#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i51 s THR 26 N 0.00 0.11 0.07 0.00 -4.23 -1.26 -5.13 115.64 105.20 3i51 s THR 26 Ca 0.00 -0.87 0.03 0.00 -1.18 0.00 0.00 61.69 59.67 3i51 s THR 26 Cb 0.00 -0.27 -0.03 0.00 1.34 0.00 0.00 72.50 73.54 3i51 s THR 26 CO 0.00 -0.48 -0.09 0.00 -0.54 0.00 0.00 174.62 173.51 3i51 s ALA 27 N -1.42 0.91 -0.37 3.99 0.00 -1.26 -5.05 121.76 118.55 3i51 s ALA 27 Ca -0.16 -1.04 0.07 0.00 0.00 0.00 0.00 51.96 50.83 3i51 s ALA 27 Cb -0.10 0.04 0.61 0.00 0.00 0.00 0.00 23.12 23.67 3i51 s ALA 27 CO -0.01 -0.04 1.67 -0.25 0.00 0.00 0.00 175.76 177.13 3i51 n ASP 28 N 0.86 4.17 -4.73 0.00 10.43 -1.26 -4.99 116.55 121.03 3i51 n ASP 28 Ca -0.18 -3.11 -0.41 0.00 2.57 0.00 0.00 54.79 53.65 3i51 n ASP 28 Cb 0.57 -0.73 -0.03 0.00 1.84 0.00 0.00 41.12 42.76 3i51 n ASP 28 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 3i51 s THR 29 N -2.63 3.92 0.69 -3.53 2.01 -1.26 -5.03 115.64 109.80 3i51 s THR 29 Ca 0.47 1.50 -0.13 0.00 0.31 0.00 0.00 61.69 63.84 3i51 s THR 29 Cb 0.38 -3.96 0.01 0.00 0.01 0.00 0.00 72.50 68.94 3i51 s THR 29 CO 0.11 0.19 1.09 -0.94 -0.69 0.00 0.00 174.62 174.37 3i51 s SER 30 N 0.49 5.09 0.32 3.53 1.04 -1.26 -4.87 113.70 118.03 3i51 s SER 30 Ca 0.54 1.85 0.05 0.00 0.48 0.00 0.00 55.95 58.88 3i51 s SER 30 Cb -0.30 -2.53 0.69 0.00 0.10 0.00 0.00 66.02 63.98 3i51 s SER 30 CO 0.33 -1.64 1.84 -0.65 0.98 0.00 0.00 173.24 174.09 3i51 h PRO 31 N -0.36 0.81 -0.21 4.02 0.11 -1.99 -0.91 132.00 133.47 3i51 h PRO 31 Ca -0.45 -0.05 -0.18 0.00 0.11 0.00 0.00 66.00 65.42 3i51 h PRO 31 Cb 1.23 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 3i51 h PRO 31 CO 0.54 0.54 -0.61 1.05 -0.21 0.00 0.00 178.00 179.31 3i51 h GLU 32 N 0.84 0.71 -0.24 1.05 9.09 -1.99 0.18 114.58 124.22 3i51 h GLU 32 Ca 0.49 -0.49 -0.03 0.00 0.05 0.00 0.00 59.36 59.39 3i51 h GLU 32 Cb 0.66 0.07 -0.01 0.00 -1.65 0.00 0.00 28.75 27.82 3i51 h GLU 32 CO -0.26 1.11 0.02 -0.09 0.05 0.00 0.00 179.01 179.84 3i51 h ARG 33 N 0.53 0.40 -0.07 1.06 2.43 -1.88 -2.26 114.38 114.59 3i51 h ARG 33 Ca -0.00 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3i51 h ARG 33 Cb 1.20 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 3i51 h ARG 33 CO 0.12 0.56 0.04 1.25 -1.51 0.00 0.00 179.97 180.43 3i51 h LEU 34 N 0.19 0.07 -0.85 3.80 5.85 -1.08 -1.23 115.31 122.07 3i51 h LEU 34 Ca 0.07 -0.00 0.20 0.00 0.84 0.00 0.00 57.88 58.99 3i51 h LEU 34 Cb 0.36 -0.02 -0.12 0.00 0.37 0.00 0.00 40.66 41.25 3i51 h LEU 34 CO 0.01 0.05 0.30 0.00 -0.34 0.00 0.00 178.44 178.46 3i51 h ALA 35 N 1.03 1.26 -0.13 1.25 0.00 -0.62 0.44 119.26 122.49 3i51 h ALA 35 Ca 0.03 0.18 -0.19 0.00 0.00 0.00 0.00 54.91 54.93 3i51 h ALA 35 Cb -0.01 0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.00 3i51 h ALA 35 CO -0.01 -0.36 -0.65 0.00 0.00 0.00 0.00 179.25 178.22 3i51 h ALA 36 N 1.69 0.25 -0.04 0.00 0.00 -1.01 0.10 119.26 120.26 3i51 h ALA 36 Ca 0.51 -0.56 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3i51 h ALA 36 Cb 0.96 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 3i51 h ALA 36 CO -0.55 0.54 0.01 0.82 0.00 0.00 0.00 179.25 180.08 3i51 h ILE 37 N 0.35 1.17 -0.41 0.00 2.04 -0.86 -2.68 117.51 117.12 3i51 h ILE 37 Ca -0.05 -0.52 0.03 0.00 1.00 0.00 0.00 64.86 65.32 3i51 h ILE 37 Cb 1.29 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 38.79 3i51 h ILE 37 CO 0.14 0.14 0.22 0.00 0.00 0.00 0.00 178.15 178.64 3i51 h ALA 38 N 0.81 0.51 -0.15 1.87 0.00 -0.86 -0.09 119.26 121.35 3i51 h ALA 38 Ca 0.01 0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3i51 h ALA 38 Cb 0.22 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 3i51 h ALA 38 CO -0.00 -0.13 -0.12 -0.22 0.00 0.00 0.00 179.25 178.78 3i51 h LYS 39 N 0.44 -0.12 0.00 0.00 3.64 -0.81 0.49 116.57 120.21 3i51 h LYS 39 Ca 0.17 0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 3i51 h LYS 39 Cb 0.06 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 3i51 h LYS 39 CO -0.11 -0.08 -0.48 0.38 -2.27 0.00 0.00 179.45 176.90 3i51 h ASP 40 N -0.12 0.00 0.03 4.20 -0.00 -1.27 -0.66 116.42 118.59 3i51 h ASP 40 Ca 0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 57.03 57.13 3i51 h ASP 40 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.60 3i51 h ASP 40 CO -0.23 0.48 -0.01 0.00 -0.00 0.00 0.00 179.24 179.47 3i51 h ALA 41 N 1.52 -0.03 -0.39 4.15 0.00 -0.72 -0.35 119.26 123.44 3i51 h ALA 41 Ca -0.00 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 3i51 h ALA 41 Cb 1.22 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3i51 h ALA 41 CO 0.06 -0.35 -0.27 -0.07 0.00 0.00 0.00 179.25 178.62 3i51 h LEU 42 N -0.38 0.85 -0.51 0.00 3.38 -0.97 -1.95 115.31 115.72 3i51 h LEU 42 Ca -0.00 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.65 3i51 h LEU 42 Cb 0.36 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3i51 h LEU 42 CO 0.01 1.07 0.32 1.23 0.09 0.00 0.00 178.44 181.15 3i51 h GLY 43 N 0.93 0.72 0.95 0.83 0.00 -1.11 0.41 103.07 105.80 3i51 h GLY 43 Ca 0.08 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 3i51 h GLY 43 CO 0.07 0.21 0.17 0.00 0.00 0.00 0.00 176.54 176.99 3i51 h ALA 44 N 1.22 0.43 -0.41 3.60 0.00 -0.88 0.15 119.26 123.37 3i51 h ALA 44 Ca 0.20 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3i51 h ALA 44 Cb -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3i51 h ALA 44 CO -0.08 -0.03 -0.02 -0.07 0.00 0.00 0.00 179.25 179.05 3i51 h LEU 45 N 0.40 0.73 -0.74 0.00 4.07 -1.10 -0.97 115.31 117.70 3i51 h LEU 45 Ca 0.11 -0.32 0.01 0.00 0.08 0.00 0.00 57.88 57.76 3i51 h LEU 45 Cb 0.10 -0.20 -0.04 0.00 1.08 0.00 0.00 40.66 41.60 3i51 h LEU 45 CO -0.02 0.88 0.49 0.78 -1.08 0.00 0.00 178.44 179.49 3i51 h ASN 46 N 0.57 0.85 -1.00 -0.43 4.21 -0.70 -2.17 115.58 116.91 3i51 h ASN 46 Ca 0.11 -0.03 0.13 0.00 1.21 0.00 0.00 56.30 57.73 3i51 h ASN 46 Cb 0.51 -0.21 -0.09 0.00 -1.12 0.00 0.00 38.32 37.41 3i51 h ASN 46 CO 0.03 0.63 0.63 0.44 -1.29 0.00 0.00 177.43 177.86 3i51 h ASP 47 N 1.00 0.91 -0.35 5.81 3.45 -0.30 -1.31 116.42 125.63 3i51 h ASP 47 Ca 0.27 0.05 -0.05 0.00 0.43 0.00 0.00 57.03 57.74 3i51 h ASP 47 Cb -0.11 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 38.52 3i51 h ASP 47 CO -0.06 0.47 0.04 0.58 -1.57 0.00 0.00 179.24 178.70 3i51 h VAL 48 N 0.97 1.24 -0.41 -1.35 2.07 -0.74 0.29 116.25 118.33 3i51 h VAL 48 Ca 0.51 -0.88 0.07 0.00 0.82 0.00 0.00 66.70 67.22 3i51 h VAL 48 Cb 0.54 1.14 -0.07 0.00 -1.52 0.00 0.00 31.29 31.38 3i51 h VAL 48 CO -0.28 0.29 0.01 0.40 0.02 0.00 0.00 177.57 178.01 3i51 h ILE 49 N 0.42 0.70 -0.35 4.57 2.04 -1.07 -1.62 117.51 122.20 3i51 h ILE 49 Ca 0.10 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 3i51 h ILE 49 Cb 0.39 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 3i51 h ILE 49 CO 0.01 0.02 0.16 -0.07 0.00 0.00 0.00 178.15 178.28 3i51 h LEU 50 N 0.12 0.47 -0.68 1.44 3.38 -1.08 -0.35 115.31 118.61 3i51 h LEU 50 Ca 0.20 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 3i51 h LEU 50 Cb 0.28 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3i51 h LEU 50 CO -0.33 0.47 0.39 0.50 0.09 0.00 0.00 178.44 179.56 3i51 h LYS 51 N 0.43 0.93 -0.01 1.13 3.64 -0.75 -2.96 116.57 118.98 3i51 h LYS 51 Ca 0.12 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3i51 h LYS 51 Cb 0.13 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3i51 h LYS 51 CO -0.01 0.69 -0.38 0.72 -2.27 0.00 0.00 179.45 178.20 3i51 n HIS 52 N -4.53 0.00 -3.62 1.91 8.25 -0.63 -4.96 115.22 111.65 3i51 n HIS 52 Ca 0.05 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.30 3i51 n HIS 52 Cb 0.08 -0.07 0.06 0.00 1.12 0.00 0.00 29.99 31.17 3i51 n HIS 52 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i51 n GLY 53 N 1.38 -0.36 3.68 -1.41 0.00 -0.22 -4.90 105.19 103.36 3i51 n GLY 53 Ca 0.11 0.14 -0.45 0.00 0.00 0.00 0.00 46.02 45.81 3i51 n GLY 53 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3i51 n VAL 54 N -4.34 0.60 -3.12 1.61 0.31 -0.73 -4.97 118.33 107.70 3i51 n VAL 54 Ca -0.23 -0.15 -0.23 0.00 -0.01 0.00 0.00 64.34 63.72 3i51 n VAL 54 Cb 0.65 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.02 3i51 n VAL 54 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3i51 s THR 55 N 0.32 4.24 0.18 2.52 -4.23 -1.26 -4.94 115.64 112.47 3i51 s THR 55 Ca 0.72 -0.54 -0.13 0.00 -1.18 0.00 0.00 61.69 60.56 3i51 s THR 55 Cb -0.64 -3.55 0.08 0.00 1.34 0.00 0.00 72.50 69.72 3i51 s THR 55 CO 0.45 -0.37 1.80 1.88 -0.54 0.00 0.00 174.62 177.84 3i51 h TYR 56 N 0.52 0.53 -0.58 3.99 -1.99 -1.98 0.11 116.97 117.56 3i51 h TYR 56 Ca -0.47 0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.32 3i51 h TYR 56 Cb 1.25 -0.16 -0.03 0.00 2.00 0.00 0.00 36.73 39.78 3i51 h TYR 56 CO 0.46 0.28 0.38 -1.35 -0.00 0.00 0.00 178.16 177.93 3i51 h PRO 57 N 0.56 0.64 -0.46 4.88 0.11 -1.99 -0.88 132.00 134.85 3i51 h PRO 57 Ca 0.22 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.22 3i51 h PRO 57 Cb 0.09 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 3i51 h PRO 57 CO -0.13 0.42 -0.00 0.93 -0.21 0.00 0.00 178.00 179.01 3i51 h GLU 58 N 0.66 0.82 -0.62 1.05 5.08 -1.84 -1.94 114.58 117.79 3i51 h GLU 58 Ca 0.23 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3i51 h GLU 58 Cb 0.11 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 3i51 h GLU 58 CO -0.06 0.88 0.33 -0.92 -1.00 0.00 0.00 179.01 178.23 3i51 h TYR 59 N 0.67 0.86 -0.89 4.33 3.20 -0.37 0.67 116.97 125.43 3i51 h TYR 59 Ca 0.13 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 3i51 h TYR 59 Cb 0.51 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 3i51 h TYR 59 CO 0.04 0.63 0.52 0.00 -1.64 0.00 0.00 178.16 177.71 3i51 h ARG 60 N 0.84 1.23 -0.38 1.82 3.08 -0.98 -1.29 114.38 118.69 3i51 h ARG 60 Ca 0.22 -0.12 -0.14 0.00 0.07 0.00 0.00 59.98 60.00 3i51 h ARG 60 Cb 0.07 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 3i51 h ARG 60 CO -0.03 0.87 -0.31 0.28 -1.07 0.00 0.00 179.97 179.71 3i51 h VAL 61 N 1.24 1.28 -0.87 2.04 2.07 -0.69 -2.04 116.25 119.28 3i51 h VAL 61 Ca 0.32 -1.48 0.04 0.00 0.82 0.00 0.00 66.70 66.40 3i51 h VAL 61 Cb -0.02 1.37 -0.06 0.00 -1.52 0.00 0.00 31.29 31.07 3i51 h VAL 61 CO -0.06 0.49 0.55 0.15 0.02 0.00 0.00 177.57 178.73 3i51 h PHE 62 N 0.69 1.03 -0.20 1.57 -0.00 -0.51 0.35 116.94 119.87 3i51 h PHE 62 Ca 0.07 0.03 -0.05 0.00 -0.00 0.00 0.00 57.97 58.02 3i51 h PHE 62 Cb 0.90 -0.34 -0.01 0.00 -0.00 0.00 0.00 35.95 36.50 3i51 h PHE 62 CO 0.06 0.56 -0.07 -0.22 -0.00 0.00 0.00 178.31 178.65 3i51 h LYS 63 N 1.04 0.40 -0.57 1.11 3.64 -1.14 -0.56 116.57 120.49 3i51 h LYS 63 Ca 0.36 -0.16 -0.06 0.00 -1.27 0.00 0.00 60.65 59.52 3i51 h LYS 63 Cb 0.07 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 3i51 h LYS 63 CO -0.14 0.67 0.13 0.37 -2.27 0.00 0.00 179.45 178.21 3i51 h GLN 64 N 0.12 0.88 -0.45 1.90 5.75 -0.99 -2.09 115.11 120.24 3i51 h GLN 64 Ca 0.05 -0.19 -0.14 0.00 -0.15 0.00 0.00 58.65 58.22 3i51 h GLN 64 Cb 0.53 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.94 3i51 h GLN 64 CO 0.02 0.80 -0.26 2.35 -2.65 0.00 0.00 178.83 179.09 3i51 h TRP 65 N 0.85 1.11 -0.60 3.99 7.01 -0.72 -0.38 115.95 127.21 3i51 h TRP 65 Ca 0.18 -0.28 0.01 0.00 2.11 0.00 0.00 58.89 60.91 3i51 h TRP 65 Cb 0.32 -0.25 -0.03 0.00 -2.10 0.00 0.00 29.16 27.10 3i51 h TRP 65 CO 0.02 1.10 0.38 -0.07 -2.79 0.00 0.00 178.44 177.09 3i51 h LEU 66 N 0.81 0.65 -0.29 0.65 3.38 -0.83 -0.11 115.31 119.59 3i51 h LEU 66 Ca 0.10 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.09 3i51 h LEU 66 Cb 0.84 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 3i51 h LEU 66 CO 0.07 0.46 0.07 0.40 0.09 0.00 0.00 178.44 179.54 3i51 h ILE 67 N 0.78 0.89 -0.81 1.22 2.04 -1.08 -2.75 117.51 117.79 3i51 h ILE 67 Ca 0.23 -0.06 0.04 0.00 1.00 0.00 0.00 64.86 66.06 3i51 h ILE 67 Cb -0.05 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 36.67 3i51 h ILE 67 CO -0.07 0.03 0.51 0.44 0.00 0.00 0.00 178.15 179.07 3i51 h ASP 68 N 0.19 0.84 -0.25 1.72 3.32 -0.81 -0.59 116.42 120.83 3i51 h ASP 68 Ca 0.13 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.24 3i51 h ASP 68 Cb 0.12 -0.18 -0.06 0.00 0.22 0.00 0.00 39.33 39.43 3i51 h ASP 68 CO -0.16 0.57 -0.16 0.58 -1.72 0.00 0.00 179.24 178.35 3i51 h VAL 69 N 0.98 0.53 -0.39 -1.35 2.07 -0.74 0.90 116.25 118.26 3i51 h VAL 69 Ca 0.33 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.82 3i51 h VAL 69 Cb 0.06 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 3i51 h VAL 69 CO -0.13 0.00 0.10 1.23 0.02 0.00 0.00 177.57 178.79 3i51 h GLY 70 N -0.15 0.66 1.49 2.17 0.00 -1.23 -1.73 103.07 104.29 3i51 h GLY 70 Ca 0.14 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 3i51 h GLY 70 CO -0.34 0.39 0.21 0.83 0.00 0.00 0.00 176.54 177.63 3i51 h GLU 71 N 0.48 0.67 -0.07 4.80 5.08 -0.82 -2.05 114.58 122.68 3i51 h GLU 71 Ca 0.12 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3i51 h GLU 71 Cb 0.30 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3i51 h GLU 71 CO 0.00 0.54 0.00 0.41 -1.00 0.00 0.00 179.01 178.96 3i51 n GLY 72 N -1.19 -0.52 2.36 -3.84 0.00 0.28 -4.93 105.19 97.36 3i51 n GLY 72 Ca 0.04 -0.22 -0.18 0.00 0.00 0.00 0.00 46.02 45.66 3i51 n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i51 n GLY 73 N 0.90 -0.21 1.55 -0.02 0.00 -0.77 -4.92 105.19 101.72 3i51 n GLY 73 Ca 0.14 -0.12 0.09 0.00 0.00 0.00 0.00 46.02 46.13 3i51 n GLY 73 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i51 n GLU 74 N -2.72 3.74 -0.13 1.61 1.02 -0.68 -4.50 120.64 118.97 3i51 n GLU 74 Ca -0.21 -2.88 -0.09 0.00 -0.02 0.00 0.00 57.16 53.95 3i51 n GLU 74 Cb 0.66 -1.89 -0.01 0.00 -0.02 0.00 0.00 31.44 30.18 3i51 n GLU 74 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 3i51 h TRP 75 N 3.94 0.63 -0.66 -0.32 4.06 -1.91 0.33 115.95 122.02 3i51 h TRP 75 Ca 0.00 -0.07 0.05 0.00 2.06 0.00 0.00 58.89 60.93 3i51 h TRP 75 Cb 1.46 -0.18 -0.05 0.00 -1.00 0.00 0.00 29.16 29.38 3i51 h TRP 75 CO 0.76 0.60 0.39 -1.35 -3.56 0.00 0.00 178.44 175.27 3i51 h PRO 76 N 0.49 0.71 0.47 0.49 0.11 -1.97 -0.95 132.00 131.35 3i51 h PRO 76 Ca 0.13 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.17 3i51 h PRO 76 Cb 0.27 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.22 3i51 h PRO 76 CO -0.00 0.47 -0.23 1.25 -0.21 0.00 0.00 178.00 179.28 3i51 h LEU 77 N 0.74 -0.53 -0.58 2.35 5.85 -1.81 -1.82 115.31 119.50 3i51 h LEU 77 Ca 0.29 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.00 3i51 h LEU 77 Cb 0.12 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 3i51 h LEU 77 CO -0.15 -0.33 0.39 0.15 -0.34 0.00 0.00 178.44 178.16 3i51 h PHE 78 N -0.70 0.73 -0.26 1.25 3.04 -0.77 0.02 116.94 120.25 3i51 h PHE 78 Ca -0.06 0.02 -0.08 0.00 3.98 0.00 0.00 57.97 61.82 3i51 h PHE 78 Cb 0.52 -0.25 -0.01 0.00 2.56 0.00 0.00 35.95 38.77 3i51 h PHE 78 CO -0.03 0.46 -0.16 -0.07 -2.02 0.00 0.00 178.31 176.50 3i51 h LEU 79 N 0.79 0.59 -1.37 0.59 3.38 -1.18 -0.87 115.31 117.24 3i51 h LEU 79 Ca 0.21 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 3i51 h LEU 79 Cb -0.09 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3i51 h LEU 79 CO -0.05 0.89 0.05 0.44 0.09 0.00 0.00 178.44 179.86 3i51 h ASP 80 N 0.29 0.44 0.03 -0.43 3.32 -1.08 0.41 116.42 119.39 3i51 h ASP 80 Ca 0.05 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 3i51 h ASP 80 Cb 0.68 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.12 3i51 h ASP 80 CO 0.04 0.47 -0.01 0.58 -1.72 0.00 0.00 179.24 178.60 3i51 h VAL 81 N 0.47 1.27 0.00 -1.35 2.07 -0.82 -3.34 116.25 114.56 3i51 h VAL 81 Ca 0.11 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.68 3i51 h VAL 81 Cb 0.22 1.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 3i51 h VAL 81 CO 0.00 0.24 -0.96 0.49 0.02 0.00 0.00 177.57 177.36 3i51 n PHE 82 N -4.91 0.00 0.00 1.57 3.72 -0.35 -4.24 117.46 113.25 3i51 n PHE 82 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 3i51 n PHE 82 Cb 0.22 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 3i51 n PHE 82 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3i51 n ILE 83 N -1.51 0.00 -0.35 4.37 2.08 0.13 -4.86 119.36 119.22 3i51 n ILE 83 Ca 0.02 0.00 0.12 0.00 0.56 0.00 0.00 62.75 63.45 3i51 n ILE 83 Cb 0.30 -0.54 0.31 0.00 -0.75 0.00 0.00 39.64 38.96 3i51 n ILE 83 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 3i51 h GLU 84 N 0.00 0.78 -0.79 0.38 4.81 -1.33 -0.91 114.58 117.52 3i51 h GLU 84 Ca 0.00 -0.05 0.18 0.00 -0.13 0.00 0.00 59.36 59.36 3i51 h GLU 84 Cb 0.72 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.87 3i51 h GLU 84 CO 0.00 0.52 0.54 1.12 -0.73 0.00 0.00 179.01 180.45 3i51 h HIS 85 N 0.80 0.40 -0.00 0.92 2.07 -1.82 0.22 115.15 117.75 3i51 h HIS 85 Ca 0.56 0.01 -0.20 0.00 -2.85 0.00 0.00 60.37 57.89 3i51 h HIS 85 Cb 0.82 -0.12 -0.01 0.00 2.57 0.00 0.00 27.41 30.67 3i51 h HIS 85 CO -0.00 0.13 -0.87 0.77 -3.07 0.00 0.00 177.93 174.88 3i51 h SER 86 N 0.32 0.31 -0.30 3.10 0.02 -1.51 -1.33 113.55 114.16 3i51 h SER 86 Ca 0.40 -0.24 -0.17 0.00 -0.84 0.00 0.00 61.79 60.94 3i51 h SER 86 Cb 1.06 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.51 3i51 h SER 86 CO -0.11 1.04 -0.45 0.58 -1.14 0.00 0.00 176.83 176.75 3i51 h VAL 87 N 0.13 1.28 -0.51 2.27 2.07 -0.61 -1.94 116.25 118.94 3i51 h VAL 87 Ca -0.05 -1.63 -0.09 0.00 0.82 0.00 0.00 66.70 65.76 3i51 h VAL 87 Cb 1.50 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.74 3i51 h VAL 87 CO 0.14 0.54 -0.03 -0.08 0.02 0.00 0.00 177.57 178.16 3i51 h GLU 88 N 0.70 0.88 -0.50 1.57 4.22 -0.98 -2.34 114.58 118.13 3i51 h GLU 88 Ca 0.04 -0.26 0.02 0.00 0.08 0.00 0.00 59.36 59.23 3i51 h GLU 88 Cb 1.04 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 3i51 h GLU 88 CO 0.10 0.90 0.31 1.49 -2.18 0.00 0.00 179.01 179.62 3i51 h GLU 89 N 0.81 0.60 0.24 1.92 4.81 -1.05 0.44 114.58 122.35 3i51 h GLU 89 Ca 0.15 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 3i51 h GLU 89 Cb 0.52 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 3i51 h GLU 89 CO 0.03 0.40 -0.36 0.28 -0.73 0.00 0.00 179.01 178.62 3i51 h VAL 90 N 0.62 0.25 -0.98 0.32 2.07 -1.28 -2.98 116.25 114.27 3i51 h VAL 90 Ca 0.19 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.82 3i51 h VAL 90 Cb -0.01 0.25 -0.08 0.00 -1.52 0.00 0.00 31.29 29.93 3i51 h VAL 90 CO -0.07 0.00 0.62 0.25 0.02 0.00 0.00 177.57 178.39 3i51 h LEU 91 N -0.67 0.91 -1.14 2.57 5.85 -0.79 -2.37 115.31 119.66 3i51 h LEU 91 Ca 0.00 0.04 0.24 0.00 0.84 0.00 0.00 57.88 59.00 3i51 h LEU 91 Cb 0.65 -0.15 -0.11 0.00 0.37 0.00 0.00 40.66 41.42 3i51 h LEU 91 CO -0.14 0.51 0.62 0.00 -0.34 0.00 0.00 178.44 179.10 3i51 h ALA 92 N 1.53 1.94 -0.21 1.25 0.00 0.00 -1.90 119.26 121.88 3i51 h ALA 92 Ca 0.47 0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.53 3i51 h ALA 92 Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3i51 h ALA 92 CO -0.23 -0.37 0.21 0.00 0.00 0.00 0.00 179.25 178.86 3i51 h ARG 93 N 0.54 0.00 -0.69 0.00 3.08 -1.43 -2.26 114.38 113.62 3i51 h ARG 93 Ca 0.61 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.66 3i51 h ARG 93 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3i51 h ARG 93 CO -0.39 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.38 3i51 n SER 94 N -3.90 4.15 -4.07 7.04 3.41 -0.71 -4.95 113.62 114.59 3i51 n SER 94 Ca 0.02 -2.18 -0.24 0.00 -0.26 0.00 0.00 58.87 56.22 3i51 n SER 94 Cb 0.34 -0.52 -0.16 0.00 -0.26 0.00 0.00 64.21 63.62 3i51 n SER 94 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3i51 s ARG 95 N -1.37 1.51 -0.02 4.33 0.52 -0.85 -5.03 118.95 118.04 3i51 s ARG 95 Ca 0.49 -0.47 0.19 0.00 -0.52 0.00 0.00 55.73 55.41 3i51 s ARG 95 Cb 0.28 -1.32 -0.29 0.00 0.52 0.00 0.00 34.95 34.14 3i51 s ARG 95 CO 0.29 0.16 0.43 1.63 0.02 0.00 0.00 175.30 177.83 3i51 n LYS 96 N 3.33 0.59 0.00 3.54 5.02 -1.26 -5.00 118.16 124.38 3i51 n LYS 96 Ca -0.19 -0.16 0.00 0.00 -2.02 0.00 0.00 58.31 55.94 3i51 n LYS 96 Cb 0.53 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 3i51 n LYS 96 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i51 n GLY 97 N 1.43 -0.51 3.74 0.72 0.00 -1.26 -4.99 105.19 104.32 3i51 n GLY 97 Ca -0.03 -1.59 -0.37 0.00 0.00 0.00 0.00 46.02 44.02 3i51 n GLY 97 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3i51 s THR 98 N 0.00 2.07 0.31 2.61 -1.32 -0.46 -4.87 115.64 113.98 3i51 s THR 98 Ca 0.00 0.05 -0.30 0.00 -1.21 0.00 0.00 61.69 60.23 3i51 s THR 98 Cb 0.00 -3.02 -0.12 0.00 -1.51 0.00 0.00 72.50 67.85 3i51 s THR 98 CO 0.00 -0.01 1.56 0.23 -2.21 0.00 0.00 174.62 174.20 3i51 n MET 99 N -1.57 2.67 -2.45 7.08 0.00 -1.26 -4.97 117.12 116.62 3i51 n MET 99 Ca 0.14 0.95 -0.23 0.00 0.00 0.00 0.00 57.70 58.55 3i51 n MET 99 Cb 0.47 -2.71 0.06 0.00 0.00 0.00 0.00 33.22 31.04 3i51 n MET 99 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 3i51 s GLY 100 N 0.34 1.77 0.34 3.03 0.00 -1.26 -4.75 107.32 106.78 3i51 s GLY 100 Ca 0.62 -1.19 -0.03 0.00 0.00 0.00 0.00 44.72 44.12 3i51 s GLY 100 CO 0.52 -0.83 0.49 -1.26 0.00 0.00 0.00 173.10 172.02 3i51 n SER 101 N -2.63 -1.38 -4.77 1.64 2.88 -0.41 -4.83 113.62 104.13 3i51 n SER 101 Ca 0.08 -2.76 -0.34 0.00 -1.33 0.00 0.00 58.87 54.53 3i51 n SER 101 Cb 0.60 2.53 0.04 0.00 -0.75 0.00 0.00 64.21 66.63 3i51 n SER 101 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 3i51 s ILE 102 N -2.73 3.10 0.10 2.46 -4.36 -1.26 -4.29 121.20 114.23 3i51 s ILE 102 Ca 0.26 0.57 -0.13 0.00 -0.26 0.00 0.00 60.65 61.09 3i51 s ILE 102 Cb -0.01 -3.13 -0.15 0.00 1.25 0.00 0.00 42.46 40.42 3i51 s ILE 102 CO 0.19 -0.26 1.31 -0.08 0.24 0.00 0.00 174.94 176.34 3i51 h GLU 103 N 0.39 0.80 0.00 0.37 4.81 -1.93 -3.44 114.58 115.58 3i51 h GLU 103 Ca -0.48 -0.64 0.20 0.00 -0.13 0.00 0.00 59.36 58.31 3i51 h GLU 103 Cb 1.26 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.72 3i51 h GLU 103 CO 0.55 1.25 -0.26 0.41 -0.73 0.00 0.00 179.01 180.22 3i51 n GLY 104 N 0.68 -2.01 0.30 1.92 0.00 -1.26 -4.53 105.19 100.28 3i51 n GLY 104 Ca -0.07 -1.32 0.14 0.00 0.00 0.00 0.00 46.02 44.77 3i51 n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3i51 n PRO 105 N -2.63 1.17 -0.39 1.61 -0.05 -1.26 -4.36 135.00 129.09 3i51 n PRO 105 Ca 0.00 -0.61 0.09 0.00 -0.05 0.00 0.00 63.50 62.94 3i51 n PRO 105 Cb 0.33 -1.49 0.27 0.00 -0.05 0.00 0.00 33.50 32.56 3i51 n PRO 105 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 175.50 176.11 3i51 n TYR 106 N -0.39 0.95 -2.35 0.54 4.02 -1.26 -4.98 117.16 113.69 3i51 n TYR 106 Ca 0.16 -0.57 -0.40 0.00 -0.01 0.00 0.00 57.90 57.09 3i51 n TYR 106 Cb 0.32 -0.11 -0.03 0.00 -0.02 0.00 0.00 39.34 39.50 3i51 n TYR 106 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 3i51 s TYR 107 N -1.43 3.30 -0.07 -0.72 5.04 -1.26 -5.04 117.35 117.17 3i51 s TYR 107 Ca 0.40 1.59 -0.00 0.00 -2.44 0.00 0.00 57.07 56.63 3i51 s TYR 107 Cb 0.24 -3.39 0.02 0.00 0.35 0.00 0.00 41.96 39.18 3i51 s TYR 107 CO 0.23 -1.05 -0.04 0.42 -1.34 0.00 0.00 175.55 173.76 3i51 s ILE 108 N -1.26 0.63 0.77 3.14 1.01 -1.26 -5.15 121.20 119.08 3i51 s ILE 108 Ca 0.50 -0.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.94 3i51 s ILE 108 Cb -0.33 -0.69 0.06 0.00 0.01 0.00 0.00 42.46 41.51 3i51 s ILE 108 CO 0.42 0.28 1.11 -1.61 0.00 0.00 0.00 174.94 175.14 3i51 s GLU 109 N 1.46 2.18 -1.29 2.79 2.02 -1.26 -4.13 118.70 120.47 3i51 s GLU 109 Ca -0.02 1.27 -0.07 0.00 0.02 0.00 0.00 54.97 56.17 3i51 s GLU 109 Cb -0.13 -1.88 0.01 0.00 0.10 0.00 0.00 34.13 32.22 3i51 s GLU 109 CO -0.03 -1.71 0.90 0.09 0.02 0.00 0.00 175.26 174.52 3i51 n ASN 110 N -3.41 -5.90 -4.76 -0.19 3.02 -1.26 -4.99 115.26 97.77 3i51 n ASN 110 Ca 0.10 -0.41 -0.38 0.00 -0.03 0.00 0.00 54.58 53.86 3i51 n ASN 110 Cb 0.53 -4.59 0.01 0.00 -0.61 0.00 0.00 39.78 35.12 3i51 n ASN 110 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3i51 s SER 111 N -3.10 5.78 0.30 6.41 1.04 -1.26 -4.92 113.70 117.95 3i51 s SER 111 Ca 0.45 2.55 -0.29 0.00 0.48 0.00 0.00 55.95 59.13 3i51 s SER 111 Cb -0.20 -2.62 -0.13 0.00 0.10 0.00 0.00 66.02 63.17 3i51 s SER 111 CO 0.55 -1.20 1.29 -2.65 0.98 0.00 0.00 173.24 172.21 3i51 n PRO 112 N -0.66 1.97 -2.49 4.02 -0.02 -1.26 -3.71 135.00 132.84 3i51 n PRO 112 Ca 0.08 0.69 -0.36 0.00 -2.02 0.00 0.00 63.50 61.89 3i51 n PRO 112 Cb 0.46 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.64 3i51 n PRO 112 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3i51 s GLU 113 N -1.32 4.03 0.06 -0.52 2.02 -1.26 -1.50 118.70 120.20 3i51 s GLU 113 Ca 0.60 1.54 0.01 0.00 0.02 0.00 0.00 54.97 57.14 3i51 s GLU 113 Cb -0.62 -2.44 -0.03 0.00 0.10 0.00 0.00 34.13 31.14 3i51 s GLU 113 CO 0.58 -0.27 -0.06 -0.51 0.02 0.00 0.00 175.26 175.02 3i51 s LEU 114 N -2.85 2.37 0.93 1.80 1.43 -0.31 -4.89 118.68 117.15 3i51 s LEU 114 Ca 0.60 -0.75 -0.12 0.00 -1.03 0.00 0.00 54.13 52.83 3i51 s LEU 114 Cb -0.22 -0.04 0.15 0.00 0.03 0.00 0.00 46.19 46.10 3i51 s LEU 114 CO 0.28 -0.36 1.12 -2.16 0.23 0.00 0.00 176.35 175.46 3i51 s PRO 115 N -2.60 0.97 0.34 1.29 0.04 -1.26 -1.09 135.00 132.68 3i51 s PRO 115 Ca -0.02 0.36 0.09 0.00 0.04 0.00 0.00 61.00 61.47 3i51 s PRO 115 Cb -0.03 -1.81 0.82 0.00 0.04 0.00 0.00 34.50 33.52 3i51 s PRO 115 CO -0.03 -2.33 1.82 0.66 0.04 0.00 0.00 177.00 177.16 3i51 h SER 116 N -1.60 0.69 -3.54 6.66 4.64 -1.76 -3.32 113.55 115.33 3i51 h SER 116 Ca -0.52 0.07 -0.67 0.00 -0.47 0.00 0.00 61.79 60.20 3i51 h SER 116 Cb 1.33 -0.06 -0.28 0.00 -0.31 0.00 0.00 62.40 63.08 3i51 h SER 116 CO 0.61 0.28 -0.68 -0.75 -0.87 0.00 0.00 176.83 175.42 3i51 s LYS 117 N -5.73 3.06 0.27 4.77 2.20 -1.26 -0.07 119.74 122.99 3i51 s LYS 117 Ca -0.10 -0.85 -0.20 0.00 -0.36 0.00 0.00 55.97 54.45 3i51 s LYS 117 Cb 0.24 -3.17 0.02 0.00 -1.51 0.00 0.00 37.83 33.41 3i51 s LYS 117 CO 0.80 -0.38 0.69 0.00 -0.36 0.00 0.00 175.35 176.10 3i51 s THR 119 N -3.93 1.47 0.57 0.00 -1.32 -1.26 -0.71 115.64 110.47 3i51 s THR 119 Ca 0.12 -0.71 -0.19 0.00 -1.21 0.00 0.00 61.69 59.70 3i51 s THR 119 Cb -0.05 -1.28 -0.06 0.00 -1.51 0.00 0.00 72.50 69.59 3i51 s THR 119 CO 0.07 0.43 0.90 0.18 -2.21 0.00 0.00 174.62 173.98 3i51 n LEU 120 N 3.37 3.08 -4.76 9.08 4.77 -0.62 -4.92 117.00 126.99 3i51 n LEU 120 Ca -0.19 0.82 -0.41 0.00 -0.03 0.00 0.00 56.01 56.19 3i51 n LEU 120 Cb 0.53 -1.35 -0.01 0.00 -2.33 0.00 0.00 43.42 40.26 3i51 n LEU 120 CO 0.26 -2.01 1.21 -2.84 -1.33 0.00 0.00 177.39 172.68 3i51 s PRO 121 N -2.55 4.11 0.15 3.23 0.02 -1.26 -4.84 135.00 133.86 3i51 s PRO 121 Ca 0.73 2.59 -0.22 0.00 0.02 0.00 0.00 61.00 64.12 3i51 s PRO 121 Cb -0.44 -3.00 0.06 0.00 0.02 0.00 0.00 34.50 31.15 3i51 s PRO 121 CO 0.49 -0.60 0.56 0.00 -0.33 0.00 0.00 177.00 177.13 3i51 s MET 122 N -1.16 1.24 0.86 5.54 0.23 -1.26 0.06 119.30 124.81 3i51 s MET 122 Ca 0.59 -0.50 -0.09 0.00 -1.03 0.00 0.00 55.69 54.66 3i51 s MET 122 Cb -0.47 0.57 0.17 0.00 -1.53 0.00 0.00 34.83 33.56 3i51 s MET 122 CO 0.54 -0.53 1.19 1.03 -2.03 0.00 0.00 175.02 175.22 3i51 s ARG 123 N -3.70 1.05 0.17 3.16 0.52 -1.26 -4.97 118.95 113.91 3i51 s ARG 123 Ca 0.01 -0.73 -0.07 0.00 -0.52 0.00 0.00 55.73 54.42 3i51 s ARG 123 Cb -0.00 -2.05 0.04 0.00 0.52 0.00 0.00 34.95 33.45 3i51 s ARG 123 CO -0.12 -2.03 1.49 0.93 0.02 0.00 0.00 175.30 175.59 3i51 h GLU 124 N -1.18 0.75 0.00 3.54 5.08 -2.03 -2.53 114.58 118.21 3i51 h GLU 124 Ca -0.41 -0.43 0.00 0.00 -1.00 0.00 0.00 59.36 57.52 3i51 h GLU 124 Cb 1.25 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.53 3i51 h GLU 124 CO 0.38 1.06 0.03 0.39 -1.00 0.00 0.00 179.01 179.87 3i51 n GLU 125 N -4.01 0.00 -0.05 2.33 4.71 -1.26 -2.42 120.64 119.94 3i51 n GLU 125 Ca -0.03 0.25 -0.04 0.00 -0.01 0.00 0.00 57.16 57.33 3i51 n GLU 125 Cb 0.58 -1.53 -0.09 0.00 -1.01 0.00 0.00 31.44 29.39 3i51 n GLU 125 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3i51 n ASP 126 N -1.23 2.28 0.00 1.62 10.43 -0.98 -4.62 116.55 124.05 3i51 n ASP 126 Ca 0.00 0.00 0.08 0.00 2.57 0.00 0.00 54.79 57.44 3i51 n ASP 126 Cb 0.03 0.89 0.38 0.00 1.84 0.00 0.00 41.12 44.26 3i51 n ASP 126 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3i51 n GLU 127 N -2.33 0.13 0.00 -1.24 1.02 -1.01 -2.13 120.64 115.07 3i51 n GLU 127 Ca -0.16 0.17 0.13 0.00 -0.02 0.00 0.00 57.16 57.29 3i51 n GLU 127 Cb 0.78 -1.50 0.34 0.00 -0.02 0.00 0.00 31.44 31.04 3i51 n GLU 127 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3i51 n LYS 128 N -1.38 0.93 -3.43 3.49 3.00 -1.25 -4.90 118.16 114.61 3i51 n LYS 128 Ca 0.06 -0.58 -0.37 0.00 -0.00 0.00 0.00 58.31 57.41 3i51 n LYS 128 Cb 0.16 -1.49 -0.06 0.00 0.00 0.00 0.00 35.03 33.64 3i51 n LYS 128 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 3i51 s ILE 129 N -2.47 4.94 0.21 3.15 -1.09 -0.90 -5.01 121.20 120.02 3i51 s ILE 129 Ca 0.24 0.90 -0.32 0.00 -2.23 0.00 0.00 60.65 59.24 3i51 s ILE 129 Cb 0.19 -3.76 -0.12 0.00 -1.58 0.00 0.00 42.46 37.19 3i51 s ILE 129 CO 0.51 0.50 1.70 1.07 -1.23 0.00 0.00 174.94 177.50 3i51 n THR 130 N 1.57 0.04 -2.01 2.92 5.66 -1.26 -4.89 114.28 116.31 3i51 n THR 130 Ca -0.11 -0.01 -0.36 0.00 -3.05 0.00 0.00 64.05 60.51 3i51 n THR 130 Cb 0.52 -1.93 0.03 0.00 -1.55 0.00 0.00 70.33 67.40 3i51 n THR 130 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 175.07 169.18 3i51 s PRO 131 N 1.08 3.05 -0.18 1.09 0.02 -1.26 -4.15 135.00 134.65 3i51 s PRO 131 Ca 0.75 1.87 0.01 0.00 0.02 0.00 0.00 61.00 63.65 3i51 s PRO 131 Cb -0.53 -2.00 0.02 0.00 0.02 0.00 0.00 34.50 32.01 3i51 s PRO 131 CO 0.33 -1.15 -0.19 -1.17 -0.33 0.00 0.00 177.00 174.49 3i51 s LEU 132 N -3.93 2.07 -0.39 -5.54 2.96 0.64 -1.57 118.68 112.93 3i51 s LEU 132 Ca 0.76 -0.63 -0.11 0.00 -0.22 0.00 0.00 54.13 53.93 3i51 s LEU 132 Cb -0.31 -1.44 0.04 0.00 0.50 0.00 0.00 46.19 44.98 3i51 s LEU 132 CO 0.35 -0.01 0.22 -0.69 -1.32 0.00 0.00 176.35 174.90 3i51 s VAL 133 N 1.32 4.47 -0.31 1.68 1.01 0.45 0.00 120.40 129.02 3i51 s VAL 133 Ca 0.05 -1.02 -0.07 0.00 0.00 0.00 0.00 61.98 60.94 3i51 s VAL 133 Cb -0.13 -3.57 0.01 0.00 0.00 0.00 0.00 36.38 32.69 3i51 s VAL 133 CO -0.13 -0.32 0.10 0.12 0.00 0.00 0.00 175.10 174.88 3i51 s PHE 134 N 1.52 3.17 0.21 5.22 5.36 0.59 -1.00 117.98 133.04 3i51 s PHE 134 Ca 0.02 -0.97 0.09 0.00 -0.96 0.00 0.00 56.93 55.11 3i51 s PHE 134 Cb -0.20 -2.29 -0.05 0.00 -0.34 0.00 0.00 43.02 40.15 3i51 s PHE 134 CO 0.05 -0.58 -0.17 -1.12 -1.46 0.00 0.00 175.22 171.94 3i51 s SER 135 N 1.51 2.85 0.00 6.13 0.01 -0.27 -0.06 113.70 123.87 3i51 s SER 135 Ca 0.02 -0.96 0.00 0.00 1.31 0.00 0.00 55.95 56.32 3i51 s SER 135 Cb -0.18 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 65.87 3i51 s SER 135 CO 0.03 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.22 3i51 n GLY 136 N -0.18 -0.93 2.87 3.44 0.00 -0.90 -0.21 105.19 109.28 3i51 n GLY 136 Ca -0.09 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.70 3i51 n GLY 136 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3i51 s GLN 137 N -1.67 0.04 -0.21 1.61 0.74 -1.25 -1.43 119.66 117.48 3i51 s GLN 137 Ca 0.00 0.01 -0.16 0.00 0.05 0.00 0.00 55.36 55.25 3i51 s GLN 137 Cb 0.00 -0.08 -0.04 0.00 1.10 0.00 0.00 33.01 33.99 3i51 s GLN 137 CO 0.00 -0.01 0.42 0.08 -0.55 0.00 0.00 175.29 175.23 3i51 s VAL 138 N 0.14 5.17 0.30 1.34 1.01 0.37 -0.49 120.40 128.24 3i51 s VAL 138 Ca -0.01 0.74 0.03 0.00 0.00 0.00 0.00 61.98 62.73 3i51 s VAL 138 Cb -0.02 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 3i51 s VAL 138 CO -0.00 0.22 0.14 0.42 0.00 0.00 0.00 175.10 175.87 3i51 s THR 139 N 1.52 0.45 0.14 3.92 -4.23 0.59 -1.42 115.64 116.61 3i51 s THR 139 Ca 0.19 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.70 3i51 s THR 139 Cb -0.15 -2.55 0.03 0.00 1.34 0.00 0.00 72.50 71.17 3i51 s THR 139 CO 0.08 0.00 0.20 -0.90 -0.54 0.00 0.00 174.62 173.46 3i51 n ASP 140 N -0.82 0.26 0.24 3.99 5.68 0.37 -0.39 116.55 125.88 3i51 n ASP 140 Ca 0.00 -1.22 0.09 0.00 -0.50 0.00 0.00 54.79 53.16 3i51 n ASP 140 Cb 0.65 -0.13 0.61 0.00 -1.14 0.00 0.00 41.12 41.12 3i51 n ASP 140 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 3i51 h LEU 141 N 0.00 0.00 -0.63 -2.12 4.07 -1.90 -2.42 115.31 112.31 3i51 h LEU 141 Ca -0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.90 3i51 h LEU 141 Cb 0.24 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.98 3i51 h LEU 141 CO 0.07 0.17 -0.29 0.47 -1.08 0.00 0.00 178.44 177.77 3i51 n ASP 142 N -3.93 1.27 0.00 -0.43 8.00 -1.26 -4.94 116.55 115.26 3i51 n ASP 142 Ca -0.02 -1.06 0.00 0.00 0.71 0.00 0.00 54.79 54.42 3i51 n ASP 142 Cb 0.26 0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 3i51 n ASP 142 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3i51 n GLY 143 N 1.35 0.80 3.68 0.44 0.00 -0.91 -5.04 105.19 105.51 3i51 n GLY 143 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3i51 n GLY 143 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i51 s ASN 144 N -2.31 6.58 0.71 1.61 -0.87 -1.26 -4.69 114.94 114.71 3i51 s ASN 144 Ca 0.00 2.48 -0.16 0.00 -1.57 0.00 0.00 52.86 53.61 3i51 s ASN 144 Cb 0.00 -2.55 0.01 0.00 -0.02 0.00 0.00 41.25 38.69 3i51 s ASN 144 CO 0.00 -0.93 1.06 0.61 -2.57 0.00 0.00 177.10 175.26 3i51 n GLY 145 N 4.14 -0.20 2.99 0.66 0.00 -1.26 -0.48 105.19 111.03 3i51 n GLY 145 Ca 0.17 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 3i51 n GLY 145 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i51 s LEU 146 N -3.59 2.00 0.51 0.99 1.43 -0.51 -4.83 118.68 114.67 3i51 s LEU 146 Ca 0.75 -0.73 -0.18 0.00 -1.03 0.00 0.00 54.13 52.95 3i51 s LEU 146 Cb -0.35 -1.17 -0.08 0.00 0.03 0.00 0.00 46.19 44.62 3i51 s LEU 146 CO 0.48 -0.12 0.99 0.00 0.23 0.00 0.00 176.35 177.93 3i51 s ALA 147 N 1.46 3.01 -0.93 4.21 0.00 -1.24 -3.46 121.76 124.80 3i51 s ALA 147 Ca 0.01 0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.25 3i51 s ALA 147 Cb -0.15 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.82 3i51 s ALA 147 CO -0.09 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.85 3i51 n GLY 148 N -1.23 0.41 3.83 0.00 0.00 -1.26 -4.50 105.19 102.44 3i51 n GLY 148 Ca 0.07 -0.51 -0.38 0.00 0.00 0.00 0.00 46.02 45.21 3i51 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i51 s ALA 149 N -2.45 3.65 -0.02 4.61 0.00 -1.25 -4.24 121.76 122.05 3i51 s ALA 149 Ca 0.00 -0.14 0.07 0.00 0.00 0.00 0.00 51.96 51.89 3i51 s ALA 149 Cb 0.00 -2.48 -0.02 0.00 0.00 0.00 0.00 23.12 20.63 3i51 s ALA 149 CO 0.00 0.46 -0.24 0.15 0.00 0.00 0.00 175.76 176.13 3i51 s LYS 150 N -1.28 1.99 -0.28 0.00 1.02 -0.20 0.10 119.74 121.09 3i51 s LYS 150 Ca 0.28 -0.86 0.03 0.00 0.02 0.00 0.00 55.97 55.44 3i51 s LYS 150 Cb -0.17 -1.90 0.07 0.00 -0.52 0.00 0.00 37.83 35.31 3i51 s LYS 150 CO 0.16 0.50 -0.05 0.08 -0.92 0.00 0.00 175.35 175.12 3i51 s VAL 151 N -0.52 2.13 -0.29 3.17 1.01 0.33 -1.68 120.40 124.55 3i51 s VAL 151 Ca 0.08 -1.82 -0.21 0.00 0.00 0.00 0.00 61.98 60.03 3i51 s VAL 151 Cb -0.10 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.91 3i51 s VAL 151 CO -0.01 -0.22 0.65 -1.61 0.00 0.00 0.00 175.10 173.92 3i51 s GLU 152 N 1.07 3.99 -0.09 2.72 2.02 0.21 0.16 118.70 128.78 3i51 s GLU 152 Ca -0.02 0.44 0.03 0.00 0.02 0.00 0.00 54.97 55.43 3i51 s GLU 152 Cb -0.20 -3.70 -0.02 0.00 0.10 0.00 0.00 34.13 30.32 3i51 s GLU 152 CO -0.06 -0.53 -0.17 -1.17 0.02 0.00 0.00 175.26 173.35 3i51 s LEU 153 N 2.62 2.53 -0.07 1.80 2.96 -0.01 -1.09 118.68 127.42 3i51 s LEU 153 Ca 0.27 -0.35 -0.09 0.00 -0.22 0.00 0.00 54.13 53.73 3i51 s LEU 153 Cb -0.15 -1.53 0.02 0.00 0.50 0.00 0.00 46.19 45.03 3i51 s LEU 153 CO 0.11 0.23 0.23 -1.66 -1.32 0.00 0.00 176.35 173.94 3i51 s TRP 154 N -0.06 -0.21 0.25 5.38 -2.14 -0.57 -1.64 118.94 119.97 3i51 s TRP 154 Ca -0.04 0.48 -0.21 0.00 2.66 0.00 0.00 56.10 58.99 3i51 s TRP 154 Cb -0.14 0.07 0.04 0.00 -3.10 0.00 0.00 33.47 30.34 3i51 s TRP 154 CO 0.04 -0.18 0.82 -3.38 -2.66 0.00 0.00 176.95 171.58 3i51 s HIS 155 N -0.28 -0.11 0.52 1.66 -3.43 -1.13 -0.91 115.29 111.61 3i51 s HIS 155 Ca -0.04 -0.33 -0.06 0.00 -0.80 0.00 0.00 55.06 53.83 3i51 s HIS 155 Cb -0.03 0.71 -0.02 0.00 -1.43 0.00 0.00 32.58 31.81 3i51 s HIS 155 CO 0.01 -1.16 0.83 0.00 -2.00 0.00 0.00 174.74 172.42 3i51 s ALA 156 N -3.40 3.36 0.97 -1.38 0.00 -1.26 -4.78 121.76 115.26 3i51 s ALA 156 Ca 0.13 -0.54 -0.03 0.00 0.00 0.00 0.00 51.96 51.51 3i51 s ALA 156 Cb -0.04 -2.62 0.05 0.00 0.00 0.00 0.00 23.12 20.51 3i51 s ALA 156 CO 0.06 -0.50 0.27 -0.40 0.00 0.00 0.00 175.76 175.20 3i51 n ASP 157 N -2.38 0.04 0.10 0.00 3.85 -0.59 -4.27 116.55 113.30 3i51 n ASP 157 Ca 0.02 -1.11 0.11 0.00 -0.71 0.00 0.00 54.79 53.10 3i51 n ASP 157 Cb 0.56 -0.20 0.46 0.00 -1.35 0.00 0.00 41.12 40.58 3i51 n ASP 157 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 3i51 n ASN 158 N -3.16 0.53 -0.10 -1.12 5.15 -1.26 -1.58 115.26 113.71 3i51 n ASN 158 Ca 0.03 0.63 0.13 0.00 -0.60 0.00 0.00 54.58 54.78 3i51 n ASN 158 Cb 0.12 -0.75 0.39 0.00 -0.53 0.00 0.00 39.78 39.02 3i51 n ASN 158 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3i51 n ASP 159 N -2.09 0.62 -0.31 1.20 10.43 -1.26 -4.55 116.55 120.59 3i51 n ASP 159 Ca 0.02 -0.45 -0.04 0.00 2.57 0.00 0.00 54.79 56.89 3i51 n ASP 159 Cb 0.22 0.08 -0.02 0.00 1.84 0.00 0.00 41.12 43.24 3i51 n ASP 159 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3i51 n GLY 160 N 1.41 0.69 3.81 0.44 0.00 -0.62 -5.04 105.19 105.89 3i51 n GLY 160 Ca 0.10 -0.86 -0.32 0.00 0.00 0.00 0.00 46.02 44.94 3i51 n GLY 160 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i51 s TYR 161 N -2.14 3.33 -0.05 1.61 4.12 -1.26 -4.82 117.35 118.13 3i51 s TYR 161 Ca 0.00 0.20 -0.02 0.00 0.02 0.00 0.00 57.07 57.27 3i51 s TYR 161 Cb 0.00 -1.72 -0.04 0.00 -1.52 0.00 0.00 41.96 38.68 3i51 s TYR 161 CO 0.00 0.56 0.06 0.71 0.02 0.00 0.00 175.55 176.91 3i51 s TYR 162 N -1.30 3.30 0.47 2.71 1.51 -1.26 -1.55 117.35 121.23 3i51 s TYR 162 Ca 0.27 0.26 -0.24 0.00 -1.01 0.00 0.00 57.07 56.35 3i51 s TYR 162 Cb -0.12 -1.79 -0.07 0.00 -0.11 0.00 0.00 41.96 39.87 3i51 s TYR 162 CO 0.18 0.56 1.31 -1.54 -1.11 0.00 0.00 175.55 174.95 3i51 s SER 163 N -1.33 5.87 0.00 2.29 1.04 -1.26 -2.03 113.70 118.28 3i51 s SER 163 Ca 0.18 2.65 0.00 0.00 0.48 0.00 0.00 55.95 59.27 3i51 s SER 163 Cb -0.12 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.37 3i51 s SER 163 CO 0.08 -1.15 0.00 0.00 0.98 0.00 0.00 173.24 173.15 3i51 n GLN 164 N -0.43 0.00 -0.66 4.02 6.02 -1.26 -4.73 117.38 120.34 3i51 n GLN 164 Ca 0.07 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.09 3i51 n GLN 164 Cb 0.45 -2.93 0.05 0.00 1.02 0.00 0.00 30.24 28.83 3i51 n GLN 164 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3i51 n PHE 165 N -2.00 0.00 -3.28 1.08 3.01 -0.86 -4.97 117.46 110.44 3i51 n PHE 165 Ca 0.00 -0.47 0.03 0.00 1.01 0.00 0.00 57.45 58.02 3i51 n PHE 165 Cb 0.00 -0.11 -0.02 0.00 -0.01 0.00 0.00 39.48 39.33 3i51 n PHE 165 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3i51 s ALA 166 N -0.90 -2.56 0.06 4.37 0.00 -1.08 -4.64 121.76 117.02 3i51 s ALA 166 Ca 0.18 1.88 0.32 0.00 0.00 0.00 0.00 51.96 54.34 3i51 s ALA 166 Cb 0.18 -2.15 1.53 0.00 0.00 0.00 0.00 23.12 22.68 3i51 s ALA 166 CO -0.04 -1.22 1.97 -1.35 0.00 0.00 0.00 175.76 175.11 3i51 h PRO 167 N 7.92 0.00 0.00 0.00 0.11 -1.93 -2.63 132.00 135.47 3i51 h PRO 167 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 3i51 h PRO 167 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3i51 h PRO 167 CO 0.12 0.00 0.00 1.12 -0.21 0.00 0.00 178.00 179.03 3i51 h HIS 168 N 0.00 0.00 -3.18 0.65 2.07 -1.98 -3.46 115.15 109.26 3i51 h HIS 168 Ca 0.00 0.00 -0.59 0.00 -2.85 0.00 0.00 60.37 56.93 3i51 h HIS 168 Cb 0.24 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 30.16 3i51 h HIS 168 CO 0.00 0.00 -0.13 -0.51 -3.07 0.00 0.00 177.93 174.22 3i51 s LEU 169 N -4.97 4.43 0.22 6.12 1.43 -0.99 -5.04 118.68 119.88 3i51 s LEU 169 Ca 0.07 1.01 -0.32 0.00 -1.03 0.00 0.00 54.13 53.86 3i51 s LEU 169 Cb 0.10 -2.71 -0.14 0.00 0.03 0.00 0.00 46.19 43.46 3i51 s LEU 169 CO 0.53 0.21 1.31 -2.65 0.23 0.00 0.00 176.35 175.98 3i51 n PRO 170 N 2.39 1.73 0.31 1.29 -0.02 -1.26 -4.61 135.00 134.83 3i51 n PRO 170 Ca -0.11 0.62 0.18 0.00 -2.02 0.00 0.00 63.50 62.17 3i51 n PRO 170 Cb 0.52 -2.21 1.02 0.00 -0.02 0.00 0.00 33.50 32.81 3i51 n PRO 170 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3i51 h GLU 171 N 3.83 0.00 -0.43 -0.52 4.11 -1.96 0.06 114.58 119.67 3i51 h GLU 171 Ca -0.44 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 58.83 3i51 h GLU 171 Cb 1.30 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.46 3i51 h GLU 171 CO 0.73 0.01 0.06 0.91 0.07 0.00 0.00 179.01 180.79 3i51 n TRP 172 N -3.53 1.40 -1.67 2.06 7.02 -1.26 -4.25 117.44 117.21 3i51 n TRP 172 Ca -0.03 -1.32 -0.45 0.00 -1.02 0.00 0.00 57.50 54.69 3i51 n TRP 172 Cb 0.09 -0.50 -0.04 0.00 -2.42 0.00 0.00 31.31 28.44 3i51 n TRP 172 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 3i51 n ASN 173 N -0.79 3.84 -2.47 -0.99 4.05 0.01 -1.06 115.26 117.84 3i51 n ASN 173 Ca 0.33 0.95 -0.20 0.00 0.45 0.00 0.00 54.58 56.10 3i51 n ASN 173 Cb 1.09 -1.47 0.01 0.00 1.23 0.00 0.00 39.78 40.65 3i51 n ASN 173 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 3i51 n LEU 174 N 6.77 -2.21 -4.01 1.20 4.77 0.11 -4.44 117.00 119.19 3i51 n LEU 174 Ca 0.21 -0.13 -0.21 0.00 -0.03 0.00 0.00 56.01 55.84 3i51 n LEU 174 Cb 0.35 -2.78 -0.16 0.00 -2.33 0.00 0.00 43.42 38.51 3i51 n LEU 174 CO 0.70 -0.01 -0.45 -0.13 -1.33 0.00 0.00 177.39 176.17 3i51 s ARG 175 N -5.26 1.11 0.02 3.23 0.52 -0.22 -2.83 118.95 115.52 3i51 s ARG 175 Ca 0.13 -0.34 -0.28 0.00 -0.52 0.00 0.00 55.73 54.73 3i51 s ARG 175 Cb -0.06 -1.01 0.08 0.00 0.52 0.00 0.00 34.95 34.48 3i51 s ARG 175 CO 0.16 0.11 0.74 0.20 0.02 0.00 0.00 175.30 176.52 3i51 s GLY 176 N 0.26 -0.53 -0.34 -3.53 0.00 -0.65 -4.49 107.32 98.05 3i51 s GLY 176 Ca -0.05 1.05 -0.08 0.00 0.00 0.00 0.00 44.72 45.64 3i51 s GLY 176 CO 0.01 0.54 0.14 -1.08 0.00 0.00 0.00 173.10 172.71 3i51 s THR 177 N -2.53 4.12 -0.08 0.90 -1.32 -0.56 -0.83 115.64 115.35 3i51 s THR 177 Ca -0.02 -0.94 -0.26 0.00 -1.21 0.00 0.00 61.69 59.26 3i51 s THR 177 Cb -0.01 -3.28 -0.03 0.00 -1.51 0.00 0.00 72.50 67.67 3i51 s THR 177 CO -0.04 -0.15 0.81 -0.63 -2.21 0.00 0.00 174.62 172.40 3i51 s ILE 178 N 1.48 4.96 -0.51 5.08 1.09 0.12 -1.16 121.20 132.26 3i51 s ILE 178 Ca 0.00 1.66 -0.22 0.00 -1.10 0.00 0.00 60.65 60.99 3i51 s ILE 178 Cb -0.19 -4.14 0.04 0.00 -1.06 0.00 0.00 42.46 37.11 3i51 s ILE 178 CO 0.04 0.17 0.78 -0.63 -0.10 0.00 0.00 174.94 175.21 3i51 s ILE 179 N 1.21 4.63 0.50 2.92 -1.09 -0.25 -0.51 121.20 128.60 3i51 s ILE 179 Ca 0.42 0.06 -0.21 0.00 -2.23 0.00 0.00 60.65 58.69 3i51 s ILE 179 Cb -0.18 -4.39 -0.07 0.00 -1.58 0.00 0.00 42.46 36.24 3i51 s ILE 179 CO 0.19 -0.89 1.13 0.00 -1.23 0.00 0.00 174.94 174.14 3i51 s ALA 180 N 3.31 2.84 1.04 9.38 0.00 0.12 -2.16 121.76 136.29 3i51 s ALA 180 Ca 0.25 0.84 -0.04 0.00 0.00 0.00 0.00 51.96 53.01 3i51 s ALA 180 Cb -0.15 -3.35 0.06 0.00 0.00 0.00 0.00 23.12 19.68 3i51 s ALA 180 CO 0.18 -0.65 0.20 -0.40 0.00 0.00 0.00 175.76 175.09 3i51 n ASP 181 N -0.89 -1.19 0.24 0.00 5.68 -0.34 -4.30 116.55 115.75 3i51 n ASP 181 Ca 0.09 -0.63 0.09 0.00 -0.50 0.00 0.00 54.79 53.85 3i51 n ASP 181 Cb 0.50 -0.18 0.61 0.00 -1.14 0.00 0.00 41.12 40.90 3i51 n ASP 181 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3i51 h GLU 182 N 0.00 0.00 0.00 0.11 3.07 -1.90 0.23 114.58 116.09 3i51 h GLU 182 Ca -0.08 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.78 3i51 h GLU 182 Cb 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 3i51 h GLU 182 CO 0.05 0.18 -0.50 0.39 -1.40 0.00 0.00 179.01 177.73 3i51 n GLU 183 N -3.83 0.25 -0.48 2.33 -0.58 -1.26 -3.70 120.64 113.37 3i51 n GLU 183 Ca -0.02 0.10 0.00 0.00 -0.42 0.00 0.00 57.16 56.82 3i51 n GLU 183 Cb 0.28 -1.68 0.00 0.00 -0.57 0.00 0.00 31.44 29.46 3i51 n GLU 183 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i51 n GLY 184 N 1.35 1.00 3.93 0.62 0.00 0.82 -2.90 105.19 110.01 3i51 n GLY 184 Ca 0.04 -0.37 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 3i51 n GLY 184 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i51 s ARG 185 N -1.18 3.45 0.07 1.61 0.52 -1.26 0.14 118.95 122.30 3i51 s ARG 185 Ca 0.00 -0.50 -0.08 0.00 -0.52 0.00 0.00 55.73 54.63 3i51 s ARG 185 Cb 0.00 -2.98 -0.00 0.00 0.52 0.00 0.00 34.95 32.48 3i51 s ARG 185 CO 0.00 0.55 0.17 1.52 0.02 0.00 0.00 175.30 177.55 3i51 s TYR 186 N -1.65 0.16 -0.25 -0.53 1.13 -0.51 -1.20 117.35 114.48 3i51 s TYR 186 Ca 0.35 -0.53 -0.02 0.00 -1.41 0.00 0.00 57.07 55.46 3i51 s TYR 186 Cb -0.12 -0.08 0.12 0.00 -1.10 0.00 0.00 41.96 40.78 3i51 s TYR 186 CO 0.28 -0.49 0.28 -2.00 -2.51 0.00 0.00 175.55 171.11 3i51 s GLU 187 N -3.42 0.28 -0.21 -3.49 2.12 0.90 -2.11 118.70 112.77 3i51 s GLU 187 Ca 0.02 0.06 -0.01 0.00 0.36 0.00 0.00 54.97 55.40 3i51 s GLU 187 Cb 0.03 -0.84 0.01 0.00 0.26 0.00 0.00 34.13 33.59 3i51 s GLU 187 CO -0.09 -0.84 -0.12 0.42 -0.54 0.00 0.00 175.26 174.09 3i51 s ILE 188 N 2.37 2.67 -0.17 -3.70 1.01 0.91 -1.06 121.20 123.22 3i51 s ILE 188 Ca 0.09 -0.79 -0.09 0.00 0.00 0.00 0.00 60.65 59.86 3i51 s ILE 188 Cb -0.15 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 3i51 s ILE 188 CO -0.23 0.44 0.13 0.28 0.00 0.00 0.00 174.94 175.55 3i51 s THR 189 N 1.36 5.38 0.00 2.92 -1.32 0.11 -0.30 115.64 123.79 3i51 s THR 189 Ca 0.04 0.17 0.00 0.00 -1.21 0.00 0.00 61.69 60.70 3i51 s THR 189 Cb -0.14 -3.42 0.00 0.00 -1.51 0.00 0.00 72.50 67.43 3i51 s THR 189 CO -0.08 0.50 0.00 1.07 -2.21 0.00 0.00 174.62 173.90 3i51 n THR 190 N 3.01 0.00 -4.45 5.08 5.66 0.10 -1.60 114.28 122.09 3i51 n THR 190 Ca -0.17 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.60 3i51 n THR 190 Cb 0.53 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.21 3i51 n THR 190 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 3i51 s ILE 191 N 0.61 1.93 -0.02 1.09 -4.36 -1.26 -0.26 121.20 118.93 3i51 s ILE 191 Ca 0.00 -2.20 -0.30 0.00 -0.26 0.00 0.00 60.65 57.89 3i51 s ILE 191 Cb 0.00 -2.41 -0.04 0.00 1.25 0.00 0.00 42.46 41.26 3i51 s ILE 191 CO 0.00 -0.34 1.15 -1.58 0.24 0.00 0.00 174.94 174.41 3i51 s GLN 192 N -3.65 4.41 0.68 0.37 0.74 -1.26 -4.78 119.66 116.17 3i51 s GLN 192 Ca 0.29 1.64 -0.15 0.00 0.05 0.00 0.00 55.36 57.19 3i51 s GLN 192 Cb 0.01 -3.48 0.01 0.00 1.10 0.00 0.00 33.01 30.66 3i51 s GLN 192 CO 0.13 -0.32 1.13 -1.25 -0.55 0.00 0.00 175.29 174.43 3i51 s PRO 193 N 1.66 2.62 0.64 1.67 0.04 -1.26 -4.61 135.00 135.76 3i51 s PRO 193 Ca 0.56 1.49 -0.14 0.00 0.04 0.00 0.00 61.00 62.94 3i51 s PRO 193 Cb -0.25 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.36 3i51 s PRO 193 CO 0.25 -1.41 1.06 0.00 0.04 0.00 0.00 177.00 176.95 3i51 s ALA 194 N -2.25 2.67 0.92 8.56 0.00 -1.00 -4.67 121.76 125.99 3i51 s ALA 194 Ca 0.69 0.30 -0.12 0.00 0.00 0.00 0.00 51.96 52.83 3i51 s ALA 194 Cb -0.23 -3.22 0.06 0.00 0.00 0.00 0.00 23.12 19.73 3i51 s ALA 194 CO 0.42 -1.03 0.63 -2.30 0.00 0.00 0.00 175.76 173.49 3i51 n PRO 195 N -2.49 -0.26 -4.42 0.00 -0.02 -1.26 -4.43 135.00 122.12 3i51 n PRO 195 Ca 0.08 -0.02 -0.34 0.00 -2.02 0.00 0.00 63.50 61.20 3i51 n PRO 195 Cb 0.53 -2.01 -0.11 0.00 -0.02 0.00 0.00 33.50 31.89 3i51 n PRO 195 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3i51 s TYR 196 N -2.40 3.07 -0.16 6.00 5.04 -0.71 -4.55 117.35 123.64 3i51 s TYR 196 Ca 0.61 -0.01 -0.02 0.00 -2.44 0.00 0.00 57.07 55.20 3i51 s TYR 196 Cb -0.23 -1.84 -0.02 0.00 0.35 0.00 0.00 41.96 40.22 3i51 s TYR 196 CO 0.64 0.25 -0.08 -1.14 -1.34 0.00 0.00 175.55 173.88 3i51 s GLN 197 N -0.39 3.48 -0.06 4.97 0.74 -1.26 -0.07 119.66 127.07 3i51 s GLN 197 Ca 0.07 -0.62 -0.30 0.00 0.05 0.00 0.00 55.36 54.56 3i51 s GLN 197 Cb -0.12 -2.82 -0.05 0.00 1.10 0.00 0.00 33.01 31.11 3i51 s GLN 197 CO 0.02 0.11 1.61 0.96 -0.55 0.00 0.00 175.29 177.44 3i51 s ILE 198 N 0.66 3.63 -0.22 -2.34 -4.36 0.21 -4.90 121.20 113.87 3i51 s ILE 198 Ca -0.04 0.79 -0.42 0.00 -0.26 0.00 0.00 60.65 60.71 3i51 s ILE 198 Cb -0.15 -3.51 -0.19 0.00 1.25 0.00 0.00 42.46 39.86 3i51 s ILE 198 CO 0.02 -0.06 1.39 -2.65 0.24 0.00 0.00 174.94 173.88 3i51 n PRO 199 N 6.92 0.27 0.21 0.37 -0.02 -1.26 -4.79 135.00 136.71 3i51 n PRO 199 Ca 0.17 0.10 0.10 0.00 -2.02 0.00 0.00 63.50 61.85 3i51 n PRO 199 Cb 0.43 -1.64 0.36 0.00 -0.02 0.00 0.00 33.50 32.64 3i51 n PRO 199 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3i51 h THR 200 N 4.08 0.44 0.00 3.45 2.02 -1.90 -3.28 112.91 117.72 3i51 h THR 200 Ca -0.47 -1.21 0.00 0.00 0.77 0.00 0.00 66.41 65.49 3i51 h THR 200 Cb 1.38 1.89 0.00 0.00 -1.74 0.00 0.00 68.15 69.68 3i51 h THR 200 CO 0.83 0.20 -0.54 0.44 0.37 0.00 0.00 175.52 176.82 3i51 h ASP 201 N 0.00 0.00 -4.12 4.18 5.19 -1.90 -2.97 116.42 116.80 3i51 h ASP 201 Ca -0.00 -0.06 -0.45 0.00 -0.62 0.00 0.00 57.03 55.90 3i51 h ASP 201 Cb 0.87 0.00 0.15 0.00 0.18 0.00 0.00 39.33 40.53 3i51 h ASP 201 CO 0.03 0.03 0.33 -0.83 -3.12 0.00 0.00 179.24 175.67 3i51 s GLY 202 N -4.05 1.64 0.28 2.75 0.00 -1.24 -4.72 107.32 101.98 3i51 s GLY 202 Ca 0.04 -0.81 -0.02 0.00 0.00 0.00 0.00 44.72 43.93 3i51 s GLY 202 CO 0.72 -0.15 1.90 -2.55 0.00 0.00 0.00 173.10 173.02 3i51 h PRO 203 N -1.65 1.12 -0.38 2.90 0.11 -1.90 0.29 132.00 132.49 3i51 h PRO 203 Ca -0.47 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 65.48 3i51 h PRO 203 Cb 1.30 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3i51 h PRO 203 CO 0.51 0.74 -0.10 1.15 -0.21 0.00 0.00 178.00 180.09 3i51 h THR 204 N 1.16 1.28 -0.56 -1.15 2.02 -1.92 -0.22 112.91 113.51 3i51 h THR 204 Ca 0.40 -1.19 -0.06 0.00 0.77 0.00 0.00 66.41 66.34 3i51 h THR 204 Cb 0.12 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 3i51 h THR 204 CO -0.15 0.40 0.11 1.23 0.37 0.00 0.00 175.52 177.48 3i51 h GLY 205 N 0.55 0.98 0.92 2.16 0.00 -1.48 -1.34 103.07 104.87 3i51 h GLY 205 Ca 0.10 -0.64 0.02 0.00 0.00 0.00 0.00 47.33 46.81 3i51 h GLY 205 CO 0.04 0.59 0.57 -1.61 0.00 0.00 0.00 176.54 176.13 3i51 h GLN 206 N 0.81 1.10 0.09 4.80 4.15 -0.27 0.35 115.11 126.13 3i51 h GLN 206 Ca 0.17 -0.07 -0.00 0.00 0.77 0.00 0.00 58.65 59.52 3i51 h GLN 206 Cb 0.38 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 27.83 3i51 h GLN 206 CO 0.01 0.73 -0.04 0.35 -1.93 0.00 0.00 178.83 177.94 3i51 h PHE 207 N 1.13 -0.11 0.26 3.99 3.57 -0.58 -1.06 116.94 124.13 3i51 h PHE 207 Ca 0.34 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.84 3i51 h PHE 207 Cb -0.04 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 3i51 h PHE 207 CO -0.02 0.01 -0.25 0.82 -2.23 0.00 0.00 178.31 176.65 3i51 h ILE 208 N -0.20 0.47 -0.77 1.41 2.04 -1.01 -3.16 117.51 116.28 3i51 h ILE 208 Ca -0.01 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.95 3i51 h ILE 208 Cb 0.17 0.47 -0.07 0.00 -0.74 0.00 0.00 36.82 36.64 3i51 h ILE 208 CO 0.02 0.00 0.41 -0.08 0.00 0.00 0.00 178.15 178.50 3i51 h GLU 209 N -0.54 0.66 0.00 2.37 4.57 -0.22 -1.46 114.58 119.96 3i51 h GLU 209 Ca -0.01 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 3i51 h GLU 209 Cb 0.49 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.93 3i51 h GLU 209 CO -0.05 0.43 -0.02 0.00 -1.18 0.00 0.00 179.01 178.20 3i51 h ALA 210 N 1.45 1.03 -0.52 2.92 0.00 -1.20 -1.33 119.26 121.61 3i51 h ALA 210 Ca 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3i51 h ALA 210 Cb 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3i51 h ALA 210 CO -0.27 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.00 3i51 n GLN 211 N -3.15 2.82 -2.07 0.00 10.64 -0.86 -4.99 117.38 119.78 3i51 n GLN 211 Ca -0.01 -2.33 -0.10 0.00 -1.83 0.00 0.00 57.00 52.74 3i51 n GLN 211 Cb 0.23 -1.41 -0.01 0.00 -0.86 0.00 0.00 30.24 28.19 3i51 n GLN 211 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3i51 n ASN 212 N 1.01 -3.39 -3.59 2.61 3.02 -0.50 -5.05 115.26 109.38 3i51 n ASN 212 Ca 0.17 0.02 -0.19 0.00 -0.03 0.00 0.00 54.58 54.55 3i51 n ASN 212 Cb 0.52 -2.54 0.12 0.00 -0.61 0.00 0.00 39.78 37.26 3i51 n ASN 212 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3i51 n GLY 213 N -1.11 -0.46 3.36 7.41 0.00 -0.61 -5.01 105.19 108.78 3i51 n GLY 213 Ca -0.11 -1.84 -0.34 0.00 0.00 0.00 0.00 46.02 43.73 3i51 n GLY 213 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3i51 s HIS 214 N -2.68 2.92 -0.33 1.61 0.09 -1.26 -4.70 115.29 110.93 3i51 s HIS 214 Ca 0.52 -0.75 -0.03 0.00 -0.00 0.00 0.00 55.06 54.79 3i51 s HIS 214 Cb -0.02 -1.99 0.05 0.00 -0.00 0.00 0.00 32.58 30.62 3i51 s HIS 214 CO 0.35 -0.36 2.67 -0.35 -0.00 0.00 0.00 174.74 177.05 3i51 n PRO 215 N 4.18 2.13 -4.68 8.40 -0.04 -1.26 -4.70 135.00 139.03 3i51 n PRO 215 Ca -0.18 -1.85 -0.26 0.00 -0.04 0.00 0.00 63.50 61.17 3i51 n PRO 215 Cb 0.52 -1.94 -0.14 0.00 -0.04 0.00 0.00 33.50 31.89 3i51 n PRO 215 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3i51 s TRP 216 N -1.28 1.85 0.03 0.54 0.52 -1.26 0.65 118.94 119.99 3i51 s TRP 216 Ca 0.51 -0.38 0.06 0.00 0.02 0.00 0.00 56.10 56.31 3i51 s TRP 216 Cb 0.32 -1.11 -0.03 0.00 -1.15 0.00 0.00 33.47 31.50 3i51 s TRP 216 CO -0.12 0.09 -0.15 1.03 0.02 0.00 0.00 176.95 177.81 3i51 s ARG 217 N -1.15 2.20 0.82 4.98 0.52 0.90 -2.10 118.95 125.13 3i51 s ARG 217 Ca 0.08 -0.91 -0.13 0.00 -0.52 0.00 0.00 55.73 54.25 3i51 s ARG 217 Cb -0.09 -2.27 0.09 0.00 0.52 0.00 0.00 34.95 33.20 3i51 s ARG 217 CO 0.02 0.56 1.15 -0.35 0.02 0.00 0.00 175.30 176.70 3i51 n PRO 218 N 1.61 0.10 -1.61 3.54 -0.04 -1.26 -1.74 135.00 135.60 3i51 n PRO 218 Ca -0.16 0.11 -0.46 0.00 -0.04 0.00 0.00 63.50 62.95 3i51 n PRO 218 Cb 0.52 -2.39 -0.03 0.00 -0.04 0.00 0.00 33.50 31.56 3i51 n PRO 218 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3i51 n ALA 219 N -3.39 -0.09 -3.49 0.55 0.00 -1.26 -4.39 120.51 108.44 3i51 n ALA 219 Ca 0.13 0.42 -0.15 0.00 0.00 0.00 0.00 53.44 53.84 3i51 n ALA 219 Cb 0.51 -2.09 -0.07 0.00 0.00 0.00 0.00 19.45 17.80 3i51 n ALA 219 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3i51 s HIS 220 N -0.50 -0.61 0.00 0.00 -3.43 -1.26 -4.26 115.29 105.23 3i51 s HIS 220 Ca 0.66 1.31 -0.15 0.00 -0.80 0.00 0.00 55.06 56.08 3i51 s HIS 220 Cb -0.74 0.28 -0.06 0.00 -1.43 0.00 0.00 32.58 30.63 3i51 s HIS 220 CO 0.55 -0.43 0.43 -0.51 -2.00 0.00 0.00 174.74 172.78 3i51 s LEU 221 N -0.40 4.47 -0.12 5.38 1.43 -0.25 -4.55 118.68 124.64 3i51 s LEU 221 Ca -0.05 0.99 -0.06 0.00 -1.03 0.00 0.00 54.13 53.98 3i51 s LEU 221 Cb -0.03 -2.63 -0.04 0.00 0.03 0.00 0.00 46.19 43.52 3i51 s LEU 221 CO 0.04 0.30 0.10 -1.00 0.23 0.00 0.00 176.35 176.03 3i51 s HIS 222 N -0.99 3.47 -0.00 0.29 3.76 -0.09 -0.71 115.29 121.02 3i51 s HIS 222 Ca 0.24 0.41 0.01 0.00 -0.15 0.00 0.00 55.06 55.57 3i51 s HIS 222 Cb -0.17 -1.93 0.00 0.00 1.11 0.00 0.00 32.58 31.59 3i51 s HIS 222 CO 0.14 0.61 -0.01 -0.51 -0.85 0.00 0.00 174.74 174.11 3i51 s LEU 223 N -0.80 1.88 -0.20 0.89 1.02 -0.73 -1.51 118.68 119.24 3i51 s LEU 223 Ca 0.13 -0.03 0.00 0.00 0.02 0.00 0.00 54.13 54.26 3i51 s LEU 223 Cb -0.12 -0.10 0.02 0.00 0.02 0.00 0.00 46.19 46.01 3i51 s LEU 223 CO 0.03 0.00 -0.15 -0.63 0.02 0.00 0.00 176.35 175.62 3i51 s ILE 224 N 0.11 2.36 -0.14 -0.59 1.01 -0.25 -0.60 121.20 123.11 3i51 s ILE 224 Ca -0.01 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.71 3i51 s ILE 224 Cb -0.02 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.37 3i51 s ILE 224 CO -0.00 0.44 -0.15 -0.69 0.00 0.00 0.00 174.94 174.54 3i51 s VAL 225 N 1.31 2.86 0.08 2.92 1.01 0.22 -0.62 120.40 128.18 3i51 s VAL 225 Ca 0.03 -0.72 -0.00 0.00 0.00 0.00 0.00 61.98 61.29 3i51 s VAL 225 Cb -0.14 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 3i51 s VAL 225 CO -0.10 0.52 -0.02 -0.94 0.00 0.00 0.00 175.10 174.56 3i51 s SER 226 N 0.50 0.61 0.04 3.32 1.04 -0.68 -0.11 113.70 118.41 3i51 s SER 226 Ca -0.10 -1.05 -0.27 0.00 0.48 0.00 0.00 55.95 55.01 3i51 s SER 226 Cb -0.16 0.19 0.07 0.00 0.10 0.00 0.00 66.02 66.23 3i51 s SER 226 CO 0.04 -0.60 0.67 0.00 0.98 0.00 0.00 173.24 174.34 3i51 s ALA 227 N -3.88 -1.71 0.05 5.32 0.00 -1.26 -1.03 121.76 119.25 3i51 s ALA 227 Ca 0.12 0.97 -0.35 0.00 0.00 0.00 0.00 51.96 52.69 3i51 s ALA 227 Cb 0.07 0.36 -0.14 0.00 0.00 0.00 0.00 23.12 23.41 3i51 s ALA 227 CO -0.06 -0.55 1.58 -2.30 0.00 0.00 0.00 175.76 174.43 3i51 n PRO 228 N 0.30 1.76 -1.04 0.00 -0.02 -1.26 -1.48 135.00 133.26 3i51 n PRO 228 Ca -0.17 0.64 -0.02 0.00 -2.02 0.00 0.00 63.50 61.93 3i51 n PRO 228 Cb 0.61 -2.38 -0.01 0.00 -0.02 0.00 0.00 33.50 31.70 3i51 n PRO 228 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i51 n GLY 229 N 3.42 0.44 3.61 -1.23 0.00 -1.26 -5.00 105.19 105.17 3i51 n GLY 229 Ca 0.19 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 3i51 n GLY 229 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i51 s LYS 230 N -1.15 2.30 -0.22 1.61 -0.14 -0.55 -1.10 119.74 120.50 3i51 s LYS 230 Ca 0.00 -0.93 -0.29 0.00 -1.36 0.00 0.00 55.97 53.39 3i51 s LYS 230 Cb 0.00 -2.40 -0.00 0.00 -1.68 0.00 0.00 37.83 33.75 3i51 s LYS 230 CO 0.00 0.53 1.17 -2.00 -0.76 0.00 0.00 175.35 174.29 3i51 s GLU 231 N -2.13 4.18 0.82 1.68 2.12 -0.54 -4.45 118.70 120.37 3i51 s GLU 231 Ca 0.22 1.43 -0.13 0.00 0.36 0.00 0.00 54.97 56.85 3i51 s GLU 231 Cb -0.11 -3.74 0.08 0.00 0.26 0.00 0.00 34.13 30.62 3i51 s GLU 231 CO 0.14 -0.76 1.12 0.43 -0.54 0.00 0.00 175.26 175.65 3i51 n SER 232 N 6.69 0.69 -4.04 -1.70 7.64 -1.26 -4.29 113.62 117.35 3i51 n SER 232 Ca 0.13 0.56 -0.25 0.00 1.01 0.00 0.00 58.87 60.32 3i51 n SER 232 Cb 0.46 -1.48 -0.17 0.00 -1.01 0.00 0.00 64.21 62.02 3i51 n SER 232 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3i51 s VAL 233 N -2.18 1.20 -0.25 0.44 0.11 0.84 -4.94 120.40 115.63 3i51 s VAL 233 Ca 0.72 -0.52 -0.11 0.00 -2.93 0.00 0.00 61.98 59.13 3i51 s VAL 233 Cb -0.28 -1.09 -0.05 0.00 -1.53 0.00 0.00 36.38 33.43 3i51 s VAL 233 CO 0.53 0.37 0.20 -0.89 -3.33 0.00 0.00 175.10 171.98 3i51 s THR 234 N 0.62 5.32 0.30 5.04 2.01 -1.26 -0.61 115.64 127.06 3i51 s THR 234 Ca -0.14 0.25 -0.04 0.00 0.31 0.00 0.00 61.69 62.06 3i51 s THR 234 Cb -0.16 -3.54 -0.01 0.00 0.01 0.00 0.00 72.50 68.81 3i51 s THR 234 CO 0.04 0.30 0.42 0.28 -0.69 0.00 0.00 174.62 174.97 3i51 s THR 235 N 1.37 0.00 0.07 -0.82 -1.32 0.23 -1.28 115.64 113.89 3i51 s THR 235 Ca 0.09 -1.63 0.03 0.00 -1.21 0.00 0.00 61.69 58.96 3i51 s THR 235 Cb -0.15 -2.52 -0.03 0.00 -1.51 0.00 0.00 72.50 68.29 3i51 s THR 235 CO 0.07 0.00 -0.08 -1.10 -2.21 0.00 0.00 174.62 171.30 3i51 s GLN 236 N -3.42 0.71 0.05 7.08 -0.21 -1.26 -1.77 119.66 120.84 3i51 s GLN 236 Ca 0.30 -1.04 0.07 0.00 0.02 0.00 0.00 55.36 54.72 3i51 s GLN 236 Cb 0.01 -0.35 -0.03 0.00 1.00 0.00 0.00 33.01 33.64 3i51 s GLN 236 CO 0.17 0.05 -0.21 -0.51 -2.12 0.00 0.00 175.29 172.67 3i51 s LEU 237 N -2.23 2.17 0.00 2.90 1.43 0.11 -4.84 118.68 118.23 3i51 s LEU 237 Ca 0.01 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.57 3i51 s LEU 237 Cb -0.04 -0.99 -0.00 0.00 0.03 0.00 0.00 46.19 45.20 3i51 s LEU 237 CO -0.01 0.16 0.00 -1.22 0.23 0.00 0.00 176.35 175.51 3i51 n TYR 238 N 1.80 1.12 -3.88 0.29 4.01 0.64 -1.09 117.16 120.05 3i51 n TYR 238 Ca -0.17 -2.46 -0.27 0.00 -0.16 0.00 0.00 57.90 54.84 3i51 n TYR 238 Cb 0.53 -0.32 -0.17 0.00 -0.31 0.00 0.00 39.34 39.08 3i51 n TYR 238 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3i51 s PHE 239 N -2.80 1.51 0.10 -0.72 0.40 -1.26 0.12 117.98 115.32 3i51 s PHE 239 Ca 0.01 -0.88 -0.36 0.00 -0.60 0.00 0.00 56.93 55.09 3i51 s PHE 239 Cb 0.00 -1.23 -0.17 0.00 0.51 0.00 0.00 43.02 42.13 3i51 s PHE 239 CO 0.00 -0.56 1.33 1.17 0.70 0.00 0.00 175.22 177.87 3i51 n LYS 240 N 4.93 1.17 0.00 0.44 4.81 0.17 0.19 118.16 129.87 3i51 n LYS 240 Ca -0.12 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 57.75 3i51 n LYS 240 Cb 0.49 -2.06 0.00 0.00 0.02 0.00 0.00 35.03 33.48 3i51 n LYS 240 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3i51 n GLY 241 N 2.50 3.00 3.51 3.14 0.00 -1.26 -5.01 105.19 111.08 3i51 n GLY 241 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 3i51 n GLY 241 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i51 n GLY 242 N -0.97 -0.96 3.77 -0.02 0.00 0.13 -4.93 105.19 102.21 3i51 n GLY 242 Ca 0.00 0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 3i51 n GLY 242 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3i51 s GLU 243 N -1.63 4.23 0.00 1.61 2.56 -1.26 -3.31 118.70 120.89 3i51 s GLU 243 Ca 0.62 1.80 0.00 0.00 0.00 0.00 0.00 54.97 57.39 3i51 s GLU 243 Cb -0.64 -2.80 0.00 0.00 2.00 0.00 0.00 34.13 32.69 3i51 s GLU 243 CO 0.58 -0.16 0.00 0.91 -0.56 0.00 0.00 175.26 176.03 3i51 n TRP 244 N 0.35 0.00 0.24 5.30 7.02 -1.26 -4.27 117.44 124.82 3i51 n TRP 244 Ca 0.03 0.00 0.08 0.00 -1.02 0.00 0.00 57.50 56.59 3i51 n TRP 244 Cb 0.46 0.00 0.60 0.00 -2.42 0.00 0.00 31.31 29.95 3i51 n TRP 244 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 3i51 h ILE 245 N 0.00 0.91 -0.00 -0.99 2.04 -1.94 0.11 117.51 117.64 3i51 h ILE 245 Ca 0.00 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.29 3i51 h ILE 245 Cb 0.00 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 3i51 h ILE 245 CO 0.00 0.15 -0.15 0.47 0.00 0.00 0.00 178.15 178.63 3i51 n ASP 246 N -4.06 0.20 -2.85 1.72 8.00 -1.26 -4.36 116.55 113.94 3i51 n ASP 246 Ca -0.02 0.09 -0.11 0.00 0.71 0.00 0.00 54.79 55.45 3i51 n ASP 246 Cb 0.24 -0.22 0.06 0.00 -0.02 0.00 0.00 41.12 41.17 3i51 n ASP 246 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3i51 n SER 247 N -1.40 -1.31 -4.66 -2.24 3.41 -0.04 -5.09 113.62 102.28 3i51 n SER 247 Ca 0.08 -3.40 -0.42 0.00 -0.26 0.00 0.00 58.87 54.87 3i51 n SER 247 Cb 0.32 1.09 -0.03 0.00 -0.26 0.00 0.00 64.21 65.33 3i51 n SER 247 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3i51 s ASP 248 N -1.65 6.69 0.63 4.04 2.15 -0.77 -4.85 116.67 122.91 3i51 s ASP 248 Ca 0.27 2.07 0.34 0.00 0.43 0.00 0.00 52.55 55.66 3i51 s ASP 248 Cb 0.32 -2.53 1.94 0.00 -0.30 0.00 0.00 42.92 42.34 3i51 s ASP 248 CO -0.06 -0.93 2.18 1.62 -0.17 0.00 0.00 175.17 177.81 3i51 h VAL 249 N 5.62 0.24 -0.28 1.11 3.04 -1.70 -1.53 116.25 122.74 3i51 h VAL 249 Ca -0.36 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.33 3i51 h VAL 249 Cb 1.16 0.88 0.00 0.00 -2.01 0.00 0.00 31.29 31.32 3i51 h VAL 249 CO 0.96 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 177.52 3i51 n ALA 250 N -2.16 2.44 -4.10 3.17 0.00 -1.26 -4.79 120.51 113.80 3i51 n ALA 250 Ca -0.01 -0.87 -0.34 0.00 0.00 0.00 0.00 53.44 52.22 3i51 n ALA 250 Cb 0.22 -0.89 -0.01 0.00 0.00 0.00 0.00 19.45 18.77 3i51 n ALA 250 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3i51 n SER 251 N 1.31 -3.60 -0.42 0.00 7.64 -0.58 -4.62 113.62 113.35 3i51 n SER 251 Ca 0.18 -0.93 0.04 0.00 1.01 0.00 0.00 58.87 59.17 3i51 n SER 251 Cb 0.57 -3.16 0.08 0.00 -1.01 0.00 0.00 64.21 60.69 3i51 n SER 251 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i51 n ALA 252 N -4.49 2.28 -2.43 -0.43 0.00 -1.26 -4.89 120.51 109.29 3i51 n ALA 252 Ca 0.04 -0.89 -0.34 0.00 0.00 0.00 0.00 53.44 52.25 3i51 n ALA 252 Cb 0.52 -0.31 -0.05 0.00 0.00 0.00 0.00 19.45 19.60 3i51 n ALA 252 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3i51 s THR 253 N -0.88 4.94 0.01 0.00 -4.23 -1.26 -4.70 115.64 109.53 3i51 s THR 253 Ca 0.14 0.59 0.01 0.00 -1.18 0.00 0.00 61.69 61.25 3i51 s THR 253 Cb 0.08 -3.67 -0.01 0.00 1.34 0.00 0.00 72.50 70.24 3i51 s THR 253 CO 0.11 0.12 -0.04 -0.54 -0.54 0.00 0.00 174.62 173.73 3i51 s LYS 254 N -2.32 0.32 0.43 3.99 1.02 -1.26 -5.05 119.74 116.87 3i51 s LYS 254 Ca 0.41 -0.39 0.12 0.00 0.02 0.00 0.00 55.97 56.13 3i51 s LYS 254 Cb -0.13 -0.16 1.00 0.00 -0.52 0.00 0.00 37.83 38.01 3i51 s LYS 254 CO 0.20 0.03 2.01 -1.35 -0.92 0.00 0.00 175.35 175.33 3i51 h PRO 255 N 5.34 0.41 0.00 -1.68 0.11 -1.99 -1.13 132.00 133.06 3i51 h PRO 255 Ca -0.30 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3i51 h PRO 255 Cb 1.20 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3i51 h PRO 255 CO 0.46 0.27 0.00 0.93 -0.21 0.00 0.00 178.00 179.45 3i51 h GLU 256 N 0.43 0.00 -0.53 1.05 3.07 -2.01 -2.95 114.58 113.64 3i51 h GLU 256 Ca 0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.08 3i51 h GLU 256 Cb 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 3i51 h GLU 256 CO -0.06 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.83 3i51 n LEU 257 N -2.70 3.42 -4.60 1.33 4.77 -0.43 -4.94 117.00 113.85 3i51 n LEU 257 Ca -0.01 -2.00 -0.39 0.00 -0.03 0.00 0.00 56.01 53.58 3i51 n LEU 257 Cb 0.12 -0.35 -0.10 0.00 -2.33 0.00 0.00 43.42 40.76 3i51 n LEU 257 CO 0.18 0.85 -0.04 -0.63 -1.33 0.00 0.00 177.39 176.42 3i51 s ILE 258 N -1.00 5.24 0.25 -0.08 1.01 -1.12 -0.26 121.20 125.23 3i51 s ILE 258 Ca 0.35 0.39 -0.15 0.00 0.00 0.00 0.00 60.65 61.25 3i51 s ILE 258 Cb 0.18 -3.62 -0.08 0.00 0.01 0.00 0.00 42.46 38.95 3i51 s ILE 258 CO 0.24 0.20 0.66 -0.76 0.00 0.00 0.00 174.94 175.28 3i51 s LEU 259 N 1.91 4.20 -0.61 2.97 1.43 0.12 -4.80 118.68 123.90 3i51 s LEU 259 Ca 0.11 1.20 0.05 0.00 -1.03 0.00 0.00 54.13 54.46 3i51 s LEU 259 Cb -0.16 -3.74 0.17 0.00 0.03 0.00 0.00 46.19 42.49 3i51 s LEU 259 CO 0.10 -0.07 0.44 -0.62 0.23 0.00 0.00 176.35 176.44 3i51 s ASP 260 N -2.05 3.70 0.33 2.29 2.15 -1.26 -0.66 116.67 121.19 3i51 s ASP 260 Ca 0.47 -3.59 -0.28 0.00 0.43 0.00 0.00 52.55 49.58 3i51 s ASP 260 Cb -0.13 -1.24 -0.10 0.00 -0.30 0.00 0.00 42.92 41.16 3i51 s ASP 260 CO 0.19 -0.11 1.26 -2.84 -0.17 0.00 0.00 175.17 173.50 3i51 s PRO 261 N -0.95 4.35 -0.12 4.34 0.02 -1.26 -4.93 135.00 136.45 3i51 s PRO 261 Ca 0.27 2.12 -0.07 0.00 0.02 0.00 0.00 61.00 63.35 3i51 s PRO 261 Cb -0.02 -3.04 -0.04 0.00 0.02 0.00 0.00 34.50 31.42 3i51 s PRO 261 CO -0.18 -0.15 0.13 0.15 -0.33 0.00 0.00 177.00 176.62 3i51 s LYS 262 N -1.81 3.46 -0.12 5.54 -0.14 0.56 -4.80 119.74 122.43 3i51 s LYS 262 Ca 0.49 -0.16 -0.25 0.00 -1.36 0.00 0.00 55.97 54.69 3i51 s LYS 262 Cb -0.38 -3.17 -0.02 0.00 -1.68 0.00 0.00 37.83 32.58 3i51 s LYS 262 CO 0.50 0.73 0.80 0.99 -0.76 0.00 0.00 175.35 177.61 3i51 s THR 263 N -0.90 4.94 0.88 2.17 2.01 -1.26 0.71 115.64 124.19 3i51 s THR 263 Ca 0.14 1.60 -0.11 0.00 0.31 0.00 0.00 61.69 63.62 3i51 s THR 263 Cb -0.12 -4.12 0.17 0.00 0.01 0.00 0.00 72.50 68.44 3i51 s THR 263 CO 0.03 0.11 1.21 -0.83 -0.69 0.00 0.00 174.62 174.46 3i51 s GLY 264 N 1.04 1.76 0.05 4.40 0.00 0.16 -4.95 107.32 109.78 3i51 s GLY 264 Ca 0.39 -1.29 0.26 0.00 0.00 0.00 0.00 44.72 44.09 3i51 s GLY 264 CO 0.16 -0.60 1.83 1.22 0.00 0.00 0.00 173.10 175.70 3i51 n ASP 265 N -3.46 0.19 -0.00 1.64 10.43 -1.26 -0.70 116.55 123.38 3i51 n ASP 265 Ca 0.14 0.52 0.15 0.00 2.57 0.00 0.00 54.79 58.17 3i51 n ASP 265 Cb 0.60 -0.57 0.77 0.00 1.84 0.00 0.00 41.12 43.76 3i51 n ASP 265 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 3i51 n ASP 266 N -1.68 0.01 -0.26 -2.24 3.85 -1.26 -4.90 116.55 110.08 3i51 n ASP 266 Ca 0.06 -0.22 -0.03 0.00 -0.71 0.00 0.00 54.79 53.89 3i51 n ASP 266 Cb 0.33 -0.26 -0.01 0.00 -1.35 0.00 0.00 41.12 39.83 3i51 n ASP 266 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3i51 n GLY 267 N 1.26 0.62 3.88 6.12 0.00 0.12 -5.03 105.19 112.17 3i51 n GLY 267 Ca 0.15 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 3i51 n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i51 s LYS 268 N -1.62 3.77 -0.12 1.61 1.02 -1.26 -4.76 119.74 118.39 3i51 s LYS 268 Ca 0.00 0.31 -0.15 0.00 0.02 0.00 0.00 55.97 56.16 3i51 s LYS 268 Cb 0.00 -2.54 -0.05 0.00 -0.52 0.00 0.00 37.83 34.73 3i51 s LYS 268 CO 0.00 0.16 0.34 -0.80 -0.92 0.00 0.00 175.35 174.13 3i51 s ASN 269 N -2.82 6.55 -0.11 2.83 0.02 -0.61 -0.66 114.94 120.14 3i51 s ASN 269 Ca 0.49 0.65 0.01 0.00 -1.02 0.00 0.00 52.86 52.98 3i51 s ASN 269 Cb -0.11 -2.21 -0.02 0.00 0.02 0.00 0.00 41.25 38.94 3i51 s ASN 269 CO 0.26 0.13 -0.14 -0.31 0.02 0.00 0.00 177.10 177.06 3i51 s TYR 270 N 0.17 2.78 -0.00 2.20 1.51 0.22 -0.41 117.35 123.81 3i51 s TYR 270 Ca 0.20 -0.58 -0.01 0.00 -1.01 0.00 0.00 57.07 55.67 3i51 s TYR 270 Cb -0.14 -1.80 -0.00 0.00 -0.11 0.00 0.00 41.96 39.91 3i51 s TYR 270 CO 0.07 -0.15 0.03 0.54 -1.11 0.00 0.00 175.55 174.92 3i51 s VAL 271 N 0.16 0.03 -0.15 0.71 0.11 -0.17 -0.32 120.40 120.76 3i51 s VAL 271 Ca -0.07 -0.24 -0.02 0.00 -2.93 0.00 0.00 61.98 58.71 3i51 s VAL 271 Cb -0.15 -0.12 -0.02 0.00 -1.53 0.00 0.00 36.38 34.55 3i51 s VAL 271 CO 0.05 -0.13 -0.07 -0.89 -3.33 0.00 0.00 175.10 170.72 3i51 s THR 272 N -0.40 3.54 -0.07 5.04 2.01 -1.26 -1.11 115.64 123.40 3i51 s THR 272 Ca -0.04 -0.48 -0.03 0.00 0.31 0.00 0.00 61.69 61.45 3i51 s THR 272 Cb -0.03 -2.53 0.04 0.00 0.01 0.00 0.00 72.50 69.99 3i51 s THR 272 CO -0.00 0.50 0.14 -0.47 -0.69 0.00 0.00 174.62 174.10 3i51 s TYR 273 N 0.41 -0.14 -0.07 4.92 6.14 0.71 -4.96 117.35 124.35 3i51 s TYR 273 Ca -0.06 0.49 -0.09 0.00 0.64 0.00 0.00 57.07 58.05 3i51 s TYR 273 Cb -0.15 -0.20 -0.05 0.00 0.42 0.00 0.00 41.96 41.99 3i51 s TYR 273 CO 0.04 -0.21 0.22 -0.80 0.64 0.00 0.00 175.55 175.44 3i51 s ASN 274 N 1.72 6.51 -0.14 4.32 0.02 -1.26 -3.94 114.94 122.16 3i51 s ASN 274 Ca -0.03 0.60 -0.07 0.00 -1.02 0.00 0.00 52.86 52.34 3i51 s ASN 274 Cb -0.12 -2.12 -0.04 0.00 0.02 0.00 0.00 41.25 38.99 3i51 s ASN 274 CO -0.05 0.37 0.11 -0.36 0.02 0.00 0.00 177.10 177.18 3i51 s PHE 275 N -1.08 3.46 -0.24 2.20 0.40 0.36 -4.93 117.98 118.14 3i51 s PHE 275 Ca 0.19 0.39 0.01 0.00 -0.60 0.00 0.00 56.93 56.92 3i51 s PHE 275 Cb -0.13 -1.99 0.04 0.00 0.51 0.00 0.00 43.02 41.45 3i51 s PHE 275 CO 0.08 0.53 -0.11 0.08 0.70 0.00 0.00 175.22 176.50 3i51 s VAL 276 N -0.52 2.32 -0.16 -0.44 1.01 -1.26 -0.30 120.40 121.05 3i51 s VAL 276 Ca 0.12 -1.37 -0.08 0.00 0.00 0.00 0.00 61.98 60.65 3i51 s VAL 276 Cb -0.12 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 3i51 s VAL 276 CO 0.02 0.13 0.11 -0.76 0.00 0.00 0.00 175.10 174.60 3i51 s LEU 277 N 1.19 4.14 0.65 3.92 1.43 0.47 -1.36 118.68 129.12 3i51 s LEU 277 Ca -0.04 0.28 -0.15 0.00 -1.03 0.00 0.00 54.13 53.18 3i51 s LEU 277 Cb -0.18 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 3i51 s LEU 277 CO -0.06 0.28 1.10 -1.81 0.23 0.00 0.00 176.35 176.08 3i51 s ASP 278 N -0.22 5.23 0.34 2.29 1.01 -1.26 -3.73 116.67 120.33 3i51 s ASP 278 Ca 0.10 1.96 -0.26 0.00 0.71 0.00 0.00 52.55 55.06 3i51 s ASP 278 Cb -0.12 -2.55 -0.09 0.00 1.01 0.00 0.00 42.92 41.17 3i51 s ASP 278 CO 0.01 -1.54 1.02 -2.16 0.21 0.00 0.00 175.17 172.71 3i51 s PRO 279 N -4.10 4.44 0.00 8.23 0.04 -1.26 -1.47 135.00 140.88 3i51 s PRO 279 Ca 0.66 1.52 0.16 0.00 0.04 0.00 0.00 61.00 63.39 3i51 s PRO 279 Cb -0.20 -2.81 0.98 0.00 0.04 0.00 0.00 34.50 32.52 3i51 s PRO 279 CO 0.41 0.10 1.39 0.00 0.04 0.00 0.00 177.00 178.94