#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w57 h ASN 4 N 0.00 0.54 -0.52 1.67 2.35 -2.01 -0.84 115.58 116.77 2w57 h ASN 4 Ca 0.00 -0.52 0.08 0.00 -0.55 0.00 0.00 56.30 55.31 2w57 h ASN 4 Cb 0.00 -0.15 -0.06 0.00 0.05 0.00 0.00 38.32 38.15 2w57 h ASN 4 CO 0.00 0.95 0.16 0.78 -1.65 0.00 0.00 177.43 177.67 2w57 h ASN 5 N 0.15 0.12 -0.02 5.81 4.21 -2.00 -1.84 115.58 122.01 2w57 h ASN 5 Ca 0.02 0.07 -0.00 0.00 1.21 0.00 0.00 56.30 57.60 2w57 h ASN 5 Cb 0.83 0.07 -0.00 0.00 -1.12 0.00 0.00 38.32 38.10 2w57 h ASN 5 CO 0.06 0.09 0.00 -0.61 -1.29 0.00 0.00 177.43 175.69 2w57 h GLN 6 N 0.32 0.02 -0.82 0.81 5.75 -1.99 -2.06 115.11 117.15 2w57 h GLN 6 Ca 0.26 -0.01 0.16 0.00 -0.15 0.00 0.00 58.65 58.91 2w57 h GLN 6 Cb 0.31 -0.00 -0.10 0.00 1.07 0.00 0.00 27.48 28.75 2w57 h GLN 6 CO -0.28 0.27 0.35 0.00 -2.65 0.00 0.00 178.83 176.52 2w57 h ALA 7 N 0.75 1.21 -0.22 3.38 0.00 -0.94 0.53 119.26 123.97 2w57 h ALA 7 Ca 0.00 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2w57 h ALA 7 Cb 0.26 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2w57 h ALA 7 CO 0.00 -0.22 0.06 -0.07 0.00 0.00 0.00 179.25 179.02 2w57 h LEU 8 N 0.47 0.33 -0.69 0.00 3.38 -1.28 -1.64 115.31 115.87 2w57 h LEU 8 Ca 0.47 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 2w57 h LEU 8 Cb 0.75 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 2w57 h LEU 8 CO -0.43 0.47 0.38 0.11 0.09 0.00 0.00 178.44 179.06 2w57 h LYS 9 N 0.17 0.97 0.00 1.13 1.57 -0.57 -0.34 116.57 119.51 2w57 h LYS 9 Ca 0.07 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2w57 h LYS 9 Cb 0.27 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 2w57 h LYS 9 CO 0.00 0.73 -0.03 -0.44 -0.57 0.00 0.00 179.45 179.14 2w57 h ASP 10 N 0.95 0.00 -0.01 0.86 3.32 0.12 -0.14 116.42 121.52 2w57 h ASP 10 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2w57 h ASP 10 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2w57 h ASP 10 CO -0.04 0.03 -0.01 0.00 -1.72 0.00 0.00 179.24 177.50 2w57 n ALA 11 N -2.13 2.59 -2.81 3.45 0.00 -0.63 -4.94 120.51 116.04 2w57 n ALA 11 Ca -0.01 -0.45 -0.12 0.00 0.00 0.00 0.00 53.44 52.85 2w57 n ALA 11 Cb 0.19 -1.15 0.03 0.00 0.00 0.00 0.00 19.45 18.52 2w57 n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w57 n GLY 12 N 1.19 0.11 3.19 0.00 0.00 -0.06 -4.92 105.19 104.70 2w57 n GLY 12 Ca 0.19 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 2w57 n GLY 12 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w57 s LEU 13 N -3.88 2.00 0.19 0.99 1.43 -0.22 -5.02 118.68 114.17 2w57 s LEU 13 Ca 0.21 -0.38 -0.31 0.00 -1.03 0.00 0.00 54.13 52.62 2w57 s LEU 13 Cb -0.09 -1.06 -0.10 0.00 0.03 0.00 0.00 46.19 44.97 2w57 s LEU 13 CO 0.26 0.22 1.52 -0.75 0.23 0.00 0.00 176.35 177.83 2w57 s LYS 14 N -0.28 4.23 -0.52 1.70 2.20 -1.26 -3.72 119.74 122.09 2w57 s LYS 14 Ca 0.03 2.33 -0.28 0.00 -0.36 0.00 0.00 55.97 57.69 2w57 s LYS 14 Cb -0.10 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.08 2w57 s LYS 14 CO 0.01 -0.54 1.57 0.08 -0.36 0.00 0.00 175.35 176.11 2w57 s VAL 15 N 0.75 3.65 0.41 4.02 1.01 -1.26 -4.97 120.40 124.01 2w57 s VAL 15 Ca 0.66 0.55 0.07 0.00 0.00 0.00 0.00 61.98 63.26 2w57 s VAL 15 Cb -0.43 -4.19 -0.07 0.00 0.00 0.00 0.00 36.38 31.69 2w57 s VAL 15 CO 0.35 -0.96 0.04 0.42 0.00 0.00 0.00 175.10 174.95 2w57 s THR 16 N 6.80 2.03 0.02 3.92 -4.23 -1.26 -5.07 115.64 117.85 2w57 s THR 16 Ca 0.61 -1.95 -0.23 0.00 -1.18 0.00 0.00 61.69 58.94 2w57 s THR 16 Cb -0.13 -2.97 -0.16 0.00 1.34 0.00 0.00 72.50 70.57 2w57 s THR 16 CO 0.26 0.00 1.34 0.25 -0.54 0.00 0.00 174.62 175.93 2w57 h LEU 17 N 1.70 0.21 -1.19 4.79 5.85 -2.00 -2.46 115.31 122.21 2w57 h LEU 17 Ca -0.44 -0.45 0.07 0.00 0.84 0.00 0.00 57.88 57.90 2w57 h LEU 17 Cb 1.24 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 42.16 2w57 h LEU 17 CO 0.79 0.62 0.57 -0.65 -0.34 0.00 0.00 178.44 179.43 2w57 h PRO 18 N -0.20 0.94 -0.11 5.25 0.11 -2.00 -1.80 132.00 134.19 2w57 h PRO 18 Ca 0.02 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 65.92 2w57 h PRO 18 Cb 0.55 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.44 2w57 h PRO 18 CO 0.02 0.62 -0.58 0.00 -0.21 0.00 0.00 178.00 177.85 2w57 h ARG 19 N 0.97 0.36 0.26 1.05 3.08 -1.92 -2.94 114.38 115.24 2w57 h ARG 19 Ca 0.38 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 2w57 h ARG 19 Cb 0.24 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2w57 h ARG 19 CO -0.14 0.84 -0.13 -0.07 -1.07 0.00 0.00 179.97 179.40 2w57 h LEU 20 N 0.27 -0.30 -1.37 3.04 3.38 -0.92 -2.78 115.31 116.63 2w57 h LEU 20 Ca -0.00 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 2w57 h LEU 20 Cb 1.09 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 2w57 h LEU 20 CO 0.10 -0.00 0.32 0.11 0.09 0.00 0.00 178.44 179.06 2w57 h LYS 21 N -0.61 0.75 -0.00 1.13 1.57 -1.36 -0.24 116.57 117.81 2w57 h LYS 21 Ca -0.04 -0.06 -0.20 0.00 -1.87 0.00 0.00 60.65 58.48 2w57 h LYS 21 Cb 0.44 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2w57 h LYS 21 CO 0.06 0.53 -0.88 0.82 -0.57 0.00 0.00 179.45 179.41 2w57 h ILE 22 N 0.76 1.46 -0.32 1.86 2.04 -1.59 -1.83 117.51 119.90 2w57 h ILE 22 Ca 0.20 -2.54 -0.11 0.00 1.00 0.00 0.00 64.86 63.41 2w57 h ILE 22 Cb -0.01 2.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.48 2w57 h ILE 22 CO -0.04 0.75 -0.25 0.25 0.00 0.00 0.00 178.15 178.86 2w57 h LEU 23 N 0.15 0.65 -0.32 1.44 5.85 -1.10 -2.16 115.31 119.82 2w57 h LEU 23 Ca -0.05 -0.23 -0.07 0.00 0.84 0.00 0.00 57.88 58.37 2w57 h LEU 23 Cb 1.51 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.35 2w57 h LEU 23 CO 0.14 0.88 -0.06 -0.33 -0.34 0.00 0.00 178.44 178.73 2w57 h GLU 24 N 0.56 0.60 -0.46 1.25 5.08 -0.78 -1.86 114.58 118.97 2w57 h GLU 24 Ca 0.08 -0.23 0.03 0.00 -1.00 0.00 0.00 59.36 58.24 2w57 h GLU 24 Cb 0.72 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.90 2w57 h GLU 24 CO 0.06 0.78 0.25 0.28 -1.00 0.00 0.00 179.01 179.38 2w57 h VAL 25 N 0.38 1.01 0.00 3.13 2.07 -1.28 -1.93 116.25 119.63 2w57 h VAL 25 Ca 0.08 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 2w57 h VAL 25 Cb 0.55 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2w57 h VAL 25 CO 0.03 0.09 -0.12 -0.07 0.02 0.00 0.00 177.57 177.52 2w57 h LEU 26 N 0.50 0.00 -0.19 2.57 3.38 -1.23 -1.45 115.31 118.90 2w57 h LEU 26 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2w57 h LEU 26 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2w57 h LEU 26 CO -0.11 0.12 -0.04 0.00 0.09 0.00 0.00 178.44 178.50 2w57 n GLN 27 N -3.84 0.86 -3.14 1.13 6.02 -0.72 -4.59 117.38 113.11 2w57 n GLN 27 Ca -0.02 -0.19 -0.39 0.00 -0.01 0.00 0.00 57.00 56.39 2w57 n GLN 27 Cb 0.22 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 29.93 2w57 n GLN 27 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2w57 s GLN 28 N -2.27 4.39 0.31 -1.09 -0.21 -0.55 -4.97 119.66 115.27 2w57 s GLN 28 Ca 0.36 0.77 0.08 0.00 0.02 0.00 0.00 55.36 56.59 2w57 s GLN 28 Cb 0.21 -3.41 0.85 0.00 1.00 0.00 0.00 33.01 31.66 2w57 s GLN 28 CO 0.42 0.19 1.71 -1.35 -2.12 0.00 0.00 175.29 174.14 2w57 h PRO 29 N 6.35 0.47 -0.11 2.91 0.11 -1.88 -0.57 132.00 139.27 2w57 h PRO 29 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2w57 h PRO 29 Cb 1.20 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2w57 h PRO 29 CO 0.73 0.31 0.00 -0.85 -0.21 0.00 0.00 178.00 177.99 2w57 n GLU 30 N -4.96 1.36 -0.61 1.05 0.00 -1.26 -3.27 120.64 112.95 2w57 n GLU 30 Ca 0.26 -0.55 0.05 0.00 0.00 0.00 0.00 57.16 56.92 2w57 n GLU 30 Cb 0.74 -1.26 0.09 0.00 0.00 0.00 0.00 31.44 31.01 2w57 n GLU 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2w57 h GLN 32 N 0.41 0.39 -4.73 0.00 4.15 -1.54 -3.35 115.11 110.44 2w57 h GLN 32 Ca -0.05 -0.05 -0.69 0.00 0.77 0.00 0.00 58.65 58.64 2w57 h GLN 32 Cb 1.31 -0.08 -0.26 0.00 0.21 0.00 0.00 27.48 28.67 2w57 h GLN 32 CO 0.02 0.34 -0.58 -1.01 -1.93 0.00 0.00 178.83 175.67 2w57 s HIS 33 N -5.85 3.19 -0.03 3.99 3.76 -1.26 -4.11 115.29 114.98 2w57 s HIS 33 Ca -0.13 -0.98 -0.02 0.00 -0.15 0.00 0.00 55.06 53.78 2w57 s HIS 33 Cb 0.09 -2.32 0.02 0.00 1.11 0.00 0.00 32.58 31.48 2w57 s HIS 33 CO 0.71 -0.60 0.06 -1.50 -0.85 0.00 0.00 174.74 172.57 2w57 s ILE 34 N 1.51 -0.02 0.66 0.60 2.07 0.30 -4.90 121.20 121.42 2w57 s ILE 34 Ca 0.02 0.07 -0.10 0.00 -1.41 0.00 0.00 60.65 59.23 2w57 s ILE 34 Cb -0.18 -0.11 -0.00 0.00 0.13 0.00 0.00 42.46 42.30 2w57 s ILE 34 CO 0.04 0.03 1.04 -0.94 -1.91 0.00 0.00 174.94 173.20 2w57 s SER 35 N 0.40 5.70 0.30 4.50 1.04 -1.26 0.13 113.70 124.51 2w57 s SER 35 Ca -0.03 1.13 0.00 0.00 0.48 0.00 0.00 55.95 57.53 2w57 s SER 35 Cb -0.04 -2.04 0.48 0.00 0.10 0.00 0.00 66.02 64.51 2w57 s SER 35 CO -0.01 -1.15 1.88 0.00 0.98 0.00 0.00 173.24 174.93 2w57 h ALA 36 N -0.46 1.31 -0.35 5.32 0.00 -1.98 -0.74 119.26 122.36 2w57 h ALA 36 Ca -0.45 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.25 2w57 h ALA 36 Cb 1.24 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2w57 h ALA 36 CO 0.63 0.50 0.02 0.93 0.00 0.00 0.00 179.25 181.33 2w57 h GLU 37 N 0.78 0.60 -0.80 0.00 3.07 -1.94 0.67 114.58 116.98 2w57 h GLU 37 Ca 0.18 -0.18 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 2w57 h GLU 37 Cb 0.20 -0.06 -0.04 0.00 -0.84 0.00 0.00 28.75 28.01 2w57 h GLU 37 CO -0.01 0.71 0.53 0.93 -1.40 0.00 0.00 179.01 179.76 2w57 h GLU 38 N 0.42 1.05 -0.27 2.33 5.08 -1.87 -0.75 114.58 120.58 2w57 h GLU 38 Ca 0.10 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.29 2w57 h GLU 38 Cb 0.42 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 2w57 h GLU 38 CO 0.01 0.70 -0.26 1.25 -1.00 0.00 0.00 179.01 179.71 2w57 h LEU 39 N 1.08 0.70 -0.02 1.33 6.46 -0.89 -1.23 115.31 122.75 2w57 h LEU 39 Ca 0.29 -0.47 0.03 0.00 -0.12 0.00 0.00 57.88 57.62 2w57 h LEU 39 Cb -0.13 -0.20 -0.05 0.00 -0.73 0.00 0.00 40.66 39.56 2w57 h LEU 39 CO -0.06 1.02 -0.25 0.22 -0.62 0.00 0.00 178.44 178.75 2w57 h TYR 40 N 0.39 -0.66 -1.00 1.25 3.20 -0.80 -1.78 116.97 117.56 2w57 h TYR 40 Ca 0.04 0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.01 2w57 h TYR 40 Cb 0.82 0.30 -0.07 0.00 1.54 0.00 0.00 36.73 39.32 2w57 h TYR 40 CO 0.07 -0.34 0.64 0.87 -1.64 0.00 0.00 178.16 177.77 2w57 h LYS 41 N -0.37 1.10 -0.63 1.82 1.57 -0.98 -0.89 116.57 118.18 2w57 h LYS 41 Ca 0.07 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2w57 h LYS 41 Cb 0.47 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 2w57 h LYS 41 CO -0.23 0.73 0.25 -0.22 -0.57 0.00 0.00 179.45 179.40 2w57 h LYS 42 N 1.13 0.95 -0.47 3.15 1.63 -1.09 -1.17 116.57 120.69 2w57 h LYS 42 Ca 0.44 -0.18 -0.09 0.00 -0.85 0.00 0.00 60.65 59.98 2w57 h LYS 42 Cb 0.24 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.70 2w57 h LYS 42 CO -0.19 0.80 -0.06 -0.07 -3.45 0.00 0.00 179.45 176.49 2w57 h LEU 43 N 0.89 0.80 -0.71 5.20 3.38 -0.39 -2.19 115.31 122.29 2w57 h LEU 43 Ca 0.21 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2w57 h LEU 43 Cb 0.21 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2w57 h LEU 43 CO -0.02 0.90 0.29 0.40 0.09 0.00 0.00 178.44 180.11 2w57 h ILE 44 N 0.75 1.25 0.00 1.22 1.08 -0.98 0.26 117.51 121.09 2w57 h ILE 44 Ca 0.14 -0.77 -0.04 0.00 -0.39 0.00 0.00 64.86 63.80 2w57 h ILE 44 Cb 0.54 0.42 -0.01 0.00 -3.07 0.00 0.00 36.82 34.70 2w57 h ILE 44 CO 0.03 0.31 -0.18 0.44 -0.69 0.00 0.00 178.15 178.06 2w57 h ASP 45 N 1.02 0.00 0.07 1.72 3.32 -0.89 0.16 116.42 121.82 2w57 h ASP 45 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2w57 h ASP 45 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2w57 h ASP 45 CO -0.02 0.18 -0.01 0.18 -1.72 0.00 0.00 179.24 177.85 2w57 n LEU 46 N -3.94 0.34 -0.40 1.55 4.77 -0.85 -4.91 117.00 113.55 2w57 n LEU 46 Ca -0.02 -0.08 -0.05 0.00 -0.03 0.00 0.00 56.01 55.83 2w57 n LEU 46 Cb 0.27 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.30 2w57 n LEU 46 CO 0.34 0.06 -0.05 0.61 -1.33 0.00 0.00 177.39 177.01 2w57 n GLY 47 N 1.08 0.69 3.85 -0.72 0.00 0.56 -5.03 105.19 105.62 2w57 n GLY 47 Ca 0.21 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 2w57 n GLY 47 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2w57 s GLU 48 N -2.64 3.44 -0.41 1.61 0.41 0.05 -5.00 118.70 116.16 2w57 s GLU 48 Ca 0.00 0.86 0.05 0.00 -0.41 0.00 0.00 54.97 55.47 2w57 s GLU 48 Cb 0.00 -2.06 0.50 0.00 -1.78 0.00 0.00 34.13 30.80 2w57 s GLU 48 CO 0.00 -0.70 1.61 0.39 -0.49 0.00 0.00 175.26 176.07 2w57 n GLU 49 N -2.68 2.52 -3.33 1.61 1.02 -1.26 -4.45 120.64 114.06 2w57 n GLU 49 Ca 0.07 -3.42 -0.39 0.00 -0.02 0.00 0.00 57.16 53.40 2w57 n GLU 49 Cb 0.54 -2.09 -0.07 0.00 -0.02 0.00 0.00 31.44 29.79 2w57 n GLU 49 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2w57 s ILE 50 N -3.97 5.15 0.73 -3.67 1.01 -1.26 -5.06 121.20 114.13 2w57 s ILE 50 Ca 0.53 0.79 -0.11 0.00 0.00 0.00 0.00 60.65 61.86 2w57 s ILE 50 Cb 0.44 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 39.17 2w57 s ILE 50 CO 0.02 0.20 1.07 -0.83 0.00 0.00 0.00 174.94 175.41 2w57 s GLY 51 N 1.17 1.65 0.49 6.18 0.00 -1.26 -4.88 107.32 110.68 2w57 s GLY 51 Ca 0.21 -0.02 0.14 0.00 0.00 0.00 0.00 44.72 45.04 2w57 s GLY 51 CO 0.09 0.33 2.11 -2.00 0.00 0.00 0.00 173.10 173.63 2w57 h LEU 52 N -0.85 0.14 -0.27 0.66 5.85 -1.97 -2.83 115.31 116.04 2w57 h LEU 52 Ca -0.45 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.21 2w57 h LEU 52 Cb 1.23 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 2w57 h LEU 52 CO 0.58 0.10 -0.08 0.00 -0.34 0.00 0.00 178.44 178.70 2w57 h ALA 53 N 1.91 0.37 -0.97 1.25 0.00 -2.00 -2.07 119.26 117.76 2w57 h ALA 53 Ca 0.06 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 54.74 2w57 h ALA 53 Cb 0.04 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 2w57 h ALA 53 CO -0.01 0.19 0.62 1.15 0.00 0.00 0.00 179.25 181.20 2w57 h THR 54 N 0.27 1.12 0.18 0.00 2.02 -1.91 0.75 112.91 115.33 2w57 h THR 54 Ca 0.07 -0.40 -0.01 0.00 0.77 0.00 0.00 66.41 66.84 2w57 h THR 54 Cb 0.56 -0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 66.82 2w57 h THR 54 CO 0.03 0.21 -0.09 0.58 0.37 0.00 0.00 175.52 176.62 2w57 h VAL 55 N 1.17 0.80 -0.24 3.16 2.07 -1.28 0.13 116.25 122.06 2w57 h VAL 55 Ca 0.40 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.97 2w57 h VAL 55 Cb 0.09 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 2w57 h VAL 55 CO -0.15 0.00 -0.05 1.88 0.02 0.00 0.00 177.57 179.27 2w57 h TYR 56 N -0.25 -0.12 0.02 1.57 -1.99 -0.63 -0.03 116.97 115.54 2w57 h TYR 56 Ca -0.02 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 2w57 h TYR 56 Cb 0.20 0.09 0.00 0.00 2.00 0.00 0.00 36.73 39.02 2w57 h TYR 56 CO -0.07 -0.10 -0.01 -0.09 -0.00 0.00 0.00 178.16 177.89 2w57 h ARG 57 N 0.01 -0.03 -0.46 4.88 2.43 -0.64 -1.85 114.38 118.72 2w57 h ARG 57 Ca 0.12 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 2w57 h ARG 57 Cb 0.17 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 2w57 h ARG 57 CO -0.24 0.07 0.20 0.28 -1.51 0.00 0.00 179.97 178.76 2w57 h VAL 58 N -0.12 1.20 -0.95 0.20 2.07 -0.83 -1.18 116.25 116.64 2w57 h VAL 58 Ca -0.00 -0.60 0.13 0.00 0.82 0.00 0.00 66.70 67.04 2w57 h VAL 58 Cb 0.11 0.74 -0.08 0.00 -1.52 0.00 0.00 31.29 30.54 2w57 h VAL 58 CO 0.01 0.23 0.61 -0.07 0.02 0.00 0.00 177.57 178.36 2w57 h LEU 59 N 0.60 0.82 -0.63 2.57 3.38 -0.85 0.73 115.31 121.92 2w57 h LEU 59 Ca 0.15 0.04 -0.10 0.00 0.09 0.00 0.00 57.88 58.07 2w57 h LEU 59 Cb 0.17 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2w57 h LEU 59 CO -0.01 0.43 -0.03 0.78 0.09 0.00 0.00 178.44 179.69 2w57 h ASN 60 N 0.87 1.03 -0.43 -0.43 4.21 -0.38 -1.26 115.58 119.19 2w57 h ASN 60 Ca 0.47 -0.31 -0.02 0.00 1.21 0.00 0.00 56.30 57.66 2w57 h ASN 60 Cb 0.57 -0.28 -0.02 0.00 -1.12 0.00 0.00 38.32 37.48 2w57 h ASN 60 CO -0.24 1.10 0.20 1.56 -1.29 0.00 0.00 177.43 178.76 2w57 h GLN 61 N 0.95 0.63 -0.73 0.81 4.20 -0.34 -0.45 115.11 120.18 2w57 h GLN 61 Ca 0.16 -0.10 0.08 0.00 0.06 0.00 0.00 58.65 58.86 2w57 h GLN 61 Cb 0.59 -0.11 -0.06 0.00 0.30 0.00 0.00 27.48 28.19 2w57 h GLN 61 CO 0.04 0.55 0.40 0.74 -0.67 0.00 0.00 178.83 179.88 2w57 h PHE 62 N 0.56 0.73 0.32 2.96 -1.00 -0.69 0.13 116.94 119.95 2w57 h PHE 62 Ca 0.15 0.03 -0.02 0.00 2.81 0.00 0.00 57.97 60.94 2w57 h PHE 62 Cb 0.13 -0.22 0.00 0.00 3.61 0.00 0.00 35.95 39.48 2w57 h PHE 62 CO -0.01 0.31 -0.15 0.22 -1.61 0.00 0.00 178.31 177.07 2w57 h ASP 63 N 0.70 -0.36 -0.66 2.17 3.58 -0.93 0.51 116.42 121.43 2w57 h ASP 63 Ca 0.34 -0.14 0.18 0.00 0.42 0.00 0.00 57.03 57.84 2w57 h ASP 63 Cb 0.28 0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.40 2w57 h ASP 63 CO -0.22 -0.05 0.47 0.44 -2.88 0.00 0.00 179.24 177.00 2w57 h ASP 64 N -0.69 0.05 -0.08 2.28 5.19 -0.78 -1.50 116.42 120.88 2w57 h ASP 64 Ca -0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 2w57 h ASP 64 Cb 0.48 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.98 2w57 h ASP 64 CO 0.07 0.02 0.00 0.00 -3.12 0.00 0.00 179.24 176.22 2w57 n ALA 65 N -2.65 2.51 -1.01 3.45 0.00 0.43 -4.95 120.51 118.29 2w57 n ALA 65 Ca 0.13 -0.61 -0.00 0.00 0.00 0.00 0.00 53.44 52.95 2w57 n ALA 65 Cb 0.70 -0.98 -0.00 0.00 0.00 0.00 0.00 19.45 19.16 2w57 n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w57 n GLY 66 N 1.28 0.35 0.15 0.00 0.00 -0.33 -4.92 105.19 101.71 2w57 n GLY 66 Ca 0.17 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 2w57 n GLY 66 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2w57 h ILE 67 N 0.00 1.34 -2.36 -0.61 2.04 -1.21 -3.42 117.51 113.30 2w57 h ILE 67 Ca -0.01 -1.36 -0.58 0.00 1.00 0.00 0.00 64.86 63.91 2w57 h ILE 67 Cb 0.39 1.86 -0.11 0.00 -0.74 0.00 0.00 36.82 38.22 2w57 h ILE 67 CO 0.01 0.41 -0.68 0.68 0.00 0.00 0.00 178.15 178.57 2w57 s VAL 68 N -4.26 3.24 -0.06 1.67 -7.23 -1.16 -1.01 120.40 111.59 2w57 s VAL 68 Ca -0.14 -1.95 0.03 0.00 -1.81 0.00 0.00 61.98 58.11 2w57 s VAL 68 Cb 0.06 -2.70 -0.02 0.00 0.56 0.00 0.00 36.38 34.27 2w57 s VAL 68 CO 0.77 -0.33 -0.14 -0.89 -0.31 0.00 0.00 175.10 174.20 2w57 s THR 69 N -2.24 3.06 -0.13 5.32 2.01 0.10 -4.38 115.64 119.38 2w57 s THR 69 Ca 0.30 -0.71 -0.04 0.00 0.31 0.00 0.00 61.69 61.54 2w57 s THR 69 Cb -0.07 -2.21 -0.03 0.00 0.01 0.00 0.00 72.50 70.20 2w57 s THR 69 CO 0.18 0.58 0.02 -0.60 -0.69 0.00 0.00 174.62 174.11 2w57 s ARG 70 N -0.53 3.44 -0.17 4.92 3.52 -1.26 -2.09 118.95 126.78 2w57 s ARG 70 Ca 0.07 -0.39 0.01 0.00 -0.13 0.00 0.00 55.73 55.29 2w57 s ARG 70 Cb -0.12 -2.96 0.01 0.00 -1.56 0.00 0.00 34.95 30.32 2w57 s ARG 70 CO 0.01 0.50 -0.19 -1.01 -0.81 0.00 0.00 175.30 173.81 2w57 s HIS 71 N -0.30 2.77 -0.28 5.12 3.76 0.04 -4.97 115.29 121.43 2w57 s HIS 71 Ca 0.07 -1.42 -0.21 0.00 -0.15 0.00 0.00 55.06 53.34 2w57 s HIS 71 Cb -0.12 -1.90 -0.01 0.00 1.11 0.00 0.00 32.58 31.65 2w57 s HIS 71 CO 0.02 -0.69 0.68 -1.01 -0.85 0.00 0.00 174.74 172.89 2w57 s HIS 72 N 1.12 3.25 0.26 1.40 0.09 -1.26 -1.31 115.29 118.83 2w57 s HIS 72 Ca 0.00 0.77 0.07 0.00 -0.00 0.00 0.00 55.06 55.91 2w57 s HIS 72 Cb -0.14 -2.98 -0.03 0.00 -0.00 0.00 0.00 32.58 29.42 2w57 s HIS 72 CO -0.07 -0.43 0.20 -0.06 -0.00 0.00 0.00 174.74 174.38 2w57 s PHE 73 N 2.66 3.06 -0.11 1.40 0.08 -0.02 -4.99 117.98 120.06 2w57 s PHE 73 Ca 0.28 -0.14 -0.38 0.00 0.12 0.00 0.00 56.93 56.81 2w57 s PHE 73 Cb -0.15 -1.44 -0.15 0.00 -0.57 0.00 0.00 43.02 40.71 2w57 s PHE 73 CO 0.10 0.48 1.65 -1.91 -0.10 0.00 0.00 175.22 175.45 2w57 n GLU 74 N -1.19 1.44 -0.05 0.44 2.13 -1.26 -1.51 120.64 120.64 2w57 n GLU 74 Ca -0.07 0.53 0.00 0.00 0.66 0.00 0.00 57.16 58.28 2w57 n GLU 74 Cb 0.58 -2.24 0.00 0.00 0.27 0.00 0.00 31.44 30.05 2w57 n GLU 74 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2w57 n GLY 75 N 3.74 0.60 1.16 8.31 0.00 -1.26 -4.64 105.19 113.10 2w57 n GLY 75 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2w57 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w57 n GLY 76 N -2.01 0.91 3.82 -0.02 0.00 -0.57 -5.08 105.19 102.24 2w57 n GLY 76 Ca 0.00 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.14 2w57 n GLY 76 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2w57 s LYS 77 N -2.19 3.13 -0.21 1.61 2.20 -1.19 -4.95 119.74 118.13 2w57 s LYS 77 Ca 0.00 -0.50 -0.08 0.00 -0.36 0.00 0.00 55.97 55.04 2w57 s LYS 77 Cb 0.00 -2.89 -0.04 0.00 -1.51 0.00 0.00 37.83 33.39 2w57 s LYS 77 CO 0.00 0.63 0.08 -1.12 -0.36 0.00 0.00 175.35 174.58 2w57 s SER 78 N -1.98 5.58 -0.08 1.43 0.01 -1.26 -0.85 113.70 116.55 2w57 s SER 78 Ca 0.26 0.01 -0.00 0.00 1.31 0.00 0.00 55.95 57.53 2w57 s SER 78 Cb -0.12 -1.98 -0.03 0.00 0.21 0.00 0.00 66.02 64.10 2w57 s SER 78 CO 0.18 0.10 -0.05 -0.69 0.41 0.00 0.00 173.24 173.18 2w57 s VAL 79 N 0.83 3.82 0.07 3.43 1.01 -0.43 -4.17 120.40 124.96 2w57 s VAL 79 Ca 0.04 -0.43 0.07 0.00 0.00 0.00 0.00 61.98 61.66 2w57 s VAL 79 Cb -0.13 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 2w57 s VAL 79 CO 0.02 0.59 -0.13 -0.36 0.00 0.00 0.00 175.10 175.22 2w57 s PHE 80 N -0.65 2.68 0.04 5.22 0.08 0.35 -0.78 117.98 124.92 2w57 s PHE 80 Ca 0.10 -0.18 -0.06 0.00 0.12 0.00 0.00 56.93 56.91 2w57 s PHE 80 Cb -0.12 -1.46 -0.01 0.00 -0.57 0.00 0.00 43.02 40.87 2w57 s PHE 80 CO 0.02 0.36 0.10 -1.83 -0.10 0.00 0.00 175.22 173.77 2w57 s GLU 81 N -1.86 0.61 0.37 0.44 -1.05 -0.89 -0.54 118.70 115.78 2w57 s GLU 81 Ca 0.18 -0.80 -0.28 0.00 -0.15 0.00 0.00 54.97 53.92 2w57 s GLU 81 Cb -0.11 0.24 -0.10 0.00 -0.44 0.00 0.00 34.13 33.72 2w57 s GLU 81 CO 0.10 -0.16 1.40 -0.51 0.95 0.00 0.00 175.26 177.05 2w57 s LEU 82 N -2.24 4.33 0.27 1.83 1.43 -1.26 0.02 118.68 123.05 2w57 s LEU 82 Ca -0.03 2.88 -0.30 0.00 -1.03 0.00 0.00 54.13 55.65 2w57 s LEU 82 Cb -0.00 -3.71 -0.10 0.00 0.03 0.00 0.00 46.19 42.41 2w57 s LEU 82 CO -0.05 -0.78 1.41 -0.44 0.23 0.00 0.00 176.35 176.71 2w57 s SER 83 N -0.35 6.68 0.10 2.29 0.01 -0.18 -4.66 113.70 117.59 2w57 s SER 83 Ca 0.53 2.68 -0.04 0.00 1.31 0.00 0.00 55.95 60.42 2w57 s SER 83 Cb -0.43 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.14 2w57 s SER 83 CO 0.58 -0.67 0.10 0.42 0.41 0.00 0.00 173.24 174.08 2w57 s THR 84 N -0.28 0.14 -0.84 1.44 -4.23 -1.26 -5.01 115.64 105.60 2w57 s THR 84 Ca 0.57 -1.63 0.24 0.00 -1.18 0.00 0.00 61.69 59.69 2w57 s THR 84 Cb -0.41 -1.70 -0.07 0.00 1.34 0.00 0.00 72.50 71.66 2w57 s THR 84 CO 0.46 -0.64 1.19 0.00 -0.54 0.00 0.00 174.62 175.09 2w57 n GLN 85 N -0.05 0.12 -1.79 3.99 6.02 -1.26 -4.87 117.38 119.54 2w57 n GLN 85 Ca -0.10 0.01 -0.38 0.00 -0.01 0.00 0.00 57.00 56.51 2w57 n GLN 85 Cb 0.62 -1.54 -0.03 0.00 1.02 0.00 0.00 30.24 30.31 2w57 n GLN 85 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2w57 s HIS 86 N -3.08 1.36 0.23 1.08 2.46 -1.26 -4.92 115.29 111.16 2w57 s HIS 86 Ca 0.08 1.16 -0.31 0.00 0.47 0.00 0.00 55.06 56.45 2w57 s HIS 86 Cb 0.16 -3.84 -0.11 0.00 -0.13 0.00 0.00 32.58 28.66 2w57 s HIS 86 CO 0.76 -2.51 1.63 -1.58 -2.47 0.00 0.00 174.74 170.57 2w57 s HIS 87 N 10.49 2.89 -0.08 3.88 2.46 -1.26 -5.01 115.29 128.66 2w57 s HIS 87 Ca 0.84 0.59 -0.30 0.00 0.47 0.00 0.00 55.06 56.66 2w57 s HIS 87 Cb -0.16 -4.06 0.10 0.00 -0.13 0.00 0.00 32.58 28.34 2w57 s HIS 87 CO 0.24 -3.80 0.87 -3.38 -2.47 0.00 0.00 174.74 166.20 2w57 s HIS 88 N 0.70 -0.45 0.52 3.88 -3.43 -1.26 -4.98 115.29 110.27 2w57 s HIS 88 Ca 0.69 0.66 0.00 0.00 -0.80 0.00 0.00 55.06 55.61 2w57 s HIS 88 Cb -0.47 0.46 -0.00 0.00 -1.43 0.00 0.00 32.58 31.14 2w57 s HIS 88 CO 0.38 -0.49 0.01 -0.51 -2.00 0.00 0.00 174.74 172.13 2w57 s ASP 89 N -1.52 4.10 -0.07 7.38 1.01 0.66 -4.94 116.67 123.30 2w57 s ASP 89 Ca -0.03 -1.70 0.02 0.00 0.71 0.00 0.00 52.55 51.55 2w57 s ASP 89 Cb -0.00 0.66 0.01 0.00 1.01 0.00 0.00 42.92 44.60 2w57 s ASP 89 CO 0.01 -0.92 -0.12 -1.00 0.21 0.00 0.00 175.17 173.35 2w57 s HIS 90 N -2.92 1.45 -0.20 4.23 3.76 -0.64 -1.70 115.29 119.27 2w57 s HIS 90 Ca 0.02 -0.55 -0.04 0.00 -0.15 0.00 0.00 55.06 54.34 2w57 s HIS 90 Cb 0.00 -1.08 -0.02 0.00 1.11 0.00 0.00 32.58 32.60 2w57 s HIS 90 CO 0.01 -0.30 -0.04 -1.17 -0.85 0.00 0.00 174.74 172.40 2w57 s LEU 91 N 0.75 3.01 -0.19 0.89 0.20 0.38 -0.29 118.68 123.42 2w57 s LEU 91 Ca -0.13 -0.31 0.01 0.00 0.69 0.00 0.00 54.13 54.39 2w57 s LEU 91 Cb -0.16 -1.76 0.03 0.00 -0.43 0.00 0.00 46.19 43.88 2w57 s LEU 91 CO 0.03 0.03 -0.14 -0.69 -0.29 0.00 0.00 176.35 175.29 2w57 s VAL 92 N 1.16 1.87 -0.39 1.68 1.01 0.15 -0.50 120.40 125.38 2w57 s VAL 92 Ca 0.02 -1.03 -0.29 0.00 0.00 0.00 0.00 61.98 60.68 2w57 s VAL 92 Cb -0.14 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.42 2w57 s VAL 92 CO -0.00 0.31 1.25 0.00 0.00 0.00 0.00 175.10 176.66 2w57 h LEU 94 N 11.21 0.47 0.00 0.00 3.38 -1.45 -1.76 115.31 127.16 2w57 h LEU 94 Ca -0.25 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2w57 h LEU 94 Cb 1.08 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2w57 h LEU 94 CO 1.08 0.40 -0.12 -2.24 0.09 0.00 0.00 178.44 177.65 2w57 h ASP 95 N 0.54 0.00 -0.65 -0.43 2.03 -1.91 -3.40 116.42 112.60 2w57 h ASP 95 Ca 0.14 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.40 2w57 h ASP 95 Cb 0.05 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.52 2w57 h ASP 95 CO -0.02 0.56 0.27 0.00 -1.03 0.00 0.00 179.24 179.02 2w57 n GLY 97 N -0.99 0.49 3.92 0.00 0.00 -0.66 -5.06 105.19 102.88 2w57 n GLY 97 Ca 0.06 -0.91 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 2w57 n GLY 97 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2w57 s GLU 98 N -2.76 3.54 -0.27 1.61 0.41 -1.26 -4.97 118.70 115.01 2w57 s GLU 98 Ca 0.00 -0.28 0.03 0.00 -0.41 0.00 0.00 54.97 54.31 2w57 s GLU 98 Cb 0.00 -2.86 0.06 0.00 -1.78 0.00 0.00 34.13 29.56 2w57 s GLU 98 CO 0.00 0.43 -0.10 0.08 -0.49 0.00 0.00 175.26 175.19 2w57 s VAL 99 N -1.79 2.20 -0.16 2.63 1.01 -1.26 -2.03 120.40 121.01 2w57 s VAL 99 Ca 0.39 -1.68 -0.18 0.00 0.00 0.00 0.00 61.98 60.51 2w57 s VAL 99 Cb -0.11 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 2w57 s VAL 99 CO 0.28 -0.07 0.48 -0.63 0.00 0.00 0.00 175.10 175.16 2w57 s ILE 100 N 1.09 5.16 0.29 2.22 1.09 0.34 -4.92 121.20 126.48 2w57 s ILE 100 Ca -0.08 0.92 -0.25 0.00 -1.10 0.00 0.00 60.65 60.14 2w57 s ILE 100 Cb -0.20 -3.81 -0.09 0.00 -1.06 0.00 0.00 42.46 37.29 2w57 s ILE 100 CO -0.05 0.26 0.89 -1.61 -0.10 0.00 0.00 174.94 174.33 2w57 s GLU 101 N 1.08 4.54 0.13 2.79 2.02 -1.26 -0.47 118.70 127.52 2w57 s GLU 101 Ca 0.24 1.24 -0.12 0.00 0.02 0.00 0.00 54.97 56.35 2w57 s GLU 101 Cb -0.15 -2.87 0.01 0.00 0.10 0.00 0.00 34.13 31.23 2w57 s GLU 101 CO 0.10 0.33 0.31 -0.59 0.02 0.00 0.00 175.26 175.43 2w57 s PHE 102 N -1.55 0.06 -0.07 1.61 -0.71 -0.69 -4.94 117.98 111.69 2w57 s PHE 102 Ca 0.48 -0.43 -0.04 0.00 -1.04 0.00 0.00 56.93 55.90 2w57 s PHE 102 Cb -0.19 0.09 0.04 0.00 -1.21 0.00 0.00 43.02 41.75 2w57 s PHE 102 CO 0.24 -0.67 0.17 0.45 -1.34 0.00 0.00 175.22 174.06 2w57 s SER 103 N -2.87 -0.15 -0.15 1.98 0.15 -1.26 -0.24 113.70 111.16 2w57 s SER 103 Ca 0.07 0.35 -0.00 0.00 0.70 0.00 0.00 55.95 57.07 2w57 s SER 103 Cb 0.03 0.25 0.04 0.00 -1.71 0.00 0.00 66.02 64.63 2w57 s SER 103 CO -0.08 -0.14 -0.06 -0.62 1.20 0.00 0.00 173.24 173.54 2w57 s ASP 104 N 1.04 2.66 0.18 5.45 2.15 -1.26 -5.03 116.67 121.85 2w57 s ASP 104 Ca -0.08 -0.56 -0.16 0.00 0.43 0.00 0.00 52.55 52.17 2w57 s ASP 104 Cb -0.10 -0.91 0.14 0.00 -0.30 0.00 0.00 42.92 41.75 2w57 s ASP 104 CO -0.06 -0.16 1.65 0.44 -0.17 0.00 0.00 175.17 176.87 2w57 h ASP 105 N 8.13 -0.51 0.42 -0.34 3.32 -2.01 -1.52 116.42 123.92 2w57 h ASP 105 Ca -0.26 0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 2w57 h ASP 105 Cb 1.12 0.32 -0.01 0.00 0.22 0.00 0.00 39.33 40.98 2w57 h ASP 105 CO 0.41 -0.18 -0.27 0.58 -1.72 0.00 0.00 179.24 178.06 2w57 h VAL 106 N -0.03 0.44 -0.41 -1.35 2.07 -1.98 0.47 116.25 115.46 2w57 h VAL 106 Ca 0.23 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.83 2w57 h VAL 106 Cb 0.38 0.44 -0.09 0.00 -1.52 0.00 0.00 31.29 30.50 2w57 h VAL 106 CO -0.50 0.00 -0.18 0.40 0.02 0.00 0.00 177.57 177.31 2w57 h ILE 107 N -0.66 0.45 -0.82 4.57 2.04 -1.93 0.17 117.51 121.32 2w57 h ILE 107 Ca -0.04 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.89 2w57 h ILE 107 Cb 0.55 0.45 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 2w57 h ILE 107 CO 0.04 0.00 0.54 -0.33 0.00 0.00 0.00 178.15 178.40 2w57 h GLU 108 N -0.09 0.83 -0.14 2.37 4.39 -0.99 -0.43 114.58 120.52 2w57 h GLU 108 Ca 0.20 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.76 2w57 h GLU 108 Cb 0.40 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2w57 h GLU 108 CO -0.47 0.55 -0.26 0.37 -1.16 0.00 0.00 179.01 178.04 2w57 h GLN 109 N 0.86 0.43 -0.85 2.33 5.75 -0.08 -3.04 115.11 120.50 2w57 h GLN 109 Ca 0.36 -0.27 -0.02 0.00 -0.15 0.00 0.00 58.65 58.58 2w57 h GLN 109 Cb 0.30 0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.84 2w57 h GLN 109 CO -0.14 0.87 0.47 0.00 -2.65 0.00 0.00 178.83 177.38 2w57 h ARG 110 N 0.04 1.19 -0.63 1.69 2.47 -0.26 -2.14 114.38 116.73 2w57 h ARG 110 Ca 0.01 -0.14 0.01 0.00 -1.26 0.00 0.00 59.98 58.60 2w57 h ARG 110 Cb 0.85 -0.23 -0.03 0.00 -1.65 0.00 0.00 29.97 28.90 2w57 h ARG 110 CO 0.06 0.87 0.41 1.96 0.56 0.00 0.00 179.97 183.83 2w57 h GLN 111 N 1.19 0.82 -0.72 0.04 4.20 -1.14 -1.23 115.11 118.27 2w57 h GLN 111 Ca 0.30 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.93 2w57 h GLN 111 Cb 0.02 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 2w57 h GLN 111 CO -0.05 0.54 0.33 0.87 -0.67 0.00 0.00 178.83 179.86 2w57 h LYS 112 N 0.84 1.05 -0.57 1.46 1.57 -1.34 -2.52 116.57 117.06 2w57 h LYS 112 Ca 0.24 -0.16 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 2w57 h LYS 112 Cb -0.07 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.03 2w57 h LYS 112 CO -0.06 0.83 0.00 0.93 -0.57 0.00 0.00 179.45 180.58 2w57 h GLU 113 N 1.02 0.99 -0.27 3.15 5.08 -0.97 -2.13 114.58 121.44 2w57 h GLU 113 Ca 0.25 -0.30 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 2w57 h GLU 113 Cb 0.14 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2w57 h GLU 113 CO -0.03 0.97 0.03 0.82 -1.00 0.00 0.00 179.01 179.80 2w57 h ILE 114 N 0.91 1.24 -0.52 3.13 2.04 -1.04 -1.52 117.51 121.76 2w57 h ILE 114 Ca 0.17 -0.84 -0.09 0.00 1.00 0.00 0.00 64.86 65.09 2w57 h ILE 114 Cb 0.53 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 2w57 h ILE 114 CO 0.03 0.27 -0.04 0.00 0.00 0.00 0.00 178.15 178.41 2w57 h ALA 115 N 0.85 0.70 -0.52 1.87 0.00 -1.45 -2.73 119.26 117.98 2w57 h ALA 115 Ca 0.08 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 54.72 2w57 h ALA 115 Cb 0.37 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2w57 h ALA 115 CO 0.01 0.55 0.27 0.00 0.00 0.00 0.00 179.25 180.08 2w57 h ALA 116 N 0.93 0.67 -0.06 0.00 0.00 -1.35 0.24 119.26 119.69 2w57 h ALA 116 Ca 0.14 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.09 2w57 h ALA 116 Cb 0.58 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2w57 h ALA 116 CO 0.03 -0.07 0.12 -0.22 0.00 0.00 0.00 179.25 179.12 2w57 h LYS 117 N 0.53 0.00 -0.14 0.00 3.64 -0.97 -1.25 116.57 118.37 2w57 h LYS 117 Ca 0.23 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 2w57 h LYS 117 Cb 0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2w57 h LYS 117 CO -0.15 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.69 2w57 n TYR 118 N -3.41 0.35 -3.75 1.91 4.01 -0.67 -4.99 117.16 110.62 2w57 n TYR 118 Ca -0.01 -0.76 -0.26 0.00 -0.16 0.00 0.00 57.90 56.70 2w57 n TYR 118 Cb 0.21 -0.15 0.05 0.00 -0.31 0.00 0.00 39.34 39.13 2w57 n TYR 118 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2w57 n ASN 119 N -0.61 -4.45 -4.53 7.72 3.02 -0.14 -4.99 115.26 111.29 2w57 n ASN 119 Ca 0.13 -0.70 -0.34 0.00 -0.03 0.00 0.00 54.58 53.64 2w57 n ASN 119 Cb 0.59 -4.36 -0.12 0.00 -0.61 0.00 0.00 39.78 35.28 2w57 n ASN 119 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2w57 s VAL 120 N -3.37 4.00 -0.41 2.41 1.01 0.67 -5.01 120.40 119.70 2w57 s VAL 120 Ca 0.48 -0.32 -0.23 0.00 0.00 0.00 0.00 61.98 61.91 2w57 s VAL 120 Cb -0.23 -2.75 0.02 0.00 0.00 0.00 0.00 36.38 33.42 2w57 s VAL 120 CO 0.79 0.50 0.76 -1.10 0.00 0.00 0.00 175.10 176.05 2w57 s GLN 121 N 0.24 3.56 0.26 2.72 1.11 -1.26 -3.95 119.66 122.33 2w57 s GLN 121 Ca -0.02 0.06 -0.31 0.00 0.01 0.00 0.00 55.36 55.10 2w57 s GLN 121 Cb -0.14 -3.88 -0.11 0.00 -1.01 0.00 0.00 33.01 27.87 2w57 s GLN 121 CO 0.03 -0.97 1.63 -0.51 0.01 0.00 0.00 175.29 175.48 2w57 s LEU 122 N 3.14 4.36 -0.22 2.90 1.43 -1.26 -4.91 118.68 124.12 2w57 s LEU 122 Ca 0.30 2.90 -0.02 0.00 -1.03 0.00 0.00 54.13 56.27 2w57 s LEU 122 Cb -0.13 -3.62 -0.13 0.00 0.03 0.00 0.00 46.19 42.34 2w57 s LEU 122 CO 0.20 -0.93 -0.22 0.35 0.23 0.00 0.00 176.35 175.98 2w57 n THR 123 N 2.90 1.25 -3.70 5.49 -2.24 -1.26 -5.10 114.28 111.62 2w57 n THR 123 Ca 0.11 -0.43 -0.03 0.00 -2.27 0.00 0.00 64.05 61.43 2w57 n THR 123 Cb 0.37 -1.42 0.02 0.00 -2.10 0.00 0.00 70.33 67.19 2w57 n THR 123 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2w57 n ASN 124 N -3.39 -1.34 -3.54 3.42 6.94 -1.26 -5.20 115.26 110.89 2w57 n ASN 124 Ca -0.40 -1.78 -0.14 0.00 -0.02 0.00 0.00 54.58 52.23 2w57 n ASN 124 Cb 0.88 2.20 -0.05 0.00 -2.36 0.00 0.00 39.78 40.46 2w57 n ASN 124 CO 0.00 0.00 0.00 -1.38 -1.03 0.00 0.00 177.26 174.85 2w57 s HIS 125 N -3.54 -0.51 0.01 -2.53 -3.43 -1.26 -5.17 115.29 98.87 2w57 s HIS 125 Ca 0.15 0.80 0.07 0.00 -0.80 0.00 0.00 55.06 55.28 2w57 s HIS 125 Cb -0.02 0.45 -0.02 0.00 -1.43 0.00 0.00 32.58 31.55 2w57 s HIS 125 CO 0.05 -0.51 -0.22 -1.54 -2.00 0.00 0.00 174.74 170.53 2w57 s SER 126 N -1.36 2.56 -0.23 7.38 1.04 -1.26 -5.08 113.70 116.76 2w57 s SER 126 Ca -0.05 -0.46 -0.03 0.00 0.48 0.00 0.00 55.95 55.89 2w57 s SER 126 Cb -0.00 -0.25 0.07 0.00 0.10 0.00 0.00 66.02 65.94 2w57 s SER 126 CO 0.04 0.23 0.07 -0.22 0.98 0.00 0.00 173.24 174.33 2w57 s LEU 127 N -0.82 1.15 -0.25 2.42 2.96 -1.26 -5.11 118.68 117.77 2w57 s LEU 127 Ca 0.08 -1.01 -0.04 0.00 -0.22 0.00 0.00 54.13 52.93 2w57 s LEU 127 Cb -0.09 -0.55 0.00 0.00 0.50 0.00 0.00 46.19 46.05 2w57 s LEU 127 CO 0.00 -0.35 -0.01 -0.31 -1.32 0.00 0.00 176.35 174.36 2w57 s TYR 128 N 1.89 3.04 -0.22 5.38 2.02 -1.26 -1.61 117.35 126.60 2w57 s TYR 128 Ca 0.03 -1.06 -0.10 0.00 -0.37 0.00 0.00 57.07 55.57 2w57 s TYR 128 Cb -0.17 -2.14 -0.05 0.00 -0.40 0.00 0.00 41.96 39.20 2w57 s TYR 128 CO -0.16 -0.59 0.13 -0.51 -1.57 0.00 0.00 175.55 172.85 2w57 s LEU 129 N 1.46 4.04 0.02 -1.29 1.43 0.60 -5.01 118.68 119.92 2w57 s LEU 129 Ca 0.04 0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.27 2w57 s LEU 129 Cb -0.16 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.97 2w57 s LEU 129 CO -0.02 0.11 0.01 -0.31 0.23 0.00 0.00 176.35 176.38 2w57 s TYR 130 N 0.77 3.08 0.24 0.29 2.02 -1.26 0.30 117.35 122.79 2w57 s TYR 130 Ca 0.07 0.07 -0.16 0.00 -0.37 0.00 0.00 57.07 56.68 2w57 s TYR 130 Cb -0.13 -1.65 0.06 0.00 -0.40 0.00 0.00 41.96 39.84 2w57 s TYR 130 CO 0.02 0.47 0.81 0.41 -1.57 0.00 0.00 175.55 175.70 2w57 n GLY 131 N 1.19 0.87 3.81 0.71 0.00 -0.63 -4.92 105.19 106.22 2w57 n GLY 131 Ca -0.13 -1.17 -0.34 0.00 0.00 0.00 0.00 46.02 44.38 2w57 n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w57 s LYS 132 N -2.06 3.21 0.00 1.61 1.02 -1.26 -1.12 119.74 121.14 2w57 s LYS 132 Ca 0.17 -0.36 0.00 0.00 0.02 0.00 0.00 55.97 55.81 2w57 s LYS 132 Cb -0.03 -2.97 0.00 0.00 -0.52 0.00 0.00 37.83 34.31 2w57 s LYS 132 CO 0.07 0.69 0.26 0.00 -0.92 0.00 0.00 175.35 175.45