#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v47 n GLU 2 N 0.00 0.00 -4.79 2.12 0.28 -1.26 -4.81 120.64 112.17 2v47 n GLU 2 Ca 0.00 0.00 -0.26 0.00 -0.16 0.00 0.00 57.16 56.74 2v47 n GLU 2 Cb 0.00 0.00 -0.16 0.00 1.43 0.00 0.00 31.44 32.71 2v47 n GLU 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2v47 s ALA 3 N -1.58 1.52 0.43 -1.84 0.00 -1.19 -4.91 121.76 114.18 2v47 s ALA 3 Ca 0.00 -0.62 0.06 0.00 0.00 0.00 0.00 51.96 51.40 2v47 s ALA 3 Cb 0.00 -0.59 0.01 0.00 0.00 0.00 0.00 23.12 22.54 2v47 s ALA 3 CO 0.00 0.21 0.59 0.15 0.00 0.00 0.00 175.76 176.71 2v47 s LYS 4 N 0.37 2.85 0.02 0.00 1.02 -1.26 0.23 119.74 122.97 2v47 s LYS 4 Ca -0.11 -1.07 -0.00 0.00 0.02 0.00 0.00 55.97 54.80 2v47 s LYS 4 Cb -0.15 -2.71 -0.00 0.00 -0.52 0.00 0.00 37.83 34.45 2v47 s LYS 4 CO 0.04 -0.29 -0.01 0.00 -0.92 0.00 0.00 175.35 174.18 2v47 n ALA 5 N -1.91 2.74 -2.83 5.17 0.00 -0.87 -4.65 120.51 118.16 2v47 n ALA 5 Ca 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 53.44 53.45 2v47 n ALA 5 Cb 0.59 0.07 -0.01 0.00 0.00 0.00 0.00 19.45 20.09 2v47 n ALA 5 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2v47 n ILE 6 N -2.81 -4.46 -4.05 0.00 5.41 -1.23 -4.82 119.36 107.40 2v47 n ILE 6 Ca -0.00 0.85 -0.32 0.00 1.00 0.00 0.00 62.75 64.27 2v47 n ILE 6 Cb 0.01 -3.59 -0.15 0.00 -0.71 0.00 0.00 39.64 35.21 2v47 n ILE 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2v47 s ALA 7 N -0.19 2.54 0.86 -1.39 0.00 -0.33 -4.97 121.76 118.28 2v47 s ALA 7 Ca -0.08 -1.80 -0.12 0.00 0.00 0.00 0.00 51.96 49.96 2v47 s ALA 7 Cb 0.01 -1.61 0.11 0.00 0.00 0.00 0.00 23.12 21.62 2v47 s ALA 7 CO 0.20 -1.24 1.14 1.03 0.00 0.00 0.00 175.76 176.89 2v47 s ARG 8 N 1.11 1.54 -0.68 0.00 0.52 -1.26 -2.43 118.95 117.76 2v47 s ARG 8 Ca -0.07 0.31 -0.19 0.00 -0.52 0.00 0.00 55.73 55.26 2v47 s ARG 8 Cb -0.20 -1.88 0.03 0.00 0.52 0.00 0.00 34.95 33.41 2v47 s ARG 8 CO -0.05 -1.92 0.35 0.66 0.02 0.00 0.00 175.30 174.35 2v47 n TYR 9 N -3.58 -0.74 0.05 -0.53 0.53 -1.26 -4.82 117.16 106.81 2v47 n TYR 9 Ca 0.07 0.04 -0.12 0.00 -1.02 0.00 0.00 57.90 56.87 2v47 n TYR 9 Cb 0.59 -1.51 -0.05 0.00 -1.03 0.00 0.00 39.34 37.34 2v47 n TYR 9 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 2v47 h VAL 10 N -0.09 0.32 -0.22 -0.72 2.07 -1.29 -3.46 116.25 112.87 2v47 h VAL 10 Ca -0.39 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.13 2v47 h VAL 10 Cb 0.77 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 2v47 h VAL 10 CO 0.29 0.00 0.00 -1.14 0.02 0.00 0.00 177.57 176.74 2v47 n ARG 11 N -5.40 0.00 -3.60 1.57 0.00 -1.26 -4.88 116.66 103.08 2v47 n ARG 11 Ca -0.05 0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 57.65 2v47 n ARG 11 Cb 0.32 -0.42 -0.07 0.00 0.00 0.00 0.00 32.46 32.29 2v47 n ARG 11 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2v47 s ILE 12 N -1.93 0.00 0.46 5.15 2.07 -1.04 -4.91 121.20 121.01 2v47 s ILE 12 Ca 0.00 -0.01 -0.22 0.00 -1.41 0.00 0.00 60.65 59.01 2v47 s ILE 12 Cb 0.00 -0.97 -0.10 0.00 0.13 0.00 0.00 42.46 41.52 2v47 s ILE 12 CO 0.00 -0.01 0.83 -0.24 -1.91 0.00 0.00 174.94 173.61 2v47 n SER 13 N 2.00 0.38 0.00 4.50 2.88 -1.23 -3.03 113.62 119.12 2v47 n SER 13 Ca -0.16 0.93 0.00 0.00 -1.33 0.00 0.00 58.87 58.31 2v47 n SER 13 Cb 0.56 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.74 2v47 n SER 13 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2v47 n PRO 14 N 0.06 0.00 -0.25 -1.46 -0.02 -1.26 -3.09 135.00 128.97 2v47 n PRO 14 Ca 0.11 0.33 0.23 0.00 -2.02 0.00 0.00 63.50 62.15 2v47 n PRO 14 Cb 0.41 -1.16 0.41 0.00 -0.02 0.00 0.00 33.50 33.15 2v47 n PRO 14 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2v47 n ARG 15 N -1.50 -0.03 -0.12 -0.52 1.74 -1.26 0.14 116.66 115.10 2v47 n ARG 15 Ca 0.00 0.87 -0.05 0.00 -0.77 0.00 0.00 57.85 57.90 2v47 n ARG 15 Cb 0.00 -1.63 0.14 0.00 -1.02 0.00 0.00 32.46 29.95 2v47 n ARG 15 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2v47 h LYS 16 N 0.00 0.83 0.03 5.56 1.57 -1.93 -3.29 116.57 119.34 2v47 h LYS 16 Ca 0.57 -0.24 -0.36 0.00 -1.87 0.00 0.00 60.65 58.75 2v47 h LYS 16 Cb 1.63 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.79 2v47 h LYS 16 CO -0.43 0.84 -2.21 1.33 -0.57 0.00 0.00 179.45 178.41 2v47 n VAL 17 N -4.20 1.56 -0.55 0.50 0.24 0.36 -4.11 118.33 112.13 2v47 n VAL 17 Ca 0.02 -0.70 0.42 0.00 -2.04 0.00 0.00 64.34 62.04 2v47 n VAL 17 Cb 0.32 -1.19 0.65 0.00 -1.47 0.00 0.00 33.84 32.14 2v47 n VAL 17 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2v47 n ARG 18 N -3.15 0.00 0.00 7.34 1.74 0.25 0.65 116.66 123.50 2v47 n ARG 18 Ca -0.34 0.87 0.00 0.00 -0.77 0.00 0.00 57.85 57.61 2v47 n ARG 18 Cb 1.06 -2.02 0.00 0.00 -1.02 0.00 0.00 32.46 30.48 2v47 n ARG 18 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2v47 n LEU 19 N -3.51 0.26 -0.26 0.55 4.32 -1.25 -2.18 117.00 114.94 2v47 n LEU 19 Ca 0.35 0.61 -0.07 0.00 -0.02 0.00 0.00 56.01 56.88 2v47 n LEU 19 Cb 1.61 -0.17 -0.06 0.00 -1.62 0.00 0.00 43.42 43.18 2v47 n LEU 19 CO 0.35 -0.17 0.41 1.33 -1.22 0.00 0.00 177.39 178.09 2v47 n VAL 20 N -1.02 -0.43 -0.34 4.08 0.24 0.21 -0.83 118.33 120.25 2v47 n VAL 20 Ca 0.00 1.85 -0.07 0.00 -2.04 0.00 0.00 64.34 64.08 2v47 n VAL 20 Cb 0.00 -2.31 -0.05 0.00 -1.47 0.00 0.00 33.84 30.00 2v47 n VAL 20 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2v47 n VAL 21 N -4.48 -0.53 -0.18 3.34 0.31 -0.77 0.24 118.33 116.26 2v47 n VAL 21 Ca 0.01 1.97 0.22 0.00 -0.01 0.00 0.00 64.34 66.53 2v47 n VAL 21 Cb 0.16 -2.48 0.60 0.00 -0.91 0.00 0.00 33.84 31.21 2v47 n VAL 21 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2v47 h ASP 22 N 0.00 0.23 0.07 4.52 3.32 -0.48 -0.77 116.42 123.31 2v47 h ASP 22 Ca 0.17 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.24 2v47 h ASP 22 Cb 0.37 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.90 2v47 h ASP 22 CO -0.78 0.10 0.00 0.18 -1.72 0.00 0.00 179.24 177.01 2v47 n LEU 23 N -4.42 0.00 0.00 1.55 4.32 0.65 -2.02 117.00 117.07 2v47 n LEU 23 Ca 0.17 0.34 0.00 0.00 -0.02 0.00 0.00 56.01 56.50 2v47 n LEU 23 Cb 0.75 -0.34 0.00 0.00 -1.62 0.00 0.00 43.42 42.21 2v47 n LEU 23 CO 0.34 -0.31 0.26 2.30 -1.22 0.00 0.00 177.39 178.76 2v47 n ILE 24 N -1.34 0.26 -1.53 -0.08 -5.35 -0.30 -5.00 119.36 106.02 2v47 n ILE 24 Ca 0.01 -0.40 -0.25 0.00 -0.27 0.00 0.00 62.75 61.84 2v47 n ILE 24 Cb 0.03 1.10 -0.12 0.00 -1.74 0.00 0.00 39.64 38.91 2v47 n ILE 24 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 2v47 n ARG 25 N -0.13 0.41 -2.13 6.28 0.63 -0.86 -3.14 116.66 117.72 2v47 n ARG 25 Ca 0.00 -0.29 -0.00 0.00 -0.92 0.00 0.00 57.85 56.64 2v47 n ARG 25 Cb 0.24 -2.52 0.00 0.00 0.45 0.00 0.00 32.46 30.63 2v47 n ARG 25 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2v47 n GLY 26 N 6.23 -3.59 3.58 5.14 0.00 -0.85 -5.02 105.19 110.67 2v47 n GLY 26 Ca 0.54 0.12 -0.12 0.00 0.00 0.00 0.00 46.02 46.57 2v47 n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2v47 s LYS 27 N -0.85 0.66 -0.38 1.61 1.02 -1.19 -4.87 119.74 115.74 2v47 s LYS 27 Ca 0.00 0.31 -0.41 0.00 0.02 0.00 0.00 55.97 55.88 2v47 s LYS 27 Cb -0.00 0.32 -0.16 0.00 -0.52 0.00 0.00 37.83 37.46 2v47 s LYS 27 CO 0.41 -0.18 1.88 -1.13 -0.92 0.00 0.00 175.35 175.41 2v47 n SER 28 N 1.19 1.80 -0.32 2.83 3.41 -1.26 -2.96 113.62 118.31 2v47 n SER 28 Ca -0.12 0.89 0.06 0.00 -0.26 0.00 0.00 58.87 59.44 2v47 n SER 28 Cb 0.57 -1.07 0.15 0.00 -0.26 0.00 0.00 64.21 63.61 2v47 n SER 28 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2v47 h LEU 29 N 8.13 -0.75 -0.28 1.04 6.46 -1.86 0.41 115.31 128.48 2v47 h LEU 29 Ca -0.35 0.27 0.03 0.00 -0.12 0.00 0.00 57.88 57.70 2v47 h LEU 29 Cb 1.35 0.53 -0.03 0.00 -0.73 0.00 0.00 40.66 41.78 2v47 h LEU 29 CO 1.00 -0.30 -0.17 -0.08 -0.62 0.00 0.00 178.44 178.27 2v47 h GLU 30 N 0.01 -0.01 0.67 1.25 4.81 -1.86 0.64 114.58 120.10 2v47 h GLU 30 Ca 0.46 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.66 2v47 h GLU 30 Cb 0.76 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.14 2v47 h GLU 30 CO -0.91 -0.01 -0.37 1.49 -0.73 0.00 0.00 179.01 178.49 2v47 h GLU 31 N -0.01 -0.92 -0.79 1.92 4.81 -0.84 -2.72 114.58 116.02 2v47 h GLU 31 Ca 0.04 0.06 0.15 0.00 -0.13 0.00 0.00 59.36 59.49 2v47 h GLU 31 Cb 0.13 0.21 -0.14 0.00 0.63 0.00 0.00 28.75 29.57 2v47 h GLU 31 CO -0.27 -0.61 -0.23 0.00 -0.73 0.00 0.00 179.01 177.17 2v47 n ALA 32 N -2.54 0.11 -0.08 2.92 0.00 0.11 0.49 120.51 121.53 2v47 n ALA 32 Ca -0.12 0.85 -0.07 0.00 0.00 0.00 0.00 53.44 54.10 2v47 n ALA 32 Cb 0.39 -0.48 -0.05 0.00 0.00 0.00 0.00 19.45 19.31 2v47 n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2v47 h ARG 33 N 0.00 -0.19 -1.01 0.00 3.08 0.60 0.66 114.38 117.52 2v47 h ARG 33 Ca 0.35 0.01 0.29 0.00 0.07 0.00 0.00 59.98 60.71 2v47 h ARG 33 Cb 0.55 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.60 2v47 h ARG 33 CO -0.81 -0.12 0.76 -0.91 -1.07 0.00 0.00 179.97 177.82 2v47 h ASN 34 N -0.19 0.00 0.00 7.04 2.35 0.21 1.46 115.58 126.45 2v47 h ASN 34 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2v47 h ASN 34 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 2v47 h ASN 34 CO -0.31 0.00 0.00 -0.38 -1.65 0.00 0.00 177.43 175.09 2v47 n ILE 35 N -4.12 0.00 -0.32 2.81 2.08 0.22 -1.35 119.36 118.67 2v47 n ILE 35 Ca 0.21 0.70 0.23 0.00 0.56 0.00 0.00 62.75 64.46 2v47 n ILE 35 Cb 1.11 -1.56 0.45 0.00 -0.75 0.00 0.00 39.64 38.89 2v47 n ILE 35 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2v47 h LEU 36 N 0.00 0.27 -0.93 1.39 3.38 -0.80 0.95 115.31 119.57 2v47 h LEU 36 Ca 0.00 0.22 0.26 0.00 0.09 0.00 0.00 57.88 58.45 2v47 h LEU 36 Cb 0.00 0.23 -0.14 0.00 0.09 0.00 0.00 40.66 40.84 2v47 h LEU 36 CO 0.00 -0.23 0.38 -0.09 0.09 0.00 0.00 178.44 178.59 2v47 h ARG 37 N 0.19 0.28 -0.01 1.13 9.65 0.21 -2.13 114.38 123.71 2v47 h ARG 37 Ca 0.71 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.58 2v47 h ARG 37 Cb 1.66 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 30.17 2v47 h ARG 37 CO -0.69 0.19 0.00 0.66 2.80 0.00 0.00 179.97 182.93 2v47 n TYR 38 N -5.13 0.01 -3.13 2.20 4.01 0.29 -5.02 117.16 110.38 2v47 n TYR 38 Ca 0.25 -0.67 -0.38 0.00 -0.16 0.00 0.00 57.90 56.94 2v47 n TYR 38 Cb 0.78 -0.09 -0.06 0.00 -0.31 0.00 0.00 39.34 39.66 2v47 n TYR 38 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2v47 s THR 39 N -1.65 4.57 -0.46 -0.72 2.01 0.12 -5.03 115.64 114.48 2v47 s THR 39 Ca 0.11 1.38 -0.12 0.00 0.31 0.00 0.00 61.69 63.37 2v47 s THR 39 Cb 0.10 -3.96 0.09 0.00 0.01 0.00 0.00 72.50 68.74 2v47 s THR 39 CO 0.01 0.43 0.36 0.21 -0.69 0.00 0.00 174.62 174.94 2v47 s ASN 40 N -1.31 5.88 -0.29 3.53 2.47 -1.26 -4.90 114.94 119.06 2v47 s ASN 40 Ca 0.36 -1.60 -0.25 0.00 0.42 0.00 0.00 52.86 51.79 2v47 s ASN 40 Cb -0.20 -2.08 0.18 0.00 -1.45 0.00 0.00 41.25 37.70 2v47 s ASN 40 CO 0.22 -0.66 1.37 -0.54 -3.72 0.00 0.00 177.10 173.78 2v47 s LYS 41 N 1.50 0.13 0.24 0.43 -0.14 -1.26 -5.03 119.74 115.61 2v47 s LYS 41 Ca 0.04 0.15 -0.05 0.00 -1.36 0.00 0.00 55.97 54.75 2v47 s LYS 41 Cb -0.25 0.07 0.44 0.00 -1.68 0.00 0.00 37.83 36.41 2v47 s LYS 41 CO 0.03 -0.02 1.72 -0.09 -0.76 0.00 0.00 175.35 176.23 2v47 h ARG 42 N 3.25 0.39 -0.66 1.68 2.43 -1.93 -2.84 114.38 116.70 2v47 h ARG 42 Ca -0.26 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 58.94 2v47 h ARG 42 Cb 1.19 -0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.58 2v47 h ARG 42 CO 0.17 0.26 -0.39 0.41 -1.51 0.00 0.00 179.97 178.91 2v47 n GLY 43 N -1.33 -2.61 0.00 2.80 0.00 -1.26 -2.76 105.19 100.03 2v47 n GLY 43 Ca 0.14 0.95 0.00 0.00 0.00 0.00 0.00 46.02 47.11 2v47 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2v47 n ALA 44 N -3.19 0.00 -0.17 4.61 0.00 -1.07 0.56 120.51 121.25 2v47 n ALA 44 Ca 0.01 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.57 2v47 n ALA 44 Cb 0.17 0.17 0.23 0.00 0.00 0.00 0.00 19.45 20.02 2v47 n ALA 44 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2v47 n TYR 45 N -2.26 0.47 -0.08 0.00 9.36 -1.11 0.24 117.16 123.77 2v47 n TYR 45 Ca 0.00 0.62 -0.16 0.00 3.32 0.00 0.00 57.90 61.68 2v47 n TYR 45 Cb 0.00 -0.97 -0.12 0.00 -0.63 0.00 0.00 39.34 37.62 2v47 n TYR 45 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 2v47 h PHE 46 N 0.00 0.00 -0.08 2.98 0.04 -0.04 -2.47 116.94 117.37 2v47 h PHE 46 Ca 0.38 0.00 0.02 0.00 2.80 0.00 0.00 57.97 61.17 2v47 h PHE 46 Cb 0.90 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.05 2v47 h PHE 46 CO -0.14 1.10 0.31 0.28 -0.60 0.00 0.00 178.31 179.26 2v47 h VAL 47 N -1.00 0.09 0.00 -0.55 2.07 0.23 -0.38 116.25 116.71 2v47 h VAL 47 Ca -0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2v47 h VAL 47 Cb 1.05 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 2v47 h VAL 47 CO -0.07 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.52 2v47 n ALA 48 N -2.01 0.00 -0.07 1.67 0.00 0.65 -2.97 120.51 117.79 2v47 n ALA 48 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 2v47 n ALA 48 Cb 0.39 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.82 2v47 n ALA 48 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2v47 n LYS 49 N -0.44 -0.07 -0.28 0.00 3.00 -0.68 0.25 118.16 119.94 2v47 n LYS 49 Ca 0.00 0.31 0.09 0.00 -0.00 0.00 0.00 58.31 58.71 2v47 n LYS 49 Cb 0.00 -0.45 0.24 0.00 0.00 0.00 0.00 35.03 34.82 2v47 n LYS 49 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.40 177.16 2v47 h VAL 50 N 0.00 0.51 -0.01 3.15 3.04 -1.26 -1.17 116.25 120.51 2v47 h VAL 50 Ca 0.03 -0.13 -0.04 0.00 -1.01 0.00 0.00 66.70 65.55 2v47 h VAL 50 Cb 0.07 0.12 0.00 0.00 -2.01 0.00 0.00 31.29 29.47 2v47 h VAL 50 CO -0.16 0.07 -0.15 0.25 -1.01 0.00 0.00 177.57 176.57 2v47 h LEU 51 N 0.37 0.15 -1.72 3.16 7.12 0.35 -1.04 115.31 123.69 2v47 h LEU 51 Ca 0.49 -0.74 0.00 0.00 0.13 0.00 0.00 57.88 57.76 2v47 h LEU 51 Cb 0.87 -0.05 0.00 0.00 -0.53 0.00 0.00 40.66 40.95 2v47 h LEU 51 CO -0.51 0.87 0.32 -0.08 -0.13 0.00 0.00 178.44 178.91 2v47 h GLU 52 N -0.55 0.00 0.06 1.25 4.57 -0.13 0.53 114.58 120.31 2v47 h GLU 52 Ca -0.02 0.00 -0.38 0.00 -1.18 0.00 0.00 59.36 57.79 2v47 h GLU 52 Cb 0.88 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.43 2v47 h GLU 52 CO 0.03 0.00 -2.24 0.45 -1.18 0.00 0.00 179.01 176.07 2v47 n SER 53 N -2.69 2.02 0.25 1.04 2.88 -0.51 -3.72 113.62 112.90 2v47 n SER 53 Ca -0.02 0.04 0.17 0.00 -1.33 0.00 0.00 58.87 57.73 2v47 n SER 53 Cb 0.36 -0.61 0.89 0.00 -0.75 0.00 0.00 64.21 64.11 2v47 n SER 53 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2v47 h ALA 54 N 0.06 1.62 0.06 -1.46 0.00 0.13 -1.32 119.26 118.35 2v47 h ALA 54 Ca -0.50 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2v47 h ALA 54 Cb 1.97 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.77 2v47 h ALA 54 CO -0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 179.25 179.02 2v47 h ALA 55 N 1.82 -0.35 -1.56 0.00 0.00 -1.06 -2.98 119.26 115.13 2v47 h ALA 55 Ca 0.05 -0.02 0.47 0.00 0.00 0.00 0.00 54.91 55.41 2v47 h ALA 55 Cb 0.33 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.06 2v47 h ALA 55 CO -0.00 -0.35 1.08 0.00 0.00 0.00 0.00 179.25 179.99 2v47 h ALA 56 N -1.85 3.27 0.12 0.00 0.00 -1.56 0.11 119.26 119.35 2v47 h ALA 56 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2v47 h ALA 56 Cb 0.06 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2v47 h ALA 56 CO 0.01 -1.80 -0.06 -0.91 0.00 0.00 0.00 179.25 176.49 2v47 h ASN 57 N 0.04 -0.13 -0.49 0.00 -0.26 -1.29 0.37 115.58 113.81 2v47 h ASN 57 Ca 0.81 -0.25 0.08 0.00 -0.56 0.00 0.00 56.30 56.38 2v47 h ASN 57 Cb 2.97 0.03 -0.03 0.00 -1.06 0.00 0.00 38.32 40.24 2v47 h ASN 57 CO -0.16 0.18 0.33 0.00 -1.06 0.00 0.00 177.43 176.72 2v47 h ALA 58 N 0.38 2.05 -3.00 -0.83 0.00 -0.63 -1.42 119.26 115.81 2v47 h ALA 58 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2v47 h ALA 58 Cb 0.37 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2v47 h ALA 58 CO 0.03 -0.15 0.00 0.28 0.00 0.00 0.00 179.25 179.40 2v47 n VAL 59 N -4.47 0.00 0.00 0.00 0.31 -0.94 -0.07 118.33 113.17 2v47 n VAL 59 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 2v47 n VAL 59 Cb 0.33 -0.23 0.00 0.00 -0.91 0.00 0.00 33.84 33.03 2v47 n VAL 59 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2v47 n ASN 60 N -0.31 0.00 0.00 4.52 3.02 0.13 -1.25 115.26 121.36 2v47 n ASN 60 Ca 0.00 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 2v47 n ASN 60 Cb 0.00 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 2v47 n ASN 60 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2v47 n ASN 61 N -0.87 0.06 -1.52 6.41 5.03 -0.93 -4.88 115.26 118.56 2v47 n ASN 61 Ca 0.00 0.00 0.01 0.00 0.87 0.00 0.00 54.58 55.46 2v47 n ASN 61 Cb 0.13 0.00 0.30 0.00 -1.02 0.00 0.00 39.78 39.19 2v47 n ASN 61 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 2v47 n HIS 62 N -2.58 1.74 -1.06 3.10 8.25 -0.58 -5.03 115.22 119.05 2v47 n HIS 62 Ca 0.00 -1.06 0.00 0.00 -0.26 0.00 0.00 57.72 56.40 2v47 n HIS 62 Cb 0.13 -0.51 0.00 0.00 1.12 0.00 0.00 29.99 30.73 2v47 n HIS 62 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2v47 n ASP 63 N -0.25 -2.21 0.00 0.41 5.75 0.91 -4.78 116.55 116.38 2v47 n ASP 63 Ca 0.31 0.23 0.00 0.00 -0.01 0.00 0.00 54.79 55.33 2v47 n ASP 63 Cb 1.15 -0.47 0.00 0.00 -1.03 0.00 0.00 41.12 40.77 2v47 n ASP 63 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 2v47 n MET 64 N 1.22 3.09 -0.92 0.11 2.81 -0.69 -4.92 117.12 117.81 2v47 n MET 64 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2v47 n MET 64 Cb 0.05 -0.39 0.00 0.00 -0.71 0.00 0.00 33.22 32.17 2v47 n MET 64 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2v47 n LEU 65 N -0.42 -1.48 -2.85 4.03 0.00 -1.26 -4.67 117.00 110.34 2v47 n LEU 65 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 56.01 55.96 2v47 n LEU 65 Cb 0.00 -0.74 -0.01 0.00 0.00 0.00 0.00 43.42 42.67 2v47 n LEU 65 CO 0.00 0.00 1.17 1.21 0.00 0.00 0.00 177.39 179.77 2v47 n GLU 66 N 0.53 0.51 0.00 1.96 2.13 -1.26 -2.22 120.64 122.29 2v47 n GLU 66 Ca 0.00 -0.58 0.00 0.00 0.66 0.00 0.00 57.16 57.24 2v47 n GLU 66 Cb 0.00 -1.96 0.00 0.00 0.27 0.00 0.00 31.44 29.75 2v47 n GLU 66 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2v47 n ASP 67 N 4.19 0.00 -2.37 4.31 8.00 -1.26 -4.94 116.55 124.49 2v47 n ASP 67 Ca 0.11 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.26 2v47 n ASP 67 Cb 0.07 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.24 2v47 n ASP 67 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2v47 n ARG 68 N -0.84 2.77 -4.32 -1.24 1.74 -0.94 -4.94 116.66 108.89 2v47 n ARG 68 Ca 0.00 -3.39 -0.17 0.00 -0.77 0.00 0.00 57.85 53.52 2v47 n ARG 68 Cb 0.00 -2.29 -0.10 0.00 -1.02 0.00 0.00 32.46 29.05 2v47 n ARG 68 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 2v47 s LEU 69 N -3.83 2.35 0.00 0.55 0.05 -1.26 0.20 118.68 116.74 2v47 s LEU 69 Ca 0.62 -1.14 0.00 0.00 0.05 0.00 0.00 54.13 53.66 2v47 s LEU 69 Cb 0.49 -0.37 0.00 0.00 -2.05 0.00 0.00 46.19 44.26 2v47 s LEU 69 CO -0.05 -0.41 0.00 0.00 -0.55 0.00 0.00 176.35 175.34 2v47 n TYR 70 N -0.38 0.00 -3.51 3.48 -0.00 -0.02 -3.62 117.16 113.12 2v47 n TYR 70 Ca -0.07 0.00 -0.38 0.00 -0.00 0.00 0.00 57.90 57.45 2v47 n TYR 70 Cb 0.63 0.00 -0.04 0.00 -0.00 0.00 0.00 39.34 39.92 2v47 n TYR 70 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.86 177.14 2v47 n VAL 71 N 0.00 3.53 -0.33 -3.48 0.31 -1.15 -2.88 118.33 114.33 2v47 n VAL 71 Ca 0.00 -5.25 0.25 0.00 -0.01 0.00 0.00 64.34 59.32 2v47 n VAL 71 Cb 0.00 -2.39 0.48 0.00 -0.91 0.00 0.00 33.84 31.03 2v47 n VAL 71 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2v47 h LYS 72 N 5.98 0.27 0.00 5.55 1.63 -1.71 -2.27 116.57 126.02 2v47 h LYS 72 Ca 0.17 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.96 2v47 h LYS 72 Cb 0.80 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.37 2v47 h LYS 72 CO 0.93 0.18 0.00 0.00 -3.45 0.00 0.00 179.45 177.11 2v47 n ALA 73 N -2.30 0.00 0.00 5.00 0.00 -0.93 -4.75 120.51 117.52 2v47 n ALA 73 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2v47 n ALA 73 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.47 2v47 n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2v47 n ALA 74 N -0.25 0.00 0.00 0.00 0.00 -1.26 -2.21 120.51 116.79 2v47 n ALA 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2v47 n ALA 74 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2v47 n ALA 74 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2v47 n TYR 75 N 0.10 0.00 -3.85 0.00 4.11 -0.91 -4.98 117.16 111.64 2v47 n TYR 75 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.78 2v47 n TYR 75 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.24 2v47 n TYR 75 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2v47 s VAL 76 N -1.92 0.06 -0.05 -3.48 0.11 -1.26 -0.85 120.40 113.02 2v47 s VAL 76 Ca 0.00 -0.50 0.02 0.00 -2.93 0.00 0.00 61.98 58.56 2v47 s VAL 76 Cb 0.00 -0.40 0.02 0.00 -1.53 0.00 0.00 36.38 34.46 2v47 s VAL 76 CO 0.00 -0.28 -0.07 -1.81 -3.33 0.00 0.00 175.10 169.61 2v47 s ASP 77 N -1.01 1.16 0.90 3.54 1.01 0.48 -4.92 116.67 117.82 2v47 s ASP 77 Ca -0.11 -0.18 -0.12 0.00 0.71 0.00 0.00 52.55 52.85 2v47 s ASP 77 Cb -0.06 -0.52 0.07 0.00 1.01 0.00 0.00 42.92 43.42 2v47 s ASP 77 CO 0.01 -0.01 0.75 1.21 0.21 0.00 0.00 175.17 177.34 2v47 n GLU 78 N 3.86 -0.21 0.00 8.23 2.13 -1.26 0.15 120.64 133.53 2v47 n GLU 78 Ca -0.24 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.58 2v47 n GLU 78 Cb 0.52 -2.09 0.00 0.00 0.27 0.00 0.00 31.44 30.13 2v47 n GLU 78 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2v47 n GLY 79 N 1.02 6.19 3.77 8.31 0.00 -0.05 -4.61 105.19 119.81 2v47 n GLY 79 Ca 0.10 -1.81 -0.37 0.00 0.00 0.00 0.00 46.02 43.94 2v47 n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2v47 s PRO 80 N 1.53 3.68 0.21 1.61 0.04 -1.26 -4.77 135.00 136.04 2v47 s PRO 80 Ca 0.00 1.86 -0.13 0.00 0.04 0.00 0.00 61.00 62.77 2v47 s PRO 80 Cb 0.00 -2.41 -0.07 0.00 0.04 0.00 0.00 34.50 32.06 2v47 s PRO 80 CO 0.00 -0.64 0.59 0.00 0.04 0.00 0.00 177.00 176.99 2v47 s ALA 81 N -1.49 3.52 -0.92 8.56 0.00 -1.26 -4.28 121.76 125.90 2v47 s ALA 81 Ca 0.64 -0.13 -0.00 0.00 0.00 0.00 0.00 51.96 52.47 2v47 s ALA 81 Cb -0.31 -2.55 0.29 0.00 0.00 0.00 0.00 23.12 20.55 2v47 s ALA 81 CO 0.37 0.44 1.28 1.28 0.00 0.00 0.00 175.76 179.13 2v47 n LEU 82 N 0.32 5.65 -4.63 0.00 4.32 -1.08 -5.04 117.00 116.54 2v47 n LEU 82 Ca -0.02 -5.33 -0.58 0.00 -0.02 0.00 0.00 56.01 50.07 2v47 n LEU 82 Cb 0.52 -1.05 -0.08 0.00 -1.62 0.00 0.00 43.42 41.20 2v47 n LEU 82 CO 0.43 1.87 1.43 0.29 -1.22 0.00 0.00 177.39 180.20 2v47 n LYS 83 N 0.95 0.93 -4.61 3.23 5.02 -1.26 -3.85 118.16 118.56 2v47 n LYS 83 Ca 0.29 0.32 -0.28 0.00 -2.02 0.00 0.00 58.31 56.63 2v47 n LYS 83 Cb 0.35 -2.05 -0.11 0.00 -0.02 0.00 0.00 35.03 33.20 2v47 n LYS 83 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2v47 s ARG 84 N 4.21 1.95 -0.09 1.97 1.81 -0.45 -4.97 118.95 123.38 2v47 s ARG 84 Ca 1.03 -2.10 0.03 0.00 -1.72 0.00 0.00 55.73 52.97 2v47 s ARG 84 Cb -1.12 -1.61 0.01 0.00 -0.45 0.00 0.00 34.95 31.79 2v47 s ARG 84 CO 0.65 -0.06 -0.18 0.08 -0.68 0.00 0.00 175.30 175.11 2v47 s VAL 85 N -2.74 1.59 -0.20 3.52 1.01 -1.26 -0.09 120.40 122.23 2v47 s VAL 85 Ca 0.35 -0.74 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 2v47 s VAL 85 Cb 0.10 -1.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.04 2v47 s VAL 85 CO 0.18 0.46 0.01 -0.22 0.00 0.00 0.00 175.10 175.52 2v47 s LEU 86 N 0.59 3.28 -0.08 3.92 2.96 0.21 -4.89 118.68 124.67 2v47 s LEU 86 Ca -0.15 -0.20 -0.30 0.00 -0.22 0.00 0.00 54.13 53.27 2v47 s LEU 86 Cb -0.17 -1.83 -0.02 0.00 0.50 0.00 0.00 46.19 44.67 2v47 s LEU 86 CO 0.05 0.06 1.04 -2.84 -1.32 0.00 0.00 176.35 173.34 2v47 s PRO 87 N 1.03 4.43 0.39 0.98 0.02 -1.26 0.79 135.00 141.37 2v47 s PRO 87 Ca 0.02 1.46 0.08 0.00 0.02 0.00 0.00 61.00 62.58 2v47 s PRO 87 Cb -0.14 -3.53 -0.04 0.00 0.02 0.00 0.00 34.50 30.81 2v47 s PRO 87 CO 0.02 -0.30 0.22 0.50 -0.33 0.00 0.00 177.00 177.10 2v47 s ARG 88 N 1.89 2.37 0.74 5.54 6.06 -1.26 -4.75 118.95 129.53 2v47 s ARG 88 Ca 0.50 -1.65 -0.16 0.00 -2.50 0.00 0.00 55.73 51.92 2v47 s ARG 88 Cb -0.20 -2.16 -0.07 0.00 0.06 0.00 0.00 34.95 32.58 2v47 s ARG 88 CO 0.20 -0.05 0.18 0.00 -2.50 0.00 0.00 175.30 173.14 2v47 n ALA 89 N -1.29 -2.51 -4.30 6.12 0.00 -1.26 -2.43 120.51 114.84 2v47 n ALA 89 Ca -0.01 -0.29 -0.31 0.00 0.00 0.00 0.00 53.44 52.83 2v47 n ALA 89 Cb 0.63 -1.65 -0.09 0.00 0.00 0.00 0.00 19.45 18.33 2v47 n ALA 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2v47 n ARG 90 N 0.15 -1.03 -4.19 0.00 1.74 -1.26 -1.24 116.66 110.84 2v47 n ARG 90 Ca 0.08 0.10 -0.36 0.00 -0.77 0.00 0.00 57.85 56.90 2v47 n ARG 90 Cb 0.50 -3.59 -0.06 0.00 -1.02 0.00 0.00 32.46 28.30 2v47 n ARG 90 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2v47 n GLY 91 N -2.55 -0.42 0.08 -0.13 0.00 -1.02 -4.82 105.19 96.33 2v47 n GLY 91 Ca -0.32 0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.66 2v47 n GLY 91 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2v47 h ARG 92 N -0.86 0.07 -0.94 1.61 2.43 -1.03 -3.47 114.38 112.19 2v47 h ARG 92 Ca -0.52 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 58.53 2v47 h ARG 92 Cb 1.34 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.93 2v47 h ARG 92 CO 0.75 0.82 0.00 0.00 -1.51 0.00 0.00 179.97 180.03 2v47 n ALA 93 N -2.54 -1.00 -2.50 2.80 0.00 -1.25 -4.75 120.51 111.27 2v47 n ALA 93 Ca -0.12 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.07 2v47 n ALA 93 Cb 1.02 -0.16 -0.10 0.00 0.00 0.00 0.00 19.45 20.21 2v47 n ALA 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2v47 s ASP 94 N -0.16 3.72 -0.15 0.00 -0.00 0.24 -4.77 116.67 115.54 2v47 s ASP 94 Ca 0.00 -1.01 -0.24 0.00 -0.00 0.00 0.00 52.55 51.30 2v47 s ASP 94 Cb 0.00 -0.37 -0.02 0.00 -0.00 0.00 0.00 42.92 42.53 2v47 s ASP 94 CO 0.00 -0.00 0.75 0.27 -0.00 0.00 0.00 175.17 176.18 2v47 s ILE 95 N -2.50 4.96 0.51 0.77 -4.36 -1.26 0.65 121.20 119.97 2v47 s ILE 95 Ca 0.31 1.47 0.03 0.00 -0.26 0.00 0.00 60.65 62.20 2v47 s ILE 95 Cb -0.04 -4.06 0.03 0.00 1.25 0.00 0.00 42.46 39.63 2v47 s ILE 95 CO 0.16 0.11 0.71 -0.51 0.24 0.00 0.00 174.94 175.65 2v47 s ILE 96 N 1.74 2.77 -0.35 8.37 1.10 0.87 -4.89 121.20 130.81 2v47 s ILE 96 Ca 0.36 -0.77 -0.01 0.00 -0.51 0.00 0.00 60.65 59.72 2v47 s ILE 96 Cb -0.17 -3.00 0.13 0.00 0.15 0.00 0.00 42.46 39.57 2v47 s ILE 96 CO 0.13 0.00 0.18 -0.54 -2.11 0.00 0.00 174.94 172.61 2v47 s LYS 97 N -4.64 0.61 -0.06 3.50 1.02 -1.26 -1.34 119.74 117.57 2v47 s LYS 97 Ca 0.57 -1.23 -0.30 0.00 0.02 0.00 0.00 55.97 55.03 2v47 s LYS 97 Cb -0.10 -1.52 -0.04 0.00 -0.52 0.00 0.00 37.83 35.64 2v47 s LYS 97 CO 0.37 -1.13 1.36 0.15 -0.92 0.00 0.00 175.35 175.18 2v47 s LYS 98 N 1.26 4.27 0.47 1.68 1.02 -1.25 -4.89 119.74 122.29 2v47 s LYS 98 Ca 0.15 1.86 0.01 0.00 0.02 0.00 0.00 55.97 58.01 2v47 s LYS 98 Cb -0.21 -3.68 0.01 0.00 -0.52 0.00 0.00 37.83 33.43 2v47 s LYS 98 CO -0.11 -0.62 0.68 1.03 -0.92 0.00 0.00 175.35 175.41 2v47 s ARG 99 N 2.88 2.92 0.13 1.68 1.81 -1.26 -2.62 118.95 124.48 2v47 s ARG 99 Ca 0.61 -0.64 0.05 0.00 -1.72 0.00 0.00 55.73 54.03 2v47 s ARG 99 Cb -0.28 -2.57 -0.04 0.00 -0.45 0.00 0.00 34.95 31.61 2v47 s ARG 99 CO 0.23 -0.36 -0.11 -0.08 -0.68 0.00 0.00 175.30 174.29 2v47 s THR 100 N -2.57 1.17 -0.01 0.02 -1.32 -1.26 -2.48 115.64 109.19 2v47 s THR 100 Ca 0.51 -1.85 -0.01 0.00 -1.21 0.00 0.00 61.69 59.13 2v47 s THR 100 Cb -0.10 -1.62 0.00 0.00 -1.51 0.00 0.00 72.50 69.27 2v47 s THR 100 CO 0.37 -0.59 0.03 -0.44 -2.21 0.00 0.00 174.62 171.78 2v47 s SER 101 N -2.76 -0.02 -0.82 8.08 0.01 -1.17 -0.87 113.70 116.15 2v47 s SER 101 Ca 0.11 0.03 -0.15 0.00 1.31 0.00 0.00 55.95 57.26 2v47 s SER 101 Cb -0.01 0.06 0.21 0.00 0.21 0.00 0.00 66.02 66.48 2v47 s SER 101 CO 0.01 -0.02 0.79 -1.00 0.41 0.00 0.00 173.24 173.43 2v47 s HIS 102 N -0.04 3.68 -0.32 2.43 3.76 0.40 -1.04 115.29 124.15 2v47 s HIS 102 Ca -0.01 -1.90 -0.24 0.00 -0.15 0.00 0.00 55.06 52.76 2v47 s HIS 102 Cb -0.01 -3.86 0.01 0.00 1.11 0.00 0.00 32.58 29.83 2v47 s HIS 102 CO 0.00 -1.04 0.83 0.96 -0.85 0.00 0.00 174.74 174.65 2v47 s ILE 103 N 0.47 4.73 -0.07 0.60 -4.36 -1.02 -0.39 121.20 121.17 2v47 s ILE 103 Ca 0.18 1.19 -0.03 0.00 -0.26 0.00 0.00 60.65 61.74 2v47 s ILE 103 Cb -0.11 -4.21 -0.04 0.00 1.25 0.00 0.00 42.46 39.36 2v47 s ILE 103 CO -0.08 -0.34 0.07 -0.89 0.24 0.00 0.00 174.94 173.94 2v47 s THR 104 N 3.11 4.81 -0.36 8.37 2.01 -0.03 -1.19 115.64 132.37 2v47 s THR 104 Ca 0.34 -0.17 0.00 0.00 0.31 0.00 0.00 61.69 62.17 2v47 s THR 104 Cb -0.13 -3.11 0.13 0.00 0.01 0.00 0.00 72.50 69.40 2v47 s THR 104 CO 0.14 0.52 0.20 -0.69 -0.69 0.00 0.00 174.62 174.11 2v47 s VAL 105 N -1.04 0.35 0.04 3.82 1.01 -1.26 -2.14 120.40 121.19 2v47 s VAL 105 Ca 0.17 -1.76 -0.25 0.00 0.00 0.00 0.00 61.98 60.14 2v47 s VAL 105 Cb -0.12 -1.27 -0.05 0.00 0.00 0.00 0.00 36.38 34.95 2v47 s VAL 105 CO 0.07 -0.94 0.78 0.27 0.00 0.00 0.00 175.10 175.28 2v47 s ILE 106 N 1.05 4.74 0.56 2.22 -4.36 -0.94 -2.05 121.20 122.44 2v47 s ILE 106 Ca 0.17 1.67 0.08 0.00 -0.26 0.00 0.00 60.65 62.30 2v47 s ILE 106 Cb -0.23 -4.13 0.07 0.00 1.25 0.00 0.00 42.46 39.42 2v47 s ILE 106 CO -0.03 0.34 0.61 -0.76 0.24 0.00 0.00 174.94 175.35 2v47 s LEU 107 N 0.06 2.90 0.00 0.37 1.02 0.63 -2.19 118.68 121.46 2v47 s LEU 107 Ca 0.40 -1.05 -0.08 0.00 0.02 0.00 0.00 54.13 53.42 2v47 s LEU 107 Cb -0.20 -1.40 0.03 0.00 0.02 0.00 0.00 46.19 44.64 2v47 s LEU 107 CO 0.23 -1.24 0.50 0.61 0.02 0.00 0.00 176.35 176.47 2v47 n GLY 108 N -2.03 1.55 3.35 -3.19 0.00 -1.14 -3.16 105.19 100.57 2v47 n GLY 108 Ca 0.08 -1.27 -0.28 0.00 0.00 0.00 0.00 46.02 44.55 2v47 n GLY 108 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2v47 s GLU 109 N -2.18 1.45 1.12 1.61 2.02 -1.26 -0.84 118.70 120.62 2v47 s GLU 109 Ca 0.13 -1.22 -0.19 0.00 0.02 0.00 0.00 54.97 53.71 2v47 s GLU 109 Cb -0.03 -1.79 0.12 0.00 0.10 0.00 0.00 34.13 32.53 2v47 s GLU 109 CO 0.10 0.44 0.02 1.17 0.02 0.00 0.00 175.26 177.00 2v47 n LYS 110 N 1.24 -1.77 0.00 1.61 3.00 0.53 -4.84 118.16 117.93 2v47 n LYS 110 Ca -0.18 -0.51 0.00 0.00 -0.00 0.00 0.00 58.31 57.63 2v47 n LYS 110 Cb 0.53 -1.66 0.00 0.00 0.00 0.00 0.00 35.03 33.90 2v47 n LYS 110 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 2v47 n HIS 111 N -4.47 0.00 0.00 5.64 1.44 -1.26 -4.98 115.22 111.59 2v47 n HIS 111 Ca 0.01 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.72 2v47 n HIS 111 Cb 0.60 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.71 2v47 n HIS 111 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2v47 n GLY 112 N 0.00 1.70 0.00 -1.39 0.00 -1.26 -5.18 105.19 99.06 2v47 n GLY 112 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2v47 n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60