#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dvc n ILE 7 N 0.00 -9.49 -1.78 1.12 2.08 -1.26 -4.79 119.36 105.24 1dvc n ILE 7 Ca 0.00 0.29 -0.42 0.00 0.56 0.00 0.00 62.75 63.19 1dvc n ILE 7 Cb 0.00 -6.48 -0.01 0.00 -0.75 0.00 0.00 39.64 32.40 1dvc n ILE 7 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1dvc n PRO 8 N -1.08 2.58 -2.23 0.38 -0.04 -1.26 -4.59 135.00 128.76 1dvc n PRO 8 Ca 0.02 -2.56 -0.04 0.00 -0.04 0.00 0.00 63.50 60.88 1dvc n PRO 8 Cb 0.52 -3.28 -0.03 0.00 -0.04 0.00 0.00 33.50 30.67 1dvc n PRO 8 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dvc n GLY 9 N 4.51 -4.50 0.00 0.55 0.00 -1.26 -4.91 105.19 99.57 1dvc n GLY 9 Ca 0.51 1.07 0.00 0.00 0.00 0.00 0.00 46.02 47.59 1dvc n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dvc n GLY 10 N 1.11 -1.27 3.34 -0.02 0.00 -1.26 -4.73 105.19 102.36 1dvc n GLY 10 Ca -0.28 0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 1dvc n GLY 10 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dvc n LEU 11 N -0.23 -1.99 0.00 0.99 4.77 -0.90 -4.93 117.00 114.72 1dvc n LEU 11 Ca 0.00 -0.41 -0.21 0.00 -0.03 0.00 0.00 56.01 55.36 1dvc n LEU 11 Cb 0.00 -2.41 0.20 0.00 -2.33 0.00 0.00 43.42 38.88 1dvc n LEU 11 CO 0.00 0.22 0.24 -1.20 -1.33 0.00 0.00 177.39 175.31 1dvc n SER 12 N -2.42 -3.52 -4.15 -1.43 7.64 -1.26 -4.88 113.62 103.60 1dvc n SER 12 Ca -0.03 -0.60 -0.35 0.00 1.01 0.00 0.00 58.87 58.89 1dvc n SER 12 Cb 0.56 -0.68 0.07 0.00 -1.01 0.00 0.00 64.21 63.15 1dvc n SER 12 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1dvc n GLU 13 N -4.63 -0.18 -2.12 1.43 2.13 -1.26 -4.65 120.64 111.36 1dvc n GLU 13 Ca 0.09 -0.04 -0.29 0.00 0.66 0.00 0.00 57.16 57.59 1dvc n GLU 13 Cb 0.41 -1.32 -0.05 0.00 0.27 0.00 0.00 31.44 30.75 1dvc n GLU 13 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1dvc s ALA 14 N -2.14 1.86 0.92 4.31 0.00 -1.26 -4.74 121.76 120.71 1dvc s ALA 14 Ca 0.46 -1.86 -0.13 0.00 0.00 0.00 0.00 51.96 50.42 1dvc s ALA 14 Cb -0.16 -4.60 0.02 0.00 0.00 0.00 0.00 23.12 18.37 1dvc s ALA 14 CO 0.76 -4.82 0.37 1.63 0.00 0.00 0.00 175.76 173.70 1dvc n LYS 15 N 8.63 -0.19 -2.63 0.00 4.76 -1.04 -4.50 118.16 123.18 1dvc n LYS 15 Ca 0.42 -0.01 -0.43 0.00 -2.87 0.00 0.00 58.31 55.41 1dvc n LYS 15 Cb 0.47 -1.81 -0.02 0.00 -1.84 0.00 0.00 35.03 31.82 1dvc n LYS 15 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1dvc s PRO 16 N -3.44 4.17 0.96 1.97 0.04 -1.26 -1.39 135.00 136.05 1dvc s PRO 16 Ca 0.57 1.25 -0.16 0.00 0.04 0.00 0.00 61.00 62.70 1dvc s PRO 16 Cb -0.23 -3.69 -0.12 0.00 0.04 0.00 0.00 34.50 30.50 1dvc s PRO 16 CO 0.67 -0.76 -0.57 0.00 0.04 0.00 0.00 177.00 176.38 1dvc n ALA 17 N 6.60 -4.87 -3.00 8.56 0.00 -0.69 -4.87 120.51 122.25 1dvc n ALA 17 Ca 0.12 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1dvc n ALA 17 Cb 0.46 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1dvc n ALA 17 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1dvc n THR 18 N -2.59 0.00 0.41 0.00 -2.24 -1.26 -4.96 114.28 103.64 1dvc n THR 18 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 1dvc n THR 18 Cb 0.55 0.00 0.42 0.00 -2.10 0.00 0.00 70.33 69.20 1dvc n THR 18 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1dvc h PRO 19 N 0.00 0.00 0.08 -0.78 0.13 -1.98 -1.96 132.00 127.48 1dvc h PRO 19 Ca 0.00 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.81 1dvc h PRO 19 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1dvc h PRO 19 CO 0.00 0.00 -1.74 0.93 -0.23 0.00 0.00 178.00 176.96 1dvc h GLU 20 N 0.00 0.18 0.16 0.86 5.08 -1.99 -3.19 114.58 115.68 1dvc h GLU 20 Ca 0.00 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 1dvc h GLU 20 Cb 0.68 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1dvc h GLU 20 CO 0.00 0.96 -0.08 0.82 -1.00 0.00 0.00 179.01 179.71 1dvc h ILE 21 N 0.05 0.96 -0.05 3.13 1.08 -1.91 -1.92 117.51 118.84 1dvc h ILE 21 Ca -0.32 -0.87 0.02 0.00 -0.39 0.00 0.00 64.86 63.29 1dvc h ILE 21 Cb 2.02 1.47 -0.00 0.00 -3.07 0.00 0.00 36.82 37.24 1dvc h ILE 21 CO 0.11 0.19 0.28 -0.61 -0.69 0.00 0.00 178.15 177.43 1dvc h GLN 22 N -0.67 0.00 0.15 2.37 5.75 -1.52 0.23 115.11 121.43 1dvc h GLN 22 Ca -0.02 0.00 -0.28 0.00 -0.15 0.00 0.00 58.65 58.20 1dvc h GLN 22 Cb 0.49 0.00 0.03 0.00 1.07 0.00 0.00 27.48 29.07 1dvc h GLN 22 CO 0.04 0.00 -1.20 1.49 -2.65 0.00 0.00 178.83 176.51 1dvc h GLU 23 N 0.00 0.54 -0.21 1.69 4.81 -1.40 0.17 114.58 120.18 1dvc h GLU 23 Ca 0.02 -0.78 0.00 0.00 -0.13 0.00 0.00 59.36 58.47 1dvc h GLU 23 Cb 0.58 0.27 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 1dvc h GLU 23 CO -0.00 1.36 0.14 0.82 -0.73 0.00 0.00 179.01 180.60 1dvc h ILE 24 N 0.11 1.05 -0.01 2.32 2.04 0.19 0.18 117.51 123.39 1dvc h ILE 24 Ca -0.19 -0.10 -0.16 0.00 1.00 0.00 0.00 64.86 65.41 1dvc h ILE 24 Cb 1.90 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.71 1dvc h ILE 24 CO 0.23 0.05 -0.71 1.62 0.00 0.00 0.00 178.15 179.34 1dvc h VAL 25 N 0.29 1.48 0.00 1.67 3.04 -1.51 -2.66 116.25 118.56 1dvc h VAL 25 Ca 0.08 -2.37 0.00 0.00 -1.01 0.00 0.00 66.70 63.40 1dvc h VAL 25 Cb -0.03 2.27 0.00 0.00 -2.01 0.00 0.00 31.29 31.52 1dvc h VAL 25 CO -0.02 0.68 0.00 -0.78 -1.01 0.00 0.00 177.57 176.44 1dvc h ASP 26 N 0.05 0.00 0.92 3.17 3.58 -0.42 -0.29 116.42 123.42 1dvc h ASP 26 Ca -0.01 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.35 1dvc h ASP 26 Cb 1.26 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.30 1dvc h ASP 26 CO 0.10 0.00 -1.14 0.11 -2.88 0.00 0.00 179.24 175.43 1dvc h LYS 27 N 0.00 0.00 -0.13 0.28 1.57 -0.36 -3.31 116.57 114.62 1dvc h LYS 27 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1dvc h LYS 27 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1dvc h LYS 27 CO 0.00 0.16 0.00 1.33 -0.57 0.00 0.00 179.45 180.37 1dvc n VAL 28 N -2.82 0.17 -0.24 0.50 0.24 -0.99 -4.47 118.33 110.72 1dvc n VAL 28 Ca -0.04 -0.59 0.02 0.00 -2.04 0.00 0.00 64.34 61.69 1dvc n VAL 28 Cb 0.70 1.27 0.14 0.00 -1.47 0.00 0.00 33.84 34.48 1dvc n VAL 28 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1dvc h LYS 29 N 4.03 0.52 0.01 7.34 3.64 -1.15 0.14 116.57 131.11 1dvc h LYS 29 Ca 0.00 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.16 1dvc h LYS 29 Cb 0.88 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1dvc h LYS 29 CO 0.00 0.35 -0.87 -1.00 -2.27 0.00 0.00 179.45 175.66 1dvc h PRO 30 N 0.54 0.08 0.00 1.90 0.13 -1.84 -2.87 132.00 129.95 1dvc h PRO 30 Ca 0.35 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 65.39 1dvc h PRO 30 Cb 0.42 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.58 1dvc h PRO 30 CO -0.30 0.90 0.00 1.04 -0.23 0.00 0.00 178.00 179.41 1dvc n GLN 31 N -3.58 0.39 -0.07 0.86 6.02 -0.46 -3.29 117.38 117.26 1dvc n GLN 31 Ca -0.02 0.04 -0.20 0.00 -0.01 0.00 0.00 57.00 56.81 1dvc n GLN 31 Cb 0.82 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 30.45 1dvc n GLN 31 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1dvc n LEU 32 N -1.26 2.75 0.21 1.08 4.77 0.38 -3.24 117.00 121.68 1dvc n LEU 32 Ca 0.13 0.05 0.15 0.00 -0.03 0.00 0.00 56.01 56.31 1dvc n LEU 32 Cb 0.19 -1.00 0.64 0.00 -2.33 0.00 0.00 43.42 40.92 1dvc n LEU 32 CO 0.19 0.86 0.93 -0.33 -1.33 0.00 0.00 177.39 177.72 1dvc h GLU 33 N -0.05 0.00 0.00 3.23 5.08 -1.52 -1.47 114.58 119.85 1dvc h GLU 33 Ca -0.51 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1dvc h GLU 33 Cb 1.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.17 1dvc h GLU 33 CO -0.03 0.00 -0.87 0.39 -1.00 0.00 0.00 179.01 177.50 1dvc n GLU 34 N -2.63 1.56 -0.06 2.33 1.02 -1.22 -2.96 120.64 118.68 1dvc n GLU 34 Ca 0.01 -0.02 -0.04 0.00 -0.02 0.00 0.00 57.16 57.09 1dvc n GLU 34 Cb 0.22 -1.27 -0.16 0.00 -0.02 0.00 0.00 31.44 30.22 1dvc n GLU 34 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1dvc n LYS 35 N -1.46 0.68 -0.02 3.49 4.81 -0.98 -4.50 118.16 120.18 1dvc n LYS 35 Ca 0.02 -0.03 0.02 0.00 -0.87 0.00 0.00 58.31 57.46 1dvc n LYS 35 Cb 0.27 -1.55 -0.09 0.00 0.02 0.00 0.00 35.03 33.68 1dvc n LYS 35 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1dvc n THR 36 N -2.65 0.23 -1.14 3.15 5.66 -0.59 -5.01 114.28 113.93 1dvc n THR 36 Ca -0.23 -0.32 0.00 0.00 -3.05 0.00 0.00 64.05 60.45 1dvc n THR 36 Cb 0.98 -0.07 0.00 0.00 -1.55 0.00 0.00 70.33 69.69 1dvc n THR 36 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1dvc n ASN 37 N -2.05 -0.79 -4.74 1.09 6.94 -1.16 -5.07 115.26 109.47 1dvc n ASN 37 Ca -0.07 0.00 -0.27 0.00 -0.02 0.00 0.00 54.58 54.22 1dvc n ASN 37 Cb 0.47 -0.31 -0.07 0.00 -2.36 0.00 0.00 39.78 37.51 1dvc n ASN 37 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1dvc s GLU 38 N -2.61 2.17 -0.70 -3.83 0.41 -1.21 -5.02 118.70 107.91 1dvc s GLU 38 Ca 0.00 -2.03 0.04 0.00 -0.41 0.00 0.00 54.97 52.56 1dvc s GLU 38 Cb 0.00 -1.84 0.33 0.00 -1.78 0.00 0.00 34.13 30.84 1dvc s GLU 38 CO 0.00 -0.22 1.15 2.41 -0.49 0.00 0.00 175.26 178.11 1dvc n THR 39 N -1.26 3.79 -0.25 3.63 -1.04 -1.26 -4.28 114.28 113.61 1dvc n THR 39 Ca -0.06 -5.67 -0.12 0.00 -2.04 0.00 0.00 64.05 56.16 1dvc n THR 39 Cb 0.65 -1.48 0.12 0.00 -1.82 0.00 0.00 70.33 67.80 1dvc n THR 39 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1dvc n TYR 40 N -0.13 -2.30 -0.09 -1.42 4.01 -1.26 -5.04 117.16 110.92 1dvc n TYR 40 Ca 0.35 -0.18 0.00 0.00 -0.16 0.00 0.00 57.90 57.90 1dvc n TYR 40 Cb 0.36 -0.80 0.00 0.00 -0.31 0.00 0.00 39.34 38.59 1dvc n TYR 40 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1dvc n GLY 43 N -1.70 4.41 3.67 2.72 0.00 -1.26 -5.06 105.19 107.98 1dvc n GLY 43 Ca 0.06 -0.43 -0.49 0.00 0.00 0.00 0.00 46.02 45.15 1dvc n GLY 43 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dvc n LYS 44 N 0.00 1.95 -2.88 1.61 5.02 -1.26 -4.68 118.16 117.92 1dvc n LYS 44 Ca 0.00 0.71 -0.36 0.00 -2.02 0.00 0.00 58.31 56.64 1dvc n LYS 44 Cb 0.00 -2.48 -0.01 0.00 -0.02 0.00 0.00 35.03 32.51 1dvc n LYS 44 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1dvc n LEU 45 N 4.73 5.98 -4.43 -0.35 4.77 -1.25 -0.47 117.00 125.98 1dvc n LEU 45 Ca 0.20 -5.45 -0.49 0.00 -0.03 0.00 0.00 56.01 50.24 1dvc n LEU 45 Cb 0.26 -0.96 -0.09 0.00 -2.33 0.00 0.00 43.42 40.31 1dvc n LEU 45 CO 0.69 2.08 1.87 -0.62 -1.33 0.00 0.00 177.39 180.08 1dvc n GLU 46 N 0.23 0.72 -1.97 3.23 1.02 -1.21 -4.39 120.64 118.27 1dvc n GLU 46 Ca 0.37 0.16 -0.41 0.00 -0.02 0.00 0.00 57.16 57.26 1dvc n GLU 46 Cb 0.33 -2.25 -0.02 0.00 -0.02 0.00 0.00 31.44 29.48 1dvc n GLU 46 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1dvc s ALA 47 N 7.84 3.61 -0.07 0.62 0.00 -1.26 -1.73 121.76 130.77 1dvc s ALA 47 Ca 1.14 1.38 -0.01 0.00 0.00 0.00 0.00 51.96 54.47 1dvc s ALA 47 Cb -0.96 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 18.56 1dvc s ALA 47 CO 0.50 -0.80 -0.07 0.28 0.00 0.00 0.00 175.76 175.67 1dvc n VAL 48 N 1.68 0.37 -4.17 0.00 0.31 -1.19 -4.63 118.33 110.69 1dvc n VAL 48 Ca 0.05 -0.12 -0.13 0.00 -0.01 0.00 0.00 64.34 64.12 1dvc n VAL 48 Cb 0.40 -1.09 -0.08 0.00 -0.91 0.00 0.00 33.84 32.16 1dvc n VAL 48 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1dvc s GLN 49 N -2.13 1.44 -0.29 5.55 -0.21 -1.25 -1.70 119.66 121.07 1dvc s GLN 49 Ca -0.09 -1.67 -0.20 0.00 0.02 0.00 0.00 55.36 53.42 1dvc s GLN 49 Cb 0.03 0.33 0.17 0.00 1.00 0.00 0.00 33.01 34.54 1dvc s GLN 49 CO 0.13 -0.52 1.19 1.52 -2.12 0.00 0.00 175.29 175.49 1dvc s TYR 50 N -3.87 -0.28 -0.10 0.91 1.13 -0.48 -1.75 117.35 112.91 1dvc s TYR 50 Ca 0.36 0.60 -0.02 0.00 -1.41 0.00 0.00 57.07 56.60 1dvc s TYR 50 Cb 0.04 0.31 -0.03 0.00 -1.10 0.00 0.00 41.96 41.17 1dvc s TYR 50 CO 0.16 -0.14 -0.02 0.15 -2.51 0.00 0.00 175.55 173.19 1dvc s LYS 51 N 0.67 3.08 0.25 -3.49 1.02 0.83 -2.49 119.74 119.62 1dvc s LYS 51 Ca -0.02 -0.45 -0.03 0.00 0.02 0.00 0.00 55.97 55.49 1dvc s LYS 51 Cb -0.04 -2.79 0.05 0.00 -0.52 0.00 0.00 37.83 34.54 1dvc s LYS 51 CO -0.12 0.60 0.34 0.25 -0.92 0.00 0.00 175.35 175.50 1dvc n THR 52 N 2.44 0.00 -3.37 2.17 -2.24 -1.26 -0.51 114.28 111.51 1dvc n THR 52 Ca -0.18 -0.34 -0.03 0.00 -2.27 0.00 0.00 64.05 61.23 1dvc n THR 52 Cb 0.53 -1.63 0.01 0.00 -2.10 0.00 0.00 70.33 67.14 1dvc n THR 52 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1dvc n GLN 53 N -1.69 0.40 -3.51 -0.78 1.13 -1.24 -2.11 117.38 109.58 1dvc n GLN 53 Ca 0.05 -0.81 -0.15 0.00 -1.94 0.00 0.00 57.00 54.15 1dvc n GLN 53 Cb 0.16 1.02 -0.05 0.00 0.11 0.00 0.00 30.24 31.49 1dvc n GLN 53 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1dvc s VAL 54 N -2.59 0.01 0.00 5.09 1.01 -1.26 -4.01 120.40 118.64 1dvc s VAL 54 Ca 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1dvc s VAL 54 Cb -0.02 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.38 1dvc s VAL 54 CO 0.04 -0.04 0.00 1.33 0.00 0.00 0.00 175.10 176.43 1dvc n VAL 55 N 0.41 0.00 -0.75 2.92 0.24 -1.26 -4.82 118.33 115.06 1dvc n VAL 55 Ca -0.18 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.20 1dvc n VAL 55 Cb 0.60 0.00 0.38 0.00 -1.47 0.00 0.00 33.84 33.35 1dvc n VAL 55 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1dvc n ALA 56 N 0.00 3.43 0.00 2.33 0.00 -1.26 -4.92 120.51 120.09 1dvc n ALA 56 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 53.44 51.68 1dvc n ALA 56 Cb 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1dvc n ALA 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dvc n GLY 57 N 0.89 -1.57 3.12 0.00 0.00 -1.26 -4.65 105.19 101.72 1dvc n GLY 57 Ca 0.27 0.64 0.04 0.00 0.00 0.00 0.00 46.02 46.97 1dvc n GLY 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dvc s THR 58 N 0.00 -0.62 0.00 2.61 2.01 -1.17 -4.72 115.64 113.75 1dvc s THR 58 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1dvc s THR 58 Cb 0.00 -0.50 0.00 0.00 0.01 0.00 0.00 72.50 72.01 1dvc s THR 58 CO 0.00 0.00 0.00 0.59 -0.69 0.00 0.00 174.62 174.52 1dvc n ASN 59 N 5.02 -1.02 -3.94 3.53 3.02 -1.26 -2.29 115.26 118.32 1dvc n ASN 59 Ca 0.07 -0.27 -0.10 0.00 -0.03 0.00 0.00 54.58 54.26 1dvc n ASN 59 Cb 0.57 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.67 1dvc n ASN 59 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1dvc s TYR 60 N -0.78 0.34 -0.15 3.10 2.02 0.28 -3.72 117.35 118.44 1dvc s TYR 60 Ca 0.00 -0.70 -0.06 0.00 -0.37 0.00 0.00 57.07 55.94 1dvc s TYR 60 Cb 0.00 0.02 0.07 0.00 -0.40 0.00 0.00 41.96 41.65 1dvc s TYR 60 CO 0.00 -0.78 0.32 0.71 -1.57 0.00 0.00 175.55 174.23 1dvc s TYR 61 N -3.97 -0.53 -0.05 2.71 2.02 0.34 -3.39 117.35 114.48 1dvc s TYR 61 Ca 0.17 1.13 -0.03 0.00 -0.37 0.00 0.00 57.07 57.97 1dvc s TYR 61 Cb 0.02 0.11 0.03 0.00 -0.40 0.00 0.00 41.96 41.72 1dvc s TYR 61 CO 0.01 -0.36 0.12 0.42 -1.57 0.00 0.00 175.55 174.17 1dvc s ILE 62 N 2.13 -0.04 -1.03 2.71 1.01 -0.63 -0.12 121.20 125.23 1dvc s ILE 62 Ca -0.03 0.15 -0.04 0.00 0.00 0.00 0.00 60.65 60.73 1dvc s ILE 62 Cb -0.11 -0.20 0.29 0.00 0.01 0.00 0.00 42.46 42.44 1dvc s ILE 62 CO -0.10 0.06 1.24 1.17 0.00 0.00 0.00 174.94 177.31 1dvc n LYS 63 N 3.94 3.84 -2.94 2.79 4.81 -0.72 0.64 118.16 130.53 1dvc n LYS 63 Ca -0.24 -4.54 -0.34 0.00 -0.87 0.00 0.00 58.31 52.33 1dvc n LYS 63 Cb 0.53 -2.48 -0.07 0.00 0.02 0.00 0.00 35.03 33.03 1dvc n LYS 63 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 1dvc s VAL 64 N -2.22 4.47 0.11 3.15 -7.23 -1.10 -3.19 120.40 114.38 1dvc s VAL 64 Ca 0.32 1.36 -0.28 0.00 -1.81 0.00 0.00 61.98 61.56 1dvc s VAL 64 Cb 0.01 -3.69 -0.06 0.00 0.56 0.00 0.00 36.38 33.19 1dvc s VAL 64 CO 0.02 -0.15 0.90 -0.13 -0.31 0.00 0.00 175.10 175.42 1dvc s ARG 65 N -2.82 4.65 -1.43 4.82 0.52 -0.71 -0.35 118.95 123.64 1dvc s ARG 65 Ca 0.56 1.34 -0.12 0.00 -0.52 0.00 0.00 55.73 56.99 1dvc s ARG 65 Cb -0.12 -3.36 0.06 0.00 0.52 0.00 0.00 34.95 32.06 1dvc s ARG 65 CO 0.17 0.29 2.25 0.00 0.02 0.00 0.00 175.30 178.02 1dvc n ALA 66 N 2.58 5.88 -0.65 2.13 0.00 -0.26 -3.33 120.51 126.86 1dvc n ALA 66 Ca 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 53.44 49.48 1dvc n ALA 66 Cb 0.49 -3.31 0.00 0.00 0.00 0.00 0.00 19.45 16.63 1dvc n ALA 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dvc n GLY 67 N 3.51 0.97 0.00 0.00 0.00 0.39 -4.56 105.19 105.49 1dvc n GLY 67 Ca 0.53 0.49 0.00 0.00 0.00 0.00 0.00 46.02 47.04 1dvc n GLY 67 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dvc n ASP 68 N 3.31 -0.57 0.29 1.61 9.92 -1.26 -4.80 116.55 125.04 1dvc n ASP 68 Ca 0.00 -0.21 0.20 0.00 -0.53 0.00 0.00 54.79 54.25 1dvc n ASP 68 Cb 0.00 0.00 1.05 0.00 -0.64 0.00 0.00 41.12 41.53 1dvc n ASP 68 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 1dvc h ASN 92 N -0.57 0.00 -3.19 -2.24 4.21 -1.99 -3.43 115.58 108.36 1dvc h ASN 92 Ca 0.00 0.00 -0.46 0.00 1.21 0.00 0.00 56.30 57.05 1dvc h ASN 92 Cb 0.00 0.00 0.22 0.00 -1.12 0.00 0.00 38.32 37.42 1dvc h ASN 92 CO 0.00 0.00 -0.23 0.29 -1.29 0.00 0.00 177.43 176.20 1dvc n LYS 93 N -2.87 -1.90 -1.73 0.81 5.02 -1.26 -4.82 118.16 111.40 1dvc n LYS 93 Ca -0.02 -0.52 0.00 0.00 -2.02 0.00 0.00 58.31 55.74 1dvc n LYS 93 Cb 0.07 -2.08 0.00 0.00 -0.02 0.00 0.00 35.03 32.99 1dvc n LYS 93 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1dvc n TYR 94 N -4.70 0.00 0.00 2.13 4.02 -1.10 -1.10 117.16 116.41 1dvc n TYR 94 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 1dvc n TYR 94 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.87 1dvc n TYR 94 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 176.86 175.73 1dvc n MET 95 N 0.00 0.00 -0.23 -0.72 1.56 0.53 -3.72 117.12 114.54 1dvc n MET 95 Ca 0.00 0.00 -0.17 0.00 -0.27 0.00 0.00 57.70 57.26 1dvc n MET 95 Cb 0.00 0.00 0.17 0.00 2.15 0.00 0.00 33.22 35.54 1dvc n MET 95 CO 0.00 0.00 0.00 0.72 -0.73 0.00 0.00 175.97 175.96 1dvc n HIS 96 N 0.00 -2.79 -3.50 1.12 8.25 -1.08 -2.73 115.22 114.50 1dvc n HIS 96 Ca 0.00 -0.36 -0.13 0.00 -0.26 0.00 0.00 57.72 56.97 1dvc n HIS 96 Cb 0.00 -0.90 -0.04 0.00 1.12 0.00 0.00 29.99 30.17 1dvc n HIS 96 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1dvc s LEU 97 N 0.00 -0.51 -0.11 2.41 2.96 0.21 -3.80 118.68 119.84 1dvc s LEU 97 Ca 0.38 0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 54.52 1dvc s LEU 97 Cb -0.07 2.31 0.06 0.00 0.50 0.00 0.00 46.19 48.98 1dvc s LEU 97 CO 0.32 -0.67 0.22 -0.75 -1.32 0.00 0.00 176.35 174.15 1dvc s LYS 98 N -2.40 0.11 0.10 1.98 2.20 -0.49 -1.61 119.74 119.63 1dvc s LYS 98 Ca -0.02 0.65 0.03 0.00 -0.36 0.00 0.00 55.97 56.27 1dvc s LYS 98 Cb -0.01 -0.13 -0.04 0.00 -1.51 0.00 0.00 37.83 36.15 1dvc s LYS 98 CO -0.03 -0.28 -0.09 0.08 -0.36 0.00 0.00 175.35 174.68 1dvc s VAL 99 N 2.22 0.86 -0.08 4.02 1.01 -1.22 -0.28 120.40 126.93 1dvc s VAL 99 Ca 0.00 -1.72 0.02 0.00 0.00 0.00 0.00 61.98 60.29 1dvc s VAL 99 Cb -0.12 -1.44 -0.02 0.00 0.00 0.00 0.00 36.38 34.80 1dvc s VAL 99 CO -0.07 -0.66 -0.15 0.12 0.00 0.00 0.00 175.10 174.34 1dvc s PHE 100 N -2.79 2.72 -0.14 5.22 5.36 -1.13 0.10 117.98 127.32 1dvc s PHE 100 Ca 0.07 -0.40 0.01 0.00 -0.96 0.00 0.00 56.93 55.65 1dvc s PHE 100 Cb -0.01 -1.71 -0.00 0.00 -0.34 0.00 0.00 43.02 40.96 1dvc s PHE 100 CO -0.01 -0.01 -0.17 0.21 -1.46 0.00 0.00 175.22 173.78 1dvc s LYS 101 N -0.26 3.21 -0.17 10.12 2.20 -0.97 -3.57 119.74 130.30 1dvc s LYS 101 Ca 0.01 -0.76 -0.27 0.00 -0.36 0.00 0.00 55.97 54.59 1dvc s LYS 101 Cb -0.13 -2.57 -0.01 0.00 -1.51 0.00 0.00 37.83 33.61 1dvc s LYS 101 CO 0.03 0.07 0.90 -1.12 -0.36 0.00 0.00 175.35 174.87 1dvc s SER 102 N 0.67 7.03 0.01 1.43 0.01 -1.26 -3.06 113.70 118.53 1dvc s SER 102 Ca -0.08 1.27 -0.25 0.00 1.31 0.00 0.00 55.95 58.20 1dvc s SER 102 Cb -0.16 -2.49 -0.18 0.00 0.21 0.00 0.00 66.02 63.40 1dvc s SER 102 CO 0.02 -0.46 1.41 -0.07 0.41 0.00 0.00 173.24 174.55 1dvc h LEU 102 N 8.50 -0.03-10.70 2.44 4.07 -1.93 -3.44 115.31 114.23 1dvc h LEU 102 Ca -0.27 -0.32 -0.46 0.00 0.08 0.00 0.00 57.88 56.91 1dvc h LEU 102 Cb 1.12 0.01 0.12 0.00 1.08 0.00 0.00 40.66 42.99 1dvc h LEU 102 CO 0.87 0.30 0.36 -2.16 -1.08 0.00 0.00 178.44 176.73 1dvc s PRO 103 N -4.87 1.48 0.00 1.13 0.04 -1.26 -5.00 135.00 126.51 1dvc s PRO 103 Ca -0.15 -0.25 0.00 0.00 0.04 0.00 0.00 61.00 60.64 1dvc s PRO 103 Cb 0.03 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1dvc s PRO 103 CO 0.66 -1.83 0.00 0.41 0.04 0.00 0.00 177.00 176.28 1dvc n GLY 104 N -3.38 2.33 0.00 0.56 0.00 -1.26 -4.98 105.19 98.46 1dvc n GLY 104 Ca 0.11 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1dvc n GLY 104 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1dvc n GLN 105 N 1.71 1.94 -1.53 1.61 3.00 -1.26 -4.75 117.38 118.10 1dvc n GLN 105 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.83 1dvc n GLN 105 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 30.24 30.11 1dvc n GLN 105 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1dvc n ASN 105 N 0.00 0.60 -3.89 1.08 2.85 -1.26 -4.87 115.26 109.77 1dvc n ASN 105 Ca 0.00 -1.17 -0.29 0.00 -0.11 0.00 0.00 54.58 53.01 1dvc n ASN 105 Cb 0.00 -1.25 0.21 0.00 1.24 0.00 0.00 39.78 39.98 1dvc n ASN 105 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1dvc n GLU 106 N 7.59 -1.40 -3.35 1.20 0.00 -1.26 -5.06 120.64 118.35 1dvc n GLU 106 Ca 0.54 -2.05 -0.22 0.00 0.00 0.00 0.00 57.16 55.43 1dvc n GLU 106 Cb 0.33 -1.39 -0.09 0.00 0.00 0.00 0.00 31.44 30.29 1dvc n GLU 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1dvc s ASP 107 N -5.81 1.57 -0.31 -1.84 1.01 -1.26 -5.10 116.67 104.94 1dvc s ASP 107 Ca 0.75 -2.21 -0.33 0.00 0.71 0.00 0.00 52.55 51.48 1dvc s ASP 107 Cb -0.02 0.09 -0.14 0.00 1.01 0.00 0.00 42.92 43.86 1dvc s ASP 107 CO 0.53 -0.23 1.09 0.18 0.21 0.00 0.00 175.17 176.95 1dvc n LEU 108 N 3.68 0.74 -4.93 1.23 4.32 -1.26 -4.90 117.00 115.89 1dvc n LEU 108 Ca 0.17 0.85 -0.25 0.00 -0.02 0.00 0.00 56.01 56.76 1dvc n LEU 108 Cb 0.44 -0.64 -0.00 0.00 -1.62 0.00 0.00 43.42 41.61 1dvc n LEU 108 CO 0.09 -0.72 0.33 0.54 -1.22 0.00 0.00 177.39 176.42 1dvc s VAL 109 N 1.84 4.81 -1.05 4.08 0.11 -1.23 -4.84 120.40 124.11 1dvc s VAL 109 Ca 0.74 -0.14 -0.13 0.00 -2.93 0.00 0.00 61.98 59.52 1dvc s VAL 109 Cb -1.05 -3.80 0.21 0.00 -1.53 0.00 0.00 36.38 30.21 1dvc s VAL 109 CO 0.56 -0.66 1.15 -0.22 -3.33 0.00 0.00 175.10 172.60 1dvc s LEU 110 N -4.58 5.79 0.33 2.54 2.96 -1.26 -2.83 118.68 121.62 1dvc s LEU 110 Ca 0.45 -2.94 0.05 0.00 -0.22 0.00 0.00 54.13 51.47 1dvc s LEU 110 Cb -0.10 -2.30 0.69 0.00 0.50 0.00 0.00 46.19 44.97 1dvc s LEU 110 CO 0.41 -0.63 1.88 0.71 -1.32 0.00 0.00 176.35 177.40 1dvc h THR 111 N 4.60 0.93 -1.64 3.68 1.35 -0.96 -3.47 112.91 117.40 1dvc h THR 111 Ca 0.20 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1dvc h THR 111 Cb 0.93 0.02 -0.00 0.00 -1.73 0.00 0.00 68.15 67.37 1dvc h THR 111 CO 1.05 0.15 0.02 0.61 -0.25 0.00 0.00 175.52 177.10 1dvc n GLY 112 N -1.41 1.35 0.00 5.82 0.00 -0.72 -4.99 105.19 105.24 1dvc n GLY 112 Ca 0.16 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1dvc n GLY 112 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1dvc n TYR 113 N -0.02 0.00 -3.22 1.61 0.18 -1.26 -1.40 117.16 113.05 1dvc n TYR 113 Ca -0.00 0.00 -0.46 0.00 1.88 0.00 0.00 57.90 59.32 1dvc n TYR 113 Cb 0.02 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 38.94 1dvc n TYR 113 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1dvc s GLN 114 N -0.66 3.28 1.00 -3.48 -1.52 -1.25 -4.92 119.66 112.11 1dvc s GLN 114 Ca 0.00 -1.86 -0.12 0.00 -1.95 0.00 0.00 55.36 51.44 1dvc s GLN 114 Cb 0.00 -4.40 0.19 0.00 -0.22 0.00 0.00 33.01 28.58 1dvc s GLN 114 CO 0.00 -1.43 1.08 0.54 -0.25 0.00 0.00 175.29 175.24 1dvc s VAL 115 N 1.54 2.26 -1.33 1.09 0.11 -1.26 -2.62 120.40 120.20 1dvc s VAL 115 Ca 0.14 0.08 -0.19 0.00 -2.93 0.00 0.00 61.98 59.08 1dvc s VAL 115 Cb -0.19 -2.28 0.02 0.00 -1.53 0.00 0.00 36.38 32.40 1dvc s VAL 115 CO -0.01 -0.11 0.47 -0.67 -3.33 0.00 0.00 175.10 171.44 1dvc n ASP 115 N -4.37 -2.35 -4.74 3.54 -0.08 -1.26 -4.91 116.55 102.38 1dvc n ASP 115 Ca 0.07 -1.23 -0.23 0.00 -1.51 0.00 0.00 54.79 51.89 1dvc n ASP 115 Cb 0.54 -2.00 -0.06 0.00 2.34 0.00 0.00 41.12 41.95 1dvc n ASP 115 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 1dvc s LYS 116 N -7.17 2.51 0.00 -0.67 2.47 -1.24 -5.00 119.74 110.65 1dvc s LYS 116 Ca 0.29 -1.37 0.00 0.00 -1.56 0.00 0.00 55.97 53.34 1dvc s LYS 116 Cb -0.15 -2.29 0.00 0.00 -1.46 0.00 0.00 37.83 33.93 1dvc s LYS 116 CO 0.96 0.26 0.00 0.09 0.16 0.00 0.00 175.35 176.82 1dvc n ASN 117 N -1.10 1.98 0.09 1.43 4.13 -1.26 -2.70 115.26 117.83 1dvc n ASN 117 Ca -0.05 -0.74 0.02 0.00 1.68 0.00 0.00 54.58 55.49 1dvc n ASN 117 Cb 0.60 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.81 1dvc n ASN 117 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 1dvc h LYS 118 N 0.00 0.00 0.00 3.52 3.64 -1.98 -3.22 116.57 118.53 1dvc h LYS 118 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1dvc h LYS 118 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1dvc h LYS 118 CO 0.00 0.34 0.00 -3.47 -2.27 0.00 0.00 179.45 174.05 1dvc n ASP 119 N -3.02 0.30 -4.58 4.20 2.03 -1.26 -4.59 116.55 109.64 1dvc n ASP 119 Ca -0.04 0.55 -0.42 0.00 0.52 0.00 0.00 54.79 55.41 1dvc n ASP 119 Cb 0.76 -0.62 -0.06 0.00 -0.72 0.00 0.00 41.12 40.48 1dvc n ASP 119 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1dvc s ASP 120 N -3.56 6.51 0.21 1.67 2.15 -1.22 -5.04 116.67 117.38 1dvc s ASP 120 Ca 0.09 0.27 -0.18 0.00 0.43 0.00 0.00 52.55 53.16 1dvc s ASP 120 Cb 0.13 -2.37 -0.08 0.00 -0.30 0.00 0.00 42.92 40.29 1dvc s ASP 120 CO 0.43 -0.70 0.67 -0.70 -0.17 0.00 0.00 175.17 174.70 1dvc s GLU 121 N 2.98 4.15 0.12 4.34 2.12 -1.26 -4.83 118.70 126.32 1dvc s GLU 121 Ca 0.29 0.74 -0.20 0.00 0.36 0.00 0.00 54.97 56.16 1dvc s GLU 121 Cb -0.14 -2.85 -0.06 0.00 0.26 0.00 0.00 34.13 31.35 1dvc s GLU 121 CO 0.16 0.39 1.76 -0.07 -0.54 0.00 0.00 175.26 176.97 1dvc h LEU 122 N 3.34 0.16 0.00 2.70 3.38 -1.97 -3.47 115.31 119.45 1dvc h LEU 122 Ca -0.48 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1dvc h LEU 122 Cb 1.19 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1dvc h LEU 122 CO 0.65 0.12 0.00 0.35 0.09 0.00 0.00 178.44 179.66 1dvc n THR 123 N -4.99 0.00 -2.20 0.22 -2.24 -1.26 -3.66 114.28 100.15 1dvc n THR 123 Ca -0.03 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.40 1dvc n THR 123 Cb 0.05 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.24 1dvc n THR 123 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1dvc s GLY 124 N -2.21 0.46 0.00 3.38 0.00 -1.26 -5.07 107.32 102.62 1dvc s GLY 124 Ca 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 44.72 43.40 1dvc s GLY 124 CO 0.00 3.22 0.11 1.97 0.00 0.00 0.00 173.10 178.40