.23 0.00 0.27 0.16 0.00 0.00 175.35 174.65 2p09 n ASN 37 N 3.22 0.00 -1.18 1.43 0.23 -1.26 -0.67 115.26 117.04 2p09 n ASN 37 Ca 0.15 0.00 0.09 0.00 -0.53 0.00 0.00 54.58 54.29 2p09 n ASN 37 Cb 0.37 0.00 0.27 0.00 -2.08 0.00 0.00 39.78 38.35 2p09 n ASN 37 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2p09 n LYS 38 N 3.76 2.66 -4.44 -3.83 4.01 -1.26 -4.93 118.16 114.14 2p09 n LYS 38 Ca 0.00 -2.18 -0.30 0.00 -0.51 0.00 0.00 58.31 55.32 2p09 n LYS 38 Cb 0.00 -1.57 -0.12 0.00 -0.51 0.00 0.00 35.03 32.83 2p09 n LYS 38 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 2p09 s HIS 39 N -1.42 2.58 -0.27 2.13 3.76 0.16 -1.04 115.29 121.20 2p09 s HIS 39 Ca 0.40 -0.24 -0.12 0.00 -0.15 0.00 0.00 55.06 54.96 2p09 s HIS 39 Cb 0.23 -1.41 -0.05 0.00 1.11 0.00 0.00 32.58 32.46 2p09 s HIS 39 CO 0.24 0.34 0.22 -1.17 -0.85 0.00 0.00 174.74 173.52 2p09 s LEU 40 N -1.85 4.05 -0.32 0.89 2.96 0.51 -0.17 118.68 124.75 2p09 s LEU 40 Ca 0.17 0.08 -0.15 0.00 -0.22 0.00 0.00 54.13 54.01 2p09 s LEU 40 Cb -0.11 -2.18 -0.02 0.00 0.50 0.00 0.00 46.19 44.38 2p09 s LEU 40 CO 0.09 -0.05 0.38 -0.60 -1.32 0.00 0.00 176.35 174.84 2p09 s ARG 41 N 1.66 3.72 -0.37 1.98 3.52 0.16 -0.43 118.95 129.19 2p09 s ARG 41 Ca 0.09 -0.24 -0.13 0.00 -0.13 0.00 0.00 55.73 55.32 2p09 s ARG 41 Cb -0.15 -3.75 0.01 0.00 -1.56 0.00 0.00 34.95 29.49 2p09 s ARG 41 CO 0.09 -0.45 0.24 0.42 -0.81 0.00 0.00 175.30 174.80 2p09 s ILE 42 N 2.07 4.99 0.73 4.11 1.01 0.08 -1.22 121.20 132.98 2p09 s ILE 42 Ca 0.13 -0.59 -0.11 0.00 0.00 0.00 0.00 60.65 60.08 2p09 s ILE 42 Cb -0.16 -3.71 0.03 0.00 0.01 0.00 0.00 42.46 38.63 2p09 s ILE 42 CO 0.11 -0.18 1.07 -0.31 0.00 0.00 0.00 174.94 175.64 2p09 s TYR 43 N 1.65 3.01 0.14 3.97 2.02 -0.12 -1.12 117.35 126.90 2p09 s TYR 43 Ca 0.04 1.32 0.16 0.00 -0.37 0.00 0.00 57.07 58.22 2p09 s TYR 43 Cb -0.18 -2.97 0.46 0.00 -0.40 0.00 0.00 41.96 38.87 2p09 s TYR 43 CO 0.09 -1.43 1.64 -0.91 -1.57 0.00 0.00 175.55 173.36 2p09 h ASN 44 N -0.86 0.00 -2.36 2.29 2.35 -1.29 -3.40 115.58 112.32 2p09 h ASN 44 Ca -0.45 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 54.69 2p09 h ASN 44 Cb 1.23 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 39.46 2p09 h ASN 44 CO 0.58 0.49 -0.74 -0.04 -1.65 0.00 0.00 177.43 176.06 2p09 s MET 45 N -3.46 1.79 1.06 0.81 -1.94 -1.26 -1.49 119.30 114.81 2p09 s MET 45 Ca 0.00 -1.65 -0.13 0.00 -1.71 0.00 0.00 55.69 52.21 2p09 s MET 45 Cb 0.11 -1.87 0.22 0.00 2.01 0.00 0.00 34.83 35.30 2p09 s MET 45 CO 0.72 0.35 1.07 0.00 -0.01 0.00 0.00 175.02 177.15 2p09 h LYS 47 N -2.15 0.99 -0.29 0.00 1.63 -1.92 -1.50 116.57 113.33 2p09 h LYS 47 Ca -0.57 -0.32 -0.01 0.00 -0.85 0.00 0.00 60.65 58.90 2p09 h LYS 47 Cb 1.33 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.86 2p09 h LYS 47 CO 0.55 1.00 0.16 1.15 -3.45 0.00 0.00 179.45 178.86 2p09 h THR 48 N 0.89 1.13 -0.33 1.00 2.02 -1.97 0.15 112.91 115.80 2p09 h THR 48 Ca 0.15 -0.33 -0.15 0.00 0.77 0.00 0.00 66.41 66.85 2p09 h THR 48 Cb 0.59 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 2p09 h THR 48 CO 0.04 0.13 -0.38 0.00 0.37 0.00 0.00 175.52 175.67 2p09 h PHE 50 N 0.65 0.03 -0.84 0.00 3.57 -0.85 0.10 116.94 119.60 2p09 h PHE 50 Ca 0.06 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.60 2p09 h PHE 50 Cb 0.94 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.62 2p09 h PHE 50 CO 0.05 0.11 0.53 -0.91 -2.23 0.00 0.00 178.31 175.87 2p09 h ASN 51 N -0.07 0.87 -0.65 0.41 2.35 -0.64 -1.56 115.58 116.30 2p09 h ASN 51 Ca 0.01 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.71 2p09 h ASN 51 Cb 0.10 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 2p09 h ASN 51 CO -0.00 0.58 0.21 -1.13 -1.65 0.00 0.00 177.43 175.44 2p09 h ASN 52 N 1.01 0.96 -0.37 5.81 -1.24 -1.01 -2.38 115.58 118.37 2p09 h ASN 52 Ca 0.35 -0.17 -0.00 0.00 0.71 0.00 0.00 56.30 57.19 2p09 h ASN 52 Cb 0.07 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 38.85 2p09 h ASN 52 CO -0.14 0.90 0.23 0.77 -1.29 0.00 0.00 177.43 177.90 2p09 h SER 53 N 1.00 0.45 -0.25 1.15 4.64 0.21 0.19 113.55 120.93 2p09 h SER 53 Ca 0.22 -0.02 -0.06 0.00 -0.47 0.00 0.00 61.79 61.46 2p09 h SER 53 Cb 0.28 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 2p09 h SER 53 CO -0.01 0.34 -0.08 0.40 -0.87 0.00 0.00 176.83 176.61 2p09 h ILE 54 N 0.52 1.29 -1.00 0.95 1.08 -0.95 -0.78 117.51 118.62 2p09 h ILE 54 Ca 0.14 -1.12 0.02 0.00 -0.39 0.00 0.00 64.86 63.51 2p09 h ILE 54 Cb -0.02 1.50 -0.05 0.00 -3.07 0.00 0.00 36.82 35.17 2p09 h ILE 54 CO -0.03 0.35 0.66 0.44 -0.69 0.00 0.00 178.15 178.88 2p09 h ASP 55 N 0.24 1.12 0.59 1.72 3.32 -0.83 -2.79 116.42 119.80 2p09 h ASP 55 Ca 0.06 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2p09 h ASP 55 Cb 0.57 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2p09 h ASP 55 CO 0.03 0.80 -0.51 2.30 -1.72 0.00 0.00 179.24 180.13 2p09 n ILE 56 N -4.41 0.07 -1.89 0.35 -5.35 -0.05 -4.97 119.36 103.10 2p09 n ILE 56 Ca 0.12 -0.06 0.00 0.00 -0.27 0.00 0.00 62.75 62.55 2p09 n ILE 56 Cb 0.04 0.14 0.00 0.00 -1.74 0.00 0.00 39.64 38.08 2p09 n ILE 56 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2p09 n GLY 57 N 1.47 0.55 3.21 3.28 0.00 -0.61 -5.06 105.19 108.04 2p09 n GLY 57 Ca 0.05 -0.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 2p09 n GLY 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2p09 s ASP 58 N -2.92 4.06 0.00 1.61 2.15 -0.40 -4.96 116.67 116.21 2p09 s ASP 58 Ca 0.00 -0.68 0.21 0.00 0.43 0.00 0.00 52.55 52.51 2p09 s ASP 58 Cb 0.00 -1.65 0.57 0.00 -0.30 0.00 0.00 42.92 41.54 2p09 s ASP 58 CO 0.00 -0.07 1.48 -0.90 -0.17 0.00 0.00 175.17 175.51 2p09 n ASP 59 N 4.70 3.53 -0.22 -0.34 5.68 -1.26 -4.57 116.55 124.06 2p09 n ASP 59 Ca -0.18 -1.99 0.01 0.00 -0.50 0.00 0.00 54.79 52.13 2p09 n ASP 59 Cb 0.49 -0.40 0.12 0.00 -1.14 0.00 0.00 41.12 40.19 2p09 n ASP 59 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 2p09 h THR 60 N 4.02 0.80 -0.22 2.12 2.02 -1.97 -1.87 112.91 117.81 2p09 h THR 60 Ca 0.00 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.01 2p09 h THR 60 Cb 0.91 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2p09 h THR 60 CO 0.00 0.09 0.00 -1.22 0.37 0.00 0.00 175.52 174.76 2p09 n TYR 61 N -4.94 0.28 -1.91 3.16 4.01 -1.26 -4.94 117.16 111.54 2p09 n TYR 61 Ca 0.10 -0.14 -0.41 0.00 -0.16 0.00 0.00 57.90 57.29 2p09 n TYR 61 Cb 0.28 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.30 2p09 n TYR 61 CO 0.00 0.00 0.00 -1.01 -0.46 0.00 0.00 176.86 175.39 2p09 s HIS 62 N -1.72 2.72 -5.00 -0.72 3.76 -0.70 -4.59 115.29 109.03 2p09 s HIS 62 Ca 0.35 1.28 0.00 0.00 -0.15 0.00 0.00 55.06 56.53 2p09 s HIS 62 Cb 0.20 -3.88 0.00 0.00 1.11 0.00 0.00 32.58 30.01 2p09 s HIS 62 CO 0.30 -2.58 0.00 0.41 -0.85 0.00 0.00 174.74 172.01 2p09 n GLY 63 N 0.59 -0.98 3.72 -2.22 0.00 -1.26 -4.97 105.19 100.06 2p09 n GLY 63 Ca 0.02 -1.62 -0.04 0.00 0.00 0.00 0.00 46.02 44.38 2p09 n GLY 63 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2p09 s HIS 64 N -1.63 -0.17 -0.05 1.61 -3.43 -1.26 -0.93 115.29 109.43 2p09 s HIS 64 Ca 0.00 -0.12 0.01 0.00 -0.80 0.00 0.00 55.06 54.15 2p09 s HIS 64 Cb 0.00 0.63 0.02 0.00 -1.43 0.00 0.00 32.58 31.80 2p09 s HIS 64 CO 0.00 -0.79 -0.06 0.08 -2.00 0.00 0.00 174.74 171.97 2p09 s VAL 65 N -3.27 0.66 -0.09 -5.38 1.01 -0.28 -4.96 120.40 108.08 2p09 s VAL 65 Ca 0.11 -0.18 -0.09 0.00 0.00 0.00 0.00 61.98 61.82 2p09 s VAL 65 Cb -0.01 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 2p09 s VAL 65 CO 0.01 0.26 0.21 -1.81 0.00 0.00 0.00 175.10 173.76 2p09 s ASP 66 N 0.97 6.49 -0.08 3.32 1.01 -1.26 -0.74 116.67 126.38 2p09 s ASP 66 Ca -0.10 0.58 0.03 0.00 0.71 0.00 0.00 52.55 53.77 2p09 s ASP 66 Cb -0.14 -2.12 0.01 0.00 1.01 0.00 0.00 42.92 41.68 2p09 s ASP 66 CO 0.00 0.37 -0.15 0.26 0.21 0.00 0.00 175.17 175.86 2p09 s TRP 67 N -0.93 1.77 0.13 4.23 0.52 0.43 -4.95 118.94 120.14 2p09 s TRP 67 Ca 0.17 -0.71 -0.31 0.00 0.02 0.00 0.00 56.10 55.27 2p09 s TRP 67 Cb -0.13 -1.26 -0.08 0.00 -1.15 0.00 0.00 33.47 30.84 2p09 s TRP 67 CO 0.06 -0.34 1.36 -1.17 0.02 0.00 0.00 176.95 176.88 2p09 s LEU 68 N 0.66 4.38 0.00 2.99 2.96 -1.26 -0.36 118.68 128.04 2p09 s LEU 68 Ca -0.14 2.32 0.29 0.00 -0.22 0.00 0.00 54.13 56.38 2p09 s LEU 68 Cb -0.16 -3.59 1.22 0.00 0.50 0.00 0.00 46.19 44.16 2p09 s LEU 68 CO 0.04 -0.62 1.89 0.23 -1.32 0.00 0.00 176.35 176.57 2p09 n MET 69 N 3.71 0.17 -4.32 1.98 2.81 -0.20 -4.85 117.12 116.41 2p09 n MET 69 Ca 0.10 -0.02 -0.23 0.00 -1.81 0.00 0.00 57.70 55.74 2p09 n MET 69 Cb 0.43 -1.50 -0.08 0.00 -0.71 0.00 0.00 33.22 31.36 2p09 n MET 69 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 2p09 s TYR 70 N -2.85 2.64 0.00 2.03 1.51 -1.26 -4.56 117.35 114.86 2p09 s TYR 70 Ca 0.18 -0.24 0.15 0.00 -1.01 0.00 0.00 57.07 56.16 2p09 s TYR 70 Cb 0.19 -1.18 0.24 0.00 -0.11 0.00 0.00 41.96 41.10 2p09 s TYR 70 CO 0.53 0.62 1.52 0.00 -1.11 0.00 0.00 175.55 177.11 2p09 h ALA 71 N 2.04 0.74 -3.10 3.71 0.00 -1.84 -3.44 119.26 117.37 2p09 h ALA 71 Ca -0.44 -0.49 -0.66 0.00 0.00 0.00 0.00 54.91 53.32 2p09 h ALA 71 Cb 1.25 -0.09 -0.29 0.00 0.00 0.00 0.00 17.79 18.66 2p09 h ALA 71 CO 0.60 0.67 -0.77 0.34 0.00 0.00 0.00 179.25 180.09 2p09 s ASP 72 N -6.50 3.92 0.00 0.00 -1.08 -1.26 -5.01 116.67 106.74 2p09 s ASP 72 Ca 0.02 -0.44 0.20 0.00 -0.52 0.00 0.00 52.55 51.81 2p09 s ASP 72 Cb 0.09 -1.64 1.17 0.00 -1.46 0.00 0.00 42.92 41.09 2p09 s ASP 72 CO 0.74 0.04 1.56 -1.54 0.52 0.00 0.00 175.17 176.49