#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v49 n GLU 2 N 0.00 0.00 -4.78 2.12 0.28 -1.26 -4.80 120.64 112.19 2v49 n GLU 2 Ca 0.00 0.00 -0.27 0.00 -0.16 0.00 0.00 57.16 56.73 2v49 n GLU 2 Cb 0.00 0.00 -0.17 0.00 1.43 0.00 0.00 31.44 32.70 2v49 n GLU 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2v49 s ALA 3 N -1.59 1.53 0.49 -1.84 0.00 -1.19 -4.92 121.76 114.24 2v49 s ALA 3 Ca 0.00 -0.59 0.04 0.00 0.00 0.00 0.00 51.96 51.42 2v49 s ALA 3 Cb 0.00 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.51 2v49 s ALA 3 CO 0.00 0.18 0.68 0.15 0.00 0.00 0.00 175.76 176.77 2v49 s LYS 4 N 0.52 2.66 0.02 0.00 1.02 -1.26 0.20 119.74 122.92 2v49 s LYS 4 Ca -0.15 -1.01 -0.00 0.00 0.02 0.00 0.00 55.97 54.83 2v49 s LYS 4 Cb -0.16 -2.61 -0.00 0.00 -0.52 0.00 0.00 37.83 34.53 2v49 s LYS 4 CO 0.05 -0.52 -0.00 0.00 -0.92 0.00 0.00 175.35 173.96 2v49 n ALA 5 N -2.12 2.94 -2.85 5.17 0.00 -0.90 -4.62 120.51 118.13 2v49 n ALA 5 Ca 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 53.44 53.50 2v49 n ALA 5 Cb 0.59 0.06 -0.01 0.00 0.00 0.00 0.00 19.45 20.10 2v49 n ALA 5 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2v49 n ILE 6 N -2.77 -4.20 -4.06 0.00 5.41 -1.23 -4.82 119.36 107.69 2v49 n ILE 6 Ca -0.00 0.78 -0.32 0.00 1.00 0.00 0.00 62.75 64.21 2v49 n ILE 6 Cb 0.00 -3.51 -0.15 0.00 -0.71 0.00 0.00 39.64 35.27 2v49 n ILE 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2v49 s ALA 7 N -0.18 2.61 0.87 -1.39 0.00 -0.47 -4.98 121.76 118.22 2v49 s ALA 7 Ca -0.07 -1.86 -0.12 0.00 0.00 0.00 0.00 51.96 49.91 2v49 s ALA 7 Cb 0.00 -1.64 0.12 0.00 0.00 0.00 0.00 23.12 21.60 2v49 s ALA 7 CO 0.19 -1.26 1.16 1.03 0.00 0.00 0.00 175.76 176.89 2v49 s ARG 8 N 1.08 1.43 -0.70 0.00 0.52 -1.26 -2.47 118.95 117.56 2v49 s ARG 8 Ca -0.07 0.18 -0.19 0.00 -0.52 0.00 0.00 55.73 55.13 2v49 s ARG 8 Cb -0.20 -1.88 0.03 0.00 0.52 0.00 0.00 34.95 33.41 2v49 s ARG 8 CO -0.05 -1.98 0.35 0.66 0.02 0.00 0.00 175.30 174.31 2v49 n TYR 9 N -3.59 -0.76 0.09 -0.53 0.53 -1.26 -4.82 117.16 106.82 2v49 n TYR 9 Ca 0.08 0.04 -0.12 0.00 -1.02 0.00 0.00 57.90 56.88 2v49 n TYR 9 Cb 0.60 -1.54 -0.05 0.00 -1.03 0.00 0.00 39.34 37.32 2v49 n TYR 9 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 2v49 h VAL 10 N -0.16 0.37 -0.29 -0.72 2.07 -1.31 -3.46 116.25 112.75 2v49 h VAL 10 Ca -0.40 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2v49 h VAL 10 Cb 0.79 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2v49 h VAL 10 CO 0.30 0.00 0.00 -1.14 0.02 0.00 0.00 177.57 176.75 2v49 n ARG 11 N -5.39 0.00 -3.58 1.57 0.00 -1.26 -4.89 116.66 103.11 2v49 n ARG 11 Ca -0.06 0.00 -0.16 0.00 -0.00 0.00 0.00 57.85 57.64 2v49 n ARG 11 Cb 0.31 -0.52 -0.07 0.00 0.00 0.00 0.00 32.46 32.18 2v49 n ARG 11 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2v49 s ILE 12 N -1.90 0.00 0.50 5.15 2.07 -1.07 -4.92 121.20 121.04 2v49 s ILE 12 Ca 0.00 -0.00 -0.21 0.00 -1.41 0.00 0.00 60.65 59.03 2v49 s ILE 12 Cb 0.00 -1.00 -0.09 0.00 0.13 0.00 0.00 42.46 41.51 2v49 s ILE 12 CO 0.00 -0.00 0.83 -0.24 -1.91 0.00 0.00 174.94 173.62 2v49 n SER 13 N 1.87 0.34 0.00 4.50 2.88 -1.24 -2.98 113.62 118.99 2v49 n SER 13 Ca -0.16 0.89 0.00 0.00 -1.33 0.00 0.00 58.87 58.27 2v49 n SER 13 Cb 0.56 -1.29 0.00 0.00 -0.75 0.00 0.00 64.21 62.73 2v49 n SER 13 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2v49 n PRO 14 N -0.16 0.00 -0.25 -1.46 -0.02 -1.26 -3.15 135.00 128.70 2v49 n PRO 14 Ca 0.11 0.43 0.24 0.00 -2.02 0.00 0.00 63.50 62.26 2v49 n PRO 14 Cb 0.43 -1.21 0.43 0.00 -0.02 0.00 0.00 33.50 33.13 2v49 n PRO 14 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2v49 n ARG 15 N -1.78 -0.04 -0.22 -0.52 1.74 -1.26 0.11 116.66 114.69 2v49 n ARG 15 Ca 0.00 0.95 -0.04 0.00 -0.77 0.00 0.00 57.85 57.98 2v49 n ARG 15 Cb 0.00 -1.74 0.12 0.00 -1.02 0.00 0.00 32.46 29.82 2v49 n ARG 15 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2v49 h LYS 16 N 0.00 1.04 0.02 5.56 1.57 -1.93 -3.28 116.57 119.55 2v49 h LYS 16 Ca 0.60 -0.20 -0.36 0.00 -1.87 0.00 0.00 60.65 58.83 2v49 h LYS 16 Cb 1.69 -0.16 -0.06 0.00 0.08 0.00 0.00 32.23 33.78 2v49 h LYS 16 CO -0.49 0.87 -2.22 1.33 -0.57 0.00 0.00 179.45 178.38 2v49 n VAL 17 N -4.28 1.52 -0.62 0.50 0.24 0.31 -4.10 118.33 111.91 2v49 n VAL 17 Ca 0.06 -0.74 0.47 0.00 -2.04 0.00 0.00 64.34 62.09 2v49 n VAL 17 Cb 0.20 -1.02 0.72 0.00 -1.47 0.00 0.00 33.84 32.27 2v49 n VAL 17 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2v49 n ARG 18 N -3.06 0.00 0.00 7.34 1.74 0.52 0.47 116.66 123.67 2v49 n ARG 18 Ca -0.33 0.96 0.00 0.00 -0.77 0.00 0.00 57.85 57.71 2v49 n ARG 18 Cb 1.08 -2.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 2v49 n ARG 18 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2v49 n LEU 19 N -3.67 0.18 -0.32 0.55 4.32 -1.24 -2.43 117.00 114.38 2v49 n LEU 19 Ca 0.39 0.70 -0.08 0.00 -0.02 0.00 0.00 56.01 56.99 2v49 n LEU 19 Cb 1.78 -0.26 -0.08 0.00 -1.62 0.00 0.00 43.42 43.24 2v49 n LEU 19 CO 0.39 -0.26 0.46 1.33 -1.22 0.00 0.00 177.39 178.09 2v49 n VAL 20 N -1.28 -0.52 -0.33 4.08 0.24 0.18 -1.13 118.33 119.56 2v49 n VAL 20 Ca 0.00 2.13 -0.07 0.00 -2.04 0.00 0.00 64.34 64.36 2v49 n VAL 20 Cb 0.00 -2.66 -0.06 0.00 -1.47 0.00 0.00 33.84 29.65 2v49 n VAL 20 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2v49 n VAL 21 N -4.77 -0.53 -0.17 3.34 0.31 -0.73 0.22 118.33 116.01 2v49 n VAL 21 Ca 0.02 1.95 0.23 0.00 -0.01 0.00 0.00 64.34 66.52 2v49 n VAL 21 Cb 0.20 -2.44 0.62 0.00 -0.91 0.00 0.00 33.84 31.31 2v49 n VAL 21 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2v49 h ASP 22 N 0.00 0.18 0.12 4.52 3.32 -0.78 -0.55 116.42 123.23 2v49 h ASP 22 Ca 0.16 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2v49 h ASP 22 Cb 0.36 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.90 2v49 h ASP 22 CO -0.77 0.07 0.00 0.18 -1.72 0.00 0.00 179.24 177.00 2v49 n LEU 23 N -4.39 0.00 0.00 1.55 4.32 0.59 -2.21 117.00 116.86 2v49 n LEU 23 Ca 0.17 0.33 0.00 0.00 -0.02 0.00 0.00 56.01 56.49 2v49 n LEU 23 Cb 0.77 -0.33 0.00 0.00 -1.62 0.00 0.00 43.42 42.24 2v49 n LEU 23 CO 0.35 -0.27 0.31 2.30 -1.22 0.00 0.00 177.39 178.86 2v49 n ILE 24 N -1.33 0.39 -1.54 -0.08 -5.35 -0.22 -4.99 119.36 106.23 2v49 n ILE 24 Ca 0.02 -0.46 -0.23 0.00 -0.27 0.00 0.00 62.75 61.81 2v49 n ILE 24 Cb 0.05 0.94 -0.11 0.00 -1.74 0.00 0.00 39.64 38.77 2v49 n ILE 24 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 2v49 n ARG 25 N -0.19 0.45 -2.11 6.28 0.63 -0.94 -3.32 116.66 117.46 2v49 n ARG 25 Ca 0.00 -0.37 -0.01 0.00 -0.92 0.00 0.00 57.85 56.55 2v49 n ARG 25 Cb 0.30 -2.71 -0.01 0.00 0.45 0.00 0.00 32.46 30.49 2v49 n ARG 25 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2v49 n GLY 26 N 6.29 -3.74 3.59 5.14 0.00 -0.73 -5.02 105.19 110.71 2v49 n GLY 26 Ca 0.53 0.28 -0.11 0.00 0.00 0.00 0.00 46.02 46.72 2v49 n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2v49 s LYS 27 N -0.83 0.59 -0.38 1.61 1.02 -1.21 -4.86 119.74 115.67 2v49 s LYS 27 Ca -0.04 0.26 -0.41 0.00 0.02 0.00 0.00 55.97 55.80 2v49 s LYS 27 Cb 0.00 0.28 -0.16 0.00 -0.52 0.00 0.00 37.83 37.44 2v49 s LYS 27 CO 0.40 -0.16 1.95 -1.13 -0.92 0.00 0.00 175.35 175.49 2v49 n SER 28 N 1.08 1.77 -0.34 2.83 3.41 -1.26 -2.68 113.62 118.42 2v49 n SER 28 Ca -0.11 0.81 0.09 0.00 -0.26 0.00 0.00 58.87 59.39 2v49 n SER 28 Cb 0.57 -1.08 0.20 0.00 -0.26 0.00 0.00 64.21 63.64 2v49 n SER 28 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2v49 h LEU 29 N 8.84 -0.72 -0.23 1.04 6.46 -1.85 0.34 115.31 129.18 2v49 h LEU 29 Ca -0.32 0.28 0.02 0.00 -0.12 0.00 0.00 57.88 57.75 2v49 h LEU 29 Cb 1.35 0.55 -0.03 0.00 -0.73 0.00 0.00 40.66 41.80 2v49 h LEU 29 CO 1.01 -0.33 -0.15 -0.08 -0.62 0.00 0.00 178.44 178.27 2v49 h GLU 30 N 0.01 -0.02 0.52 1.25 4.81 -1.86 0.53 114.58 119.81 2v49 h GLU 30 Ca 0.52 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.73 2v49 h GLU 30 Cb 0.91 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.30 2v49 h GLU 30 CO -0.96 -0.02 -0.31 1.49 -0.73 0.00 0.00 179.01 178.48 2v49 h GLU 31 N -0.02 -0.75 -0.74 1.92 4.81 -0.87 -2.70 114.58 116.23 2v49 h GLU 31 Ca 0.04 0.05 0.15 0.00 -0.13 0.00 0.00 59.36 59.46 2v49 h GLU 31 Cb 0.12 0.17 -0.14 0.00 0.63 0.00 0.00 28.75 29.53 2v49 h GLU 31 CO -0.23 -0.50 -0.20 0.00 -0.73 0.00 0.00 179.01 177.36 2v49 n ALA 32 N -2.50 0.15 -0.06 2.92 0.00 0.71 0.71 120.51 122.44 2v49 n ALA 32 Ca -0.10 0.81 -0.07 0.00 0.00 0.00 0.00 53.44 54.09 2v49 n ALA 32 Cb 0.32 -0.47 -0.05 0.00 0.00 0.00 0.00 19.45 19.25 2v49 n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2v49 h ARG 33 N 0.00 -0.19 -0.91 0.00 3.08 0.37 0.57 114.38 117.30 2v49 h ARG 33 Ca 0.35 0.01 0.26 0.00 0.07 0.00 0.00 59.98 60.67 2v49 h ARG 33 Cb 0.53 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 2v49 h ARG 33 CO -0.76 -0.13 0.73 -0.91 -1.07 0.00 0.00 179.97 177.84 2v49 h ASN 34 N -0.20 0.00 0.00 7.04 2.35 0.47 0.93 115.58 126.17 2v49 h ASN 34 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2v49 h ASN 34 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 2v49 h ASN 34 CO -0.27 0.00 0.00 -0.38 -1.65 0.00 0.00 177.43 175.13 2v49 n ILE 35 N -4.00 0.00 -0.32 2.81 2.08 0.19 -1.54 119.36 118.57 2v49 n ILE 35 Ca 0.19 0.75 0.22 0.00 0.56 0.00 0.00 62.75 64.48 2v49 n ILE 35 Cb 1.05 -1.59 0.44 0.00 -0.75 0.00 0.00 39.64 38.79 2v49 n ILE 35 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2v49 h LEU 36 N 0.00 0.32 -0.87 1.39 3.38 -0.90 0.91 115.31 119.53 2v49 h LEU 36 Ca 0.00 0.21 0.23 0.00 0.09 0.00 0.00 57.88 58.41 2v49 h LEU 36 Cb 0.00 0.21 -0.14 0.00 0.09 0.00 0.00 40.66 40.82 2v49 h LEU 36 CO 0.00 -0.20 0.26 -0.09 0.09 0.00 0.00 178.44 178.50 2v49 h ARG 37 N 0.23 0.24 -0.06 1.13 9.65 0.88 -2.28 114.38 124.18 2v49 h ARG 37 Ca 0.71 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.57 2v49 h ARG 37 Cb 1.62 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 30.14 2v49 h ARG 37 CO -0.66 0.16 0.00 0.66 2.80 0.00 0.00 179.97 182.93 2v49 n TYR 38 N -5.19 0.09 -3.04 2.20 4.01 0.25 -5.02 117.16 110.46 2v49 n TYR 38 Ca 0.21 -0.59 -0.39 0.00 -0.16 0.00 0.00 57.90 56.97 2v49 n TYR 38 Cb 0.66 -0.07 -0.06 0.00 -0.31 0.00 0.00 39.34 39.56 2v49 n TYR 38 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2v49 s THR 39 N -1.36 4.45 -0.49 -0.72 2.01 0.24 -5.03 115.64 114.74 2v49 s THR 39 Ca 0.10 1.59 -0.13 0.00 0.31 0.00 0.00 61.69 63.55 2v49 s THR 39 Cb 0.07 -4.07 0.10 0.00 0.01 0.00 0.00 72.50 68.61 2v49 s THR 39 CO 0.03 0.50 0.40 0.21 -0.69 0.00 0.00 174.62 175.07 2v49 s ASN 40 N -1.18 5.97 -0.29 3.53 2.47 -1.26 -4.89 114.94 119.28 2v49 s ASN 40 Ca 0.35 -1.66 -0.25 0.00 0.42 0.00 0.00 52.86 51.72 2v49 s ASN 40 Cb -0.22 -2.12 0.17 0.00 -1.45 0.00 0.00 41.25 37.63 2v49 s ASN 40 CO 0.25 -0.71 1.31 -0.54 -3.72 0.00 0.00 177.10 173.68 2v49 s LYS 41 N 1.52 0.20 0.22 0.43 -0.14 -1.26 -5.03 119.74 115.68 2v49 s LYS 41 Ca 0.04 0.22 -0.08 0.00 -1.36 0.00 0.00 55.97 54.79 2v49 s LYS 41 Cb -0.26 0.10 0.35 0.00 -1.68 0.00 0.00 37.83 36.33 2v49 s LYS 41 CO 0.03 -0.03 1.70 -0.09 -0.76 0.00 0.00 175.35 176.20 2v49 h ARG 42 N 3.38 0.26 -0.65 1.68 2.43 -1.93 -2.61 114.38 116.92 2v49 h ARG 42 Ca -0.26 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 58.95 2v49 h ARG 42 Cb 1.19 -0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 30.60 2v49 h ARG 42 CO 0.16 0.17 -0.39 0.41 -1.51 0.00 0.00 179.97 178.82 2v49 n GLY 43 N -1.33 -2.33 0.02 2.80 0.00 -1.26 -2.58 105.19 100.51 2v49 n GLY 43 Ca 0.11 0.90 -0.01 0.00 0.00 0.00 0.00 46.02 47.02 2v49 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2v49 n ALA 44 N -3.24 -0.03 -0.20 4.61 0.00 -0.98 0.69 120.51 121.35 2v49 n ALA 44 Ca 0.01 0.05 0.14 0.00 0.00 0.00 0.00 53.44 53.64 2v49 n ALA 44 Cb 0.17 0.18 0.26 0.00 0.00 0.00 0.00 19.45 20.06 2v49 n ALA 44 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2v49 n TYR 45 N -2.69 0.54 -0.05 0.00 9.36 -1.06 0.20 117.16 123.46 2v49 n TYR 45 Ca 0.00 0.71 -0.18 0.00 3.32 0.00 0.00 57.90 61.75 2v49 n TYR 45 Cb 0.01 -1.05 -0.13 0.00 -0.63 0.00 0.00 39.34 37.55 2v49 n TYR 45 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 2v49 h PHE 46 N 0.00 0.14 -0.06 2.98 0.04 0.11 -2.66 116.94 117.49 2v49 h PHE 46 Ca 0.43 -0.10 0.02 0.00 2.80 0.00 0.00 57.97 61.12 2v49 h PHE 46 Cb 1.05 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 39.19 2v49 h PHE 46 CO -0.15 1.26 0.22 0.28 -0.60 0.00 0.00 178.31 179.32 2v49 h VAL 47 N -0.81 0.11 0.00 -0.55 2.07 0.11 -0.35 116.25 116.83 2v49 h VAL 47 Ca -0.16 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.36 2v49 h VAL 47 Cb 1.29 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 2v49 h VAL 47 CO -0.03 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.56 2v49 n ALA 48 N -2.05 0.00 -0.08 1.67 0.00 0.55 -3.04 120.51 117.56 2v49 n ALA 48 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.41 2v49 n ALA 48 Cb 0.29 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.73 2v49 n ALA 48 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2v49 n LYS 49 N -0.45 -0.08 -0.30 0.00 3.00 -0.91 0.26 118.16 119.67 2v49 n LYS 49 Ca 0.00 0.32 0.10 0.00 -0.00 0.00 0.00 58.31 58.73 2v49 n LYS 49 Cb 0.00 -0.46 0.27 0.00 0.00 0.00 0.00 35.03 34.84 2v49 n LYS 49 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.40 177.16 2v49 h VAL 50 N 0.00 0.60 0.01 3.15 3.04 -1.24 -1.38 116.25 120.43 2v49 h VAL 50 Ca 0.03 -0.18 -0.07 0.00 -1.01 0.00 0.00 66.70 65.47 2v49 h VAL 50 Cb 0.07 0.04 0.01 0.00 -2.01 0.00 0.00 31.29 29.40 2v49 h VAL 50 CO -0.17 0.09 -0.28 0.25 -1.01 0.00 0.00 177.57 176.46 2v49 h LEU 51 N 0.52 0.22 -1.84 3.16 7.12 0.36 -1.52 115.31 123.33 2v49 h LEU 51 Ca 0.52 -0.82 0.00 0.00 0.13 0.00 0.00 57.88 57.71 2v49 h LEU 51 Cb 0.87 -0.07 0.00 0.00 -0.53 0.00 0.00 40.66 40.93 2v49 h LEU 51 CO -0.44 1.01 0.31 -0.08 -0.13 0.00 0.00 178.44 179.11 2v49 h GLU 52 N -0.54 0.00 0.06 1.25 4.57 -0.27 0.33 114.58 119.98 2v49 h GLU 52 Ca -0.04 0.00 -0.37 0.00 -1.18 0.00 0.00 59.36 57.77 2v49 h GLU 52 Cb 1.07 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.62 2v49 h GLU 52 CO 0.05 0.00 -2.15 0.45 -1.18 0.00 0.00 179.01 176.18 2v49 n SER 53 N -2.76 2.04 0.27 1.04 2.88 -0.57 -3.70 113.62 112.82 2v49 n SER 53 Ca -0.02 0.11 0.18 0.00 -1.33 0.00 0.00 58.87 57.81 2v49 n SER 53 Cb 0.36 -0.70 0.93 0.00 -0.75 0.00 0.00 64.21 64.04 2v49 n SER 53 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2v49 h ALA 54 N -0.07 1.50 0.10 -1.46 0.00 0.62 -0.89 119.26 119.05 2v49 h ALA 54 Ca -0.49 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 2v49 h ALA 54 Cb 1.90 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.70 2v49 h ALA 54 CO -0.04 -0.22 -0.05 0.00 0.00 0.00 0.00 179.25 178.95 2v49 h ALA 55 N 1.74 -0.29 -1.34 0.00 0.00 -1.08 -3.00 119.26 115.29 2v49 h ALA 55 Ca 0.04 -0.03 0.40 0.00 0.00 0.00 0.00 54.91 55.33 2v49 h ALA 55 Cb 0.39 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.14 2v49 h ALA 55 CO -0.00 -0.28 0.91 0.00 0.00 0.00 0.00 179.25 179.89 2v49 h ALA 56 N -1.66 2.92 0.19 0.00 0.00 -1.52 -0.03 119.26 119.16 2v49 h ALA 56 Ca -0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2v49 h ALA 56 Cb 0.10 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2v49 h ALA 56 CO 0.02 -1.43 -0.09 -0.91 0.00 0.00 0.00 179.25 176.84 2v49 h ASN 57 N 0.11 -0.22 -0.44 0.00 -0.26 -1.23 0.42 115.58 113.97 2v49 h ASN 57 Ca 0.73 -0.15 0.09 0.00 -0.56 0.00 0.00 56.30 56.41 2v49 h ASN 57 Cb 2.49 0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 39.78 2v49 h ASN 57 CO -0.22 0.02 0.30 0.00 -1.06 0.00 0.00 177.43 176.48 2v49 h ALA 58 N 0.31 2.12 -3.00 -0.83 0.00 -0.86 -1.46 119.26 115.54 2v49 h ALA 58 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2v49 h ALA 58 Cb 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2v49 h ALA 58 CO 0.04 -0.22 0.00 0.28 0.00 0.00 0.00 179.25 179.35 2v49 n VAL 59 N -4.46 0.00 0.00 0.00 0.31 -0.94 -0.09 118.33 113.15 2v49 n VAL 59 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 2v49 n VAL 59 Cb 0.35 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 2v49 n VAL 59 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2v49 n ASN 60 N -0.36 0.00 0.00 4.52 3.02 0.14 -1.07 115.26 121.51 2v49 n ASN 60 Ca 0.00 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 2v49 n ASN 60 Cb 0.00 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 2v49 n ASN 60 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2v49 n ASN 61 N -0.88 0.19 -1.38 6.41 5.03 -0.94 -4.88 115.26 118.82 2v49 n ASN 61 Ca 0.00 0.00 0.04 0.00 0.87 0.00 0.00 54.58 55.49 2v49 n ASN 61 Cb 0.13 0.00 0.30 0.00 -1.02 0.00 0.00 39.78 39.19 2v49 n ASN 61 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 2v49 n HIS 62 N -2.41 1.53 -1.11 3.10 8.25 -0.59 -5.03 115.22 118.96 2v49 n HIS 62 Ca 0.00 -0.97 0.00 0.00 -0.26 0.00 0.00 57.72 56.49 2v49 n HIS 62 Cb 0.11 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 30.76 2v49 n HIS 62 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2v49 n ASP 63 N -0.23 -2.39 0.00 0.41 5.75 0.87 -4.78 116.55 116.18 2v49 n ASP 63 Ca 0.28 0.26 0.00 0.00 -0.01 0.00 0.00 54.79 55.32 2v49 n ASP 63 Cb 1.08 -0.50 0.00 0.00 -1.03 0.00 0.00 41.12 40.67 2v49 n ASP 63 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 2v49 n MET 64 N 1.29 3.26 -0.77 0.11 2.81 -0.62 -4.92 117.12 118.27 2v49 n MET 64 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2v49 n MET 64 Cb 0.05 -0.45 0.00 0.00 -0.71 0.00 0.00 33.22 32.11 2v49 n MET 64 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2v49 n LEU 65 N -0.44 -1.32 -2.88 4.03 0.00 -1.26 -4.68 117.00 110.45 2v49 n LEU 65 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 56.01 55.95 2v49 n LEU 65 Cb 0.00 -0.66 -0.01 0.00 0.00 0.00 0.00 43.42 42.75 2v49 n LEU 65 CO 0.00 0.00 1.28 1.21 0.00 0.00 0.00 177.39 179.88 2v49 n GLU 66 N 0.80 0.65 0.00 1.96 2.13 -1.26 -2.28 120.64 122.64 2v49 n GLU 66 Ca 0.00 -0.67 0.00 0.00 0.66 0.00 0.00 57.16 57.15 2v49 n GLU 66 Cb 0.00 -2.01 0.00 0.00 0.27 0.00 0.00 31.44 29.70 2v49 n GLU 66 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2v49 n ASP 67 N 4.22 0.00 -2.40 4.31 8.00 -1.26 -4.93 116.55 124.48 2v49 n ASP 67 Ca 0.14 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.29 2v49 n ASP 67 Cb 0.08 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.26 2v49 n ASP 67 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2v49 n ARG 68 N -0.85 2.72 -4.30 -1.24 1.74 -0.97 -4.94 116.66 108.82 2v49 n ARG 68 Ca 0.00 -3.35 -0.16 0.00 -0.77 0.00 0.00 57.85 53.57 2v49 n ARG 68 Cb 0.00 -2.29 -0.10 0.00 -1.02 0.00 0.00 32.46 29.05 2v49 n ARG 68 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 2v49 s LEU 69 N -3.86 2.36 0.00 0.55 0.05 -1.26 0.18 118.68 116.70 2v49 s LEU 69 Ca 0.63 -1.13 0.00 0.00 0.05 0.00 0.00 54.13 53.68 2v49 s LEU 69 Cb 0.50 -0.34 0.00 0.00 -2.05 0.00 0.00 46.19 44.30 2v49 s LEU 69 CO -0.07 -0.41 0.00 0.00 -0.55 0.00 0.00 176.35 175.32 2v49 n TYR 70 N -0.34 0.00 -3.48 3.48 -0.00 -0.00 -3.54 117.16 113.29 2v49 n TYR 70 Ca -0.07 0.00 -0.39 0.00 -0.00 0.00 0.00 57.90 57.44 2v49 n TYR 70 Cb 0.62 0.00 -0.04 0.00 -0.00 0.00 0.00 39.34 39.93 2v49 n TYR 70 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.86 177.14 2v49 n VAL 71 N 0.00 3.68 -0.33 -3.48 0.31 -1.09 -2.91 118.33 114.51 2v49 n VAL 71 Ca 0.00 -5.28 0.27 0.00 -0.01 0.00 0.00 64.34 59.31 2v49 n VAL 71 Cb 0.00 -2.40 0.52 0.00 -0.91 0.00 0.00 33.84 31.05 2v49 n VAL 71 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2v49 h LYS 72 N 6.03 0.20 0.00 5.55 1.63 -1.69 -1.94 116.57 126.35 2v49 h LYS 72 Ca 0.17 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.96 2v49 h LYS 72 Cb 0.80 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.38 2v49 h LYS 72 CO 0.95 0.14 0.00 0.00 -3.45 0.00 0.00 179.45 177.09 2v49 n ALA 73 N -2.28 0.00 0.00 5.00 0.00 -0.88 -4.73 120.51 117.61 2v49 n ALA 73 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.78 2v49 n ALA 73 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.55 2v49 n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2v49 n ALA 74 N 0.00 0.00 0.00 0.00 0.00 -1.26 -2.45 120.51 116.79 2v49 n ALA 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2v49 n ALA 74 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2v49 n ALA 74 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2v49 n TYR 75 N 0.56 0.00 -3.83 0.00 4.11 -0.87 -4.98 117.16 112.15 2v49 n TYR 75 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.78 2v49 n TYR 75 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.23 2v49 n TYR 75 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2v49 s VAL 76 N -1.82 0.04 -0.06 -3.48 0.11 -1.26 -0.85 120.40 113.08 2v49 s VAL 76 Ca 0.00 -0.36 0.02 0.00 -2.93 0.00 0.00 61.98 58.71 2v49 s VAL 76 Cb 0.00 -0.37 0.02 0.00 -1.53 0.00 0.00 36.38 34.49 2v49 s VAL 76 CO 0.00 -0.20 -0.09 -1.81 -3.33 0.00 0.00 175.10 169.67 2v49 s ASP 77 N -0.71 1.42 0.89 3.54 1.01 0.09 -4.93 116.67 117.98 2v49 s ASP 77 Ca -0.08 -0.23 -0.12 0.00 0.71 0.00 0.00 52.55 52.83 2v49 s ASP 77 Cb -0.05 -0.67 0.07 0.00 1.01 0.00 0.00 42.92 43.28 2v49 s ASP 77 CO 0.01 -0.00 0.76 1.21 0.21 0.00 0.00 175.17 177.36 2v49 n GLU 78 N 3.90 -0.18 0.00 8.23 2.13 -1.26 0.13 120.64 133.59 2v49 n GLU 78 Ca -0.24 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.59 2v49 n GLU 78 Cb 0.51 -2.10 0.00 0.00 0.27 0.00 0.00 31.44 30.13 2v49 n GLU 78 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2v49 n GLY 79 N 1.02 6.01 3.77 8.31 0.00 0.06 -4.62 105.19 119.74 2v49 n GLY 79 Ca 0.10 -1.80 -0.38 0.00 0.00 0.00 0.00 46.02 43.94 2v49 n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2v49 s PRO 80 N 1.62 3.81 0.21 1.61 0.04 -1.26 -4.77 135.00 136.25 2v49 s PRO 80 Ca 0.00 1.84 -0.16 0.00 0.04 0.00 0.00 61.00 62.72 2v49 s PRO 80 Cb 0.00 -2.49 -0.08 0.00 0.04 0.00 0.00 34.50 31.98 2v49 s PRO 80 CO 0.00 -0.53 0.65 0.00 0.04 0.00 0.00 177.00 177.16 2v49 s ALA 81 N -1.48 3.47 -0.95 8.56 0.00 -1.26 -4.27 121.76 125.83 2v49 s ALA 81 Ca 0.62 0.01 -0.01 0.00 0.00 0.00 0.00 51.96 52.58 2v49 s ALA 81 Cb -0.30 -2.68 0.30 0.00 0.00 0.00 0.00 23.12 20.44 2v49 s ALA 81 CO 0.37 0.39 1.38 1.28 0.00 0.00 0.00 175.76 179.18 2v49 n LEU 82 N 0.54 5.98 -4.61 0.00 4.32 -1.05 -5.03 117.00 117.14 2v49 n LEU 82 Ca -0.02 -5.34 -0.58 0.00 -0.02 0.00 0.00 56.01 50.05 2v49 n LEU 82 Cb 0.52 -1.08 -0.08 0.00 -1.62 0.00 0.00 43.42 41.16 2v49 n LEU 82 CO 0.43 1.89 1.45 0.29 -1.22 0.00 0.00 177.39 180.23 2v49 n LYS 83 N 0.81 0.83 -4.59 3.23 5.02 -1.26 -3.83 118.16 118.37 2v49 n LYS 83 Ca 0.32 0.29 -0.29 0.00 -2.02 0.00 0.00 58.31 56.60 2v49 n LYS 83 Cb 0.34 -2.01 -0.10 0.00 -0.02 0.00 0.00 35.03 33.23 2v49 n LYS 83 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2v49 s ARG 84 N 4.33 2.03 -0.09 1.97 1.81 -0.48 -4.97 118.95 123.55 2v49 s ARG 84 Ca 1.04 -2.14 0.02 0.00 -1.72 0.00 0.00 55.73 52.93 2v49 s ARG 84 Cb -1.15 -1.66 0.01 0.00 -0.45 0.00 0.00 34.95 31.71 2v49 s ARG 84 CO 0.65 -0.12 -0.15 0.08 -0.68 0.00 0.00 175.30 175.08 2v49 s VAL 85 N -2.73 1.39 -0.20 3.52 1.01 -1.26 -0.46 120.40 121.67 2v49 s VAL 85 Ca 0.30 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 61.62 2v49 s VAL 85 Cb 0.08 -1.27 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 2v49 s VAL 85 CO 0.16 0.42 0.03 -0.22 0.00 0.00 0.00 175.10 175.48 2v49 s LEU 86 N 0.84 3.42 -0.05 3.92 2.96 0.22 -4.91 118.68 125.08 2v49 s LEU 86 Ca -0.10 -0.13 -0.30 0.00 -0.22 0.00 0.00 54.13 53.38 2v49 s LEU 86 Cb -0.15 -1.88 -0.02 0.00 0.50 0.00 0.00 46.19 44.64 2v49 s LEU 86 CO 0.01 0.07 1.03 -2.84 -1.32 0.00 0.00 176.35 173.31 2v49 s PRO 87 N 0.96 4.46 0.39 0.98 0.02 -1.26 0.83 135.00 141.37 2v49 s PRO 87 Ca 0.02 1.46 0.08 0.00 0.02 0.00 0.00 61.00 62.58 2v49 s PRO 87 Cb -0.14 -3.50 -0.05 0.00 0.02 0.00 0.00 34.50 30.83 2v49 s PRO 87 CO 0.02 -0.23 0.18 0.50 -0.33 0.00 0.00 177.00 177.13 2v49 s ARG 88 N 1.62 2.29 0.80 5.54 6.06 -1.26 -4.75 118.95 129.25 2v49 s ARG 88 Ca 0.51 -1.72 -0.16 0.00 -2.50 0.00 0.00 55.73 51.87 2v49 s ARG 88 Cb -0.21 -2.08 -0.06 0.00 0.06 0.00 0.00 34.95 32.66 2v49 s ARG 88 CO 0.23 -0.04 0.11 0.00 -2.50 0.00 0.00 175.30 173.10 2v49 n ALA 89 N -1.22 -2.87 -4.20 6.12 0.00 -1.26 -2.44 120.51 114.65 2v49 n ALA 89 Ca -0.01 -0.39 -0.31 0.00 0.00 0.00 0.00 53.44 52.73 2v49 n ALA 89 Cb 0.63 -1.62 -0.08 0.00 0.00 0.00 0.00 19.45 18.38 2v49 n ALA 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2v49 n ARG 90 N 0.12 -0.85 -4.45 0.00 1.74 -1.26 -1.38 116.66 110.58 2v49 n ARG 90 Ca 0.06 0.08 -0.41 0.00 -0.77 0.00 0.00 57.85 56.81 2v49 n ARG 90 Cb 0.52 -3.23 -0.08 0.00 -1.02 0.00 0.00 32.46 28.65 2v49 n ARG 90 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2v49 n GLY 91 N -2.44 -0.40 0.08 -0.13 0.00 -1.02 -4.82 105.19 96.45 2v49 n GLY 91 Ca -0.28 0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 2v49 n GLY 91 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2v49 h ARG 92 N -0.83 0.02 -0.82 1.61 2.43 -1.08 -3.47 114.38 112.24 2v49 h ARG 92 Ca -0.57 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 2v49 h ARG 92 Cb 1.37 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.93 2v49 h ARG 92 CO 0.86 0.70 0.00 0.00 -1.51 0.00 0.00 179.97 180.01 2v49 n ALA 93 N -2.50 -1.00 -2.53 2.80 0.00 -1.25 -4.76 120.51 111.26 2v49 n ALA 93 Ca -0.12 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.08 2v49 n ALA 93 Cb 1.02 -0.14 -0.09 0.00 0.00 0.00 0.00 19.45 20.24 2v49 n ALA 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2v49 s ASP 94 N -0.13 3.95 -0.12 0.00 -0.00 0.24 -4.78 116.67 115.84 2v49 s ASP 94 Ca 0.00 -0.93 -0.23 0.00 -0.00 0.00 0.00 52.55 51.39 2v49 s ASP 94 Cb 0.00 -0.49 -0.03 0.00 -0.00 0.00 0.00 42.92 42.40 2v49 s ASP 94 CO 0.00 -0.04 0.70 0.27 -0.00 0.00 0.00 175.17 176.10 2v49 s ILE 95 N -2.47 5.01 0.49 0.77 -4.36 -1.26 0.70 121.20 120.09 2v49 s ILE 95 Ca 0.31 1.39 0.05 0.00 -0.26 0.00 0.00 60.65 62.14 2v49 s ILE 95 Cb -0.04 -4.02 0.03 0.00 1.25 0.00 0.00 42.46 39.67 2v49 s ILE 95 CO 0.17 0.17 0.68 -0.51 0.24 0.00 0.00 174.94 175.70 2v49 s ILE 96 N 1.35 2.80 -0.34 8.37 1.10 0.39 -4.89 121.20 129.99 2v49 s ILE 96 Ca 0.35 -0.83 -0.01 0.00 -0.51 0.00 0.00 60.65 59.65 2v49 s ILE 96 Cb -0.17 -2.97 0.12 0.00 0.15 0.00 0.00 42.46 39.59 2v49 s ILE 96 CO 0.14 0.00 0.18 -0.54 -2.11 0.00 0.00 174.94 172.61 2v49 s LYS 97 N -4.57 0.56 -0.06 3.50 1.02 -1.26 -1.38 119.74 117.54 2v49 s LYS 97 Ca 0.56 -1.15 -0.30 0.00 0.02 0.00 0.00 55.97 55.11 2v49 s LYS 97 Cb -0.10 -1.48 -0.04 0.00 -0.52 0.00 0.00 37.83 35.70 2v49 s LYS 97 CO 0.36 -1.12 1.33 0.15 -0.92 0.00 0.00 175.35 175.15 2v49 s LYS 98 N 1.35 4.28 0.51 1.68 1.02 -1.25 -4.89 119.74 122.44 2v49 s LYS 98 Ca 0.14 1.82 0.02 0.00 0.02 0.00 0.00 55.97 57.98 2v49 s LYS 98 Cb -0.20 -3.66 0.02 0.00 -0.52 0.00 0.00 37.83 33.47 2v49 s LYS 98 CO -0.13 -0.60 0.72 1.03 -0.92 0.00 0.00 175.35 175.45 2v49 s ARG 99 N 2.78 2.67 0.11 1.68 1.81 -1.26 -2.54 118.95 124.20 2v49 s ARG 99 Ca 0.60 -0.82 0.04 0.00 -1.72 0.00 0.00 55.73 53.82 2v49 s ARG 99 Cb -0.27 -2.55 -0.04 0.00 -0.45 0.00 0.00 34.95 31.64 2v49 s ARG 99 CO 0.22 -0.56 -0.10 -0.08 -0.68 0.00 0.00 175.30 174.11 2v49 s THR 100 N -2.65 0.97 -0.00 0.02 -1.32 -1.26 -2.58 115.64 108.82 2v49 s THR 100 Ca 0.55 -1.79 0.00 0.00 -1.21 0.00 0.00 61.69 59.25 2v49 s THR 100 Cb -0.10 -1.53 -0.00 0.00 -1.51 0.00 0.00 72.50 69.35 2v49 s THR 100 CO 0.37 -0.65 -0.01 -0.44 -2.21 0.00 0.00 174.62 171.68 2v49 s SER 101 N -2.72 0.17 -0.81 8.08 0.01 -1.16 -0.76 113.70 116.52 2v49 s SER 101 Ca 0.09 -0.04 -0.14 0.00 1.31 0.00 0.00 55.95 57.17 2v49 s SER 101 Cb -0.00 -0.01 0.21 0.00 0.21 0.00 0.00 66.02 66.43 2v49 s SER 101 CO -0.00 0.01 0.75 -1.00 0.41 0.00 0.00 173.24 173.40 2v49 s HIS 102 N -0.08 3.73 -0.33 2.43 3.76 0.35 -1.07 115.29 124.07 2v49 s HIS 102 Ca -0.00 -1.95 -0.25 0.00 -0.15 0.00 0.00 55.06 52.70 2v49 s HIS 102 Cb -0.01 -3.81 0.01 0.00 1.11 0.00 0.00 32.58 29.88 2v49 s HIS 102 CO -0.00 -0.99 0.89 0.96 -0.85 0.00 0.00 174.74 174.75 2v49 s ILE 103 N 0.26 4.67 -0.09 0.60 -4.36 -1.03 -0.73 121.20 120.51 2v49 s ILE 103 Ca 0.17 1.29 -0.04 0.00 -0.26 0.00 0.00 60.65 61.81 2v49 s ILE 103 Cb -0.12 -4.26 -0.04 0.00 1.25 0.00 0.00 42.46 39.30 2v49 s ILE 103 CO -0.08 -0.39 0.08 -0.89 0.24 0.00 0.00 174.94 173.90 2v49 s THR 104 N 3.26 4.94 -0.39 8.37 2.01 -0.03 -1.37 115.64 132.43 2v49 s THR 104 Ca 0.37 -0.06 0.01 0.00 0.31 0.00 0.00 61.69 62.32 2v49 s THR 104 Cb -0.13 -3.14 0.14 0.00 0.01 0.00 0.00 72.50 69.38 2v49 s THR 104 CO 0.15 0.57 0.23 -0.69 -0.69 0.00 0.00 174.62 174.20 2v49 s VAL 105 N -1.00 0.57 0.04 3.82 1.01 -1.26 -2.04 120.40 121.53 2v49 s VAL 105 Ca 0.16 -2.07 -0.27 0.00 0.00 0.00 0.00 61.98 59.80 2v49 s VAL 105 Cb -0.12 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.80 2v49 s VAL 105 CO 0.05 -0.98 0.83 0.27 0.00 0.00 0.00 175.10 175.27 2v49 s ILE 106 N 0.75 4.72 0.57 2.22 -4.36 -1.03 -2.12 121.20 121.95 2v49 s ILE 106 Ca 0.19 1.77 0.08 0.00 -0.26 0.00 0.00 60.65 62.43 2v49 s ILE 106 Cb -0.21 -4.18 0.07 0.00 1.25 0.00 0.00 42.46 39.39 2v49 s ILE 106 CO -0.01 0.32 0.63 -0.76 0.24 0.00 0.00 174.94 175.35 2v49 s LEU 107 N 0.17 2.88 0.00 0.37 1.02 0.55 -2.07 118.68 121.59 2v49 s LEU 107 Ca 0.42 -1.06 -0.09 0.00 0.02 0.00 0.00 54.13 53.42 2v49 s LEU 107 Cb -0.21 -1.37 0.04 0.00 0.02 0.00 0.00 46.19 44.67 2v49 s LEU 107 CO 0.25 -1.27 0.55 0.61 0.02 0.00 0.00 176.35 176.50 2v49 n GLY 108 N -2.05 1.46 3.37 -3.19 0.00 -1.14 -3.19 105.19 100.44 2v49 n GLY 108 Ca 0.08 -1.27 -0.29 0.00 0.00 0.00 0.00 46.02 44.54 2v49 n GLY 108 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2v49 s GLU 109 N -2.17 1.54 1.13 1.61 2.02 -1.26 -0.82 118.70 120.74 2v49 s GLU 109 Ca 0.14 -1.26 -0.19 0.00 0.02 0.00 0.00 54.97 53.68 2v49 s GLU 109 Cb -0.03 -1.92 0.12 0.00 0.10 0.00 0.00 34.13 32.40 2v49 s GLU 109 CO 0.10 0.47 0.05 1.17 0.02 0.00 0.00 175.26 177.07 2v49 n LYS 110 N 1.23 -1.75 0.00 1.61 3.00 0.48 -4.85 118.16 117.88 2v49 n LYS 110 Ca -0.18 -0.50 0.00 0.00 -0.00 0.00 0.00 58.31 57.64 2v49 n LYS 110 Cb 0.53 -1.70 0.00 0.00 0.00 0.00 0.00 35.03 33.85 2v49 n LYS 110 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 2v49 n HIS 111 N -4.49 0.00 0.00 5.64 1.44 -1.26 -4.98 115.22 111.56 2v49 n HIS 111 Ca 0.01 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.72 2v49 n HIS 111 Cb 0.61 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.72 2v49 n HIS 111 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2v49 n GLY 112 N 0.00 1.67 0.00 -1.39 0.00 -1.26 -5.18 105.19 99.03 2v49 n GLY 112 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2v49 n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60