#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v47 n HIS 3 N 0.00 0.00 -0.38 2.89 -0.00 -1.26 -4.88 115.22 111.59 2v47 n HIS 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2v47 n HIS 3 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2v47 n HIS 3 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 2v47 n LEU 4 N 0.00 0.76 0.00 2.41 -0.00 -1.26 -4.75 117.00 114.16 2v47 n LEU 4 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2v47 n LEU 4 Cb 0.00 -1.22 0.00 0.00 -0.00 0.00 0.00 43.42 42.20 2v47 n LEU 4 CO 0.00 -0.38 0.15 0.29 -0.00 0.00 0.00 177.39 177.45 2v47 n LYS 5 N -1.74 0.00 -1.40 1.96 4.01 -1.26 -4.74 118.16 114.99 2v47 n LYS 5 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2v47 n LYS 5 Cb 0.00 -1.40 0.00 0.00 -0.51 0.00 0.00 35.03 33.12 2v47 n LYS 5 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 2v47 n SER 6 N -0.78 0.00 -0.84 4.39 3.41 -1.26 -5.03 113.62 113.51 2v47 n SER 6 Ca 0.00 -0.97 0.00 0.00 -0.26 0.00 0.00 58.87 57.64 2v47 n SER 6 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2v47 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2v47 n GLY 7 N 0.00 -0.09 2.30 5.00 0.00 -1.26 -4.79 105.19 106.36 2v47 n GLY 7 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2v47 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2v47 n ARG 8 N -0.74 0.00 -0.94 1.61 5.12 -1.26 -4.89 116.66 115.55 2v47 n ARG 8 Ca 0.00 0.00 -0.36 0.00 -1.93 0.00 0.00 57.85 55.56 2v47 n ARG 8 Cb 0.09 0.00 0.06 0.00 -1.16 0.00 0.00 32.46 31.45 2v47 n ARG 8 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 2v47 n LYS 9 N -0.12 -0.16 0.00 5.56 2.85 -1.26 -5.07 118.16 119.96 2v47 n LYS 9 Ca 0.00 -0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.22 2v47 n LYS 9 Cb 0.00 -1.19 0.00 0.00 -0.65 0.00 0.00 35.03 33.19 2v47 n LYS 9 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2v47 n LEU 10 N 2.36 0.00 -3.81 -5.58 4.77 -1.26 -5.14 117.00 108.34 2v47 n LEU 10 Ca -0.00 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.68 2v47 n LEU 10 Cb 0.61 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.56 2v47 n LEU 10 CO 0.50 0.00 -0.25 0.21 -1.33 0.00 0.00 177.39 176.52 2v47 s ASN 11 N 0.00 4.01 0.00 -1.43 3.84 -1.26 -4.90 114.94 115.20 2v47 s ASN 11 Ca 0.00 -2.51 0.00 0.00 0.21 0.00 0.00 52.86 50.56 2v47 s ASN 11 Cb 0.00 -1.23 0.00 0.00 -0.55 0.00 0.00 41.25 39.47 2v47 s ASN 11 CO 0.00 -0.29 0.00 0.54 -2.79 0.00 0.00 177.10 174.56 2v47 n ARG 12 N 3.72 0.00 0.00 0.43 1.74 -1.26 -5.01 116.66 116.28 2v47 n ARG 12 Ca 0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2v47 n ARG 12 Cb 0.36 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.80 2v47 n ARG 12 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 2v47 n HIS 13 N 0.00 0.00 0.00 -1.55 1.44 -1.26 -4.95 115.22 108.89 2v47 n HIS 13 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2v47 n HIS 13 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2v47 n HIS 13 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2v47 n SER 14 N 0.00 0.00 -0.04 4.39 3.41 -1.26 0.37 113.62 120.49 2v47 n SER 14 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2v47 n SER 14 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 2v47 n SER 14 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2v47 n SER 15 N 0.00 -0.05 0.00 4.04 3.41 -1.26 -0.71 113.62 119.05 2v47 n SER 15 Ca 0.00 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 2v47 n SER 15 Cb 0.00 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 2v47 n SER 15 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2v47 n HIS 16 N -4.19 0.00 -0.00 7.33 -0.00 -0.96 -0.98 115.22 116.42 2v47 n HIS 16 Ca 0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 57.72 57.74 2v47 n HIS 16 Cb 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 29.99 30.04 2v47 n HIS 16 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.34 174.21 2v47 n ARG 17 N 0.00 -0.00 -0.33 1.57 0.63 0.16 0.24 116.66 118.93 2v47 n ARG 17 Ca 0.00 0.04 -0.09 0.00 -0.92 0.00 0.00 57.85 56.89 2v47 n ARG 17 Cb 0.00 -0.06 -0.08 0.00 0.45 0.00 0.00 32.46 32.77 2v47 n ARG 17 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2v47 n LEU 18 N -2.29 -0.83 -0.17 6.15 -0.00 0.12 0.01 117.00 119.99 2v47 n LEU 18 Ca 0.00 1.58 -0.10 0.00 -0.00 0.00 0.00 56.01 57.49 2v47 n LEU 18 Cb 0.00 -0.27 -0.05 0.00 -0.00 0.00 0.00 43.42 43.10 2v47 n LEU 18 CO -0.00 -1.23 0.56 0.00 -0.00 0.00 0.00 177.39 176.72 2v47 h ALA 19 N 0.20 -0.45 -0.93 1.96 0.00 0.49 0.14 119.26 120.68 2v47 h ALA 19 Ca 0.13 0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.25 2v47 h ALA 19 Cb 0.32 0.97 -0.15 0.00 0.00 0.00 0.00 17.79 18.93 2v47 h ALA 19 CO -0.73 -0.88 -0.40 1.37 0.00 0.00 0.00 179.25 178.60 2v47 h LEU 20 N -0.29 -1.46 -0.61 0.00 8.10 0.64 0.40 115.31 122.08 2v47 h LEU 20 Ca 0.15 0.30 0.06 0.00 0.11 0.00 0.00 57.88 58.50 2v47 h LEU 20 Cb 0.57 0.75 -0.09 0.00 -0.44 0.00 0.00 40.66 41.45 2v47 h LEU 20 CO -0.64 -0.29 -0.52 1.88 -4.11 0.00 0.00 178.44 174.77 2v47 h TYR 21 N -0.03 -1.62 -0.94 0.17 0.99 0.49 0.25 116.97 116.28 2v47 h TYR 21 Ca 0.31 0.09 0.24 0.00 2.00 0.00 0.00 58.73 61.37 2v47 h TYR 21 Cb 0.58 0.79 -0.17 0.00 1.00 0.00 0.00 36.73 38.92 2v47 h TYR 21 CO -0.85 -0.39 -0.03 0.00 -0.00 0.00 0.00 178.16 176.89 2v47 h ARG 22 N -0.20 0.03 0.76 4.88 3.08 0.02 0.21 114.38 123.16 2v47 h ARG 22 Ca 0.10 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 2v47 h ARG 22 Cb 0.46 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.51 2v47 h ARG 22 CO -0.68 0.02 -0.39 -0.91 -1.07 0.00 0.00 179.97 176.94 2v47 h ASN 23 N 0.03 -0.94 -0.93 7.04 -0.26 -0.04 1.58 115.58 122.06 2v47 h ASN 23 Ca 0.54 0.04 0.24 0.00 -0.56 0.00 0.00 56.30 56.55 2v47 h ASN 23 Cb 1.02 0.25 -0.13 0.00 -1.06 0.00 0.00 38.32 38.41 2v47 h ASN 23 CO -0.89 -0.64 0.46 1.56 -1.06 0.00 0.00 177.43 176.86 2v47 h GLN 24 N -1.05 0.42 0.68 0.81 4.20 0.34 1.29 115.11 121.79 2v47 h GLN 24 Ca -0.10 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.55 2v47 h GLN 24 Cb 0.82 -0.09 0.01 0.00 0.30 0.00 0.00 27.48 28.51 2v47 h GLN 24 CO 0.16 0.28 -0.33 0.00 -0.67 0.00 0.00 178.83 178.27 2v47 h ALA 25 N 1.73 -0.91 -1.08 3.87 0.00 -0.34 1.93 119.26 124.46 2v47 h ALA 25 Ca 0.60 -0.21 0.29 0.00 0.00 0.00 0.00 54.91 55.59 2v47 h ALA 25 Cb 1.17 0.35 -0.08 0.00 0.00 0.00 0.00 17.79 19.23 2v47 h ALA 25 CO -0.53 -0.87 0.72 0.87 0.00 0.00 0.00 179.25 179.44 2v47 h LYS 26 N -1.19 0.27 0.10 0.00 1.57 0.45 0.82 116.57 118.59 2v47 h LYS 26 Ca -0.09 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2v47 h LYS 26 Cb 0.72 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.97 2v47 h LYS 26 CO 0.15 0.18 -0.05 0.77 -0.57 0.00 0.00 179.45 179.93 2v47 h SER 27 N 0.27 -0.12 -0.89 0.86 0.02 0.19 -3.34 113.55 110.55 2v47 h SER 27 Ca 0.60 0.00 0.12 0.00 -0.84 0.00 0.00 61.79 61.67 2v47 h SER 27 Cb 1.74 0.03 -0.13 0.00 0.14 0.00 0.00 62.40 64.18 2v47 h SER 27 CO -0.23 0.03 -0.46 0.25 -1.14 0.00 0.00 176.83 175.29 2v47 h LEU 28 N -0.37 -1.66 -0.49 5.07 7.12 0.42 0.45 115.31 125.86 2v47 h LEU 28 Ca -0.01 0.30 0.00 0.00 0.13 0.00 0.00 57.88 58.29 2v47 h LEU 28 Cb 0.11 0.79 0.00 0.00 -0.53 0.00 0.00 40.66 41.03 2v47 h LEU 28 CO 0.02 -0.28 0.00 0.18 -0.13 0.00 0.00 178.44 178.23 2v47 n LEU 29 N -5.39 0.00 0.05 2.25 4.32 0.27 0.63 117.00 119.13 2v47 n LEU 29 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.05 2v47 n LEU 29 Cb 0.35 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.15 2v47 n LEU 29 CO -0.11 0.00 0.00 0.41 -1.22 0.00 0.00 177.39 176.47 2v47 n THR 30 N -0.01 0.35 1.30 -5.08 -1.04 0.16 -4.75 114.28 105.20 2v47 n THR 30 Ca 0.00 0.11 0.11 0.00 -2.04 0.00 0.00 64.05 62.24 2v47 n THR 30 Cb 0.00 -0.81 0.64 0.00 -1.82 0.00 0.00 70.33 68.34 2v47 n THR 30 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2v47 n HIS 31 N -3.04 0.00 0.00 -1.42 8.25 -0.98 -4.87 115.22 113.17 2v47 n HIS 31 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2v47 n HIS 31 Cb 0.00 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.00 2v47 n HIS 31 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2v47 n GLY 32 N 0.51 0.03 2.63 -1.41 0.00 0.20 -4.69 105.19 102.46 2v47 n GLY 32 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 2v47 n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2v47 s ARG 33 N 0.00 0.29 0.28 1.61 0.52 -1.26 0.20 118.95 120.60 2v47 s ARG 33 Ca 0.00 -0.37 0.08 0.00 -0.52 0.00 0.00 55.73 54.92 2v47 s ARG 33 Cb 0.00 -1.74 -0.04 0.00 0.52 0.00 0.00 34.95 33.70 2v47 s ARG 33 CO 0.00 -0.78 0.12 0.42 0.02 0.00 0.00 175.30 175.07 2v47 s ILE 34 N 2.02 3.67 -0.07 1.52 -1.09 0.69 -4.94 121.20 123.00 2v47 s ILE 34 Ca 0.04 -1.66 0.03 0.00 -2.23 0.00 0.00 60.65 56.84 2v47 s ILE 34 Cb -0.16 -3.08 0.00 0.00 -1.58 0.00 0.00 42.46 37.64 2v47 s ILE 34 CO -0.18 -0.31 -0.17 -0.89 -1.23 0.00 0.00 174.94 172.16 2v47 s THR 35 N -2.29 1.51 0.00 2.92 2.01 -1.26 -0.72 115.64 117.81 2v47 s THR 35 Ca 0.34 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.62 2v47 s THR 35 Cb -0.06 -1.33 0.00 0.00 0.01 0.00 0.00 72.50 71.12 2v47 s THR 35 CO 0.23 0.44 0.00 0.35 -0.69 0.00 0.00 174.62 174.94 2v47 n THR 36 N 3.50 0.00 -1.73 -0.82 -2.24 -0.97 -4.99 114.28 107.03 2v47 n THR 36 Ca -0.20 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.27 2v47 n THR 36 Cb 0.52 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.81 2v47 n THR 36 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2v47 s THR 37 N -2.34 3.67 0.06 4.28 -4.23 -1.26 0.62 115.64 116.43 2v47 s THR 37 Ca 0.00 0.54 -0.17 0.00 -1.18 0.00 0.00 61.69 60.88 2v47 s THR 37 Cb 0.00 -3.42 -0.07 0.00 1.34 0.00 0.00 72.50 70.36 2v47 s THR 37 CO 0.00 -0.71 1.28 0.58 -0.54 0.00 0.00 174.62 175.24 2v47 h VAL 38 N -0.73 0.00 0.00 2.29 2.07 -1.67 -2.90 116.25 115.30 2v47 h VAL 38 Ca -0.45 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2v47 h VAL 38 Cb 1.24 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 2v47 h VAL 38 CO 0.61 0.00 0.00 -2.65 0.02 0.00 0.00 177.57 175.55 2v47 n PRO 39 N -4.05 0.00 -0.09 1.57 -0.02 -1.26 -0.61 135.00 130.54 2v47 n PRO 39 Ca -0.03 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2v47 n PRO 39 Cb 0.19 -1.35 0.01 0.00 -0.02 0.00 0.00 33.50 32.33 2v47 n PRO 39 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2v47 n LYS 40 N -1.98 -0.05 0.02 -0.52 5.02 -1.23 0.14 118.16 119.56 2v47 n LYS 40 Ca 0.00 0.38 -0.01 0.00 -2.02 0.00 0.00 58.31 56.66 2v47 n LYS 40 Cb 0.00 -0.56 -0.00 0.00 -0.02 0.00 0.00 35.03 34.45 2v47 n LYS 40 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2v47 h ALA 41 N 0.36 -0.77 -0.62 7.82 0.00 -1.30 0.44 119.26 125.20 2v47 h ALA 41 Ca 0.09 -0.01 0.18 0.00 0.00 0.00 0.00 54.91 55.17 2v47 h ALA 41 Cb 0.15 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2v47 h ALA 41 CO -0.24 -0.76 0.97 1.17 0.00 0.00 0.00 179.25 180.38 2v47 n LYS 42 N -2.21 0.02 -0.12 0.00 4.81 0.36 0.24 118.16 121.26 2v47 n LYS 42 Ca -0.01 0.83 -0.25 0.00 -0.87 0.00 0.00 58.31 58.01 2v47 n LYS 42 Cb 0.02 -2.11 -0.10 0.00 0.02 0.00 0.00 35.03 32.86 2v47 n LYS 42 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2v47 n GLU 43 N -2.70 0.57 -0.34 1.64 4.07 0.93 -4.40 120.64 120.42 2v47 n GLU 43 Ca 0.14 0.41 0.32 0.00 -0.06 0.00 0.00 57.16 57.97 2v47 n GLU 43 Cb 1.15 -1.61 0.57 0.00 -0.06 0.00 0.00 31.44 31.49 2v47 n GLU 43 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 2v47 n LEU 44 N -4.35 0.29 0.00 4.31 -0.00 0.67 -3.27 117.00 114.65 2v47 n LEU 44 Ca -0.43 1.49 0.00 0.00 -0.00 0.00 0.00 56.01 57.07 2v47 n LEU 44 Cb 0.78 -0.73 0.00 0.00 -0.00 0.00 0.00 43.42 43.47 2v47 n LEU 44 CO 0.11 -1.66 0.04 -2.11 -0.00 0.00 0.00 177.39 173.77 2v47 n ARG 45 N -4.98 0.00 -0.09 1.96 1.85 -0.85 -2.47 116.66 112.08 2v47 n ARG 45 Ca 0.36 0.08 -0.02 0.00 -1.00 0.00 0.00 57.85 57.27 2v47 n ARG 45 Cb 1.28 -0.47 -0.02 0.00 -1.05 0.00 0.00 32.46 32.19 2v47 n ARG 45 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2v47 n GLY 46 N -0.17 -1.19 0.41 2.89 0.00 -1.20 -0.76 105.19 105.16 2v47 n GLY 46 Ca 0.00 0.37 -0.09 0.00 0.00 0.00 0.00 46.02 46.30 2v47 n GLY 46 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2v47 h PHE 47 N 0.00 -1.51 -0.00 1.61 3.57 -1.72 -0.27 116.94 118.61 2v47 h PHE 47 Ca 0.03 0.10 0.03 0.00 3.53 0.00 0.00 57.97 61.66 2v47 h PHE 47 Cb 0.09 0.75 -0.03 0.00 2.79 0.00 0.00 35.95 39.55 2v47 h PHE 47 CO -0.41 -0.42 -0.17 0.28 -2.23 0.00 0.00 178.31 175.35 2v47 h VAL 48 N -0.18 0.58 0.00 1.41 2.07 -0.62 -2.62 116.25 116.90 2v47 h VAL 48 Ca 0.17 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.69 2v47 h VAL 48 Cb 0.54 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 2v47 h VAL 48 CO -0.77 0.00 0.00 0.47 0.02 0.00 0.00 177.57 177.29 2v47 n ASP 49 N -5.30 0.00 -0.03 0.57 9.92 -0.44 -1.40 116.55 119.87 2v47 n ASP 49 Ca -0.05 0.41 0.00 0.00 -0.53 0.00 0.00 54.79 54.63 2v47 n ASP 49 Cb 0.22 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 40.71 2v47 n ASP 49 CO 0.00 0.00 0.00 1.57 0.13 0.00 0.00 177.20 178.90 2v47 n HIS 50 N -0.67 0.02 0.06 1.24 -0.00 -0.24 0.22 115.22 115.85 2v47 n HIS 50 Ca 0.00 0.09 -0.15 0.00 0.46 0.00 0.00 57.72 58.13 2v47 n HIS 50 Cb 0.00 -0.54 -0.09 0.00 -0.12 0.00 0.00 29.99 29.24 2v47 n HIS 50 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 2v47 h LEU 51 N 0.00 -1.49 -0.27 0.27 3.38 -0.85 -2.49 115.31 113.86 2v47 h LEU 51 Ca 0.03 0.16 0.06 0.00 0.09 0.00 0.00 57.88 58.23 2v47 h LEU 51 Cb 0.05 0.56 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 2v47 h LEU 51 CO -0.08 -0.48 -0.12 0.40 0.09 0.00 0.00 178.44 178.25 2v47 h ILE 52 N -0.63 0.61 0.00 1.22 1.08 0.40 -0.32 117.51 119.87 2v47 h ILE 52 Ca 0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.48 2v47 h ILE 52 Cb 0.66 0.61 0.00 0.00 -3.07 0.00 0.00 36.82 35.03 2v47 h ILE 52 CO -0.31 0.00 0.31 1.57 -0.69 0.00 0.00 178.15 179.04 2v47 n HIS 53 N -5.29 0.33 0.04 1.37 -0.00 -0.87 0.32 115.22 111.12 2v47 n HIS 53 Ca -0.00 0.18 -0.18 0.00 0.46 0.00 0.00 57.72 58.17 2v47 n HIS 53 Cb 0.21 -0.56 -0.14 0.00 -0.12 0.00 0.00 29.99 29.38 2v47 n HIS 53 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 2v47 h LEU 54 N 0.00 0.39 -1.79 0.27 4.07 -0.84 -2.93 115.31 114.48 2v47 h LEU 54 Ca 0.00 -0.68 0.00 0.00 0.08 0.00 0.00 57.88 57.28 2v47 h LEU 54 Cb 0.63 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.24 2v47 h LEU 54 CO 0.00 1.59 0.00 0.00 -1.08 0.00 0.00 178.44 178.95 2v47 h ALA 55 N 0.35 1.00 -0.25 1.53 0.00 0.53 -0.15 119.26 122.28 2v47 h ALA 55 Ca -0.33 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.61 2v47 h ALA 55 Cb 2.04 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.80 2v47 h ALA 55 CO 0.13 0.00 0.08 -0.22 0.00 0.00 0.00 179.25 179.24 2v47 h LYS 56 N 0.00 0.19 0.00 0.00 1.63 -0.04 -3.42 116.57 114.94 2v47 h LYS 56 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2v47 h LYS 56 Cb 0.29 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.88 2v47 h LYS 56 CO 0.00 0.13 0.00 0.54 -3.45 0.00 0.00 179.45 176.67 2v47 n ARG 57 N -5.04 0.28 0.00 1.90 1.74 -0.07 -4.95 116.66 110.52 2v47 n ARG 57 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 2v47 n ARG 57 Cb 0.09 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.53 2v47 n ARG 57 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2v47 n GLY 58 N 5.00 0.00 3.68 -0.13 0.00 -1.26 -4.93 105.19 107.54 2v47 n GLY 58 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.49 2v47 n GLY 58 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2v47 n ASP 59 N -0.22 2.89 -0.21 1.61 3.85 -1.26 -4.72 116.55 118.49 2v47 n ASP 59 Ca 0.00 0.97 0.19 0.00 -0.71 0.00 0.00 54.79 55.24 2v47 n ASP 59 Cb 0.00 -1.26 0.34 0.00 -1.35 0.00 0.00 41.12 38.85 2v47 n ASP 59 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2v47 n LEU 60 N 6.42 0.17 -0.40 -2.12 -0.00 -1.26 0.18 117.00 119.99 2v47 n LEU 60 Ca 0.26 0.87 -0.05 0.00 -0.00 0.00 0.00 56.01 57.08 2v47 n LEU 60 Cb 0.22 -0.42 -0.02 0.00 -0.00 0.00 0.00 43.42 43.19 2v47 n LEU 60 CO 0.77 -0.96 0.53 1.57 -0.00 0.00 0.00 177.39 179.30 2v47 n HIS 61 N -4.08 -0.17 0.10 1.47 -0.00 -1.26 0.11 115.22 111.39 2v47 n HIS 61 Ca 0.22 1.23 -0.16 0.00 0.46 0.00 0.00 57.72 59.46 2v47 n HIS 61 Cb 0.77 -0.74 -0.10 0.00 -0.12 0.00 0.00 29.99 29.80 2v47 n HIS 61 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2v47 h ALA 62 N 0.99 -0.97 -1.74 1.57 0.00 0.15 0.49 119.26 119.76 2v47 h ALA 62 Ca 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2v47 h ALA 62 Cb 0.51 0.91 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2v47 h ALA 62 CO -0.96 -1.12 0.00 -2.13 0.00 0.00 0.00 179.25 175.04 2v47 n ARG 63 N -5.48 0.00 -0.26 0.00 0.63 0.31 0.08 116.66 111.93 2v47 n ARG 63 Ca -0.08 0.65 0.07 0.00 -0.92 0.00 0.00 57.85 57.57 2v47 n ARG 63 Cb 0.41 -1.12 0.20 0.00 0.45 0.00 0.00 32.46 32.39 2v47 n ARG 63 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2v47 h ARG 64 N 0.00 0.21 -0.26 -0.14 3.08 -0.68 0.81 114.38 117.39 2v47 h ARG 64 Ca 0.00 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.11 2v47 h ARG 64 Cb 0.00 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 2v47 h ARG 64 CO 0.00 0.14 0.42 1.25 -1.07 0.00 0.00 179.97 180.71 2v47 h LEU 65 N 0.21 0.00 0.00 3.04 7.12 0.29 0.37 115.31 126.34 2v47 h LEU 65 Ca 0.44 0.00 -0.36 0.00 0.13 0.00 0.00 57.88 58.09 2v47 h LEU 65 Cb 0.79 0.00 -0.07 0.00 -0.53 0.00 0.00 40.66 40.85 2v47 h LEU 65 CO -0.58 0.00 -2.32 0.52 -0.13 0.00 0.00 178.44 175.94 2v47 n VAL 66 N -3.37 1.42 0.30 1.05 0.31 0.25 -3.85 118.33 114.44 2v47 n VAL 66 Ca 0.04 -0.85 0.19 0.00 -0.01 0.00 0.00 64.34 63.71 2v47 n VAL 66 Cb 0.55 -0.54 0.99 0.00 -0.91 0.00 0.00 33.84 33.93 2v47 n VAL 66 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2v47 h LEU 67 N 0.00 0.00 0.00 7.52 -0.00 0.28 -1.39 115.31 121.72 2v47 h LEU 67 Ca -0.52 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.36 2v47 h LEU 67 Cb 2.22 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.88 2v47 h LEU 67 CO 0.03 0.00 0.00 0.54 -0.00 0.00 0.00 178.44 179.01 2v47 n ARG 68 N -3.22 0.00 0.17 1.13 1.74 -0.47 -3.66 116.66 112.34 2v47 n ARG 68 Ca -0.02 0.01 -0.14 0.00 -0.77 0.00 0.00 57.85 56.94 2v47 n ARG 68 Cb 0.23 -0.90 -0.08 0.00 -1.02 0.00 0.00 32.46 30.70 2v47 n ARG 68 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2v47 h ASP 69 N 0.00 -1.14 -0.76 0.55 3.45 -1.75 -3.40 116.42 113.37 2v47 h ASP 69 Ca 0.00 0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.56 2v47 h ASP 69 Cb 0.00 0.40 0.00 0.00 -0.56 0.00 0.00 39.33 39.17 2v47 h ASP 69 CO 0.00 -0.48 0.00 0.18 -1.57 0.00 0.00 179.24 177.37 2v47 n LEU 70 N -4.79 0.00 0.00 1.55 4.77 -0.53 -4.82 117.00 113.17 2v47 n LEU 70 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2v47 n LEU 70 Cb 0.34 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2v47 n LEU 70 CO 0.17 -0.60 0.00 1.67 -1.33 0.00 0.00 177.39 177.30 2v47 n GLN 71 N -0.72 0.00 -2.78 3.23 7.27 -1.24 -4.59 117.38 118.54 2v47 n GLN 71 Ca 0.00 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 56.64 2v47 n GLN 71 Cb 0.00 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 32.61 2v47 n GLN 71 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2v47 s ASP 72 N 0.00 6.58 0.12 1.69 3.68 -1.26 -4.94 116.67 122.55 2v47 s ASP 72 Ca 0.00 0.34 -0.07 0.00 2.13 0.00 0.00 52.55 54.95 2v47 s ASP 72 Cb 0.00 -2.47 0.15 0.00 -1.45 0.00 0.00 42.92 39.15 2v47 s ASP 72 CO 0.00 -1.01 0.76 1.33 0.13 0.00 0.00 175.17 176.38 2v47 n VAL 73 N 6.32 -0.24 0.07 1.11 0.24 -1.26 -2.05 118.33 122.52 2v47 n VAL 73 Ca 0.07 1.14 -0.08 0.00 -2.04 0.00 0.00 64.34 63.44 2v47 n VAL 73 Cb 0.48 -1.53 -0.05 0.00 -1.47 0.00 0.00 33.84 31.27 2v47 n VAL 73 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2v47 h LYS 74 N 0.00 -0.26 -0.71 7.34 6.56 -2.01 -3.35 116.57 124.14 2v47 h LYS 74 Ca 0.19 0.02 0.27 0.00 -1.06 0.00 0.00 60.65 60.07 2v47 h LYS 74 Cb 0.31 0.06 -0.13 0.00 -0.57 0.00 0.00 32.23 31.90 2v47 h LYS 74 CO -0.49 0.02 0.30 1.28 -2.06 0.00 0.00 179.45 178.50 2v47 n LEU 75 N -4.95 0.17 -0.24 2.94 7.99 -0.87 0.33 117.00 122.37 2v47 n LEU 75 Ca -0.06 1.18 -0.05 0.00 -0.01 0.00 0.00 56.01 57.07 2v47 n LEU 75 Cb 0.20 -0.54 0.10 0.00 -0.11 0.00 0.00 43.42 43.07 2v47 n LEU 75 CO 0.17 -1.29 1.02 1.62 -1.51 0.00 0.00 177.39 177.40 2v47 h VAL 76 N 0.00 1.25 0.91 4.08 3.04 -1.67 0.12 116.25 123.98 2v47 h VAL 76 Ca 0.56 -0.84 -0.04 0.00 -1.01 0.00 0.00 66.70 65.37 2v47 h VAL 76 Cb 1.43 0.43 0.01 0.00 -2.01 0.00 0.00 31.29 31.16 2v47 h VAL 76 CO -0.57 0.33 -0.44 0.03 -1.01 0.00 0.00 177.57 175.91 2v47 h ARG 77 N 1.05 -1.18 0.00 4.17 3.08 0.53 1.43 114.38 123.46 2v47 h ARG 77 Ca 0.24 0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.37 2v47 h ARG 77 Cb 0.26 0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.58 2v47 h ARG 77 CO -0.01 -0.78 0.04 1.17 -1.07 0.00 0.00 179.97 179.31 2v47 n LYS 78 N -5.60 0.11 -0.03 0.04 4.81 -0.66 -0.15 118.16 116.68 2v47 n LYS 78 Ca -0.16 0.60 -0.02 0.00 -0.87 0.00 0.00 58.31 57.86 2v47 n LYS 78 Cb 0.48 -1.89 -0.01 0.00 0.02 0.00 0.00 35.03 33.64 2v47 n LYS 78 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2v47 n LEU 79 N -2.08 0.79 0.06 3.14 -0.00 0.41 -1.95 117.00 117.37 2v47 n LEU 79 Ca -0.01 0.38 -0.03 0.00 -0.00 0.00 0.00 56.01 56.35 2v47 n LEU 79 Cb 0.06 -0.65 -0.01 0.00 -0.00 0.00 0.00 43.42 42.82 2v47 n LEU 79 CO 0.07 -0.48 0.45 -0.26 -0.00 0.00 0.00 177.39 177.17 2v47 h PHE 80 N -0.43 -0.15 0.00 1.96 0.05 0.23 0.34 116.94 118.94 2v47 h PHE 80 Ca 0.00 -0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 2v47 h PHE 80 Cb 0.25 0.05 0.00 0.00 2.00 0.00 0.00 35.95 38.25 2v47 h PHE 80 CO -0.11 -0.09 0.00 -0.25 -0.18 0.00 0.00 178.31 177.68 2v47 n ASP 81 N -2.48 1.74 0.00 2.17 10.43 0.79 -3.92 116.55 125.28 2v47 n ASP 81 Ca -0.02 -1.20 0.00 0.00 2.57 0.00 0.00 54.79 56.14 2v47 n ASP 81 Cb 0.06 -0.34 0.00 0.00 1.84 0.00 0.00 41.12 42.69 2v47 n ASP 81 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 2v47 n GLU 82 N 1.24 0.00 -0.17 -1.24 0.00 -1.18 -4.84 120.64 114.46 2v47 n GLU 82 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 57.16 57.09 2v47 n GLU 82 Cb 0.21 0.00 0.02 0.00 0.00 0.00 0.00 31.44 31.67 2v47 n GLU 82 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 2v47 h ILE 83 N 0.00 1.15 -0.28 6.31 1.08 -0.24 -3.08 117.51 122.45 2v47 h ILE 83 Ca 0.00 -0.34 0.07 0.00 -0.39 0.00 0.00 64.86 64.20 2v47 h ILE 83 Cb 0.00 0.46 -0.08 0.00 -3.07 0.00 0.00 36.82 34.14 2v47 h ILE 83 CO 0.00 0.16 -0.26 0.00 -0.69 0.00 0.00 178.15 177.36 2v47 h ALA 84 N 1.15 -0.13 -0.08 1.87 0.00 -0.55 -3.04 119.26 118.49 2v47 h ALA 84 Ca 0.18 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.19 2v47 h ALA 84 Cb -0.02 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2v47 h ALA 84 CO -0.03 -0.68 -0.05 -2.30 0.00 0.00 0.00 179.25 176.19 2v47 n PRO 85 N -5.39 -0.04 -0.09 0.00 -0.02 -1.16 -0.93 135.00 127.37 2v47 n PRO 85 Ca -0.00 1.01 0.14 0.00 -2.02 0.00 0.00 63.50 62.62 2v47 n PRO 85 Cb 0.30 -1.51 0.21 0.00 -0.02 0.00 0.00 33.50 32.49 2v47 n PRO 85 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2v47 n ARG 86 N -3.15 0.01 0.00 -0.52 1.74 -1.15 -3.67 116.66 109.92 2v47 n ARG 86 Ca 0.00 0.54 0.00 0.00 -0.77 0.00 0.00 57.85 57.62 2v47 n ARG 86 Cb 0.02 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 2v47 n ARG 86 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2v47 n TYR 87 N -2.26 0.00 0.00 -1.55 4.01 -0.10 -4.85 117.16 112.41 2v47 n TYR 87 Ca 0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.85 2v47 n TYR 87 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.82 2v47 n TYR 87 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2v47 n ARG 88 N 0.00 0.00 0.06 -0.72 0.00 -1.18 -3.13 116.66 111.69 2v47 n ARG 88 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.74 2v47 n ARG 88 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 32.41 2v47 n ARG 88 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 2v47 h ASP 89 N 0.00 -0.61 -3.02 6.15 3.32 -1.90 -3.41 116.42 116.94 2v47 h ASP 89 Ca 0.00 0.08 -0.58 0.00 0.02 0.00 0.00 57.03 56.55 2v47 h ASP 89 Cb 0.00 0.25 0.17 0.00 0.22 0.00 0.00 39.33 39.96 2v47 h ASP 89 CO 0.00 -0.28 -0.28 -1.14 -1.72 0.00 0.00 179.24 175.83 2v47 n ARG 90 N -5.34 0.62 -3.83 3.56 0.63 -1.18 -4.97 116.66 106.15 2v47 n ARG 90 Ca -0.05 0.24 -0.28 0.00 -0.92 0.00 0.00 57.85 56.84 2v47 n ARG 90 Cb 0.25 -1.78 -0.16 0.00 0.45 0.00 0.00 32.46 31.22 2v47 n ARG 90 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 2v47 s GLN 91 N -2.15 1.09 0.00 -0.14 0.74 -1.26 -5.00 119.66 112.94 2v47 s GLN 91 Ca 0.69 -0.51 0.00 0.00 0.05 0.00 0.00 55.36 55.59 2v47 s GLN 91 Cb -0.46 -2.06 0.00 0.00 1.10 0.00 0.00 33.01 31.59 2v47 s GLN 91 CO 0.53 -0.53 0.00 0.41 -0.55 0.00 0.00 175.29 175.15 2v47 n GLY 92 N 4.93 -1.11 3.75 2.59 0.00 -1.26 -4.97 105.19 109.12 2v47 n GLY 92 Ca -0.10 -1.60 -0.28 0.00 0.00 0.00 0.00 46.02 44.04 2v47 n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2v47 n GLY 93 N -0.89 -0.78 1.44 -0.02 0.00 -1.26 -4.79 105.19 98.89 2v47 n GLY 93 Ca 0.00 0.34 -0.04 0.00 0.00 0.00 0.00 46.02 46.32 2v47 n GLY 93 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2v47 n TYR 94 N -3.12 0.41 -3.61 1.61 4.02 -1.26 -4.78 117.16 110.44 2v47 n TYR 94 Ca -0.16 -1.05 -0.07 0.00 -0.01 0.00 0.00 57.90 56.61 2v47 n TYR 94 Cb 0.46 -0.52 -0.05 0.00 -0.02 0.00 0.00 39.34 39.21 2v47 n TYR 94 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 2v47 s THR 95 N -0.56 0.00 0.27 -0.72 -1.32 -1.19 -4.43 115.64 107.69 2v47 s THR 95 Ca 0.08 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.60 2v47 s THR 95 Cb 0.06 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 70.00 2v47 s THR 95 CO 0.00 0.00 0.02 0.00 -2.21 0.00 0.00 174.62 172.44 2v47 s ARG 96 N -0.84 1.49 -0.12 7.08 1.70 -1.08 -4.98 118.95 122.20 2v47 s ARG 96 Ca 0.03 -1.79 -0.04 0.00 -0.47 0.00 0.00 55.73 53.46 2v47 s ARG 96 Cb -0.01 -0.74 0.05 0.00 -0.57 0.00 0.00 34.95 33.68 2v47 s ARG 96 CO -0.04 -0.13 0.08 0.08 -1.08 0.00 0.00 175.30 174.21 2v47 s VAL 97 N -3.36 -0.09 -0.27 4.99 1.01 -1.26 -0.86 120.40 120.57 2v47 s VAL 97 Ca 0.33 0.04 -0.16 0.00 0.00 0.00 0.00 61.98 62.19 2v47 s VAL 97 Cb 0.07 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 2v47 s VAL 97 CO 0.12 -0.12 0.40 -0.76 0.00 0.00 0.00 175.10 174.75 2v47 s LEU 98 N 2.15 4.04 1.10 3.92 1.43 0.17 -4.91 118.68 126.58 2v47 s LEU 98 Ca 0.03 0.34 -0.13 0.00 -1.03 0.00 0.00 54.13 53.35 2v47 s LEU 98 Cb -0.15 -2.48 0.25 0.00 0.03 0.00 0.00 46.19 43.85 2v47 s LEU 98 CO -0.07 -0.20 1.05 -0.54 0.23 0.00 0.00 176.35 176.82 2v47 s LYS 99 N 2.10 -0.42 0.19 1.70 1.02 -1.26 0.98 119.74 124.05 2v47 s LYS 99 Ca 0.16 0.74 0.02 0.00 0.02 0.00 0.00 55.97 56.91 2v47 s LYS 99 Cb -0.16 -1.62 -0.05 0.00 -0.52 0.00 0.00 37.83 35.49 2v47 s LYS 99 CO 0.10 -3.36 0.01 -0.51 -0.92 0.00 0.00 175.35 170.67 2v47 s LEU 100 N -6.94 2.07 0.06 3.17 2.01 -1.20 -4.60 118.68 113.25 2v47 s LEU 100 Ca 0.67 -1.20 0.01 0.00 0.01 0.00 0.00 54.13 53.62 2v47 s LEU 100 Cb -0.23 -0.06 -0.04 0.00 0.01 0.00 0.00 46.19 45.87 2v47 s LEU 100 CO 0.62 -0.58 0.16 0.00 1.01 0.00 0.00 176.35 177.56 2v47 s ALA 101 N -3.65 3.84 0.16 4.21 0.00 -1.26 -4.79 121.76 120.27 2v47 s ALA 101 Ca 0.26 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.32 2v47 s ALA 101 Cb 0.06 -1.68 0.00 0.00 0.00 0.00 0.00 23.12 21.50 2v47 s ALA 101 CO 0.05 0.80 0.00 0.39 0.00 0.00 0.00 175.76 177.00 2v47 n GLU 102 N 0.39 -2.23 0.00 0.00 1.02 -1.26 -4.97 120.64 113.59 2v47 n GLU 102 Ca -0.07 1.62 0.00 0.00 -0.02 0.00 0.00 57.16 58.69 2v47 n GLU 102 Cb 0.51 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 2v47 n GLU 102 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2v47 n ARG 103 N -0.04 3.05 -2.92 3.49 3.00 -1.26 -4.46 116.66 117.52 2v47 n ARG 103 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.85 57.42 2v47 n ARG 103 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 32.41 2v47 n ARG 103 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2v47 s ARG 104 N 2.07 3.72 -1.07 5.56 3.00 -0.57 -4.89 118.95 126.77 2v47 s ARG 104 Ca 0.00 0.31 -0.26 0.00 0.00 0.00 0.00 55.73 55.78 2v47 s ARG 104 Cb 0.00 -3.83 -0.21 0.00 0.00 0.00 0.00 34.95 30.91 2v47 s ARG 104 CO 0.00 -0.92 2.13 1.03 0.00 0.00 0.00 175.30 177.54 2v47 s ARG 105 N 3.24 1.26 0.00 3.54 0.52 -1.26 -2.20 118.95 124.05 2v47 s ARG 105 Ca 0.33 -0.41 0.00 0.00 -0.52 0.00 0.00 55.73 55.13 2v47 s ARG 105 Cb -0.13 -4.98 0.00 0.00 0.52 0.00 0.00 34.95 30.36 2v47 s ARG 105 CO 0.18 -5.38 0.00 0.41 0.02 0.00 0.00 175.30 170.54 2v47 n GLY 106 N 6.18 -0.23 0.00 -3.53 0.00 -1.26 -4.99 105.19 101.35 2v47 n GLY 106 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.44 2v47 n GLY 106 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2v47 n ASP 107 N 0.00 0.00 -2.69 1.61 3.85 -0.93 -5.02 116.55 113.36 2v47 n ASP 107 Ca 0.00 -0.14 -0.19 0.00 -0.71 0.00 0.00 54.79 53.75 2v47 n ASP 107 Cb 0.00 0.00 0.04 0.00 -1.35 0.00 0.00 41.12 39.81 2v47 n ASP 107 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2v47 n GLY 108 N 0.00 -0.33 3.59 6.12 0.00 -1.14 -4.99 105.19 108.43 2v47 n GLY 108 Ca 0.00 0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 2v47 n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2v47 s ALA 109 N -3.12 3.54 0.12 4.61 0.00 -1.26 -4.85 121.76 120.80 2v47 s ALA 109 Ca 0.31 -0.97 -0.30 0.00 0.00 0.00 0.00 51.96 50.99 2v47 s ALA 109 Cb -0.13 -2.61 -0.07 0.00 0.00 0.00 0.00 23.12 20.31 2v47 s ALA 109 CO 0.38 -0.63 1.19 -1.25 0.00 0.00 0.00 175.76 175.44 2v47 s PRO 110 N 1.92 4.47 0.20 0.00 0.04 -1.26 -1.51 135.00 138.85 2v47 s PRO 110 Ca 0.11 1.80 0.03 0.00 0.04 0.00 0.00 61.00 62.98 2v47 s PRO 110 Cb -0.16 -3.30 0.03 0.00 0.04 0.00 0.00 34.50 31.11 2v47 s PRO 110 CO 0.11 -0.16 0.27 1.28 0.04 0.00 0.00 177.00 178.53 2v47 n LEU 111 N 3.27 0.00 -3.79 -3.56 4.77 -1.26 -2.56 117.00 113.88 2v47 n LEU 111 Ca 0.07 -0.83 -0.01 0.00 -0.03 0.00 0.00 56.01 55.20 2v47 n LEU 111 Cb 0.46 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2v47 n LEU 111 CO 0.55 -0.58 0.89 0.00 -1.33 0.00 0.00 177.39 176.93 2v47 s ALA 112 N -2.26 -1.90 -0.13 -1.18 0.00 0.20 -3.26 121.76 113.23 2v47 s ALA 112 Ca 0.21 0.13 0.02 0.00 0.00 0.00 0.00 51.96 52.32 2v47 s ALA 112 Cb -0.02 0.63 0.01 0.00 0.00 0.00 0.00 23.12 23.75 2v47 s ALA 112 CO 0.13 -1.07 -0.21 -1.17 0.00 0.00 0.00 175.76 173.45 2v47 s LEU 113 N -3.20 2.02 -0.30 0.00 2.96 0.28 -2.30 118.68 118.14 2v47 s LEU 113 Ca 0.18 -0.56 -0.06 0.00 -0.22 0.00 0.00 54.13 53.47 2v47 s LEU 113 Cb 0.00 -1.36 0.02 0.00 0.50 0.00 0.00 46.19 45.35 2v47 s LEU 113 CO 0.01 0.07 0.06 -0.69 -1.32 0.00 0.00 176.35 174.49 2v47 s VAL 114 N 0.81 3.75 0.03 1.68 1.01 0.10 0.43 120.40 128.22 2v47 s VAL 114 Ca -0.08 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 60.97 2v47 s VAL 114 Cb -0.16 -2.98 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 2v47 s VAL 114 CO -0.01 0.04 0.32 -0.70 0.00 0.00 0.00 175.10 174.75 2v47 s GLU 115 N 1.45 3.66 0.01 2.72 2.12 -0.04 -0.22 118.70 128.40 2v47 s GLU 115 Ca 0.01 0.04 -0.02 0.00 0.36 0.00 0.00 54.97 55.35 2v47 s GLU 115 Cb -0.18 -3.05 -0.01 0.00 0.26 0.00 0.00 34.13 31.15 2v47 s GLU 115 CO 0.01 0.62 1.04 1.25 -0.54 0.00 0.00 175.26 177.64 2v47 h LEU 116 N 3.90 -0.11 0.00 2.70 6.46 0.19 -2.85 115.31 125.61 2v47 h LEU 116 Ca -0.50 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.27 2v47 h LEU 116 Cb 1.20 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 41.17 2v47 h LEU 116 CO 0.66 -0.04 0.00 0.55 -0.62 0.00 0.00 178.44 178.99 2v47 n VAL 117 N -2.62 0.00 0.00 1.05 3.14 -1.26 -3.20 118.33 115.44 2v47 n VAL 117 Ca -0.01 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.37 2v47 n VAL 117 Cb 0.03 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.81 2v47 n VAL 117 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58