#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v48 n ASN 9 N 0.00 -1.91 -3.35 0.55 6.94 -1.26 -5.09 115.26 111.14 2v48 n ASN 9 Ca 0.00 -1.05 -0.10 0.00 -0.02 0.00 0.00 54.58 53.41 2v48 n ASN 9 Cb 0.00 -0.83 -0.08 0.00 -2.36 0.00 0.00 39.78 36.51 2v48 n ASN 9 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2v48 s LEU 10 N 0.00 -0.63 -0.49 -4.53 2.96 -1.26 -5.12 118.68 109.60 2v48 s LEU 10 Ca 0.59 0.00 -0.44 0.00 -0.22 0.00 0.00 54.13 54.06 2v48 s LEU 10 Cb -0.06 1.06 -0.19 0.00 0.50 0.00 0.00 46.19 47.50 2v48 s LEU 10 CO 0.45 -0.32 2.11 -1.20 -1.32 0.00 0.00 176.35 176.07 2v48 n SER 11 N 5.36 0.74 0.00 3.68 7.64 -1.26 -4.33 113.62 125.45 2v48 n SER 11 Ca -0.02 0.68 0.00 0.00 1.01 0.00 0.00 58.87 60.53 2v48 n SER 11 Cb 0.50 -0.89 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 2v48 n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2v48 n ALA 12 N 7.39 0.00 0.00 -0.43 0.00 -1.26 -4.85 120.51 121.36 2v48 n ALA 12 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.98 2v48 n ALA 12 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.41 2v48 n ALA 12 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2v48 n LEU 13 N -0.29 0.00 -0.29 0.00 -0.00 -1.26 -0.56 117.00 114.60 2v48 n LEU 13 Ca 0.00 0.26 0.09 0.00 -0.00 0.00 0.00 56.01 56.36 2v48 n LEU 13 Cb 0.00 -0.26 0.25 0.00 -0.00 0.00 0.00 43.42 43.41 2v48 n LEU 13 CO 0.00 -0.26 1.05 0.50 -0.00 0.00 0.00 177.39 178.68 2v48 h LYS 14 N 0.00 0.46 -0.72 1.47 3.64 -1.94 0.49 116.57 119.97 2v48 h LYS 14 Ca 0.00 -0.03 0.14 0.00 -1.27 0.00 0.00 60.65 59.49 2v48 h LYS 14 Cb 0.08 -0.10 -0.14 0.00 -0.41 0.00 0.00 32.23 31.66 2v48 h LYS 14 CO 0.00 0.31 -0.27 0.00 -2.27 0.00 0.00 179.45 177.22 2v48 h ARG 15 N 0.48 -0.06 -0.24 1.90 2.47 -1.26 -1.63 114.38 116.04 2v48 h ARG 15 Ca 0.49 0.00 0.03 0.00 -1.26 0.00 0.00 59.98 59.24 2v48 h ARG 15 Cb 0.81 0.01 -0.05 0.00 -1.65 0.00 0.00 29.97 29.10 2v48 h ARG 15 CO -0.45 -0.04 -0.35 1.25 0.56 0.00 0.00 179.97 180.94 2v48 h HIS 16 N -0.06 -1.07 -0.93 3.04 2.76 -0.21 0.33 115.15 119.01 2v48 h HIS 16 Ca 0.31 0.05 0.27 0.00 -2.20 0.00 0.00 60.37 58.81 2v48 h HIS 16 Cb 0.56 0.50 -0.15 0.00 1.55 0.00 0.00 27.41 29.87 2v48 h HIS 16 CO -0.65 -0.31 0.36 0.00 -1.30 0.00 0.00 177.93 176.03 2v48 h ARG 17 N -0.26 0.24 0.07 5.26 3.08 -1.22 1.32 114.38 122.86 2v48 h ARG 17 Ca 0.04 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.09 2v48 h ARG 17 Cb 0.38 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 2v48 h ARG 17 CO -0.36 0.16 -0.14 1.96 -1.07 0.00 0.00 179.97 180.51 2v48 h GLN 18 N 0.24 -0.27 -0.74 0.04 4.20 0.22 -2.11 115.11 116.69 2v48 h GLN 18 Ca 0.63 0.02 0.14 0.00 0.06 0.00 0.00 58.65 59.50 2v48 h GLN 18 Cb 1.35 0.06 -0.14 0.00 0.30 0.00 0.00 27.48 29.05 2v48 h GLN 18 CO -0.65 -0.18 -0.25 0.77 -0.67 0.00 0.00 178.83 177.86 2v48 h SER 19 N -0.28 -0.90 -0.08 1.46 0.02 0.52 0.26 113.55 114.55 2v48 h SER 19 Ca 0.03 0.24 0.02 0.00 -0.84 0.00 0.00 61.79 61.24 2v48 h SER 19 Cb 0.30 0.53 -0.05 0.00 0.14 0.00 0.00 62.40 63.32 2v48 h SER 19 CO -0.09 -0.27 -0.45 -0.07 -1.14 0.00 0.00 176.83 174.81 2v48 h LEU 20 N -0.04 -1.43 -0.37 5.07 3.38 -0.53 2.97 115.31 124.36 2v48 h LEU 20 Ca 0.33 0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.51 2v48 h LEU 20 Cb 0.56 0.55 -0.07 0.00 0.09 0.00 0.00 40.66 41.80 2v48 h LEU 20 CO -0.78 -0.41 -0.45 0.11 0.09 0.00 0.00 178.44 177.00 2v48 h LYS 21 N -0.51 -0.27 0.00 1.13 1.57 -0.46 0.21 116.57 118.23 2v48 h LYS 21 Ca 0.02 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2v48 h LYS 21 Cb 0.58 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.95 2v48 h LYS 21 CO -0.35 -0.18 0.00 0.54 -0.57 0.00 0.00 179.45 178.89 2v48 n ARG 22 N -4.81 0.00 -0.04 3.15 1.74 0.72 -1.00 116.66 116.42 2v48 n ARG 22 Ca -0.02 0.55 -0.01 0.00 -0.77 0.00 0.00 57.85 57.60 2v48 n ARG 22 Cb 0.26 -1.27 -0.01 0.00 -1.02 0.00 0.00 32.46 30.42 2v48 n ARG 22 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2v48 n ARG 23 N -1.75 -0.04 0.00 5.56 0.63 0.99 -0.28 116.66 121.77 2v48 n ARG 23 Ca 0.00 0.23 0.00 0.00 -0.92 0.00 0.00 57.85 57.16 2v48 n ARG 23 Cb 0.00 -0.35 0.00 0.00 0.45 0.00 0.00 32.46 32.56 2v48 n ARG 23 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2v48 n LEU 24 N -3.22 0.00 0.00 6.15 -0.00 0.70 -1.01 117.00 119.63 2v48 n LEU 24 Ca 0.00 0.71 0.00 0.00 -0.00 0.00 0.00 56.01 56.72 2v48 n LEU 24 Cb 0.02 -0.21 0.00 0.00 -0.00 0.00 0.00 43.42 43.23 2v48 n LEU 24 CO -0.02 -0.21 0.01 -1.14 -0.00 0.00 0.00 177.39 176.03 2v48 n ARG 25 N -1.43 0.00 0.18 1.96 0.63 0.62 0.17 116.66 118.79 2v48 n ARG 25 Ca 0.00 0.02 0.07 0.00 -0.92 0.00 0.00 57.85 57.01 2v48 n ARG 25 Cb 0.00 -0.04 0.57 0.00 0.45 0.00 0.00 32.46 33.44 2v48 n ARG 25 CO 0.00 0.00 0.00 -2.95 -2.51 0.00 0.00 177.63 172.17 2v48 h ASN 26 N 0.00 0.13 -0.06 6.15 -0.00 -1.58 -2.14 115.58 118.09 2v48 h ASN 26 Ca 0.00 -0.01 0.01 0.00 -0.00 0.00 0.00 56.30 56.31 2v48 h ASN 26 Cb 0.00 -0.03 -0.02 0.00 -0.00 0.00 0.00 38.32 38.26 2v48 h ASN 26 CO 0.00 0.12 -0.19 0.50 -0.00 0.00 0.00 177.43 177.86 2v48 h LYS 27 N 0.15 -0.19 0.00 4.14 3.11 0.35 0.22 116.57 124.35 2v48 h LYS 27 Ca 0.04 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.89 2v48 h LYS 27 Cb 0.02 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.29 2v48 h LYS 27 CO -0.01 -0.12 0.00 0.00 -2.81 0.00 0.00 179.45 176.51 2v48 n ALA 28 N -2.74 0.00 -0.26 5.00 0.00 -0.17 -1.33 120.51 121.01 2v48 n ALA 28 Ca -0.02 0.00 0.25 0.00 0.00 0.00 0.00 53.44 53.67 2v48 n ALA 28 Cb 0.13 0.00 0.46 0.00 0.00 0.00 0.00 19.45 20.03 2v48 n ALA 28 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2v48 n LYS 29 N 0.00 -0.04 0.31 0.00 2.85 -1.18 0.83 118.16 120.93 2v48 n LYS 29 Ca 0.00 1.02 -0.17 0.00 -1.05 0.00 0.00 58.31 58.11 2v48 n LYS 29 Cb 0.00 -1.87 -0.09 0.00 -0.65 0.00 0.00 35.03 32.42 2v48 n LYS 29 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 2v48 h LYS 30 N 0.00 -0.96 -0.95 -1.58 1.63 0.75 -1.62 116.57 113.85 2v48 h LYS 30 Ca 0.64 0.07 0.24 0.00 -0.85 0.00 0.00 60.65 60.75 2v48 h LYS 30 Cb 1.77 0.22 -0.13 0.00 -0.60 0.00 0.00 32.23 33.49 2v48 h LYS 30 CO -0.54 -0.64 0.48 0.66 -3.45 0.00 0.00 179.45 175.96 2v48 h SER 31 N -1.00 0.47 0.00 4.20 4.64 0.17 -1.40 113.55 120.62 2v48 h SER 31 Ca -0.07 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2v48 h SER 31 Cb 0.85 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2v48 h SER 31 CO -0.02 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.95 2v48 n ALA 32 N -2.41 -0.13 -0.18 5.18 0.00 -0.65 -0.17 120.51 122.14 2v48 n ALA 32 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2v48 n ALA 32 Cb 0.73 0.36 0.03 0.00 0.00 0.00 0.00 19.45 20.56 2v48 n ALA 32 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2v48 n ILE 33 N -2.67 -0.24 0.00 0.00 5.41 -0.54 0.49 119.36 121.81 2v48 n ILE 33 Ca 0.00 1.10 0.00 0.00 1.00 0.00 0.00 62.75 64.85 2v48 n ILE 33 Cb 0.00 -1.47 0.00 0.00 -0.71 0.00 0.00 39.64 37.46 2v48 n ILE 33 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2v48 n LYS 34 N -4.71 0.00 -0.12 0.38 5.02 0.76 -0.61 118.16 118.88 2v48 n LYS 34 Ca 0.06 0.79 -0.03 0.00 -2.02 0.00 0.00 58.31 57.11 2v48 n LYS 34 Cb 0.20 -1.39 -0.03 0.00 -0.02 0.00 0.00 35.03 33.79 2v48 n LYS 34 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2v48 n THR 35 N -2.38 -0.20 -0.04 -0.18 -2.24 0.18 -1.48 114.28 107.94 2v48 n THR 35 Ca 0.00 1.66 -0.01 0.00 -2.27 0.00 0.00 64.05 63.43 2v48 n THR 35 Cb 0.00 -2.14 -0.01 0.00 -2.10 0.00 0.00 70.33 66.08 2v48 n THR 35 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2v48 n LEU 36 N -3.63 -0.11 -0.13 3.22 7.99 -0.95 -0.64 117.00 122.75 2v48 n LEU 36 Ca 0.01 0.99 -0.03 0.00 -0.01 0.00 0.00 56.01 56.96 2v48 n LEU 36 Cb 0.08 -0.43 -0.03 0.00 -0.11 0.00 0.00 43.42 42.93 2v48 n LEU 36 CO -0.05 -0.55 0.26 -1.20 -1.51 0.00 0.00 177.39 174.35 2v48 n SER 37 N -3.16 -0.34 0.18 -1.43 7.64 0.23 0.47 113.62 117.22 2v48 n SER 37 Ca 0.00 0.79 -0.08 0.00 1.01 0.00 0.00 58.87 60.59 2v48 n SER 37 Cb 0.03 -0.18 -0.04 0.00 -1.01 0.00 0.00 64.21 63.00 2v48 n SER 37 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2v48 h LYS 38 N 0.00 -0.48 -0.85 1.43 1.57 -0.83 -2.38 116.57 115.03 2v48 h LYS 38 Ca 0.05 0.03 0.29 0.00 -1.87 0.00 0.00 60.65 59.16 2v48 h LYS 38 Cb 0.13 0.11 -0.16 0.00 0.08 0.00 0.00 32.23 32.39 2v48 h LYS 38 CO -0.30 -0.32 0.22 1.17 -0.57 0.00 0.00 179.45 179.65 2v48 n LYS 39 N -3.54 -0.06 -0.09 3.15 4.81 0.19 0.27 118.16 122.90 2v48 n LYS 39 Ca -0.06 1.23 -0.06 0.00 -0.87 0.00 0.00 58.31 58.54 2v48 n LYS 39 Cb 0.21 -2.06 0.00 0.00 0.02 0.00 0.00 35.03 33.20 2v48 n LYS 39 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2v48 h ALA 40 N 1.70 0.26 0.00 3.14 0.00 0.50 -1.77 119.26 123.09 2v48 h ALA 40 Ca 0.61 0.10 -0.18 0.00 0.00 0.00 0.00 54.91 55.44 2v48 h ALA 40 Cb 1.46 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 2v48 h ALA 40 CO -0.73 -0.43 -0.85 -0.84 0.00 0.00 0.00 179.25 176.40 2v48 h ILE 41 N 0.06 1.56 0.00 0.00 3.07 0.44 -3.09 117.51 119.55 2v48 h ILE 41 Ca 0.15 -2.77 0.00 0.00 1.55 0.00 0.00 64.86 63.79 2v48 h ILE 41 Cb 0.21 2.52 0.00 0.00 -0.27 0.00 0.00 36.82 39.28 2v48 h ILE 41 CO -0.28 0.80 0.00 1.67 -1.05 0.00 0.00 178.15 179.29 2v48 n GLN 42 N -3.59 0.00 0.00 0.16 -0.06 0.38 -1.03 117.38 113.25 2v48 n GLN 42 Ca -0.02 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.98 2v48 n GLN 42 Cb 0.80 -1.12 0.00 0.00 -4.06 0.00 0.00 30.24 25.86 2v48 n GLN 42 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 2v48 n LEU 43 N -0.51 0.20 -0.29 1.69 4.77 -1.20 -4.33 117.00 117.33 2v48 n LEU 43 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 2v48 n LEU 43 Cb 0.00 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.33 2v48 n LEU 43 CO 0.00 -0.22 0.88 0.00 -1.33 0.00 0.00 177.39 176.72 2v48 h ALA 44 N 0.00 1.07 -0.03 -1.18 0.00 -1.00 1.35 119.26 119.47 2v48 h ALA 44 Ca 0.00 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2v48 h ALA 44 Cb 0.39 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 2v48 h ALA 44 CO 0.00 -0.46 -0.00 0.37 0.00 0.00 0.00 179.25 179.16 2v48 h GLN 45 N 0.15 0.06 0.00 0.00 -0.00 -1.34 -2.47 115.11 111.50 2v48 h GLN 45 Ca 0.50 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 59.13 2v48 h GLN 45 Cb 0.97 -0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.45 2v48 h GLN 45 CO -0.68 0.38 0.00 -1.91 0.00 0.00 0.00 178.83 176.61 2v48 n GLU 46 N -4.89 0.01 -2.39 1.69 2.13 0.34 -4.83 120.64 112.71 2v48 n GLU 46 Ca -0.07 0.37 -0.02 0.00 0.66 0.00 0.00 57.16 58.10 2v48 n GLU 46 Cb 0.19 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.41 2v48 n GLU 46 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2v48 n GLY 47 N -1.27 0.67 0.00 8.31 0.00 0.38 -5.01 105.19 108.26 2v48 n GLY 47 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2v48 n GLY 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2v48 n LYS 48 N -0.92 0.00 0.00 1.61 4.76 -0.88 -5.02 118.16 117.71 2v48 n LYS 48 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 2v48 n LYS 48 Cb 0.51 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.70 2v48 n LYS 48 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2v48 n ALA 49 N -3.00 0.00 -0.28 7.82 0.00 -1.26 -4.92 120.51 118.87 2v48 n ALA 49 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2v48 n ALA 49 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2v48 n ALA 49 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2v48 n GLU 50 N 0.00 -0.21 -0.01 0.00 0.28 -1.26 0.82 120.64 120.26 2v48 n GLU 50 Ca 0.00 1.10 -0.16 0.00 -0.16 0.00 0.00 57.16 57.94 2v48 n GLU 50 Cb 0.00 -1.63 -0.10 0.00 1.43 0.00 0.00 31.44 31.14 2v48 n GLU 50 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2v48 h GLU 51 N 0.00 0.39 -0.58 3.44 4.11 -1.97 0.33 114.58 120.30 2v48 h GLU 51 Ca 0.21 -0.37 0.06 0.00 0.07 0.00 0.00 59.36 59.34 2v48 h GLU 51 Cb 0.39 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 29.64 2v48 h GLU 51 CO -0.70 1.03 -0.56 0.00 0.07 0.00 0.00 179.01 178.84 2v48 h ALA 52 N 0.37 -0.72 -0.22 1.06 0.00 -0.52 -1.42 119.26 117.81 2v48 h ALA 52 Ca -0.05 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2v48 h ALA 52 Cb 1.17 1.20 -0.01 0.00 0.00 0.00 0.00 17.79 20.15 2v48 h ALA 52 CO 0.10 -1.03 -0.03 -0.07 0.00 0.00 0.00 179.25 178.22 2v48 h LEU 53 N -0.28 0.41 -1.07 0.00 3.38 0.38 -2.83 115.31 115.30 2v48 h LEU 53 Ca 0.10 -0.34 0.42 0.00 0.09 0.00 0.00 57.88 58.15 2v48 h LEU 53 Cb 0.54 -0.11 -0.16 0.00 0.09 0.00 0.00 40.66 41.01 2v48 h LEU 53 CO -0.69 0.65 0.61 1.17 0.09 0.00 0.00 178.44 180.28 2v48 n LYS 54 N -4.63 -0.05 0.35 1.13 4.81 0.12 0.14 118.16 120.03 2v48 n LYS 54 Ca -0.04 1.30 -0.16 0.00 -0.87 0.00 0.00 58.31 58.53 2v48 n LYS 54 Cb 0.26 -2.39 -0.08 0.00 0.02 0.00 0.00 35.03 32.84 2v48 n LYS 54 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 2v48 h ILE 55 N 0.00 0.00 -1.00 3.15 1.08 -1.03 -1.68 117.51 118.03 2v48 h ILE 55 Ca 0.83 0.00 0.29 0.00 -0.39 0.00 0.00 64.86 65.59 2v48 h ILE 55 Cb 2.33 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 36.04 2v48 h ILE 55 CO -0.66 0.00 1.16 -0.03 -0.69 0.00 0.00 178.15 177.93 2v48 h MET 56 N -1.00 0.00 0.00 2.37 4.05 0.12 1.31 114.93 121.78 2v48 h MET 56 Ca -0.09 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2v48 h MET 56 Cb 0.80 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.60 2v48 h MET 56 CO 0.08 0.00 0.00 -2.13 0.23 0.00 0.00 176.91 175.09 2v48 n ARG 57 N -3.30 0.00 -0.31 0.39 3.00 -0.64 -0.28 116.66 115.52 2v48 n ARG 57 Ca 0.22 0.00 0.17 0.00 -0.00 0.00 0.00 57.85 58.25 2v48 n ARG 57 Cb 1.46 -0.50 0.36 0.00 0.00 0.00 0.00 32.46 33.79 2v48 n ARG 57 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 2v48 h LYS 58 N 0.00 0.17 0.16 -0.14 1.63 -1.15 0.74 116.57 118.00 2v48 h LYS 58 Ca 0.00 -0.01 0.02 0.00 -0.85 0.00 0.00 60.65 59.81 2v48 h LYS 58 Cb 0.00 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.55 2v48 h LYS 58 CO 0.00 0.12 -0.40 0.00 -3.45 0.00 0.00 179.45 175.72 2v48 h ALA 59 N 1.85 -0.73 -0.01 5.00 0.00 0.15 0.67 119.26 126.20 2v48 h ALA 59 Ca 0.63 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.46 2v48 h ALA 59 Cb 1.37 0.65 -0.00 0.00 0.00 0.00 0.00 17.79 19.80 2v48 h ALA 59 CO -0.70 -0.97 -0.04 1.49 0.00 0.00 0.00 179.25 179.03 2v48 h GLU 60 N -0.66 -0.04 -0.68 0.00 4.81 0.36 -1.21 114.58 117.15 2v48 h GLU 60 Ca 0.01 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.35 2v48 h GLU 60 Cb 0.67 0.01 -0.12 0.00 0.63 0.00 0.00 28.75 29.94 2v48 h GLU 60 CO -0.21 -0.03 -0.43 1.03 -0.73 0.00 0.00 179.01 178.64 2v48 h SER 61 N -0.04 -1.52 -1.03 1.04 0.87 -0.99 0.41 113.55 112.27 2v48 h SER 61 Ca 0.00 0.26 0.37 0.00 -1.23 0.00 0.00 61.79 61.20 2v48 h SER 61 Cb 0.05 0.71 -0.16 0.00 -0.44 0.00 0.00 62.40 62.56 2v48 h SER 61 CO -0.03 -0.32 0.59 -0.07 -0.53 0.00 0.00 176.83 176.47 2v48 h LEU 62 N -0.17 0.41 0.00 2.23 3.38 0.89 -1.43 115.31 120.62 2v48 h LEU 62 Ca 0.21 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.39 2v48 h LEU 62 Cb 0.55 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2v48 h LEU 62 CO -0.76 -0.27 0.00 -0.38 0.09 0.00 0.00 178.44 177.12 2v48 n ILE 63 N -5.10 0.00 0.00 1.22 5.41 0.14 -3.59 119.36 117.44 2v48 n ILE 63 Ca 0.35 0.28 0.00 0.00 1.00 0.00 0.00 62.75 64.38 2v48 n ILE 63 Cb 1.16 -1.21 0.00 0.00 -0.71 0.00 0.00 39.64 38.87 2v48 n ILE 63 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2v48 n ASP 64 N 0.00 0.00 -0.73 4.38 9.92 -1.00 0.26 116.55 129.38 2v48 n ASP 64 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2v48 n ASP 64 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2v48 n ASP 64 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2v48 n LYS 65 N -3.12 0.48 -0.00 -1.24 5.02 -0.57 -0.76 118.16 117.97 2v48 n LYS 65 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 2v48 n LYS 65 Cb 0.00 -1.25 -0.07 0.00 -0.02 0.00 0.00 35.03 33.69 2v48 n LYS 65 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2v48 n ALA 66 N 0.48 2.56 0.09 7.82 0.00 0.72 -4.48 120.51 127.71 2v48 n ALA 66 Ca 0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 53.44 53.11 2v48 n ALA 66 Cb 0.18 -0.35 -0.00 0.00 0.00 0.00 0.00 19.45 19.27 2v48 n ALA 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2v48 h ALA 67 N 1.03 0.55 0.00 0.00 0.00 -0.94 -3.09 119.26 116.81 2v48 h ALA 67 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 2v48 h ALA 67 Cb 0.42 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2v48 h ALA 67 CO 0.00 0.93 0.03 1.63 0.00 0.00 0.00 179.25 181.84 2v48 n LYS 68 N -3.64 0.01 -0.95 0.00 5.02 -1.26 -4.61 118.16 112.72 2v48 n LYS 68 Ca -0.03 0.48 0.00 0.00 -2.02 0.00 0.00 58.31 56.74 2v48 n LYS 68 Cb 0.80 -1.56 0.00 0.00 -0.02 0.00 0.00 35.03 34.26 2v48 n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2v48 n GLY 69 N -1.46 6.01 2.14 0.72 0.00 -1.17 -5.01 105.19 106.41 2v48 n GLY 69 Ca -0.00 -2.07 -0.22 0.00 0.00 0.00 0.00 46.02 43.72 2v48 n GLY 69 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2v48 n SER 70 N -0.55 3.77 0.00 1.61 7.64 -1.26 -4.82 113.62 120.01 2v48 n SER 70 Ca 0.00 -3.49 0.00 0.00 1.01 0.00 0.00 58.87 56.39 2v48 n SER 70 Cb 0.00 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 2v48 n SER 70 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2v48 n THR 71 N -1.02 0.00 -2.03 0.44 -1.04 -1.23 -4.89 114.28 104.50 2v48 n THR 71 Ca 0.56 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 62.15 2v48 n THR 71 Cb 1.57 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 70.06 2v48 n THR 71 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2v48 s LEU 72 N 0.00 3.46 0.21 -4.42 1.43 -1.23 -4.95 118.68 113.19 2v48 s LEU 72 Ca 0.00 1.04 0.03 0.00 -1.03 0.00 0.00 54.13 54.17 2v48 s LEU 72 Cb 0.00 -3.27 -0.03 0.00 0.03 0.00 0.00 46.19 42.92 2v48 s LEU 72 CO 0.00 -1.86 0.35 -1.00 0.23 0.00 0.00 176.35 174.07 2v48 s HIS 73 N 7.36 3.47 0.00 0.29 3.76 -1.26 -3.30 115.29 125.60 2v48 s HIS 73 Ca 0.76 0.08 0.00 0.00 -0.15 0.00 0.00 55.06 55.75 2v48 s HIS 73 Cb -0.19 -1.65 0.00 0.00 1.11 0.00 0.00 32.58 31.85 2v48 s HIS 73 CO 0.30 0.44 0.00 0.36 -0.85 0.00 0.00 174.74 174.99 2v48 n LYS 74 N -1.09 0.00 0.17 1.40 0.00 -1.26 0.82 118.16 118.20 2v48 n LYS 74 Ca -0.08 0.00 0.16 0.00 -0.00 0.00 0.00 58.31 58.40 2v48 n LYS 74 Cb 0.56 0.00 0.60 0.00 -0.00 0.00 0.00 35.03 36.19 2v48 n LYS 74 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 2v48 h ASN 75 N 0.00 0.00 -0.50 -5.58 2.35 -1.98 1.16 115.58 111.03 2v48 h ASN 75 Ca 0.00 0.00 0.10 0.00 -0.55 0.00 0.00 56.30 55.85 2v48 h ASN 75 Cb 0.00 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.29 2v48 h ASN 75 CO 0.00 0.00 0.01 0.00 -1.65 0.00 0.00 177.43 175.79 2v48 h ALA 76 N 1.03 0.49 0.32 -0.83 0.00 0.11 0.59 119.26 120.97 2v48 h ALA 76 Ca 0.14 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2v48 h ALA 76 Cb 1.37 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.37 2v48 h ALA 76 CO -0.00 -0.38 -0.44 0.00 0.00 0.00 0.00 179.25 178.43 2v48 h ALA 77 N 1.44 -0.90 -3.00 0.00 0.00 0.13 -2.47 119.26 114.46 2v48 h ALA 77 Ca 0.25 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2v48 h ALA 77 Cb 0.38 0.67 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2v48 h ALA 77 CO -0.41 -1.06 0.00 0.00 0.00 0.00 0.00 179.25 177.79 2v48 n ALA 78 N -2.78 0.00 -0.09 0.00 0.00 0.51 -1.40 120.51 116.74 2v48 n ALA 78 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2v48 n ALA 78 Cb 0.41 0.10 0.02 0.00 0.00 0.00 0.00 19.45 19.97 2v48 n ALA 78 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2v48 n ARG 79 N -0.49 -0.05 -0.18 0.00 0.63 0.18 0.17 116.66 116.92 2v48 n ARG 79 Ca 0.00 0.38 -0.09 0.00 -0.92 0.00 0.00 57.85 57.23 2v48 n ARG 79 Cb 0.00 -0.57 0.01 0.00 0.45 0.00 0.00 32.46 32.35 2v48 n ARG 79 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2v48 h ARG 80 N 0.00 0.81 0.02 -0.14 2.47 -1.23 -2.93 114.38 113.38 2v48 h ARG 80 Ca 0.09 -0.20 -0.05 0.00 -1.26 0.00 0.00 59.98 58.56 2v48 h ARG 80 Cb 0.16 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.37 2v48 h ARG 80 CO -0.25 0.78 -0.25 0.87 0.56 0.00 0.00 179.97 181.68 2v48 h LYS 81 N 0.69 0.05 0.00 0.04 1.57 0.30 -0.05 116.57 119.17 2v48 h LYS 81 Ca 0.16 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2v48 h LYS 81 Cb 0.34 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.68 2v48 h LYS 81 CO 0.00 1.04 0.00 -1.13 -0.57 0.00 0.00 179.45 178.79 2v48 n SER 82 N -4.51 0.00 0.00 0.86 3.41 0.46 -1.67 113.62 112.17 2v48 n SER 82 Ca -0.13 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 2v48 n SER 82 Cb 0.56 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 2v48 n SER 82 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2v48 n ARG 83 N -1.10 2.52 0.32 4.33 1.74 -1.11 -4.23 116.66 119.13 2v48 n ARG 83 Ca 0.02 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.97 2v48 n ARG 83 Cb 0.01 -0.78 -0.06 0.00 -1.02 0.00 0.00 32.46 30.61 2v48 n ARG 83 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2v48 h LEU 84 N 0.00 -0.70 -0.74 0.55 7.12 -0.07 -1.40 115.31 120.07 2v48 h LEU 84 Ca 0.00 0.02 -0.12 0.00 0.13 0.00 0.00 57.88 57.91 2v48 h LEU 84 Cb 0.18 0.18 -0.02 0.00 -0.53 0.00 0.00 40.66 40.48 2v48 h LEU 84 CO 0.00 -0.41 -0.57 0.00 -0.13 0.00 0.00 178.44 177.32 2v48 h MET 85 N -1.00 0.00 -0.73 1.25 -0.00 -1.71 -0.50 114.93 112.24 2v48 h MET 85 Ca -0.08 0.00 0.11 0.00 -0.00 0.00 0.00 59.70 59.73 2v48 h MET 85 Cb 0.63 0.00 -0.05 0.00 -0.00 0.00 0.00 31.60 32.18 2v48 h MET 85 CO 0.14 0.57 0.48 -0.09 -0.00 0.00 0.00 176.91 178.02 2v48 h ARG 86 N 0.00 0.54 0.13 -0.10 2.43 -1.69 -1.40 114.38 114.30 2v48 h ARG 86 Ca -0.01 -0.03 -0.32 0.00 -0.81 0.00 0.00 59.98 58.81 2v48 h ARG 86 Cb 1.09 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 2v48 h ARG 86 CO 0.07 0.36 -1.66 -0.22 -1.51 0.00 0.00 179.97 177.02 2v48 h LYS 87 N 0.56 0.28 0.17 0.20 1.63 -0.80 -3.36 116.57 115.25 2v48 h LYS 87 Ca 0.35 -0.48 0.01 0.00 -0.85 0.00 0.00 60.65 59.68 2v48 h LYS 87 Cb 0.59 0.18 -0.02 0.00 -0.60 0.00 0.00 32.23 32.38 2v48 h LYS 87 CO -0.12 1.23 -0.19 0.28 -3.45 0.00 0.00 179.45 177.20 2v48 h VAL 88 N -0.13 0.58 -0.87 2.00 2.07 -0.70 -1.88 116.25 117.32 2v48 h VAL 88 Ca -0.35 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.39 2v48 h VAL 88 Cb 1.90 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 32.20 2v48 h VAL 88 CO 0.08 0.00 0.60 -0.09 0.02 0.00 0.00 177.57 178.18 2v48 h ARG 89 N -0.40 0.20 -1.70 1.57 2.43 -1.47 0.13 114.38 115.15 2v48 h ARG 89 Ca 0.01 -0.01 -0.73 0.00 -0.81 0.00 0.00 59.98 58.43 2v48 h ARG 89 Cb 0.38 -0.05 -0.28 0.00 -0.42 0.00 0.00 29.97 29.60 2v48 h ARG 89 CO -0.06 0.13 0.91 1.04 -1.51 0.00 0.00 179.97 180.48 2v48 n GLN 90 N -4.41 2.78 0.00 0.20 6.02 -0.72 -3.38 117.38 117.88 2v48 n GLN 90 Ca 0.18 -3.51 0.00 0.00 -0.01 0.00 0.00 57.00 53.66 2v48 n GLN 90 Cb 0.80 -2.27 0.00 0.00 1.02 0.00 0.00 30.24 29.78 2v48 n GLN 90 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2v48 n LEU 91 N -0.64 0.00 -1.25 1.08 4.77 -0.03 -4.80 117.00 116.13 2v48 n LEU 91 Ca 0.56 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.58 2v48 n LEU 91 Cb 0.37 0.09 0.24 0.00 -2.33 0.00 0.00 43.42 41.79 2v48 n LEU 91 CO 0.58 -0.24 0.63 0.18 -1.33 0.00 0.00 177.39 177.21 2v48 n LEU 92 N -1.98 3.61 -1.04 2.23 4.77 -0.83 -3.33 117.00 120.43 2v48 n LEU 92 Ca 0.00 -1.83 0.10 0.00 -0.03 0.00 0.00 56.01 54.26 2v48 n LEU 92 Cb 0.00 -0.56 0.27 0.00 -2.33 0.00 0.00 43.42 40.79 2v48 n LEU 92 CO 0.00 0.49 0.73 -1.84 -1.33 0.00 0.00 177.39 175.44 2v48 n GLU 93 N 0.44 2.33 -2.71 3.23 0.00 -1.22 -4.25 120.64 118.47 2v48 n GLU 93 Ca 0.16 -2.04 -0.43 0.00 0.00 0.00 0.00 57.16 54.86 2v48 n GLU 93 Cb 0.75 -1.47 0.01 0.00 0.00 0.00 0.00 31.44 30.73 2v48 n GLU 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2v48 n ALA 94 N 1.19 5.36 -3.08 -1.84 0.00 -1.21 -4.81 120.51 116.12 2v48 n ALA 94 Ca 0.19 -4.60 -0.09 0.00 0.00 0.00 0.00 53.44 48.95 2v48 n ALA 94 Cb 0.51 -2.59 0.01 0.00 0.00 0.00 0.00 19.45 17.38 2v48 n ALA 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2v48 n ALA 95 N 2.18 -2.61 0.00 0.00 0.00 -1.26 -4.95 120.51 113.87 2v48 n ALA 95 Ca 0.33 0.36 0.00 0.00 0.00 0.00 0.00 53.44 54.13 2v48 n ALA 95 Cb 0.34 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2v48 n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2v48 n GLY 96 N 0.63 0.00 0.00 0.00 0.00 -1.26 -5.14 105.19 99.43 2v48 n GLY 96 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2v48 n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2v48 n ALA 97 N 0.00 -0.32 -0.45 4.61 0.00 -1.26 -4.51 120.51 118.59 2v48 n ALA 97 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 2v48 n ALA 97 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2v48 n ALA 97 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2v48 n PRO 98 N 0.00 0.90 -0.34 0.00 -0.02 -1.26 -4.66 135.00 129.62 2v48 n PRO 98 Ca 0.00 -1.04 0.31 0.00 -2.02 0.00 0.00 63.50 60.74 2v48 n PRO 98 Cb 0.00 -2.32 0.47 0.00 -0.02 0.00 0.00 33.50 31.63 2v48 n PRO 98 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2v48 n LEU 99 N 5.47 0.00 -4.88 2.45 4.77 -1.26 -4.33 117.00 119.21 2v48 n LEU 99 Ca 0.27 0.68 -0.30 0.00 -0.03 0.00 0.00 56.01 56.63 2v48 n LEU 99 Cb 0.14 -0.29 -0.05 0.00 -2.33 0.00 0.00 43.42 40.90 2v48 n LEU 99 CO 0.71 -0.68 -0.17 -0.63 -1.33 0.00 0.00 177.39 175.29 2v48 s ILE 100 N -4.16 5.15 0.09 -0.08 1.09 -1.26 -4.98 121.20 117.05 2v48 s ILE 100 Ca -0.03 -0.54 0.16 0.00 -1.10 0.00 0.00 60.65 59.15 2v48 s ILE 100 Cb 0.15 -3.53 0.08 0.00 -1.06 0.00 0.00 42.46 38.11 2v48 s ILE 100 CO 0.51 0.10 1.62 1.23 -0.10 0.00 0.00 174.94 178.30 2v48 h GLY 101 N 2.99 0.00 0.00 6.18 0.00 -1.87 -3.45 103.07 106.93 2v48 h GLY 101 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2v48 h GLY 101 CO 0.72 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.87 2v48 n GLY 102 N 0.56 0.39 0.00 4.60 0.00 -1.26 -1.92 105.19 107.56 2v48 n GLY 102 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2v48 n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2v48 n GLY 103 N 0.00 1.00 3.88 -0.02 0.00 -1.26 -4.94 105.19 103.85 2v48 n GLY 103 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2v48 n GLY 103 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2v48 s LEU 104 N 0.00 4.16 -0.37 0.99 0.20 -0.81 -5.06 118.68 117.80 2v48 s LEU 104 Ca 0.00 0.13 -0.20 0.00 0.69 0.00 0.00 54.13 54.75 2v48 s LEU 104 Cb 0.00 -2.77 0.00 0.00 -0.43 0.00 0.00 46.19 43.00 2v48 s LEU 104 CO 0.00 0.12 0.60 -0.94 -0.29 0.00 0.00 176.35 175.84 2v48 s SER 105 N -2.79 6.37 0.00 3.68 1.04 -1.26 -4.78 113.70 115.96 2v48 s SER 105 Ca 0.33 0.01 0.15 0.00 0.48 0.00 0.00 55.95 56.92 2v48 s SER 105 Cb -0.12 -2.31 0.89 0.00 0.10 0.00 0.00 66.02 64.59 2v48 s SER 105 CO 0.26 -0.58 1.31 0.00 0.98 0.00 0.00 173.24 175.21