#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wul n SER 41 N 0.00 -1.56 -0.07 1.61 2.88 -1.26 -4.49 113.62 110.73 2wul n SER 41 Ca 0.00 0.46 -0.13 0.00 -1.33 0.00 0.00 58.87 57.88 2wul n SER 41 Cb 0.00 -1.22 -0.06 0.00 -0.75 0.00 0.00 64.21 62.18 2wul n SER 41 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wul h ALA 42 N -0.96 0.27 -0.63 -1.46 0.00 -1.99 -1.96 119.26 112.53 2wul h ALA 42 Ca -0.45 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.09 2wul h ALA 42 Cb 1.31 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 2wul h ALA 42 CO 0.39 0.15 0.14 1.05 0.00 0.00 0.00 179.25 180.97 2wul h GLU 43 N 0.10 0.99 -0.29 0.00 9.09 -2.00 -2.02 114.58 120.47 2wul h GLU 43 Ca 0.04 -0.23 -0.10 0.00 0.05 0.00 0.00 59.36 59.12 2wul h GLU 43 Cb 0.65 -0.14 -0.01 0.00 -1.65 0.00 0.00 28.75 27.60 2wul h GLU 43 CO 0.04 0.89 -0.25 -0.56 0.05 0.00 0.00 179.01 179.18 2wul h GLN 44 N 0.95 0.56 -0.01 1.06 -0.00 -1.92 -2.69 115.11 113.06 2wul h GLN 44 Ca 0.20 -0.22 -0.21 0.00 -0.00 0.00 0.00 58.65 58.42 2wul h GLN 44 Cb 0.35 -0.03 -0.00 0.00 -0.00 0.00 0.00 27.48 27.80 2wul h GLN 44 CO 0.00 0.76 -0.90 -0.07 -0.00 0.00 0.00 178.83 178.63 2wul h LEU 45 N 0.49 0.43 -0.54 0.06 3.38 -1.23 -2.37 115.31 115.53 2wul h LEU 45 Ca 0.07 -0.34 0.04 0.00 0.09 0.00 0.00 57.88 57.74 2wul h LEU 45 Cb 0.69 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 2wul h LEU 45 CO 0.05 1.13 0.29 -0.78 0.09 0.00 0.00 178.44 179.23 2wul h ASP 46 N 0.19 0.45 0.39 -0.43 -0.00 -1.23 -0.76 116.42 115.02 2wul h ASP 46 Ca -0.06 0.02 -0.01 0.00 -0.00 0.00 0.00 57.03 56.97 2wul h ASP 46 Cb 1.52 -0.07 -0.01 0.00 -0.00 0.00 0.00 39.33 40.78 2wul h ASP 46 CO 0.15 0.31 -0.25 0.00 -0.00 0.00 0.00 179.24 179.45 2wul h ALA 47 N 1.27 -0.61 -0.62 -0.78 0.00 -1.47 -2.77 119.26 114.29 2wul h ALA 47 Ca 0.23 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 55.15 2wul h ALA 47 Cb 0.10 0.31 -0.11 0.00 0.00 0.00 0.00 17.79 18.09 2wul h ALA 47 CO -0.14 -0.85 -0.01 -0.07 0.00 0.00 0.00 179.25 178.18 2wul h LEU 48 N -0.61 -0.30 -0.66 0.00 3.38 -1.00 0.16 115.31 116.28 2wul h LEU 48 Ca -0.04 0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 2wul h LEU 48 Cb 0.51 0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 2wul h LEU 48 CO 0.04 -0.12 -0.56 -0.37 0.09 0.00 0.00 178.44 177.52 2wul h VAL 49 N 0.10 1.19 0.00 1.22 -1.51 -1.16 -3.00 116.25 113.10 2wul h VAL 49 Ca 0.32 -2.06 -0.06 0.00 -1.23 0.00 0.00 66.70 63.67 2wul h VAL 49 Cb 0.52 2.18 -0.01 0.00 -2.13 0.00 0.00 31.29 31.84 2wul h VAL 49 CO -0.54 0.55 -0.62 0.11 -1.23 0.00 0.00 177.57 175.84 2wul h LYS 50 N 0.00 0.00 -0.81 5.19 1.57 -1.09 -3.22 116.57 118.21 2wul h LYS 50 Ca -0.01 0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.93 2wul h LYS 50 Cb 1.13 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.38 2wul h LYS 50 CO 0.07 0.19 0.53 -0.22 -0.57 0.00 0.00 179.45 179.46 2wul h LYS 51 N 0.00 0.48 -4.43 3.15 3.64 -0.55 -3.44 116.57 115.42 2wul h LYS 51 Ca -0.03 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.14 2wul h LYS 51 Cb 1.21 -0.11 -0.16 0.00 -0.41 0.00 0.00 32.23 32.76 2wul h LYS 51 CO 0.03 0.32 -0.70 -0.51 -2.27 0.00 0.00 179.45 176.32 2wul s ASP 52 N -5.87 0.78 0.08 4.20 1.01 -1.26 -5.07 116.67 110.54 2wul s ASP 52 Ca -0.09 -0.90 -0.19 0.00 0.71 0.00 0.00 52.55 52.08 2wul s ASP 52 Cb 0.21 0.13 -0.09 0.00 1.01 0.00 0.00 42.92 44.18 2wul s ASP 52 CO 0.77 -0.47 1.54 0.11 0.21 0.00 0.00 175.17 177.34 2wul h LYS 53 N 3.37 0.38 -4.95 8.23 6.56 -1.87 -3.40 116.57 124.89 2wul h LYS 53 Ca -0.35 -0.11 -0.66 0.00 -1.06 0.00 0.00 60.65 58.48 2wul h LYS 53 Cb 1.16 -0.04 -0.36 0.00 -0.57 0.00 0.00 32.23 32.43 2wul h LYS 53 CO 0.60 0.54 -0.84 0.08 -2.06 0.00 0.00 179.45 177.76 2wul s VAL 54 N -5.11 2.01 -0.07 0.50 1.01 -1.26 0.39 120.40 117.88 2wul s VAL 54 Ca -0.14 -1.06 0.01 0.00 0.00 0.00 0.00 61.98 60.80 2wul s VAL 54 Cb 0.07 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.57 2wul s VAL 54 CO 0.73 0.39 -0.08 -0.69 0.00 0.00 0.00 175.10 175.45 2wul s VAL 55 N 1.28 0.87 0.03 2.92 1.01 0.15 -1.58 120.40 125.07 2wul s VAL 55 Ca 0.02 -0.29 0.07 0.00 0.00 0.00 0.00 61.98 61.78 2wul s VAL 55 Cb -0.15 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 2wul s VAL 55 CO -0.11 0.31 -0.21 0.68 0.00 0.00 0.00 175.10 175.76 2wul s VAL 56 N 0.98 1.72 -0.20 2.92 -7.23 0.02 -0.17 120.40 118.43 2wul s VAL 56 Ca -0.09 -1.13 -0.04 0.00 -1.81 0.00 0.00 61.98 58.90 2wul s VAL 56 Cb -0.15 -1.47 -0.02 0.00 0.56 0.00 0.00 36.38 35.30 2wul s VAL 56 CO 0.00 0.30 -0.03 -0.36 -0.31 0.00 0.00 175.10 174.70 2wul s PHE 57 N -0.71 2.98 0.27 2.82 0.40 -0.12 -1.54 117.98 122.08 2wul s PHE 57 Ca 0.08 -0.69 0.07 0.00 -0.60 0.00 0.00 56.93 55.79 2wul s PHE 57 Cb -0.09 -2.07 -0.06 0.00 0.51 0.00 0.00 43.02 41.32 2wul s PHE 57 CO 0.01 -0.37 -0.07 -0.51 0.70 0.00 0.00 175.22 174.98 2wul s LEU 58 N 1.13 2.50 -0.38 -0.37 1.43 -0.04 -1.50 118.68 121.45 2wul s LEU 58 Ca 0.02 -1.17 -0.18 0.00 -1.03 0.00 0.00 54.13 51.77 2wul s LEU 58 Cb -0.15 -0.67 0.01 0.00 0.03 0.00 0.00 46.19 45.41 2wul s LEU 58 CO 0.00 -0.31 0.53 -0.54 0.23 0.00 0.00 176.35 176.26 2wul s LYS 59 N -3.71 3.46 0.53 1.70 1.02 -1.26 -0.67 119.74 120.81 2wul s LYS 59 Ca 0.29 -0.31 0.00 0.00 0.02 0.00 0.00 55.97 55.97 2wul s LYS 59 Cb 0.03 -3.87 0.00 0.00 -0.52 0.00 0.00 37.83 33.47 2wul s LYS 59 CO 0.12 -0.76 0.00 0.41 -0.92 0.00 0.00 175.35 174.20 2wul n GLY 60 N 4.90 -1.81 3.40 -3.33 0.00 -1.26 -2.00 105.19 105.09 2wul n GLY 60 Ca -0.05 -1.82 -0.20 0.00 0.00 0.00 0.00 46.02 43.95 2wul n GLY 60 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wul s THR 61 N 0.00 1.35 0.31 2.61 -4.23 -0.48 -4.31 115.64 110.89 2wul s THR 61 Ca 0.00 -2.07 0.02 0.00 -1.18 0.00 0.00 61.69 58.46 2wul s THR 61 Cb 0.00 -2.48 0.29 0.00 1.34 0.00 0.00 72.50 71.65 2wul s THR 61 CO 0.00 -0.25 1.90 -0.65 -0.54 0.00 0.00 174.62 175.08 2wul h PRO 62 N 2.31 0.94 -0.31 3.99 0.11 -1.96 -0.90 132.00 136.19 2wul h PRO 62 Ca -0.40 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 65.53 2wul h PRO 62 Cb 1.23 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 2wul h PRO 62 CO 0.67 0.62 -0.32 0.93 -0.21 0.00 0.00 178.00 179.69 2wul h GLU 63 N 0.97 0.76 -2.55 1.05 3.07 -2.02 -3.39 114.58 112.48 2wul h GLU 63 Ca 0.40 -0.41 -0.59 0.00 -0.50 0.00 0.00 59.36 58.26 2wul h GLU 63 Cb 0.28 0.02 -0.39 0.00 -0.84 0.00 0.00 28.75 27.82 2wul h GLU 63 CO -0.16 1.03 -0.88 -0.65 -1.40 0.00 0.00 179.01 176.95 2wul s GLN 64 N -4.36 1.05 0.56 2.33 -0.21 -0.91 -5.12 119.66 113.00 2wul s GLN 64 Ca -0.12 -2.09 -0.16 0.00 0.02 0.00 0.00 55.36 53.01 2wul s GLN 64 Cb 0.09 -1.71 -0.05 0.00 1.00 0.00 0.00 33.01 32.34 2wul s GLN 64 CO 0.84 -1.32 1.03 -2.14 -2.12 0.00 0.00 175.29 171.58 2wul s PRO 65 N 0.11 3.59 0.00 2.91 0.02 -0.39 -1.38 135.00 139.86 2wul s PRO 65 Ca 0.28 1.09 0.07 0.00 0.02 0.00 0.00 61.00 62.46 2wul s PRO 65 Cb -0.05 -2.08 0.16 0.00 0.02 0.00 0.00 34.50 32.55 2wul s PRO 65 CO -0.14 -0.58 1.02 1.04 -0.33 0.00 0.00 177.00 178.01 2wul n GLN 66 N -1.85 1.88 -3.66 5.54 1.13 -0.85 -4.86 117.38 114.71 2wul n GLN 66 Ca 0.08 -1.54 -0.10 0.00 -1.94 0.00 0.00 57.00 53.49 2wul n GLN 66 Cb 0.53 -1.17 -0.08 0.00 0.11 0.00 0.00 30.24 29.63 2wul n GLN 66 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2wul h GLY 68 N 6.35 1.37 0.84 0.00 0.00 -1.95 0.19 103.07 109.88 2wul h GLY 68 Ca -0.31 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 2wul h GLY 68 CO 0.17 -0.05 0.03 0.74 0.00 0.00 0.00 176.54 177.44 2wul h PHE 69 N 0.61 0.14 -0.73 5.60 0.04 -1.97 -0.65 116.94 119.97 2wul h PHE 69 Ca 0.46 -0.01 0.07 0.00 2.80 0.00 0.00 57.97 61.29 2wul h PHE 69 Cb 0.67 -0.04 -0.06 0.00 2.20 0.00 0.00 35.95 38.71 2wul h PHE 69 CO -0.10 0.28 0.42 0.77 -0.60 0.00 0.00 178.31 179.08 2wul h SER 70 N -0.03 0.62 -0.95 2.17 0.02 -1.75 -2.99 113.55 110.63 2wul h SER 70 Ca 0.03 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2wul h SER 70 Cb 0.20 -0.09 -0.05 0.00 0.14 0.00 0.00 62.40 62.61 2wul h SER 70 CO -0.00 0.38 0.62 -1.13 -1.14 0.00 0.00 176.83 175.56 2wul h ASN 71 N 0.75 1.10 -0.98 3.07 -1.24 -0.24 -2.72 115.58 115.31 2wul h ASN 71 Ca 0.34 -0.03 0.08 0.00 0.71 0.00 0.00 56.30 57.39 2wul h ASN 71 Cb 0.23 -0.27 -0.07 0.00 0.73 0.00 0.00 38.32 38.94 2wul h ASN 71 CO -0.20 0.80 0.62 0.00 -1.29 0.00 0.00 177.43 177.37 2wul h ALA 72 N 1.34 1.39 -0.04 1.57 0.00 -0.97 0.34 119.26 122.89 2wul h ALA 72 Ca 0.35 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 2wul h ALA 72 Cb -0.14 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.38 2wul h ALA 72 CO -0.07 0.36 0.02 0.28 0.00 0.00 0.00 179.25 179.83 2wul h VAL 73 N 1.09 1.12 -0.96 0.00 2.07 -1.53 -1.84 116.25 116.20 2wul h VAL 73 Ca 0.44 -0.35 0.09 0.00 0.82 0.00 0.00 66.70 67.70 2wul h VAL 73 Cb 0.25 1.28 -0.08 0.00 -1.52 0.00 0.00 31.29 31.23 2wul h VAL 73 CO -0.20 0.10 0.60 0.58 0.02 0.00 0.00 177.57 178.67 2wul h VAL 74 N -0.07 0.98 -0.20 2.57 2.07 -0.86 -2.06 116.25 118.67 2wul h VAL 74 Ca 0.01 -0.35 -0.11 0.00 0.82 0.00 0.00 66.70 67.08 2wul h VAL 74 Cb 0.14 -0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 29.79 2wul h VAL 74 CO -0.00 0.19 -0.28 1.56 0.02 0.00 0.00 177.57 179.05 2wul h GLN 75 N 1.01 0.55 -0.01 1.57 1.08 -0.88 -1.64 115.11 116.79 2wul h GLN 75 Ca 0.45 -0.32 0.02 0.00 -1.45 0.00 0.00 58.65 57.35 2wul h GLN 75 Cb 0.34 0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.76 2wul h GLN 75 CO -0.23 0.92 -0.14 0.82 -0.95 0.00 0.00 178.83 179.26 2wul h ILE 76 N 0.23 0.65 -0.94 2.54 2.04 -1.12 0.80 117.51 121.72 2wul h ILE 76 Ca 0.02 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.01 2wul h ILE 76 Cb 0.86 0.65 -0.08 0.00 -0.74 0.00 0.00 36.82 37.52 2wul h ILE 76 CO 0.07 0.00 0.60 -0.07 0.00 0.00 0.00 178.15 178.74 2wul h LEU 77 N -0.23 0.79 -0.70 1.44 3.38 -1.41 -1.23 115.31 117.35 2wul h LEU 77 Ca 0.05 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 2wul h LEU 77 Cb 0.29 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2wul h LEU 77 CO -0.14 0.42 0.25 0.03 0.09 0.00 0.00 178.44 179.09 2wul h ARG 78 N 0.85 1.07 -0.55 1.13 3.08 -0.37 -0.81 114.38 118.79 2wul h ARG 78 Ca 0.46 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 60.27 2wul h ARG 78 Cb 0.58 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 2wul h ARG 78 CO -0.23 0.90 0.24 -0.07 -1.07 0.00 0.00 179.97 179.74 2wul h LEU 79 N 1.02 0.74 0.00 3.04 3.38 0.32 -2.04 115.31 121.77 2wul h LEU 79 Ca 0.23 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2wul h LEU 79 Cb 0.25 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2wul h LEU 79 CO -0.01 0.69 0.00 1.41 0.09 0.00 0.00 178.44 180.62 2wul n HIS 80 N -4.53 0.00 -1.42 1.13 8.25 -0.91 -4.37 115.22 113.36 2wul n HIS 80 Ca 0.03 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.46 2wul n HIS 80 Cb 0.14 -0.17 -0.01 0.00 1.12 0.00 0.00 29.99 31.08 2wul n HIS 80 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wul n GLY 81 N 1.00 0.49 3.55 -1.41 0.00 -0.77 0.34 105.19 108.39 2wul n GLY 81 Ca 0.17 -0.88 -0.40 0.00 0.00 0.00 0.00 46.02 44.92 2wul n GLY 81 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wul s VAL 82 N -2.13 3.68 -0.40 1.61 1.01 -0.35 -4.80 120.40 119.03 2wul s VAL 82 Ca 0.00 0.10 0.23 0.00 0.00 0.00 0.00 61.98 62.30 2wul s VAL 82 Cb 0.00 -4.73 -0.10 0.00 0.00 0.00 0.00 36.38 31.54 2wul s VAL 82 CO 0.00 -1.67 0.96 0.54 0.00 0.00 0.00 175.10 174.93 2wul n ARG 83 N 9.22 0.45 -3.77 2.72 1.74 -1.26 -4.59 116.66 121.16 2wul n ARG 83 Ca 0.14 0.01 -0.33 0.00 -0.77 0.00 0.00 57.85 56.90 2wul n ARG 83 Cb 0.50 -1.66 -0.10 0.00 -1.02 0.00 0.00 32.46 30.18 2wul n ARG 83 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2wul s ASP 84 N -4.50 5.29 0.06 0.55 1.11 -1.26 -5.04 116.67 112.88 2wul s ASP 84 Ca 0.01 -3.55 -0.05 0.00 0.18 0.00 0.00 52.55 49.14 2wul s ASP 84 Cb 0.13 -1.78 -0.02 0.00 1.07 0.00 0.00 42.92 42.32 2wul s ASP 84 CO 0.81 -0.18 0.07 -0.72 1.18 0.00 0.00 175.17 176.33 2wul s TYR 85 N -1.06 0.33 -0.08 4.23 -0.85 -1.26 -4.78 117.35 113.88 2wul s TYR 85 Ca 0.24 -0.81 -0.21 0.00 -0.52 0.00 0.00 57.07 55.77 2wul s TYR 85 Cb -0.11 -0.23 -0.04 0.00 0.38 0.00 0.00 41.96 41.97 2wul s TYR 85 CO -0.11 -0.44 0.61 0.00 -1.52 0.00 0.00 175.55 174.09 2wul s ALA 86 N -3.72 3.40 -0.11 9.51 0.00 -0.61 -5.02 121.76 125.21 2wul s ALA 86 Ca 0.05 0.02 0.02 0.00 0.00 0.00 0.00 51.96 52.04 2wul s ALA 86 Cb 0.06 -2.83 0.01 0.00 0.00 0.00 0.00 23.12 20.36 2wul s ALA 86 CO -0.10 -0.04 -0.17 0.00 0.00 0.00 0.00 175.76 175.46 2wul s ALA 87 N 0.64 1.77 -0.08 0.00 0.00 -1.26 -0.80 121.76 122.03 2wul s ALA 87 Ca 0.33 -0.77 0.05 0.00 0.00 0.00 0.00 51.96 51.56 2wul s ALA 87 Cb -0.17 -0.82 -0.01 0.00 0.00 0.00 0.00 23.12 22.12 2wul s ALA 87 CO 0.15 -0.01 -0.22 0.71 0.00 0.00 0.00 175.76 176.39 2wul s TYR 88 N 0.86 2.54 -0.41 0.00 2.02 -0.59 -5.00 117.35 116.76 2wul s TYR 88 Ca -0.09 -0.74 -0.19 0.00 -0.37 0.00 0.00 57.07 55.68 2wul s TYR 88 Cb -0.15 -1.66 0.02 0.00 -0.40 0.00 0.00 41.96 39.76 2wul s TYR 88 CO 0.00 -0.23 0.55 1.21 -1.57 0.00 0.00 175.55 175.51 2wul s ASN 89 N -0.03 6.29 0.40 2.29 2.47 -1.26 -0.86 114.94 124.23 2wul s ASN 89 Ca -0.07 -0.34 0.26 0.00 0.42 0.00 0.00 52.86 53.13 2wul s ASN 89 Cb -0.15 -2.28 0.73 0.00 -1.45 0.00 0.00 41.25 38.10 2wul s ASN 89 CO 0.05 -0.64 1.74 -0.37 -3.72 0.00 0.00 177.10 174.16 2wul h VAL 90 N 5.76 0.00 0.00 -5.21 -1.51 -1.18 -2.71 116.25 111.40 2wul h VAL 90 Ca -0.26 -0.71 -0.02 0.00 -1.23 0.00 0.00 66.70 64.47 2wul h VAL 90 Cb 1.11 1.68 -0.00 0.00 -2.13 0.00 0.00 31.29 31.95 2wul h VAL 90 CO 0.83 0.00 -0.12 -0.07 -1.23 0.00 0.00 177.57 176.98 2wul h LEU 91 N 0.00 0.00 -0.65 4.19 3.38 -1.93 -2.81 115.31 117.49 2wul h LEU 91 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2wul h LEU 91 Cb 0.78 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2wul h LEU 91 CO 0.00 0.12 -0.21 0.44 0.09 0.00 0.00 178.44 178.87 2wul h ASP 92 N 0.00 0.00 -2.31 -0.43 3.32 -1.87 -3.43 116.42 111.70 2wul h ASP 92 Ca -0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 2wul h ASP 92 Cb 0.32 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 39.53 2wul h ASP 92 CO 0.02 0.21 -0.61 -0.62 -1.72 0.00 0.00 179.24 176.52 2wul s ASP 93 N -6.19 1.38 0.45 6.45 2.15 -1.06 -5.02 116.67 114.83 2wul s ASP 93 Ca 0.03 -0.37 0.11 0.00 0.43 0.00 0.00 52.55 52.75 2wul s ASP 93 Cb 0.08 0.51 1.00 0.00 -0.30 0.00 0.00 42.92 44.21 2wul s ASP 93 CO 0.66 -0.35 2.06 -0.65 -0.17 0.00 0.00 175.17 176.72 2wul h PRO 94 N 8.28 0.26 -0.30 4.34 0.11 -1.84 -1.23 132.00 141.61 2wul h PRO 94 Ca -0.16 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.85 2wul h PRO 94 Cb 1.12 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2wul h PRO 94 CO 0.30 0.22 -0.12 0.93 -0.21 0.00 0.00 178.00 179.13 2wul h GLU 95 N 0.26 0.51 -0.09 1.05 3.07 -1.95 -1.07 114.58 116.36 2wul h GLU 95 Ca 0.07 -0.15 -0.04 0.00 -0.50 0.00 0.00 59.36 58.74 2wul h GLU 95 Cb 0.07 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 2wul h GLU 95 CO -0.01 0.63 -0.11 1.25 -1.40 0.00 0.00 179.01 179.37 2wul h LEU 96 N 0.47 0.25 -0.35 1.33 5.85 -1.69 0.23 115.31 121.40 2wul h LEU 96 Ca 0.09 -0.51 0.06 0.00 0.84 0.00 0.00 57.88 58.36 2wul h LEU 96 Cb 0.50 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.37 2wul h LEU 96 CO 0.03 0.71 -0.43 -0.09 -0.34 0.00 0.00 178.44 178.32 2wul h ARG 97 N -0.21 -0.35 -0.49 1.25 2.43 -0.99 0.09 114.38 116.11 2wul h ARG 97 Ca 0.01 0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.09 2wul h ARG 97 Cb 0.65 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.26 2wul h ARG 97 CO 0.03 -0.23 -0.15 0.37 -1.51 0.00 0.00 179.97 178.47 2wul h GLN 98 N -0.36 0.95 -0.66 0.20 5.75 -1.25 -3.31 115.11 116.44 2wul h GLN 98 Ca 0.12 -0.37 -0.07 0.00 -0.15 0.00 0.00 58.65 58.19 2wul h GLN 98 Cb 0.59 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.06 2wul h GLN 98 CO -0.54 1.03 0.13 0.78 -2.65 0.00 0.00 178.83 177.59 2wul h GLY 99 N 0.93 1.15 1.60 2.39 0.00 0.09 -2.77 103.07 106.45 2wul h GLY 99 Ca 0.12 -0.74 -0.08 0.00 0.00 0.00 0.00 47.33 46.63 2wul h GLY 99 CO 0.05 0.69 -0.17 1.19 0.00 0.00 0.00 176.54 178.30 2wul h ILE 100 N 0.99 1.24 -0.50 2.60 6.09 -1.09 -1.58 117.51 125.26 2wul h ILE 100 Ca 0.20 -1.10 0.02 0.00 -1.37 0.00 0.00 64.86 62.61 2wul h ILE 100 Cb 0.40 1.22 -0.03 0.00 0.47 0.00 0.00 36.82 38.88 2wul h ILE 100 CO 0.01 0.35 0.31 0.11 -3.07 0.00 0.00 178.15 175.86 2wul h LYS 101 N 0.44 0.61 -0.22 2.19 1.57 -1.60 -1.00 116.57 118.55 2wul h LYS 101 Ca 0.08 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.70 2wul h LYS 101 Cb 0.55 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2wul h LYS 101 CO 0.04 0.40 -0.38 -0.44 -0.57 0.00 0.00 179.45 178.49 2wul h ASP 102 N 0.63 0.53 -0.13 0.86 3.32 -1.22 -0.23 116.42 120.18 2wul h ASP 102 Ca 0.19 -0.23 -0.07 0.00 0.02 0.00 0.00 57.03 56.95 2wul h ASP 102 Cb -0.02 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 2wul h ASP 102 CO -0.07 0.87 -0.19 0.22 -1.72 0.00 0.00 179.24 178.35 2wul h TYR 103 N 0.42 0.43 0.00 4.55 3.20 -1.10 -3.29 116.97 121.19 2wul h TYR 103 Ca 0.04 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.77 2wul h TYR 103 Cb 0.86 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 39.05 2wul h TYR 103 CO 0.03 0.80 -0.61 0.66 -1.64 0.00 0.00 178.16 177.40 2wul h SER 104 N -0.06 0.00 -3.26 -2.11 4.64 -1.16 -3.48 113.55 108.14 2wul h SER 104 Ca 0.01 -0.10 -0.32 0.00 -0.47 0.00 0.00 61.79 60.91 2wul h SER 104 Cb 0.75 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.87 2wul h SER 104 CO 0.04 0.05 -0.46 -3.20 -0.87 0.00 0.00 176.83 172.39 2wul n ASN 105 N -2.43 -5.10 -4.10 4.97 5.15 -0.12 -5.03 115.26 108.60 2wul n ASN 105 Ca 0.03 -0.17 -0.28 0.00 -0.60 0.00 0.00 54.58 53.56 2wul n ASN 105 Cb 0.48 -4.03 -0.17 0.00 -0.53 0.00 0.00 39.78 35.54 2wul n ASN 105 CO 0.00 0.00 0.00 0.86 1.40 0.00 0.00 177.26 179.52 2wul s TRP 106 N -2.98 2.00 -1.14 1.20 -0.11 -1.10 -5.06 118.94 111.76 2wul s TRP 106 Ca 0.17 -0.84 0.29 0.00 1.22 0.00 0.00 56.10 56.94 2wul s TRP 106 Cb -0.07 -1.40 1.24 0.00 -1.50 0.00 0.00 33.47 31.73 2wul s TRP 106 CO 0.21 -0.39 1.91 -0.35 -4.62 0.00 0.00 176.95 173.71 2wul n PRO 107 N 3.85 0.14 -4.31 5.86 -0.04 -1.26 -4.28 135.00 134.95 2wul n PRO 107 Ca -0.20 -0.01 -0.16 0.00 -0.04 0.00 0.00 63.50 63.08 2wul n PRO 107 Cb 0.52 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 2wul n PRO 107 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2wul s THR 108 N -2.87 0.60 -0.05 0.52 -4.23 -1.26 -5.02 115.64 103.34 2wul s THR 108 Ca 0.18 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.75 2wul s THR 108 Cb 0.19 -2.59 -0.01 0.00 1.34 0.00 0.00 72.50 71.44 2wul s THR 108 CO 0.53 -0.06 -0.24 -0.63 -0.54 0.00 0.00 174.62 173.68 2wul s ILE 109 N -3.72 1.95 0.47 2.99 -1.09 -1.26 -4.47 121.20 116.06 2wul s ILE 109 Ca 0.36 -1.02 -0.07 0.00 -2.23 0.00 0.00 60.65 57.70 2wul s ILE 109 Cb 0.08 -1.64 -0.04 0.00 -1.58 0.00 0.00 42.46 39.27 2wul s ILE 109 CO 0.13 0.54 0.79 -2.16 -1.23 0.00 0.00 174.94 173.01 2wul s PRO 110 N -0.20 3.61 -0.07 2.79 0.04 -1.26 -4.67 135.00 135.24 2wul s PRO 110 Ca -0.01 0.31 0.04 0.00 0.04 0.00 0.00 61.00 61.37 2wul s PRO 110 Cb -0.13 -2.37 -0.00 0.00 0.04 0.00 0.00 34.50 32.05 2wul s PRO 110 CO 0.03 -0.17 -0.21 -0.65 0.04 0.00 0.00 177.00 176.04 2wul s GLN 111 N -4.50 2.46 -0.19 4.56 -0.21 -0.56 -4.22 119.66 117.00 2wul s GLN 111 Ca 0.49 -0.74 -0.03 0.00 0.02 0.00 0.00 55.36 55.09 2wul s GLN 111 Cb -0.10 -1.96 -0.01 0.00 1.00 0.00 0.00 33.01 31.93 2wul s GLN 111 CO 0.41 0.20 -0.06 0.08 -2.12 0.00 0.00 175.29 173.81 2wul s VAL 112 N 0.25 3.39 -0.16 1.09 1.01 0.46 -0.95 120.40 125.50 2wul s VAL 112 Ca -0.12 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 61.35 2wul s VAL 112 Cb -0.16 -2.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 2wul s VAL 112 CO 0.06 0.45 -0.13 -0.31 0.00 0.00 0.00 175.10 175.17 2wul s TYR 113 N 1.10 2.82 -0.14 5.22 1.51 0.75 0.03 117.35 128.64 2wul s TYR 113 Ca 0.01 -0.95 -0.02 0.00 -1.01 0.00 0.00 57.07 55.10 2wul s TYR 113 Cb -0.15 -1.91 -0.02 0.00 -0.11 0.00 0.00 41.96 39.77 2wul s TYR 113 CO -0.01 -0.43 -0.08 -0.51 -1.11 0.00 0.00 175.55 173.41 2wul s LEU 114 N 0.82 2.98 -1.54 -1.29 1.43 -0.43 -0.68 118.68 119.98 2wul s LEU 114 Ca -0.04 -0.23 -0.02 0.00 -1.03 0.00 0.00 54.13 52.80 2wul s LEU 114 Cb -0.15 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 44.37 2wul s LEU 114 CO 0.00 0.16 0.27 -3.20 0.23 0.00 0.00 176.35 173.81 2wul n ASN 115 N 3.56 -5.64 -0.05 2.29 5.15 0.16 -1.29 115.26 119.45 2wul n ASN 115 Ca -0.18 -0.13 -0.01 0.00 -0.60 0.00 0.00 54.58 53.66 2wul n ASN 115 Cb 0.53 -4.58 -0.00 0.00 -0.53 0.00 0.00 39.78 35.19 2wul n ASN 115 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2wul n GLY 116 N -1.23 0.41 3.37 8.20 0.00 -1.22 -4.98 105.19 109.74 2wul n GLY 116 Ca -0.17 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 2wul n GLY 116 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wul s GLU 117 N -0.75 2.22 0.10 1.61 2.02 -0.41 -4.80 118.70 118.69 2wul s GLU 117 Ca 0.00 -0.87 -0.31 0.00 0.02 0.00 0.00 54.97 53.81 2wul s GLU 117 Cb 0.00 -2.14 -0.07 0.00 0.10 0.00 0.00 34.13 32.01 2wul s GLU 117 CO 0.00 0.58 1.33 0.12 0.02 0.00 0.00 175.26 177.31 2wul s PHE 118 N -0.66 3.30 -0.18 1.61 5.36 -1.26 -1.31 117.98 124.83 2wul s PHE 118 Ca 0.11 1.06 -0.07 0.00 -0.96 0.00 0.00 56.93 57.07 2wul s PHE 118 Cb -0.10 -3.60 -0.09 0.00 -0.34 0.00 0.00 43.02 38.89 2wul s PHE 118 CO -0.00 -2.05 -0.22 0.28 -1.46 0.00 0.00 175.22 171.77 2wul n VAL 119 N 3.88 1.02 -3.26 3.12 0.31 0.10 -4.92 118.33 118.58 2wul n VAL 119 Ca 0.10 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 2wul n VAL 119 Cb 0.43 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 2wul n VAL 119 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wul n GLY 120 N 2.02 -0.25 0.00 2.92 0.00 -1.21 -4.97 105.19 103.70 2wul n GLY 120 Ca -0.35 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.40 2wul n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wul n GLY 121 N 0.00 3.11 0.18 -0.02 0.00 -1.26 -0.40 105.19 106.80 2wul n GLY 121 Ca 0.00 -1.96 0.01 0.00 0.00 0.00 0.00 46.02 44.06 2wul n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wul h ASP 123 N 0.05 0.35 -0.37 0.00 3.32 -1.96 -0.95 116.42 116.86 2wul h ASP 123 Ca 0.00 -0.33 -0.02 0.00 0.02 0.00 0.00 57.03 56.70 2wul h ASP 123 Cb 0.78 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 2wul h ASP 123 CO 0.06 0.60 0.14 0.40 -1.72 0.00 0.00 179.24 178.72 2wul h ILE 124 N 0.10 1.19 -0.57 0.35 2.04 -1.93 -2.09 117.51 116.60 2wul h ILE 124 Ca 0.05 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 65.31 2wul h ILE 124 Cb 0.43 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 2wul h ILE 124 CO 0.01 0.21 0.35 0.25 0.00 0.00 0.00 178.15 178.98 2wul h LEU 125 N 0.45 0.68 -1.11 1.44 5.85 -1.28 -0.31 115.31 121.03 2wul h LEU 125 Ca 0.12 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 2wul h LEU 125 Cb 0.20 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2wul h LEU 125 CO -0.01 0.52 0.29 0.25 -0.34 0.00 0.00 178.44 179.16 2wul h LEU 126 N 0.77 0.83 -0.26 2.25 5.85 -1.15 -0.22 115.31 123.39 2wul h LEU 126 Ca 0.21 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 2wul h LEU 126 Cb -0.03 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 2wul h LEU 126 CO -0.04 0.72 0.10 -0.61 -0.34 0.00 0.00 178.44 178.27 2wul h GLN 127 N 0.91 0.39 0.00 1.25 4.15 -0.63 -1.64 115.11 119.55 2wul h GLN 127 Ca 0.22 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.53 2wul h GLN 127 Cb 0.12 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 2wul h GLN 127 CO -0.03 0.44 -0.19 0.52 -1.93 0.00 0.00 178.83 177.64 2wul h MET 128 N 0.26 0.00 -0.33 1.69 2.86 -0.86 -1.77 114.93 116.79 2wul h MET 128 Ca 0.09 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.58 2wul h MET 128 Cb 0.20 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 2wul h MET 128 CO -0.01 0.19 -0.37 1.25 1.06 0.00 0.00 176.91 179.04 2wul h HIS 129 N 0.00 0.91 0.00 -0.22 -0.00 -0.71 0.95 115.15 116.08 2wul h HIS 129 Ca -0.00 -0.26 -0.17 0.00 -0.00 0.00 0.00 60.37 59.94 2wul h HIS 129 Cb 0.41 -0.20 -0.03 0.00 -0.00 0.00 0.00 27.41 27.60 2wul h HIS 129 CO 0.00 1.02 -1.03 1.96 -0.00 0.00 0.00 177.93 179.88 2wul h GLN 130 N 0.63 0.00 -0.41 5.26 4.20 -0.84 -3.34 115.11 120.62 2wul h GLN 130 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2wul h GLN 130 Cb 0.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.70 2wul h GLN 130 CO 0.08 0.53 0.00 0.27 -0.67 0.00 0.00 178.83 179.04 2wul n ASN 131 N -3.12 4.49 0.00 1.46 0.23 -0.71 -4.95 115.26 112.66 2wul n ASN 131 Ca -0.04 -2.85 0.00 0.00 -0.53 0.00 0.00 54.58 51.16 2wul n ASN 131 Cb 0.84 -0.57 0.00 0.00 -2.08 0.00 0.00 39.78 37.98 2wul n ASN 131 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wul n GLY 132 N 0.11 1.35 0.27 4.83 0.00 -1.19 -4.88 105.19 105.67 2wul n GLY 132 Ca 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.21 2wul n GLY 132 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wul h ASP 133 N 0.00 0.65 -0.40 1.61 3.32 -1.68 -2.94 116.42 116.97 2wul h ASP 133 Ca 0.00 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 56.77 2wul h ASP 133 Cb 0.00 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 2wul h ASP 133 CO 0.00 0.78 -0.15 0.25 -1.72 0.00 0.00 179.24 178.40 2wul h LEU 134 N 0.62 0.83 -0.90 1.55 5.85 -1.18 -1.09 115.31 121.00 2wul h LEU 134 Ca 0.11 -0.39 0.14 0.00 0.84 0.00 0.00 57.88 58.58 2wul h LEU 134 Cb 0.52 -0.23 -0.09 0.00 0.37 0.00 0.00 40.66 41.23 2wul h LEU 134 CO 0.03 1.03 0.50 0.58 -0.34 0.00 0.00 178.44 180.25 2wul h VAL 135 N 0.63 0.79 -0.19 1.05 2.07 -1.76 0.32 116.25 119.16 2wul h VAL 135 Ca 0.10 -0.25 -0.21 0.00 0.82 0.00 0.00 66.70 67.16 2wul h VAL 135 Cb 0.70 -0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2wul h VAL 135 CO 0.05 0.14 -0.69 -0.33 0.02 0.00 0.00 177.57 176.76 2wul h GLU 136 N 0.74 0.80 -0.85 1.57 3.07 -1.31 0.66 114.58 119.25 2wul h GLU 136 Ca 0.48 -0.61 -0.03 0.00 -0.50 0.00 0.00 59.36 58.70 2wul h GLU 136 Cb 0.61 0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.59 2wul h GLU 136 CO -0.33 1.22 0.43 0.93 -1.40 0.00 0.00 179.01 179.87 2wul h GLU 137 N 0.54 1.21 -0.32 2.33 4.39 -0.64 -0.75 114.58 121.34 2wul h GLU 137 Ca -0.03 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.47 2wul h GLU 137 Cb 1.31 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 29.72 2wul h GLU 137 CO 0.14 0.91 0.06 -0.07 -1.16 0.00 0.00 179.01 178.89 2wul h LEU 138 N 1.21 0.51 -0.96 1.33 3.38 -0.30 -3.00 115.31 117.47 2wul h LEU 138 Ca 0.30 -0.25 0.08 0.00 0.09 0.00 0.00 57.88 58.10 2wul h LEU 138 Cb 0.08 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.62 2wul h LEU 138 CO -0.04 0.63 0.60 0.50 0.09 0.00 0.00 178.44 180.22 2wul h LYS 139 N 0.36 1.01 -0.12 1.13 3.64 -0.49 -1.19 116.57 120.92 2wul h LYS 139 Ca 0.10 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.45 2wul h LYS 139 Cb 0.33 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2wul h LYS 139 CO 0.00 0.67 0.08 0.87 -2.27 0.00 0.00 179.45 178.81 2wul h LYS 140 N 1.04 0.00 -0.01 1.90 1.57 -1.02 -2.09 116.57 117.96 2wul h LYS 140 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 2wul h LYS 140 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2wul h LYS 140 CO -0.21 0.00 -0.02 1.28 -0.57 0.00 0.00 179.45 179.93 2wul n LEU 141 N -4.47 1.30 0.00 2.94 4.77 -0.74 -4.90 117.00 115.90 2wul n LEU 141 Ca -0.00 -0.42 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 2wul n LEU 141 Cb 0.20 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2wul n LEU 141 CO 0.34 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 2wul n GLY 142 N 1.17 0.60 3.26 -0.72 0.00 -0.78 -5.05 105.19 103.68 2wul n GLY 142 Ca 0.19 -0.79 -0.36 0.00 0.00 0.00 0.00 46.02 45.06 2wul n GLY 142 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wul s ILE 143 N -2.00 3.47 -0.30 -0.61 1.01 -0.53 -5.02 121.20 117.23 2wul s ILE 143 Ca 0.00 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 59.38 2wul s ILE 143 Cb 0.00 -2.85 0.00 0.00 0.01 0.00 0.00 42.46 39.62 2wul s ILE 143 CO 0.00 0.04 1.28 -2.28 0.00 0.00 0.00 174.94 173.98 2wul s HIS 144 N 1.39 2.72 0.29 3.97 5.65 -1.26 -3.24 115.29 124.81 2wul s HIS 144 Ca -0.00 0.90 -0.29 0.00 0.25 0.00 0.00 55.06 55.91 2wul s HIS 144 Cb -0.18 -3.88 -0.10 0.00 -1.18 0.00 0.00 32.58 27.24 2wul s HIS 144 CO 0.00 -1.64 1.13 0.45 -0.65 0.00 0.00 174.74 174.02 2wul s SER 145 N 2.68 7.17 0.61 9.88 0.15 -1.26 -4.90 113.70 128.03 2wul s SER 145 Ca 0.55 2.32 0.39 0.00 0.70 0.00 0.00 55.95 59.92 2wul s SER 145 Cb -0.16 -2.63 1.91 0.00 -1.71 0.00 0.00 66.02 63.42 2wul s SER 145 CO 0.22 -0.22 2.18 0.00 1.20 0.00 0.00 173.24 176.63 2wul h ALA 146 N 3.69 1.01 -0.19 5.45 0.00 -0.35 -2.58 119.26 126.30 2wul h ALA 146 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2wul h ALA 146 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2wul h ALA 146 CO 0.66 0.01 0.00 1.28 0.00 0.00 0.00 179.25 181.20 2wul n LEU 147 N -3.11 1.43 -0.21 0.00 4.77 -1.26 -5.01 117.00 113.61 2wul n LEU 147 Ca -0.01 -0.72 0.03 0.00 -0.03 0.00 0.00 56.01 55.28 2wul n LEU 147 Cb 0.19 -0.25 0.02 0.00 -2.33 0.00 0.00 43.42 41.05 2wul n LEU 147 CO 0.24 0.30 0.33 -0.11 -1.33 0.00 0.00 177.39 176.82