#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g42 s ASN 2 N 0.00 2.51 0.26 1.61 4.22 -1.26 -5.18 114.94 117.10 2g42 s ASN 2 Ca 0.00 -1.31 -0.02 0.00 -2.14 0.00 0.00 52.86 49.38 2g42 s ASN 2 Cb 0.00 -0.12 0.46 0.00 1.28 0.00 0.00 41.25 42.87 2g42 s ASN 2 CO 0.00 -0.52 1.82 -0.29 -2.04 0.00 0.00 177.10 176.07 2g42 h ILE 3 N 2.17 0.92 -0.67 0.54 6.09 -1.99 -2.07 117.51 122.50 2g42 h ILE 3 Ca -0.41 -0.31 -0.03 0.00 -1.37 0.00 0.00 64.86 62.75 2g42 h ILE 3 Cb 1.24 -0.05 -0.03 0.00 0.47 0.00 0.00 36.82 38.45 2g42 h ILE 3 CO 0.69 0.16 0.30 0.44 -3.07 0.00 0.00 178.15 176.67 2g42 h ASP 4 N 0.89 0.90 -0.50 2.19 3.32 -2.04 -1.12 116.42 120.07 2g42 h ASP 4 Ca 0.44 -0.15 -0.11 0.00 0.02 0.00 0.00 57.03 57.22 2g42 h ASP 4 Cb 0.40 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2g42 h ASP 4 CO -0.25 0.81 -0.13 -0.08 -1.72 0.00 0.00 179.24 177.87 2g42 h GLU 5 N 0.94 0.97 -0.18 3.56 4.81 -1.85 -2.64 114.58 120.20 2g42 h GLU 5 Ca 0.23 -0.37 -0.00 0.00 -0.13 0.00 0.00 59.36 59.08 2g42 h GLU 5 Cb 0.16 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2g42 h GLU 5 CO -0.02 1.04 0.11 0.82 -0.73 0.00 0.00 179.01 180.23 2g42 h ILE 6 N 0.82 1.07 -0.48 2.32 2.04 -1.14 -1.11 117.51 121.03 2g42 h ILE 6 Ca 0.12 -0.15 0.04 0.00 1.00 0.00 0.00 64.86 65.87 2g42 h ILE 6 Cb 0.69 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 2g42 h ILE 6 CO 0.05 0.06 0.32 -0.33 0.00 0.00 0.00 178.15 178.25 2g42 h GLU 7 N 0.22 0.49 -0.01 2.37 4.39 -1.15 0.32 114.58 121.20 2g42 h GLU 7 Ca 0.06 -0.03 -0.14 0.00 0.34 0.00 0.00 59.36 59.60 2g42 h GLU 7 Cb 0.01 -0.11 0.01 0.00 -0.10 0.00 0.00 28.75 28.56 2g42 h GLU 7 CO -0.01 0.32 -0.53 -0.09 -1.16 0.00 0.00 179.01 177.54 2g42 h ARG 8 N 0.50 0.38 -0.17 2.33 2.43 -1.15 -2.77 114.38 115.94 2g42 h ARG 8 Ca 0.20 -0.40 -0.05 0.00 -0.81 0.00 0.00 59.98 58.92 2g42 h ARG 8 Cb 0.17 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 2g42 h ARG 8 CO -0.05 1.06 -0.14 0.87 -1.51 0.00 0.00 179.97 180.21 2g42 h LYS 9 N -0.14 0.27 -0.38 0.20 1.57 -0.82 -1.97 116.57 115.31 2g42 h LYS 9 Ca -0.06 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2g42 h LYS 9 Cb 1.24 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 2g42 h LYS 9 CO 0.11 0.42 0.23 0.82 -0.57 0.00 0.00 179.45 180.46 2g42 h ILE 10 N 0.26 1.12 -0.27 1.86 2.04 -0.33 0.62 117.51 122.82 2g42 h ILE 10 Ca 0.05 -0.27 -0.11 0.00 1.00 0.00 0.00 64.86 65.54 2g42 h ILE 10 Cb 0.40 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 2g42 h ILE 10 CO 0.02 0.12 -0.28 0.44 0.00 0.00 0.00 178.15 178.46 2g42 h ASP 11 N 0.50 0.55 -0.87 1.72 3.32 -1.28 -2.16 116.42 118.20 2g42 h ASP 11 Ca 0.14 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 2g42 h ASP 11 Cb -0.01 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.35 2g42 h ASP 11 CO -0.03 0.81 0.50 -0.33 -1.72 0.00 0.00 179.24 178.48 2g42 h GLU 12 N 0.47 1.20 -0.17 3.56 5.08 -1.04 -2.06 114.58 121.62 2g42 h GLU 12 Ca 0.06 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 2g42 h GLU 12 Cb 0.73 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2g42 h GLU 12 CO 0.06 0.86 -0.37 0.00 -1.00 0.00 0.00 179.01 178.56 2g42 h ALA 13 N 1.34 1.05 -0.12 3.43 0.00 -0.45 -2.45 119.26 122.06 2g42 h ALA 13 Ca 0.31 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2g42 h ALA 13 Cb -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2g42 h ALA 13 CO -0.05 0.59 -0.22 0.82 0.00 0.00 0.00 179.25 180.38 2g42 h ILE 14 N 0.31 1.38 -0.81 0.00 2.04 -1.21 -0.37 117.51 118.85 2g42 h ILE 14 Ca 0.03 -1.49 0.08 0.00 1.00 0.00 0.00 64.86 64.49 2g42 h ILE 14 Cb 0.80 2.06 -0.07 0.00 -0.74 0.00 0.00 36.82 38.87 2g42 h ILE 14 CO 0.06 0.43 0.47 -0.08 0.00 0.00 0.00 178.15 179.04 2g42 h GLU 15 N -0.06 0.80 -0.20 2.37 4.81 -1.30 -2.53 114.58 118.46 2g42 h GLU 15 Ca 0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2g42 h GLU 15 Cb 0.81 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.01 2g42 h GLU 15 CO 0.05 0.53 0.00 1.63 -0.73 0.00 0.00 179.01 180.49 2g42 n LYS 16 N -4.72 1.70 -2.82 1.92 5.02 -0.93 -4.92 118.16 113.41 2g42 n LYS 16 Ca 0.13 -1.05 -0.21 0.00 -2.02 0.00 0.00 58.31 55.15 2g42 n LYS 16 Cb 0.24 -1.35 0.01 0.00 -0.02 0.00 0.00 35.03 33.91 2g42 n LYS 16 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2g42 n GLU 17 N 0.29 -3.48 -3.25 1.97 1.02 -0.94 -4.92 120.64 111.34 2g42 n GLU 17 Ca 0.15 0.85 -0.45 0.00 -0.02 0.00 0.00 57.16 57.69 2g42 n GLU 17 Cb 0.30 -5.61 0.00 0.00 -0.02 0.00 0.00 31.44 26.11 2g42 n GLU 17 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2g42 n ASP 18 N -2.27 5.57 0.17 1.62 2.03 -0.19 -4.83 116.55 118.65 2g42 n ASP 18 Ca -0.14 -3.07 0.06 0.00 0.52 0.00 0.00 54.79 52.15 2g42 n ASP 18 Cb 0.63 -1.39 0.12 0.00 -0.72 0.00 0.00 41.12 39.75 2g42 n ASP 18 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 2g42 h TYR 19 N 6.57 0.00 -0.33 -0.67 0.05 -1.91 -1.51 116.97 119.17 2g42 h TYR 19 Ca 0.20 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.89 2g42 h TYR 19 Cb 0.84 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.57 2g42 h TYR 19 CO 0.82 0.35 -0.14 1.49 -1.05 0.00 0.00 178.16 179.63 2g42 h GLU 20 N 0.00 0.68 -0.53 4.88 4.57 -1.96 -1.50 114.58 120.71 2g42 h GLU 20 Ca -0.00 -0.29 -0.08 0.00 -1.18 0.00 0.00 59.36 57.81 2g42 h GLU 20 Cb 1.21 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.75 2g42 h GLU 20 CO 0.05 0.88 0.02 1.15 -1.18 0.00 0.00 179.01 179.92 2g42 h THR 21 N 0.45 1.25 -0.09 0.32 2.02 -1.92 -2.02 112.91 112.91 2g42 h THR 21 Ca 0.08 -1.04 0.03 0.00 0.77 0.00 0.00 66.41 66.24 2g42 h THR 21 Cb 0.67 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 2g42 h THR 21 CO 0.04 0.37 -0.09 0.25 0.37 0.00 0.00 175.52 176.47 2g42 h LEU 22 N 0.83 -0.27 -0.57 2.58 5.85 -1.22 0.89 115.31 123.40 2g42 h LEU 22 Ca 0.16 0.06 0.09 0.00 0.84 0.00 0.00 57.88 59.02 2g42 h LEU 22 Cb 0.47 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 2g42 h LEU 22 CO 0.02 -0.12 0.21 -0.07 -0.34 0.00 0.00 178.44 178.14 2g42 h LEU 23 N -0.11 0.20 -0.27 2.25 4.07 -1.11 0.26 115.31 120.60 2g42 h LEU 23 Ca 0.07 0.07 -0.03 0.00 0.08 0.00 0.00 57.88 58.07 2g42 h LEU 23 Cb 0.20 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.99 2g42 h LEU 23 CO -0.16 0.13 0.06 -1.28 -1.08 0.00 0.00 178.44 176.12 2g42 h SER 24 N 0.39 0.42 -0.72 -0.43 0.87 -1.07 -1.49 113.55 111.52 2g42 h SER 24 Ca 0.29 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.57 2g42 h SER 24 Cb 0.34 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 2g42 h SER 24 CO -0.29 0.54 0.31 -0.07 -0.53 0.00 0.00 176.83 176.79 2g42 h LEU 25 N 0.27 0.99 -1.10 2.23 3.38 -0.32 -1.74 115.31 119.02 2g42 h LEU 25 Ca 0.09 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 2g42 h LEU 25 Cb 0.29 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2g42 h LEU 25 CO 0.00 0.87 -0.25 -0.07 0.09 0.00 0.00 178.44 179.08 2g42 h LEU 26 N 1.06 0.33 -0.47 1.67 3.38 -0.29 -0.55 115.31 120.44 2g42 h LEU 26 Ca 0.25 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 58.00 2g42 h LEU 26 Cb 0.17 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2g42 h LEU 26 CO -0.02 0.58 -0.17 0.78 0.09 0.00 0.00 178.44 179.70 2g42 h ASN 27 N 0.30 0.96 -0.27 -0.43 4.21 -0.86 -1.84 115.58 117.64 2g42 h ASN 27 Ca 0.05 -0.38 -0.07 0.00 1.21 0.00 0.00 56.30 57.10 2g42 h ASN 27 Cb 0.60 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.52 2g42 h ASN 27 CO 0.04 1.12 -0.06 0.11 -1.29 0.00 0.00 177.43 177.35 2g42 h LYS 28 N 0.79 0.65 -0.22 0.81 1.57 -1.07 -2.99 116.57 116.10 2g42 h LYS 28 Ca 0.11 -0.18 -0.15 0.00 -1.87 0.00 0.00 60.65 58.56 2g42 h LYS 28 Cb 0.73 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 2g42 h LYS 28 CO 0.06 0.71 -0.48 -0.09 -0.57 0.00 0.00 179.45 179.08 2g42 h ARG 29 N 0.60 0.59 0.00 3.15 2.43 -0.99 -3.20 114.38 116.96 2g42 h ARG 29 Ca 0.11 -0.34 -0.02 0.00 -0.81 0.00 0.00 59.98 58.93 2g42 h ARG 29 Cb 0.47 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2g42 h ARG 29 CO 0.02 0.94 -0.09 -0.22 -1.51 0.00 0.00 179.97 179.11 2g42 h LYS 30 N 0.47 0.00 -0.47 0.20 1.63 -1.18 -0.79 116.57 116.43 2g42 h LYS 30 Ca 0.02 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.70 2g42 h LYS 30 Cb 1.01 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.62 2g42 h LYS 30 CO 0.09 0.09 -0.20 0.93 -3.45 0.00 0.00 179.45 176.92 2g42 h GLU 31 N 0.00 0.93 -2.69 1.90 3.07 -1.59 -3.39 114.58 112.81 2g42 h GLU 31 Ca -0.00 -0.38 -0.36 0.00 -0.50 0.00 0.00 59.36 58.12 2g42 h GLU 31 Cb 0.18 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 2g42 h GLU 31 CO 0.01 1.04 1.64 1.28 -1.40 0.00 0.00 179.01 181.58 2g42 n LEU 32 N -4.12 5.86 0.00 1.33 4.77 -0.31 -4.66 117.00 119.88 2g42 n LEU 32 Ca 0.00 -3.27 0.00 0.00 -0.03 0.00 0.00 56.01 52.71 2g42 n LEU 32 Cb 0.44 -1.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.25 2g42 n LEU 32 CO 0.46 1.42 0.00 -1.84 -1.33 0.00 0.00 177.39 176.09 2g42 n GLU 34 N 3.23 0.00 0.04 3.23 -0.00 -1.26 -3.36 120.64 122.51 2g42 n GLU 34 Ca 0.51 0.00 0.13 0.00 -0.00 0.00 0.00 57.16 57.80 2g42 n GLU 34 Cb 0.47 0.00 0.43 0.00 -0.00 0.00 0.00 31.44 32.34 2g42 n GLU 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2g42 n GLY 35 N 0.00 -1.51 3.78 -1.84 0.00 -1.26 -4.94 105.19 99.42 2g42 n GLY 35 Ca 0.00 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 2g42 n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g42 s LEU 36 N -3.62 3.64 0.77 0.99 1.43 -1.21 -5.02 118.68 115.66 2g42 s LEU 36 Ca 0.11 2.07 -0.14 0.00 -1.03 0.00 0.00 54.13 55.15 2g42 s LEU 36 Cb 0.16 -4.57 0.06 0.00 0.03 0.00 0.00 46.19 41.88 2g42 s LEU 36 CO 0.61 -1.28 1.18 -2.84 0.23 0.00 0.00 176.35 174.25 2g42 s PRO 37 N -3.57 1.91 0.52 1.29 0.02 -1.26 -4.86 135.00 129.04 2g42 s PRO 37 Ca 0.70 1.67 0.17 0.00 0.02 0.00 0.00 61.00 63.56 2g42 s PRO 37 Cb -0.21 -1.82 1.27 0.00 0.02 0.00 0.00 34.50 33.76 2g42 s PRO 37 CO 0.31 -1.99 2.12 1.57 -0.33 0.00 0.00 177.00 178.68 2g42 h LYS 38 N -0.69 0.03 -0.37 5.54 -0.00 -1.99 -2.25 116.57 116.84 2g42 h LYS 38 Ca -0.46 -0.00 -0.14 0.00 -0.00 0.00 0.00 60.65 60.05 2g42 h LYS 38 Cb 1.28 -0.01 -0.01 0.00 -0.00 0.00 0.00 32.23 33.50 2g42 h LYS 38 CO 0.48 0.02 -0.30 0.38 -0.00 0.00 0.00 179.45 180.03 2g42 h ASP 39 N 0.03 0.90 -0.04 7.07 3.04 -2.00 -2.69 116.42 122.74 2g42 h ASP 39 Ca 0.06 -0.45 -0.15 0.00 -3.24 0.00 0.00 57.03 53.24 2g42 h ASP 39 Cb 0.19 -0.25 -0.01 0.00 -1.04 0.00 0.00 39.33 38.22 2g42 h ASP 39 CO -0.00 1.16 -0.49 0.50 -2.04 0.00 0.00 179.24 178.37 2g42 h LYS 40 N 0.65 0.60 0.08 4.15 1.63 -1.82 -2.35 116.57 119.51 2g42 h LYS 40 Ca 0.07 -0.35 0.00 0.00 -0.85 0.00 0.00 60.65 59.52 2g42 h LYS 40 Cb 0.89 0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.54 2g42 h LYS 40 CO 0.08 0.95 -0.06 -0.07 -3.45 0.00 0.00 179.45 176.90 2g42 h LEU 41 N 0.48 -0.16 -1.25 5.20 3.38 -1.42 -0.66 115.31 120.88 2g42 h LEU 41 Ca 0.02 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2g42 h LEU 41 Cb 1.02 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.80 2g42 h LEU 41 CO 0.10 -0.10 0.25 0.77 0.09 0.00 0.00 178.44 179.55 2g42 h SER 42 N -0.14 0.69 -0.66 -0.43 4.64 -1.48 0.62 113.55 116.79 2g42 h SER 42 Ca -0.00 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 2g42 h SER 42 Cb 0.13 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 2g42 h SER 42 CO -0.01 0.60 0.39 -0.08 -0.87 0.00 0.00 176.83 176.86 2g42 h GLU 43 N 0.76 0.90 -0.31 4.77 4.81 -1.16 -2.14 114.58 122.21 2g42 h GLU 43 Ca 0.19 -0.09 -0.14 0.00 -0.13 0.00 0.00 59.36 59.19 2g42 h GLU 43 Cb 0.10 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2g42 h GLU 43 CO -0.02 0.65 -0.37 0.82 -0.73 0.00 0.00 179.01 179.35 2g42 h ILE 44 N 0.90 1.29 -0.33 2.32 2.04 -0.24 -2.28 117.51 121.21 2g42 h ILE 44 Ca 0.24 -1.53 -0.10 0.00 1.00 0.00 0.00 64.86 64.46 2g42 h ILE 44 Cb -0.01 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2g42 h ILE 44 CO -0.04 0.50 -0.20 -0.07 0.00 0.00 0.00 178.15 178.33 2g42 h LEU 45 N 0.59 0.62 -0.08 1.44 3.38 -0.78 -0.72 115.31 119.76 2g42 h LEU 45 Ca 0.06 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 2g42 h LEU 45 Cb 0.91 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 2g42 h LEU 45 CO 0.08 0.82 -0.03 -0.08 0.09 0.00 0.00 178.44 179.32 2g42 h GLU 46 N 0.55 0.17 -0.82 1.13 4.57 -1.28 -2.65 114.58 116.24 2g42 h GLU 46 Ca 0.08 -0.07 0.05 0.00 -1.18 0.00 0.00 59.36 58.24 2g42 h GLU 46 Cb 0.66 -0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 29.18 2g42 h GLU 46 CO 0.05 0.52 0.51 0.87 -1.18 0.00 0.00 179.01 179.78 2g42 h LYS 47 N -0.19 0.94 -0.71 1.92 1.57 -1.34 -2.10 116.57 116.66 2g42 h LYS 47 Ca 0.02 -0.06 0.09 0.00 -1.87 0.00 0.00 60.65 58.83 2g42 h LYS 47 Cb 0.46 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.51 2g42 h LYS 47 CO 0.01 0.62 0.46 -0.44 -0.57 0.00 0.00 179.45 179.53 2g42 h ASP 48 N 0.96 0.56 0.63 0.86 5.19 -1.01 -1.22 116.42 122.40 2g42 h ASP 48 Ca 0.35 0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.74 2g42 h ASP 48 Cb 0.10 -0.11 0.01 0.00 0.18 0.00 0.00 39.33 39.51 2g42 h ASP 48 CO -0.15 0.35 -0.30 0.03 -3.12 0.00 0.00 179.24 176.05 2g42 h ARG 49 N 0.63 -0.82 -0.92 3.56 -0.00 -1.01 -0.21 114.38 115.61 2g42 h ARG 49 Ca 0.32 0.06 0.16 0.00 -0.50 0.00 0.00 59.98 60.01 2g42 h ARG 49 Cb 0.41 0.19 -0.10 0.00 0.00 0.00 0.00 29.97 30.47 2g42 h ARG 49 CO -0.11 -0.52 0.52 0.87 0.00 0.00 0.00 179.97 180.73 2g42 h LYS 50 N -0.93 0.69 -0.52 0.04 1.57 -1.46 -0.91 116.57 115.04 2g42 h LYS 50 Ca -0.09 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2g42 h LYS 50 Cb 0.68 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.81 2g42 h LYS 50 CO 0.14 0.46 0.34 0.00 -0.57 0.00 0.00 179.45 179.82 2g42 h ARG 51 N 0.71 0.69 -0.99 3.15 3.08 -1.02 -1.18 114.38 118.82 2g42 h ARG 51 Ca 0.51 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.53 2g42 h ARG 51 Cb 0.72 -0.15 -0.05 0.00 0.08 0.00 0.00 29.97 30.57 2g42 h ARG 51 CO -0.36 0.47 0.65 -0.07 -1.07 0.00 0.00 179.97 179.59 2g42 h LEU 52 N 0.71 1.11 -0.42 3.04 3.38 0.03 -2.18 115.31 120.98 2g42 h LEU 52 Ca 0.19 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 2g42 h LEU 52 Cb -0.07 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 2g42 h LEU 52 CO -0.04 0.79 0.14 -0.33 0.09 0.00 0.00 178.44 179.09 2g42 h GLU 53 N 1.31 0.64 -0.05 1.13 5.08 -0.57 -1.39 114.58 120.74 2g42 h GLU 53 Ca 0.37 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2g42 h GLU 53 Cb -0.10 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.06 2g42 h GLU 53 CO -0.09 0.62 0.02 0.82 -1.00 0.00 0.00 179.01 179.38 2g42 h ILE 54 N 0.53 1.09 0.00 3.13 2.04 -0.99 -1.26 117.51 122.06 2g42 h ILE 54 Ca 0.14 -0.26 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 2g42 h ILE 54 Cb 0.23 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 2g42 h ILE 54 CO -0.01 0.07 -0.37 0.16 0.00 0.00 0.00 178.15 178.00 2g42 h ILE 55 N -0.03 0.79 -0.30 -0.67 3.07 -1.40 -2.26 117.51 116.72 2g42 h ILE 55 Ca 0.02 -1.63 -0.16 0.00 1.55 0.00 0.00 64.86 64.63 2g42 h ILE 55 Cb 0.10 2.04 -0.00 0.00 -0.27 0.00 0.00 36.82 38.68 2g42 h ILE 55 CO -0.00 0.37 -0.47 -0.08 -1.05 0.00 0.00 178.15 176.91 2g42 h GLU 56 N 0.00 0.80 -0.86 0.16 4.57 -1.07 0.35 114.58 118.52 2g42 h GLU 56 Ca -0.00 -0.46 -0.03 0.00 -1.18 0.00 0.00 59.36 57.69 2g42 h GLU 56 Cb 1.01 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 29.59 2g42 h GLU 56 CO 0.05 1.09 0.43 -0.22 -1.18 0.00 0.00 179.01 179.18 2g42 h LYS 57 N 0.63 1.22 -0.25 1.92 3.64 -1.06 -1.31 116.57 121.36 2g42 h LYS 57 Ca 0.03 -0.17 -0.19 0.00 -1.27 0.00 0.00 60.65 59.06 2g42 h LYS 57 Cb 1.05 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 2g42 h LYS 57 CO 0.10 0.92 -0.58 0.00 -2.27 0.00 0.00 179.45 177.63 2g42 h ARG 58 N 1.21 0.79 -0.81 1.90 3.08 -1.28 -1.64 114.38 117.63 2g42 h ARG 58 Ca 0.30 -0.52 0.02 0.00 0.07 0.00 0.00 59.98 59.84 2g42 h ARG 58 Cb 0.09 0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.17 2g42 h ARG 58 CO -0.04 1.15 0.53 -0.22 -1.07 0.00 0.00 179.97 180.32 2g42 h LYS 59 N 0.60 1.03 -0.55 0.04 3.64 -0.78 -2.10 116.57 118.45 2g42 h LYS 59 Ca 0.00 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 2g42 h LYS 59 Cb 1.18 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.74 2g42 h LYS 59 CO 0.12 0.68 0.16 1.15 -2.27 0.00 0.00 179.45 179.30 2g42 h THR 60 N 1.06 1.22 -0.61 1.00 2.02 -1.14 -2.26 112.91 114.21 2g42 h THR 60 Ca 0.31 -0.75 -0.06 0.00 0.77 0.00 0.00 66.41 66.68 2g42 h THR 60 Cb -0.07 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 66.94 2g42 h THR 60 CO -0.09 0.29 0.14 0.00 0.37 0.00 0.00 175.52 176.23 2g42 h ALA 61 N 1.38 1.11 -0.40 6.16 0.00 -0.82 -2.19 119.26 124.49 2g42 h ALA 61 Ca 0.18 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 2g42 h ALA 61 Cb 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2g42 h ALA 61 CO -0.01 0.60 -0.13 -0.07 0.00 0.00 0.00 179.25 179.63 2g42 h LEU 62 N 0.91 0.82 -1.10 0.00 3.38 -1.05 -2.29 115.31 115.98 2g42 h LEU 62 Ca 0.19 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 2g42 h LEU 62 Cb 0.33 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 2g42 h LEU 62 CO 0.00 1.01 0.51 -0.26 0.09 0.00 0.00 178.44 179.79 2g42 h PHE 63 N 0.61 1.09 -0.74 1.13 0.04 -1.35 -1.01 116.94 116.72 2g42 h PHE 63 Ca 0.10 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.89 2g42 h PHE 63 Cb 0.67 -0.36 -0.04 0.00 2.20 0.00 0.00 35.95 38.42 2g42 h PHE 63 CO 0.05 0.72 0.47 0.37 -0.60 0.00 0.00 178.31 179.33 2g42 h GLN 64 N 1.14 0.91 -0.61 1.51 -0.00 -1.08 0.17 115.11 117.15 2g42 h GLN 64 Ca 0.30 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.90 2g42 h GLN 64 Cb -0.06 -0.20 -0.03 0.00 0.00 0.00 0.00 27.48 27.19 2g42 h GLN 64 CO -0.06 0.60 0.39 1.49 0.00 0.00 0.00 178.83 181.25 2g42 h GLU 65 N 0.94 0.81 -0.91 1.69 4.81 -0.88 -0.92 114.58 120.12 2g42 h GLU 65 Ca 0.29 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.47 2g42 h GLU 65 Cb -0.02 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.14 2g42 h GLU 65 CO -0.10 0.56 0.60 0.82 -0.73 0.00 0.00 179.01 180.16 2g42 h ILE 66 N 0.82 1.24 -0.27 2.32 2.04 -0.54 -0.36 117.51 122.75 2g42 h ILE 66 Ca 0.22 -0.43 -0.10 0.00 1.00 0.00 0.00 64.86 65.55 2g42 h ILE 66 Cb -0.07 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 35.90 2g42 h ILE 66 CO -0.05 0.23 -0.22 0.78 0.00 0.00 0.00 178.15 178.89 2g42 h ASN 67 N 1.24 0.67 -0.63 1.72 2.35 -0.13 -1.09 115.58 119.70 2g42 h ASN 67 Ca 0.33 -0.45 -0.04 0.00 -0.55 0.00 0.00 56.30 55.59 2g42 h ASN 67 Cb -0.14 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.01 2g42 h ASN 67 CO -0.07 0.98 0.23 0.58 -1.65 0.00 0.00 177.43 177.50 2g42 h VAL 68 N 0.36 1.24 -0.89 2.81 2.07 -1.07 -2.83 116.25 117.94 2g42 h VAL 68 Ca 0.05 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 2g42 h VAL 68 Cb 0.77 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 2g42 h VAL 68 CO 0.06 0.31 0.50 0.40 0.02 0.00 0.00 177.57 178.86 2g42 h ILE 69 N 0.96 1.25 -0.79 4.57 2.04 -0.84 -1.45 117.51 123.26 2g42 h ILE 69 Ca 0.22 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 2g42 h ILE 69 Cb 0.23 0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 36.31 2g42 h ILE 69 CO -0.01 0.28 0.38 -0.09 0.00 0.00 0.00 178.15 178.71 2g42 h ARG 70 N 1.25 1.14 -0.78 2.37 2.43 -1.03 -1.22 114.38 118.53 2g42 h ARG 70 Ca 0.32 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2g42 h ARG 70 Cb 0.00 -0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 29.31 2g42 h ARG 70 CO -0.05 0.88 0.50 0.93 -1.51 0.00 0.00 179.97 180.72 2g42 h GLU 71 N 1.12 1.04 -0.69 0.20 5.08 -1.19 -2.08 114.58 118.06 2g42 h GLU 71 Ca 0.27 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.48 2g42 h GLU 71 Cb 0.12 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2g42 h GLU 71 CO -0.03 0.71 0.14 0.00 -1.00 0.00 0.00 179.01 178.82 2g42 h ALA 72 N 1.27 0.91 0.06 3.43 0.00 -0.82 -1.62 119.26 122.49 2g42 h ALA 72 Ca 0.28 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2g42 h ALA 72 Cb -0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2g42 h ALA 72 CO -0.06 0.66 -0.10 -0.09 0.00 0.00 0.00 179.25 179.67 2g42 h ARG 73 N 1.06 -0.19 -0.40 0.00 2.43 -0.98 0.20 114.38 116.49 2g42 h ARG 73 Ca 0.21 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.48 2g42 h ARG 73 Cb 0.41 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.92 2g42 h ARG 73 CO 0.01 -0.13 -0.15 0.77 -1.51 0.00 0.00 179.97 178.96 2g42 h SER 74 N -0.20 -0.54 0.23 -3.80 0.02 -1.18 0.36 113.55 108.44 2g42 h SER 74 Ca 0.02 0.14 -0.06 0.00 -0.84 0.00 0.00 61.79 61.05 2g42 h SER 74 Cb 0.21 0.31 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 2g42 h SER 74 CO -0.06 -0.19 -0.27 -1.28 -1.14 0.00 0.00 176.83 173.90 2g42 h SER 75 N -0.07 0.06 0.56 3.07 0.87 -0.97 -1.91 113.55 115.15 2g42 h SER 75 Ca 0.20 -0.02 -0.14 0.00 -1.23 0.00 0.00 61.79 60.60 2g42 h SER 75 Cb 0.37 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 2g42 h SER 75 CO -0.45 0.33 -0.66 -0.07 -0.53 0.00 0.00 176.83 175.45 2g42 h LEU 76 N 0.06 0.10 -6.87 2.23 3.38 0.61 -3.37 115.31 111.45 2g42 h LEU 76 Ca 0.01 -0.07 -0.80 0.00 0.09 0.00 0.00 57.88 57.11 2g42 h LEU 76 Cb 0.50 -0.03 -0.26 0.00 0.09 0.00 0.00 40.66 40.96 2g42 h LEU 76 CO 0.04 0.73 0.98 0.00 0.09 0.00 0.00 178.44 180.28 2g42 n GLN 77 N -3.79 4.31 0.00 1.13 6.02 0.11 -5.08 117.38 120.09 2g42 n GLN 77 Ca -0.02 -4.38 0.00 0.00 -0.01 0.00 0.00 57.00 52.59 2g42 n GLN 77 Cb 0.65 -2.58 0.00 0.00 1.02 0.00 0.00 30.24 29.33 2g42 n GLN 77 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68