#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ude n HIS 5 N 0.00 -0.18 -1.03 -5.13 8.25 -1.26 -4.85 115.22 111.02 1ude n HIS 5 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1ude n HIS 5 Cb 0.00 0.24 0.00 0.00 1.12 0.00 0.00 29.99 31.35 1ude n HIS 5 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1ude n ASP 6 N -1.98 -0.28 -4.65 0.41 5.68 -1.26 -4.91 116.55 109.57 1ude n ASP 6 Ca 0.00 0.14 -0.27 0.00 -0.50 0.00 0.00 54.79 54.16 1ude n ASP 6 Cb 0.00 -0.35 0.11 0.00 -1.14 0.00 0.00 41.12 39.75 1ude n ASP 6 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 1ude s LEU 7 N -1.67 2.75 0.26 -2.12 0.20 -1.26 -5.09 118.68 111.75 1ude s LEU 7 Ca 0.00 0.34 0.08 0.00 0.69 0.00 0.00 54.13 55.25 1ude s LEU 7 Cb 0.00 -2.73 -0.04 0.00 -0.43 0.00 0.00 46.19 42.99 1ude s LEU 7 CO 0.00 -2.04 0.07 -1.61 -0.29 0.00 0.00 176.35 172.49 1ude s GLU 8 N -5.49 2.55 0.58 1.98 2.02 -1.26 -4.59 118.70 114.49 1ude s GLU 8 Ca 0.66 -1.26 0.30 0.00 0.02 0.00 0.00 54.97 54.68 1ude s GLU 8 Cb -0.08 -2.33 1.43 0.00 0.10 0.00 0.00 34.13 33.25 1ude s GLU 8 CO 0.48 0.38 1.81 -1.35 0.02 0.00 0.00 175.26 176.60 1ude h PRO 9 N 1.76 0.00 0.00 0.39 0.11 -1.86 -3.42 132.00 128.99 1ude h PRO 9 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1ude h PRO 9 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ude h PRO 9 CO 0.60 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.80 1ude n GLY 10 N -1.60 0.97 0.00 -0.55 0.00 -1.26 0.62 105.19 103.37 1ude n GLY 10 Ca 0.14 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.12 1ude n GLY 10 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ude n PRO 11 N -1.55 0.00 -1.53 1.61 -0.02 -1.25 -4.69 135.00 127.57 1ude n PRO 11 Ca 0.00 0.00 -0.46 0.00 -2.02 0.00 0.00 63.50 61.02 1ude n PRO 11 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.46 1ude n PRO 11 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1ude n ASN 12 N 0.00 0.55 0.00 2.55 4.13 -1.26 -4.85 115.26 116.38 1ude n ASN 12 Ca 0.00 1.16 0.00 0.00 1.68 0.00 0.00 54.58 57.42 1ude n ASN 12 Cb 0.00 -1.18 0.00 0.00 -1.54 0.00 0.00 39.78 37.06 1ude n ASN 12 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1ude n VAL 13 N 0.21 0.00 0.32 2.41 0.31 -1.26 -1.92 118.33 118.41 1ude n VAL 13 Ca 0.12 0.33 0.14 0.00 -0.01 0.00 0.00 64.34 64.92 1ude n VAL 13 Cb 0.29 -1.11 0.76 0.00 -0.91 0.00 0.00 33.84 32.88 1ude n VAL 13 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1ude h PRO 14 N 0.00 0.00 0.00 5.55 0.11 -1.89 -2.18 132.00 133.60 1ude h PRO 14 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ude h PRO 14 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1ude h PRO 14 CO 0.00 0.00 -0.06 0.93 -0.21 0.00 0.00 178.00 178.66 1ude h GLU 15 N 0.00 0.00 -6.32 1.05 4.39 -1.94 -3.43 114.58 108.34 1ude h GLU 15 Ca 0.00 0.00 -0.69 0.00 0.34 0.00 0.00 59.36 59.01 1ude h GLU 15 Cb 0.67 0.00 -0.30 0.00 -0.10 0.00 0.00 28.75 29.02 1ude h GLU 15 CO 0.00 0.00 -0.88 0.08 -1.16 0.00 0.00 179.01 177.05 1ude s VAL 16 N -1.62 2.12 0.11 3.13 1.01 -0.81 -4.07 120.40 120.27 1ude s VAL 16 Ca -0.02 -1.07 0.03 0.00 0.00 0.00 0.00 61.98 60.92 1ude s VAL 16 Cb 0.00 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 1ude s VAL 16 CO 0.03 0.58 -0.08 0.54 0.00 0.00 0.00 175.10 176.16 1ude s VAL 17 N -0.41 0.83 0.15 2.92 0.11 0.18 -3.74 120.40 120.44 1ude s VAL 17 Ca 0.04 -1.90 -0.17 0.00 -2.93 0.00 0.00 61.98 57.02 1ude s VAL 17 Cb -0.12 -1.65 -0.07 0.00 -1.53 0.00 0.00 36.38 33.01 1ude s VAL 17 CO 0.01 -0.79 0.61 -0.31 -3.33 0.00 0.00 175.10 171.29 1ude s TYR 18 N -3.34 3.67 -0.21 1.54 4.12 0.20 0.14 117.35 123.46 1ude s TYR 18 Ca 0.12 1.21 0.00 0.00 0.02 0.00 0.00 57.07 58.42 1ude s TYR 18 Cb 0.03 -2.47 0.05 0.00 -1.52 0.00 0.00 41.96 38.05 1ude s TYR 18 CO -0.03 0.44 -0.05 0.00 0.02 0.00 0.00 175.55 175.93 1ude s ALA 19 N -1.40 1.80 -0.56 3.71 0.00 0.31 -4.34 121.76 121.28 1ude s ALA 19 Ca 0.37 -1.19 -0.20 0.00 0.00 0.00 0.00 51.96 50.94 1ude s ALA 19 Cb -0.17 -1.34 0.07 0.00 0.00 0.00 0.00 23.12 21.69 1ude s ALA 19 CO 0.20 -1.07 0.74 -1.17 0.00 0.00 0.00 175.76 174.46 1ude s LEU 20 N 1.48 4.87 0.18 0.00 2.96 0.60 -0.90 118.68 127.86 1ude s LEU 20 Ca -0.04 -0.99 -0.30 0.00 -0.22 0.00 0.00 54.13 52.58 1ude s LEU 20 Cb -0.18 -2.46 -0.08 0.00 0.50 0.00 0.00 46.19 43.98 1ude s LEU 20 CO -0.07 -1.09 1.16 -0.63 -1.32 0.00 0.00 176.35 174.40 1ude s ILE 21 N 3.06 3.69 -0.09 6.68 -1.09 -0.71 -0.95 121.20 131.79 1ude s ILE 21 Ca 0.17 1.44 0.03 0.00 -2.23 0.00 0.00 60.65 60.06 1ude s ILE 21 Cb -0.19 -3.92 -0.07 0.00 -1.58 0.00 0.00 42.46 36.69 1ude s ILE 21 CO 0.11 0.24 -0.05 -0.62 -1.23 0.00 0.00 174.94 173.39 1ude n GLU 22 N 2.45 1.08 -3.90 2.79 1.02 -0.64 0.10 120.64 123.53 1ude n GLU 22 Ca 0.04 0.04 -0.30 0.00 -0.02 0.00 0.00 57.16 56.92 1ude n GLU 22 Cb 0.45 -1.20 -0.16 0.00 -0.02 0.00 0.00 31.44 30.52 1ude n GLU 22 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1ude s ILE 23 N -2.19 1.30 0.35 -3.67 1.01 -0.13 -4.60 121.20 113.26 1ude s ILE 23 Ca -0.10 -0.99 -0.27 0.00 0.00 0.00 0.00 60.65 59.28 1ude s ILE 23 Cb 0.03 -1.58 -0.09 0.00 0.01 0.00 0.00 42.46 40.83 1ude s ILE 23 CO 0.26 -0.06 1.19 -2.16 0.00 0.00 0.00 174.94 174.17 1ude s PRO 24 N 1.51 4.29 0.38 2.79 0.04 -1.26 -0.54 135.00 142.21 1ude s PRO 24 Ca -0.04 1.93 -0.25 0.00 0.04 0.00 0.00 61.00 62.69 1ude s PRO 24 Cb -0.18 -2.92 -0.12 0.00 0.04 0.00 0.00 34.50 31.32 1ude s PRO 24 CO -0.07 -0.14 0.83 1.17 0.04 0.00 0.00 177.00 178.83 1ude n LYS 25 N 0.56 1.02 -0.29 4.56 4.81 -1.15 -1.92 118.16 125.74 1ude n LYS 25 Ca 0.02 0.36 0.00 0.00 -0.87 0.00 0.00 58.31 57.82 1ude n LYS 25 Cb 0.45 -1.76 0.00 0.00 0.02 0.00 0.00 35.03 33.73 1ude n LYS 25 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ude n GLY 26 N 1.43 0.92 3.79 3.14 0.00 0.12 -4.71 105.19 109.88 1ude n GLY 26 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1ude n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ude s SER 27 N -2.96 7.28 -0.11 1.61 0.01 -0.81 -4.55 113.70 114.17 1ude s SER 27 Ca 0.00 1.51 0.18 0.00 1.31 0.00 0.00 55.95 58.95 1ude s SER 27 Cb 0.00 -2.45 -0.24 0.00 0.21 0.00 0.00 66.02 63.54 1ude s SER 27 CO 0.00 0.22 0.35 -1.14 0.41 0.00 0.00 173.24 173.08 1ude n ARG 28 N 1.69 0.67 -2.33 12.44 0.63 -1.26 -0.11 116.66 128.37 1ude n ARG 28 Ca -0.07 0.05 -0.43 0.00 -0.92 0.00 0.00 57.85 56.48 1ude n ARG 28 Cb 0.49 -1.61 -0.02 0.00 0.45 0.00 0.00 32.46 31.77 1ude n ARG 28 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 1ude s ASN 29 N -5.49 6.80 -0.39 6.15 0.01 -1.26 -2.02 114.94 118.75 1ude s ASN 29 Ca -0.08 1.68 -0.20 0.00 -0.71 0.00 0.00 52.86 53.55 1ude s ASN 29 Cb 0.08 -2.54 0.01 0.00 0.41 0.00 0.00 41.25 39.21 1ude s ASN 29 CO 0.84 -0.89 0.59 -0.75 -1.51 0.00 0.00 177.10 175.38 1ude s LYS 30 N 3.81 3.45 0.61 -0.60 2.20 0.29 -4.96 119.74 124.55 1ude s LYS 30 Ca 0.59 -0.24 0.06 0.00 -0.36 0.00 0.00 55.97 56.02 1ude s LYS 30 Cb -0.23 -3.88 0.11 0.00 -1.51 0.00 0.00 37.83 32.32 1ude s LYS 30 CO 0.20 -0.83 0.85 0.66 -0.36 0.00 0.00 175.35 175.86 1ude n TYR 31 N 6.02 -2.55 -3.64 4.03 4.02 -1.26 0.14 117.16 123.92 1ude n TYR 31 Ca -0.03 -1.92 -0.09 0.00 -0.01 0.00 0.00 57.90 55.85 1ude n TYR 31 Cb 0.48 -0.60 -0.07 0.00 -0.02 0.00 0.00 39.34 39.14 1ude n TYR 31 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1ude s GLU 32 N -4.72 0.61 0.16 -0.72 2.56 -0.41 -4.59 118.70 111.59 1ude s GLU 32 Ca 0.61 0.82 -0.30 0.00 0.00 0.00 0.00 54.97 56.09 1ude s GLU 32 Cb -0.04 0.25 -0.08 0.00 2.00 0.00 0.00 34.13 36.26 1ude s GLU 32 CO 0.39 -0.09 1.27 -1.17 -0.56 0.00 0.00 175.26 175.10 1ude s LEU 33 N 0.64 4.41 -0.02 2.70 2.96 -1.26 -1.83 118.68 126.27 1ude s LEU 33 Ca -0.01 2.28 -0.25 0.00 -0.22 0.00 0.00 54.13 55.93 1ude s LEU 33 Cb -0.05 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 1ude s LEU 33 CO -0.07 -0.49 0.75 -0.62 -1.32 0.00 0.00 176.35 174.60 1ude s ASP 34 N 0.49 7.10 0.06 3.68 -1.08 -0.56 -4.94 116.67 121.42 1ude s ASP 34 Ca 0.57 1.32 0.04 0.00 -0.52 0.00 0.00 52.55 53.96 1ude s ASP 34 Cb -0.34 -2.45 -0.24 0.00 -1.46 0.00 0.00 42.92 38.43 1ude s ASP 34 CO 0.35 -0.09 1.05 0.50 0.52 0.00 0.00 175.17 177.51 1ude h LYS 35 N 6.40 0.09 -0.08 4.34 3.64 -1.94 0.60 116.57 129.62 1ude h LYS 35 Ca -0.42 -0.16 -0.14 0.00 -1.27 0.00 0.00 60.65 58.66 1ude h LYS 35 Cb 1.20 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 1ude h LYS 35 CO 0.74 0.96 -0.58 1.05 -2.27 0.00 0.00 179.45 179.35 1ude h GLU 36 N 0.03 0.27 0.00 1.90 4.11 -1.98 -3.39 114.58 115.52 1ude h GLU 36 Ca -0.13 -0.18 -0.20 0.00 0.07 0.00 0.00 59.36 58.92 1ude h GLU 36 Cb 1.90 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 31.14 1ude h GLU 36 CO 0.14 0.78 -1.65 0.25 0.07 0.00 0.00 179.01 178.59 1ude n THR 37 N -3.89 0.65 0.00 -1.06 -2.24 -1.24 -5.02 114.28 101.48 1ude n THR 37 Ca -0.02 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1ude n THR 37 Cb 0.61 -1.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.17 1ude n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ude n GLY 38 N 2.26 1.02 3.73 3.38 0.00 0.21 -3.90 105.19 111.89 1ude n GLY 38 Ca -0.23 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 1ude n GLY 38 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ude s LEU 39 N 0.00 3.46 0.05 0.99 2.96 -1.26 -4.72 118.68 120.16 1ude s LEU 39 Ca 0.00 -0.49 -0.30 0.00 -0.22 0.00 0.00 54.13 53.11 1ude s LEU 39 Cb 0.00 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.66 1ude s LEU 39 CO 0.00 -0.04 1.11 -0.22 -1.32 0.00 0.00 176.35 175.88 1ude s LEU 40 N -3.76 4.38 0.06 -0.68 2.96 -1.26 -1.50 118.68 118.89 1ude s LEU 40 Ca 0.33 1.91 0.07 0.00 -0.22 0.00 0.00 54.13 56.21 1ude s LEU 40 Cb -0.07 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 43.02 1ude s LEU 40 CO 0.22 -0.37 -0.19 -0.75 -1.32 0.00 0.00 176.35 173.94 1ude s LYS 41 N 0.88 1.17 -0.37 1.98 2.20 -0.76 -4.95 119.74 119.89 1ude s LYS 41 Ca 0.55 -0.99 -0.29 0.00 -0.36 0.00 0.00 55.97 54.89 1ude s LYS 41 Cb -0.27 -1.31 0.02 0.00 -1.51 0.00 0.00 37.83 34.76 1ude s LYS 41 CO 0.29 0.32 1.09 -1.17 -0.36 0.00 0.00 175.35 175.52 1ude s LEU 42 N -1.46 3.85 -0.02 5.43 2.96 -1.26 -1.29 118.68 126.89 1ude s LEU 42 Ca 0.05 0.87 -0.04 0.00 -0.22 0.00 0.00 54.13 54.79 1ude s LEU 42 Cb -0.09 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.04 1ude s LEU 42 CO 0.03 -0.99 0.40 -0.78 -1.32 0.00 0.00 176.35 173.69 1ude h ASP 43 N 8.43 -0.13 -5.05 3.68 1.82 -0.55 -3.48 116.42 121.14 1ude h ASP 43 Ca -0.21 0.00 0.04 0.00 -0.39 0.00 0.00 57.03 56.47 1ude h ASP 43 Cb 1.06 0.03 -0.06 0.00 0.68 0.00 0.00 39.33 41.04 1ude h ASP 43 CO 1.06 0.02 0.16 0.00 -1.61 0.00 0.00 179.24 178.87 1ude s ARG 44 N -2.14 1.69 -0.31 0.28 1.70 -0.95 -5.01 118.95 114.21 1ude s ARG 44 Ca -0.02 -0.99 -0.10 0.00 -0.47 0.00 0.00 55.73 54.14 1ude s ARG 44 Cb 0.00 0.58 -0.02 0.00 -0.57 0.00 0.00 34.95 34.94 1ude s ARG 44 CO 0.07 -0.76 0.17 0.14 -1.08 0.00 0.00 175.30 173.84 1ude s VAL 45 N -3.92 4.82 -0.03 4.99 -7.23 -1.26 -0.55 120.40 117.21 1ude s VAL 45 Ca 0.12 -0.27 -0.37 0.00 -1.81 0.00 0.00 61.98 59.65 1ude s VAL 45 Cb -0.04 -3.42 -0.18 0.00 0.56 0.00 0.00 36.38 33.29 1ude s VAL 45 CO 0.05 0.10 1.02 0.18 -0.31 0.00 0.00 175.10 176.15 1ude n LEU 46 N 5.01 0.07 0.00 1.32 4.77 -0.86 -4.78 117.00 122.54 1ude n LEU 46 Ca -0.14 1.07 0.06 0.00 -0.03 0.00 0.00 56.01 56.97 1ude n LEU 46 Cb 0.50 -0.84 0.30 0.00 -2.33 0.00 0.00 43.42 41.05 1ude n LEU 46 CO 0.34 -1.69 0.63 -1.22 -1.33 0.00 0.00 177.39 174.13 1ude n TYR 47 N 1.55 0.00 -4.07 -1.77 4.02 -1.26 -4.67 117.16 110.95 1ude n TYR 47 Ca 0.19 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.97 1ude n TYR 47 Cb 0.06 -0.26 -0.11 0.00 -0.02 0.00 0.00 39.34 39.02 1ude n TYR 47 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1ude s THR 48 N -2.51 0.49 0.00 -0.72 -4.23 -1.26 -5.01 115.64 102.40 1ude s THR 48 Ca 0.12 -1.27 -0.00 0.00 -1.18 0.00 0.00 61.69 59.35 1ude s THR 48 Cb 0.08 -0.83 -0.01 0.00 1.34 0.00 0.00 72.50 73.07 1ude s THR 48 CO 0.18 -0.54 0.50 -0.81 -0.54 0.00 0.00 174.62 173.41 1ude n PRO 49 N 1.09 0.19 -3.24 3.99 -0.04 -1.26 -4.83 135.00 130.90 1ude n PRO 49 Ca -0.20 -0.05 -0.34 0.00 -0.04 0.00 0.00 63.50 62.87 1ude n PRO 49 Cb 0.56 -1.47 -0.06 0.00 -0.04 0.00 0.00 33.50 32.49 1ude n PRO 49 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1ude s PHE 50 N 2.03 3.53 -0.15 0.54 2.99 -1.26 -5.07 117.98 120.59 1ude s PHE 50 Ca 0.03 1.15 0.01 0.00 0.00 0.00 0.00 56.93 58.12 1ude s PHE 50 Cb 0.01 -2.46 0.02 0.00 0.00 0.00 0.00 43.02 40.60 1ude s PHE 50 CO 0.00 0.30 -0.17 -1.01 -0.00 0.00 0.00 175.22 174.34 1ude s HIS 51 N -1.67 2.33 -0.46 0.36 3.76 -1.26 -4.31 115.29 114.03 1ude s HIS 51 Ca 0.45 -1.28 -0.46 0.00 -0.15 0.00 0.00 55.06 53.62 1ude s HIS 51 Cb -0.14 -1.66 -0.20 0.00 1.11 0.00 0.00 32.58 31.69 1ude s HIS 51 CO 0.20 -0.66 1.54 0.66 -0.85 0.00 0.00 174.74 175.62 1ude n TYR 52 N 4.56 1.66 0.67 1.40 4.02 0.84 -4.55 117.16 125.76 1ude n TYR 52 Ca -0.19 1.13 0.09 0.00 -0.01 0.00 0.00 57.90 58.92 1ude n TYR 52 Cb 0.50 -2.18 0.40 0.00 -0.02 0.00 0.00 39.34 38.04 1ude n TYR 52 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1ude n PRO 53 N 3.79 0.06 -3.96 -0.72 -0.04 -1.26 0.15 135.00 133.02 1ude n PRO 53 Ca 0.30 0.18 -0.11 0.00 -0.04 0.00 0.00 63.50 63.83 1ude n PRO 53 Cb -0.05 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.89 1ude n PRO 53 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ude s VAL 54 N -2.90 0.00 -0.39 0.52 -7.23 -1.26 -4.89 120.40 104.26 1ude s VAL 54 Ca 0.11 -1.32 -0.24 0.00 -1.81 0.00 0.00 61.98 58.71 1ude s VAL 54 Cb 0.12 -2.53 0.02 0.00 0.56 0.00 0.00 36.38 34.54 1ude s VAL 54 CO 0.31 0.00 0.86 -1.81 -0.31 0.00 0.00 175.10 174.15 1ude s ASP 55 N -3.10 6.58 -0.03 4.85 -0.00 -0.69 -2.93 116.67 121.35 1ude s ASP 55 Ca 0.22 0.36 -0.11 0.00 -0.00 0.00 0.00 52.55 53.02 1ude s ASP 55 Cb -0.02 -2.43 -0.05 0.00 -0.00 0.00 0.00 42.92 40.42 1ude s ASP 55 CO 0.13 -0.84 0.31 -0.47 -0.00 0.00 0.00 175.17 174.30 1ude s TYR 56 N 3.35 3.67 0.00 4.23 5.04 0.30 -0.83 117.35 133.10 1ude s TYR 56 Ca 0.35 0.80 0.00 0.00 -2.44 0.00 0.00 57.07 55.77 1ude s TYR 56 Cb -0.12 -2.14 0.00 0.00 0.35 0.00 0.00 41.96 40.04 1ude s TYR 56 CO 0.19 0.66 0.00 0.41 -1.34 0.00 0.00 175.55 175.48 1ude n GLY 57 N 1.74 2.01 3.31 8.97 0.00 -0.42 -0.96 105.19 119.84 1ude n GLY 57 Ca -0.15 -0.69 -0.16 0.00 0.00 0.00 0.00 46.02 45.01 1ude n GLY 57 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ude s ILE 58 N -2.57 0.84 -0.23 -0.61 -4.36 -0.12 -0.81 121.20 113.33 1ude s ILE 58 Ca 0.00 -2.01 -0.07 0.00 -0.26 0.00 0.00 60.65 58.31 1ude s ILE 58 Cb 0.00 -2.37 -0.03 0.00 1.25 0.00 0.00 42.46 41.31 1ude s ILE 58 CO 0.00 -0.28 0.06 -0.63 0.24 0.00 0.00 174.94 174.33 1ude s ILE 59 N -3.55 4.37 0.09 8.37 1.01 -0.64 -0.29 121.20 130.56 1ude s ILE 59 Ca 0.30 -0.16 -0.36 0.00 0.00 0.00 0.00 60.65 60.42 1ude s ILE 59 Cb 0.06 -3.02 -0.17 0.00 0.01 0.00 0.00 42.46 39.34 1ude s ILE 59 CO 0.09 0.38 1.25 -2.65 0.00 0.00 0.00 174.94 174.00 1ude n PRO 60 N 4.51 0.94 -3.46 2.79 -0.02 -1.26 -3.63 135.00 134.87 1ude n PRO 60 Ca -0.16 0.34 -0.14 0.00 -2.02 0.00 0.00 63.50 61.51 1ude n PRO 60 Cb 0.52 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 1ude n PRO 60 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ude n ARG 61 N 2.19 -1.47 -4.04 -0.52 1.74 -1.26 -3.43 116.66 109.86 1ude n ARG 61 Ca 0.18 1.11 -0.12 0.00 -0.77 0.00 0.00 57.85 58.25 1ude n ARG 61 Cb 0.18 -3.82 -0.11 0.00 -1.02 0.00 0.00 32.46 27.68 1ude n ARG 61 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1ude s THR 62 N -2.95 0.40 -0.31 0.55 -4.23 -1.24 -4.70 115.64 103.17 1ude s THR 62 Ca 0.01 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.55 1ude s THR 62 Cb -0.00 -0.49 0.10 0.00 1.34 0.00 0.00 72.50 73.44 1ude s THR 62 CO 0.83 -0.39 0.07 0.86 -0.54 0.00 0.00 174.62 175.46 1ude s TRP 63 N -1.33 2.25 -0.68 3.99 -0.11 0.21 -4.26 118.94 119.00 1ude s TRP 63 Ca -0.11 -2.03 -0.22 0.00 1.22 0.00 0.00 56.10 54.96 1ude s TRP 63 Cb -0.10 -1.99 0.08 0.00 -1.50 0.00 0.00 33.47 29.97 1ude s TRP 63 CO -0.00 -0.88 0.95 -0.47 -4.62 0.00 0.00 176.95 171.93 1ude s TYR 64 N 1.43 2.75 0.00 5.86 6.14 -1.09 -4.51 117.35 127.93 1ude s TYR 64 Ca 0.09 -0.68 0.00 0.00 0.64 0.00 0.00 57.07 57.12 1ude s TYR 64 Cb -0.18 -4.26 0.00 0.00 0.42 0.00 0.00 41.96 37.94 1ude s TYR 64 CO -0.19 -1.60 0.00 0.39 0.64 0.00 0.00 175.55 174.79 1ude n GLU 65 N 7.44 0.00 -2.06 4.97 1.02 -1.26 -3.89 120.64 126.86 1ude n GLU 65 Ca -0.02 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.69 1ude n GLU 65 Cb 0.45 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.85 1ude n GLU 65 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1ude s ASP 66 N 0.00 6.07 0.11 1.62 -1.08 -1.26 -4.45 116.67 117.68 1ude s ASP 66 Ca 0.00 1.35 0.00 0.00 -0.52 0.00 0.00 52.55 53.38 1ude s ASP 66 Cb 0.00 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.93 1ude s ASP 66 CO 0.00 -1.55 0.00 0.61 0.52 0.00 0.00 175.17 174.75 1ude n GLY 67 N 5.19 1.03 1.01 2.66 0.00 -1.25 -5.04 105.19 108.79 1ude n GLY 67 Ca 0.21 -0.81 -0.15 0.00 0.00 0.00 0.00 46.02 45.27 1ude n GLY 67 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ude n ASP 68 N 1.30 -0.30 -4.81 1.61 -0.08 -1.26 -4.34 116.55 108.67 1ude n ASP 68 Ca 0.00 0.34 -0.29 0.00 -1.51 0.00 0.00 54.79 53.32 1ude n ASP 68 Cb 0.00 -0.28 0.11 0.00 2.34 0.00 0.00 41.12 43.29 1ude n ASP 68 CO 0.00 0.00 0.00 -2.84 0.12 0.00 0.00 177.20 174.48 1ude s PRO 69 N -0.24 1.74 -0.04 -0.67 0.02 -1.26 -2.68 135.00 131.87 1ude s PRO 69 Ca 0.21 0.44 -0.30 0.00 0.02 0.00 0.00 61.00 61.37 1ude s PRO 69 Cb -0.29 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.29 1ude s PRO 69 CO 0.17 -1.82 1.36 0.12 -0.33 0.00 0.00 177.00 176.50 1ude s PHE 70 N -3.25 2.85 0.30 6.54 2.19 -1.26 -4.70 117.98 120.65 1ude s PHE 70 Ca 0.62 0.87 -0.20 0.00 0.33 0.00 0.00 56.93 58.55 1ude s PHE 70 Cb -0.14 -3.61 -0.09 0.00 -1.31 0.00 0.00 43.02 37.86 1ude s PHE 70 CO 0.53 -2.24 0.81 -0.51 1.83 0.00 0.00 175.22 175.65 1ude s ASP 71 N 1.93 7.03 -0.01 6.13 -0.00 -1.26 -1.62 116.67 128.88 1ude s ASP 71 Ca 0.62 1.52 0.01 0.00 -0.00 0.00 0.00 52.55 54.70 1ude s ASP 71 Cb -0.29 -2.46 0.00 0.00 -0.00 0.00 0.00 42.92 40.17 1ude s ASP 71 CO 0.24 -0.11 -0.03 -0.51 -0.00 0.00 0.00 175.17 174.76 1ude s ILE 72 N -1.77 0.29 -0.24 0.77 2.07 0.01 -1.64 121.20 120.69 1ude s ILE 72 Ca 0.50 -0.12 -0.05 0.00 -1.41 0.00 0.00 60.65 59.57 1ude s ILE 72 Cb -0.14 -0.28 -0.01 0.00 0.13 0.00 0.00 42.46 42.16 1ude s ILE 72 CO 0.19 0.10 -0.00 -0.04 -1.91 0.00 0.00 174.94 173.28 1ude s MET 73 N 0.14 3.41 -0.15 3.50 -1.94 0.31 -1.29 119.30 123.27 1ude s MET 73 Ca -0.01 -0.62 -0.05 0.00 -1.71 0.00 0.00 55.69 53.30 1ude s MET 73 Cb -0.04 -3.13 -0.04 0.00 2.01 0.00 0.00 34.83 33.63 1ude s MET 73 CO -0.00 -0.23 0.04 0.08 -0.01 0.00 0.00 175.02 174.90 1ude s VAL 74 N 1.51 4.63 -0.10 -6.03 1.01 -0.01 -0.27 120.40 121.14 1ude s VAL 74 Ca 0.05 -0.11 -0.24 0.00 0.00 0.00 0.00 61.98 61.69 1ude s VAL 74 Cb -0.15 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 1ude s VAL 74 CO -0.01 0.52 0.75 -0.63 0.00 0.00 0.00 175.10 175.73 1ude s ILE 75 N -0.11 4.99 -0.03 2.22 1.01 -1.13 -1.71 121.20 126.44 1ude s ILE 75 Ca 0.06 1.52 -0.01 0.00 0.00 0.00 0.00 60.65 62.22 1ude s ILE 75 Cb -0.12 -4.08 0.02 0.00 0.01 0.00 0.00 42.46 38.29 1ude s ILE 75 CO 0.01 0.17 0.07 -0.32 0.00 0.00 0.00 174.94 174.87 1ude s MET 76 N 1.25 0.03 0.32 2.79 1.75 -1.26 -3.95 119.30 120.24 1ude s MET 76 Ca 0.38 0.18 0.26 0.00 -1.25 0.00 0.00 55.69 55.26 1ude s MET 76 Cb -0.18 -0.11 0.85 0.00 2.84 0.00 0.00 34.83 38.23 1ude s MET 76 CO 0.17 -0.10 1.76 0.00 -0.65 0.00 0.00 175.02 176.20 1ude h ARG 77 N 6.74 0.00 -2.97 4.11 3.08 -2.00 -3.42 114.38 119.92 1ude h ARG 77 Ca -0.36 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.45 1ude h ARG 77 Cb 1.16 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 30.88 1ude h ARG 77 CO 0.47 0.00 -0.56 -2.00 -1.07 0.00 0.00 179.97 176.81 1ude s GLU 78 N -3.27 0.12 0.53 0.04 2.12 -1.26 -5.15 118.70 111.83 1ude s GLU 78 Ca 0.07 0.64 -0.22 0.00 0.36 0.00 0.00 54.97 55.83 1ude s GLU 78 Cb 0.10 -0.13 -0.06 0.00 0.26 0.00 0.00 34.13 34.30 1ude s GLU 78 CO 0.55 -0.27 1.18 -0.35 -0.54 0.00 0.00 175.26 175.83 1ude n PRO 79 N 5.14 1.43 -2.89 4.30 -0.04 -1.26 -5.02 135.00 136.66 1ude n PRO 79 Ca -0.09 0.53 -0.21 0.00 -0.04 0.00 0.00 63.50 63.68 1ude n PRO 79 Cb 0.50 -2.36 0.08 0.00 -0.04 0.00 0.00 33.50 31.69 1ude n PRO 79 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1ude s THR 80 N -1.34 2.06 0.22 0.52 -4.23 -1.26 -4.97 115.64 106.64 1ude s THR 80 Ca 0.70 -0.86 -0.06 0.00 -1.18 0.00 0.00 61.69 60.30 1ude s THR 80 Cb -0.45 -2.20 -0.06 0.00 1.34 0.00 0.00 72.50 71.14 1ude s THR 80 CO 0.51 0.00 0.48 -0.31 -0.54 0.00 0.00 174.62 174.76 1ude s TYR 81 N -2.86 3.46 0.69 3.99 1.51 -1.26 -4.56 117.35 118.32 1ude s TYR 81 Ca 0.64 0.64 -0.17 0.00 -1.01 0.00 0.00 57.07 57.18 1ude s TYR 81 Cb -0.05 -2.09 0.00 0.00 -0.11 0.00 0.00 41.96 39.72 1ude s TYR 81 CO 0.41 0.30 1.10 -0.35 -1.11 0.00 0.00 175.55 175.90 1ude n PRO 82 N -0.40 0.72 -1.33 -1.71 -0.04 -1.26 -2.17 135.00 128.80 1ude n PRO 82 Ca -0.02 0.30 -0.11 0.00 -0.04 0.00 0.00 63.50 63.63 1ude n PRO 82 Cb 0.53 -2.34 -0.05 0.00 -0.04 0.00 0.00 33.50 31.60 1ude n PRO 82 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1ude n LEU 83 N -1.81 -0.79 -4.79 1.53 4.77 0.12 -5.00 117.00 111.02 1ude n LEU 83 Ca 0.14 0.28 -0.37 0.00 -0.03 0.00 0.00 56.01 56.03 1ude n LEU 83 Cb 0.49 -1.89 -0.06 0.00 -2.33 0.00 0.00 43.42 39.63 1ude n LEU 83 CO 0.48 -0.64 0.05 -0.89 -1.33 0.00 0.00 177.39 175.06 1ude s THR 84 N -2.38 5.18 -0.04 -5.08 2.01 -0.92 -4.84 115.64 109.57 1ude s THR 84 Ca 0.00 0.71 -0.20 0.00 0.31 0.00 0.00 61.69 62.52 1ude s THR 84 Cb 0.00 -3.67 -0.05 0.00 0.01 0.00 0.00 72.50 68.79 1ude s THR 84 CO 0.00 0.49 0.57 -0.63 -0.69 0.00 0.00 174.62 174.36 1ude s ILE 85 N -0.40 5.01 -0.03 1.82 1.01 -1.26 -1.74 121.20 125.62 1ude s ILE 85 Ca 0.21 1.17 0.04 0.00 0.00 0.00 0.00 60.65 62.08 1ude s ILE 85 Cb -0.15 -3.90 -0.01 0.00 0.01 0.00 0.00 42.46 38.41 1ude s ILE 85 CO 0.09 0.38 -0.16 -0.63 0.00 0.00 0.00 174.94 174.63 1ude s ILE 86 N 0.12 1.27 -0.25 2.92 1.01 -0.08 -4.91 121.20 121.27 1ude s ILE 86 Ca 0.30 -0.66 -0.26 0.00 0.00 0.00 0.00 60.65 60.04 1ude s ILE 86 Cb -0.17 -1.08 -0.00 0.00 0.01 0.00 0.00 42.46 41.22 1ude s ILE 86 CO 0.15 0.37 0.88 -1.61 0.00 0.00 0.00 174.94 174.73 1ude s GLU 87 N -0.15 4.18 -0.03 2.79 2.02 -1.26 0.11 118.70 126.36 1ude s GLU 87 Ca 0.01 1.01 0.07 0.00 0.02 0.00 0.00 54.97 56.08 1ude s GLU 87 Cb -0.08 -3.65 -0.02 0.00 0.10 0.00 0.00 34.13 30.48 1ude s GLU 87 CO 0.01 -0.57 -0.24 0.00 0.02 0.00 0.00 175.26 174.47 1ude s ALA 88 N 2.96 2.03 -0.51 5.21 0.00 0.38 -2.27 121.76 129.57 1ude s ALA 88 Ca 0.37 -1.02 -0.15 0.00 0.00 0.00 0.00 51.96 51.16 1ude s ALA 88 Cb -0.15 -0.56 0.11 0.00 0.00 0.00 0.00 23.12 22.52 1ude s ALA 88 CO 0.08 0.46 0.45 0.50 0.00 0.00 0.00 175.76 177.24 1ude s ARG 89 N -0.41 2.92 0.47 0.00 3.52 0.06 0.47 118.95 126.00 1ude s ARG 89 Ca 0.05 -1.61 -0.23 0.00 -0.13 0.00 0.00 55.73 53.81 1ude s ARG 89 Cb -0.11 -4.20 -0.09 0.00 -1.56 0.00 0.00 34.95 29.00 1ude s ARG 89 CO 0.01 -1.22 1.10 -0.35 -0.81 0.00 0.00 175.30 174.02 1ude n PRO 90 N 5.19 1.44 0.00 5.12 -0.04 -1.26 -1.98 135.00 143.47 1ude n PRO 90 Ca -0.13 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 63.85 1ude n PRO 90 Cb 0.41 -2.20 0.00 0.00 -0.04 0.00 0.00 33.50 31.67 1ude n PRO 90 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1ude n ILE 91 N -0.73 0.00 -3.61 0.52 -5.35 -0.04 -4.82 119.36 105.32 1ude n ILE 91 Ca 0.10 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.57 1ude n ILE 91 Cb 0.42 1.64 -0.01 0.00 -1.74 0.00 0.00 39.64 39.95 1ude n ILE 91 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1ude s GLY 92 N 0.00 -0.36 -0.21 3.28 0.00 -0.75 0.36 107.32 109.64 1ude s GLY 92 Ca 0.00 1.12 -0.00 0.00 0.00 0.00 0.00 44.72 45.84 1ude s GLY 92 CO 0.00 0.31 -0.03 -2.27 0.00 0.00 0.00 173.10 171.11 1ude s LEU 93 N -2.62 2.06 -0.11 0.66 2.96 0.22 -0.89 118.68 120.96 1ude s LEU 93 Ca 0.12 -1.01 -0.30 0.00 -0.22 0.00 0.00 54.13 52.73 1ude s LEU 93 Cb 0.02 -0.98 -0.01 0.00 0.50 0.00 0.00 46.19 45.72 1ude s LEU 93 CO -0.04 -0.25 1.03 0.12 -1.32 0.00 0.00 176.35 175.89 1ude s PHE 94 N 1.55 3.46 -0.22 5.38 2.19 0.04 -1.56 117.98 128.82 1ude s PHE 94 Ca -0.04 1.54 -0.03 0.00 0.33 0.00 0.00 56.93 58.73 1ude s PHE 94 Cb -0.18 -3.22 -0.00 0.00 -1.31 0.00 0.00 43.02 38.31 1ude s PHE 94 CO -0.07 -0.37 -0.06 0.15 1.83 0.00 0.00 175.22 176.70 1ude s LYS 95 N 2.11 3.27 0.12 10.12 1.02 0.10 -1.46 119.74 135.02 1ude s LYS 95 Ca 0.49 -0.69 -0.06 0.00 0.02 0.00 0.00 55.97 55.72 1ude s LYS 95 Cb -0.19 -2.96 -0.02 0.00 -0.52 0.00 0.00 37.83 34.14 1ude s LYS 95 CO 0.18 -0.23 0.17 0.00 -0.92 0.00 0.00 175.35 174.56 1ude s MET 96 N 1.44 0.95 -0.17 1.68 0.23 -1.26 -0.51 119.30 121.67 1ude s MET 96 Ca 0.05 -1.16 0.01 0.00 -1.03 0.00 0.00 55.69 53.56 1ude s MET 96 Cb -0.14 0.32 0.02 0.00 -1.53 0.00 0.00 34.83 33.50 1ude s MET 96 CO -0.04 -0.31 -0.20 0.42 -2.03 0.00 0.00 175.02 172.86 1ude s ILE 97 N -3.94 2.02 0.00 3.16 1.09 0.11 -0.15 121.20 123.49 1ude s ILE 97 Ca 0.13 -0.93 0.00 0.00 -1.10 0.00 0.00 60.65 58.76 1ude s ILE 97 Cb 0.05 -1.82 0.00 0.00 -1.06 0.00 0.00 42.46 39.63 1ude s ILE 97 CO -0.04 0.54 0.00 -0.67 -0.10 0.00 0.00 174.94 174.66 1ude n ASP 98 N 4.49 0.00 -3.16 3.58 -0.08 -0.87 -1.60 116.55 118.91 1ude n ASP 98 Ca -0.21 0.00 -0.36 0.00 -1.51 0.00 0.00 54.79 52.72 1ude n ASP 98 Cb 0.50 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.92 1ude n ASP 98 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1ude n SER 99 N 0.00 8.07 0.00 1.67 7.64 -1.26 -4.42 113.62 125.32 1ude n SER 99 Ca 0.00 -2.74 0.00 0.00 1.01 0.00 0.00 58.87 57.14 1ude n SER 99 Cb 0.00 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 61.73 1ude n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ude n GLY 100 N 2.83 1.24 3.52 0.23 0.00 -1.26 -5.04 105.19 106.70 1ude n GLY 100 Ca 0.69 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.46 1ude n GLY 100 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ude s ASP 101 N -3.14 3.89 0.43 1.61 1.01 -1.26 -5.06 116.67 114.15 1ude s ASP 101 Ca 0.00 -0.82 -0.25 0.00 0.71 0.00 0.00 52.55 52.18 1ude s ASP 101 Cb 0.00 -0.49 -0.08 0.00 1.01 0.00 0.00 42.92 43.36 1ude s ASP 101 CO 0.00 0.06 1.35 -0.54 0.21 0.00 0.00 175.17 176.25 1ude s LYS 102 N -3.22 3.79 -0.35 8.23 3.01 -1.26 -2.06 119.74 127.88 1ude s LYS 102 Ca 0.27 2.25 0.15 0.00 -1.01 0.00 0.00 55.97 57.63 1ude s LYS 102 Cb -0.07 -2.67 0.43 0.00 -1.01 0.00 0.00 37.83 34.51 1ude s LYS 102 CO 0.15 -0.67 1.06 -3.47 0.51 0.00 0.00 175.35 172.93 1ude n ASP 103 N -0.10 0.36 -4.63 2.83 -0.08 0.79 -4.83 116.55 110.90 1ude n ASP 103 Ca 0.05 -2.68 -0.30 0.00 -1.51 0.00 0.00 54.79 50.35 1ude n ASP 103 Cb 0.43 -0.03 0.19 0.00 2.34 0.00 0.00 41.12 44.04 1ude n ASP 103 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1ude s TYR 104 N -2.06 1.71 -0.02 -0.67 2.02 -1.26 -4.32 117.35 112.76 1ude s TYR 104 Ca 0.26 1.48 -0.10 0.00 -0.37 0.00 0.00 57.07 58.35 1ude s TYR 104 Cb 0.43 -3.21 0.01 0.00 -0.40 0.00 0.00 41.96 38.79 1ude s TYR 104 CO -0.01 -3.03 0.20 0.15 -1.57 0.00 0.00 175.55 171.30 1ude s LYS 105 N -4.65 0.49 -0.20 -0.62 1.02 -0.53 -4.77 119.74 110.48 1ude s LYS 105 Ca 0.66 -0.20 -0.25 0.00 0.02 0.00 0.00 55.97 56.21 1ude s LYS 105 Cb -0.22 0.21 -0.01 0.00 -0.52 0.00 0.00 37.83 37.29 1ude s LYS 105 CO 0.60 -0.12 0.81 0.08 -0.92 0.00 0.00 175.35 175.80 1ude s VAL 106 N -1.07 4.88 -0.39 3.17 1.01 -0.66 -0.78 120.40 126.56 1ude s VAL 106 Ca -0.12 1.56 -0.18 0.00 0.00 0.00 0.00 61.98 63.25 1ude s VAL 106 Cb -0.06 -4.11 0.01 0.00 0.00 0.00 0.00 36.38 32.22 1ude s VAL 106 CO 0.02 0.00 0.48 -0.22 0.00 0.00 0.00 175.10 175.38 1ude s LEU 107 N 2.36 4.58 0.00 3.92 2.96 -0.07 0.11 118.68 132.54 1ude s LEU 107 Ca 0.36 -0.35 0.00 0.00 -0.22 0.00 0.00 54.13 53.92 1ude s LEU 107 Cb -0.16 -2.49 -0.00 0.00 0.50 0.00 0.00 46.19 44.04 1ude s LEU 107 CO 0.10 -0.53 0.00 0.00 -1.32 0.00 0.00 176.35 174.60 1ude n ALA 108 N 5.70 0.18 -3.27 5.97 0.00 0.63 -0.87 120.51 128.85 1ude n ALA 108 Ca -0.06 -0.91 -0.14 0.00 0.00 0.00 0.00 53.44 52.33 1ude n ALA 108 Cb 0.48 0.50 -0.08 0.00 0.00 0.00 0.00 19.45 20.35 1ude n ALA 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ude s VAL 109 N -1.75 0.05 0.11 0.00 0.11 -0.84 -2.83 120.40 115.25 1ude s VAL 109 Ca 0.00 -0.39 -0.31 0.00 -2.93 0.00 0.00 61.98 58.36 1ude s VAL 109 Cb 0.00 -0.66 -0.08 0.00 -1.53 0.00 0.00 36.38 34.11 1ude s VAL 109 CO 0.00 -0.21 1.48 -2.16 -3.33 0.00 0.00 175.10 170.88 1ude s PRO 110 N -1.21 4.27 0.02 1.54 0.04 -1.25 -0.76 135.00 137.65 1ude s PRO 110 Ca -0.12 2.19 -0.25 0.00 0.04 0.00 0.00 61.00 62.85 1ude s PRO 110 Cb -0.04 -3.29 -0.18 0.00 0.04 0.00 0.00 34.50 31.03 1ude s PRO 110 CO 0.05 -0.54 1.43 0.28 0.04 0.00 0.00 177.00 178.26 1ude h VAL 111 N 4.31 1.18 0.00 -0.36 2.07 -1.82 -3.25 116.25 118.37 1ude h VAL 111 Ca -0.42 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.42 1ude h VAL 111 Cb 1.20 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 1ude h VAL 111 CO 0.89 0.17 0.00 -0.62 0.02 0.00 0.00 177.57 178.03 1ude n GLU 112 N -4.97 0.76 -3.59 1.57 -0.58 -1.26 -4.51 120.64 108.06 1ude n GLU 112 Ca -0.08 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.37 1ude n GLU 112 Cb 0.17 -1.23 -0.13 0.00 -0.57 0.00 0.00 31.44 29.68 1ude n GLU 112 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1ude s ASP 113 N 0.48 3.46 0.65 1.62 -1.08 -1.23 -5.01 116.67 115.55 1ude s ASP 113 Ca 0.00 -2.00 0.10 0.00 -0.52 0.00 0.00 52.55 50.13 1ude s ASP 113 Cb 0.00 -0.63 0.44 0.00 -1.46 0.00 0.00 42.92 41.27 1ude s ASP 113 CO 0.00 -0.35 1.21 -0.65 0.52 0.00 0.00 175.17 175.90 1ude h PRO 114 N 7.45 0.00 -1.00 4.34 0.11 -1.87 -0.23 132.00 140.79 1ude h PRO 114 Ca -0.05 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.13 1ude h PRO 114 Cb 0.98 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.02 1ude h PRO 114 CO 0.39 0.00 0.64 -0.92 -0.21 0.00 0.00 178.00 177.90 1ude h TYR 115 N 0.00 1.19 -0.86 0.65 5.03 -1.95 -1.37 116.97 119.66 1ude h TYR 115 Ca 0.10 0.03 -0.47 0.00 2.58 0.00 0.00 58.73 60.97 1ude h TYR 115 Cb 1.98 -0.39 -0.27 0.00 1.55 0.00 0.00 36.73 39.60 1ude h TYR 115 CO 0.00 0.61 0.49 1.19 -1.32 0.00 0.00 178.16 179.13 1ude n PHE 116 N -4.52 2.68 -0.19 -3.82 3.01 -0.10 -4.61 117.46 109.91 1ude n PHE 116 Ca 0.15 -1.97 -0.10 0.00 1.01 0.00 0.00 57.45 56.54 1ude n PHE 116 Cb 0.19 -0.91 0.01 0.00 -0.01 0.00 0.00 39.48 38.77 1ude n PHE 116 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1ude h LYS 117 N 1.17 1.00 -0.78 -1.08 3.64 -1.36 -2.89 116.57 116.27 1ude h LYS 117 Ca 0.54 -0.34 -0.15 0.00 -1.27 0.00 0.00 60.65 59.43 1ude h LYS 117 Cb 2.31 -0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 33.96 1ude h LYS 117 CO 1.02 1.02 0.20 -0.25 -2.27 0.00 0.00 179.45 179.16 1ude n ASP 118 N -4.21 4.45 -4.55 4.20 8.00 -1.26 -4.83 116.55 118.35 1ude n ASP 118 Ca 0.02 -2.97 -0.38 0.00 0.71 0.00 0.00 54.79 52.17 1ude n ASP 118 Cb 0.36 -0.70 -0.11 0.00 -0.02 0.00 0.00 41.12 40.65 1ude n ASP 118 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1ude s TRP 119 N -2.55 3.19 0.00 1.24 0.52 -1.09 -4.91 118.94 115.35 1ude s TRP 119 Ca 0.46 -0.06 0.00 0.00 0.02 0.00 0.00 56.10 56.52 1ude s TRP 119 Cb 0.36 -2.36 0.00 0.00 -1.15 0.00 0.00 33.47 30.32 1ude s TRP 119 CO 0.12 -0.24 0.17 1.63 0.02 0.00 0.00 176.95 178.65 1ude n LYS 120 N 5.04 0.00 -3.64 4.98 5.02 -1.26 -5.01 118.16 123.29 1ude n LYS 120 Ca -0.14 -0.17 -0.10 0.00 -2.02 0.00 0.00 58.31 55.88 1ude n LYS 120 Cb 0.51 -0.42 -0.07 0.00 -0.02 0.00 0.00 35.03 35.04 1ude n LYS 120 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ude s ASP 121 N 0.00 -0.53 0.13 4.39 3.68 -1.26 -4.56 116.67 118.53 1ude s ASP 121 Ca 0.00 1.01 0.04 0.00 2.13 0.00 0.00 52.55 55.73 1ude s ASP 121 Cb 0.00 1.03 0.41 0.00 -1.45 0.00 0.00 42.92 42.91 1ude s ASP 121 CO 0.00 -0.17 0.62 2.30 0.13 0.00 0.00 175.17 178.04 1ude n ILE 122 N 2.36 -0.17 0.51 4.11 -5.35 0.16 0.38 119.36 121.36 1ude n ILE 122 Ca -0.13 0.83 0.02 0.00 -0.27 0.00 0.00 62.75 63.21 1ude n ILE 122 Cb 0.56 -1.28 0.12 0.00 -1.74 0.00 0.00 39.64 37.30 1ude n ILE 122 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1ude n SER 123 N -4.15 0.00 -0.90 7.28 3.41 -1.26 -0.32 113.62 117.68 1ude n SER 123 Ca 0.12 -0.38 0.10 0.00 -0.26 0.00 0.00 58.87 58.45 1ude n SER 123 Cb 0.40 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.49 1ude n SER 123 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1ude n ASP 124 N -0.76 2.96 -4.22 4.04 8.00 1.24 -4.90 116.55 122.92 1ude n ASP 124 Ca 0.03 -1.88 -0.34 0.00 0.71 0.00 0.00 54.79 53.31 1ude n ASP 124 Cb 0.01 -0.12 -0.15 0.00 -0.02 0.00 0.00 41.12 40.84 1ude n ASP 124 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ude s VAL 125 N -1.46 2.87 0.36 2.53 1.01 0.57 -4.91 120.40 121.36 1ude s VAL 125 Ca 0.29 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 61.27 1ude s VAL 125 Cb 0.18 -2.35 -0.14 0.00 0.00 0.00 0.00 36.38 34.07 1ude s VAL 125 CO 0.26 0.36 0.08 -0.81 0.00 0.00 0.00 175.10 174.99 1ude n PRO 126 N 4.71 0.00 0.07 2.72 -0.04 -1.26 -4.75 135.00 136.45 1ude n PRO 126 Ca -0.18 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.23 1ude n PRO 126 Cb 0.49 -0.90 0.14 0.00 -0.04 0.00 0.00 33.50 33.20 1ude n PRO 126 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1ude h LYS 127 N 0.30 0.29 -0.26 0.54 2.10 -1.98 -3.09 116.57 114.47 1ude h LYS 127 Ca -0.33 -0.17 0.01 0.00 -2.00 0.00 0.00 60.65 58.15 1ude h LYS 127 Cb 1.30 0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 32.63 1ude h LYS 127 CO 0.42 0.75 0.17 0.00 -2.00 0.00 0.00 179.45 178.79 1ude h ALA 128 N 1.22 1.85 0.13 0.07 0.00 -1.99 -0.86 119.26 119.69 1ude h ALA 128 Ca 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ude h ALA 128 Cb 1.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1ude h ALA 128 CO 0.08 0.13 -0.06 0.35 0.00 0.00 0.00 179.25 179.75 1ude h PHE 129 N 0.32 -0.16 -0.82 0.00 3.57 -1.87 -0.55 116.94 117.42 1ude h PHE 129 Ca 0.10 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.69 1ude h PHE 129 Cb 0.01 0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.73 1ude h PHE 129 CO -0.00 0.24 0.47 -0.07 -2.23 0.00 0.00 178.31 176.72 1ude h LEU 130 N -0.62 0.68 -1.54 0.59 3.38 -1.43 0.34 115.31 116.70 1ude h LEU 130 Ca -0.02 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1ude h LEU 130 Cb 0.48 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1ude h LEU 130 CO 0.03 0.39 -0.24 0.44 0.09 0.00 0.00 178.44 179.15 1ude h ASP 131 N 0.79 0.00 -0.09 -0.43 3.32 -1.05 -0.06 116.42 118.90 1ude h ASP 131 Ca 0.39 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.38 1ude h ASP 131 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 1ude h ASP 131 CO -0.24 0.24 -0.19 -0.08 -1.72 0.00 0.00 179.24 177.25 1ude h GLU 132 N 0.00 0.29 -0.53 3.56 4.81 0.12 0.25 114.58 123.08 1ude h GLU 132 Ca -0.00 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 1ude h GLU 132 Cb 0.48 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1ude h GLU 132 CO 0.03 0.78 0.25 0.82 -0.73 0.00 0.00 179.01 180.16 1ude h ILE 133 N -0.17 1.20 0.37 2.32 2.04 -0.36 -2.10 117.51 120.81 1ude h ILE 133 Ca 0.00 -0.57 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 1ude h ILE 133 Cb 0.78 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1ude h ILE 133 CO 0.04 0.23 -0.18 0.00 0.00 0.00 0.00 178.15 178.24 1ude h ALA 134 N 1.09 -0.49 -0.24 1.87 0.00 -0.99 -2.57 119.26 117.93 1ude h ALA 134 Ca 0.18 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.02 1ude h ALA 134 Cb 0.13 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1ude h ALA 134 CO -0.02 -0.73 0.23 1.25 0.00 0.00 0.00 179.25 179.97 1ude h HIS 135 N -0.58 0.00 0.57 0.00 -0.00 -0.44 -2.26 115.15 112.43 1ude h HIS 135 Ca -0.05 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.29 1ude h HIS 135 Cb 0.43 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 27.85 1ude h HIS 135 CO -0.03 0.00 -0.27 0.35 -0.00 0.00 0.00 177.93 177.98 1ude h PHE 136 N 0.00 -0.70 -0.02 5.26 3.57 -0.98 -2.61 116.94 121.44 1ude h PHE 136 Ca 0.11 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 1ude h PHE 136 Cb 0.56 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.53 1ude h PHE 136 CO 0.00 -0.37 -0.23 0.74 -2.23 0.00 0.00 178.31 176.21 1ude h PHE 137 N -1.02 0.04 -0.25 0.41 -1.00 -1.20 0.33 116.94 114.24 1ude h PHE 137 Ca -0.08 -0.01 -0.05 0.00 2.81 0.00 0.00 57.97 60.65 1ude h PHE 137 Cb 0.65 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 40.18 1ude h PHE 137 CO 0.00 0.27 -0.05 -0.22 -1.61 0.00 0.00 178.31 176.70 1ude h LYS 138 N 0.04 0.39 0.00 1.51 3.64 -1.40 -3.34 116.57 117.40 1ude h LYS 138 Ca 0.00 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1ude h LYS 138 Cb 0.43 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1ude h LYS 138 CO 0.03 0.46 -0.39 0.54 -2.27 0.00 0.00 179.45 177.82 1ude n ARG 139 N -4.28 4.22 0.31 1.90 5.12 -0.98 -4.49 116.66 118.45 1ude n ARG 139 Ca 0.00 0.00 0.21 0.00 -1.93 0.00 0.00 57.85 56.13 1ude n ARG 139 Cb 0.25 -0.69 1.09 0.00 -1.16 0.00 0.00 32.46 31.95 1ude n ARG 139 CO 0.00 0.00 0.00 0.10 -1.93 0.00 0.00 177.63 175.80 1ude h TYR 140 N 0.00 0.00 -0.11 -1.55 -0.00 -0.48 -2.02 116.97 112.81 1ude h TYR 140 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1ude h TYR 140 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1ude h TYR 140 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.79 1ude n LYS 141 N -2.94 1.22 -0.22 0.10 5.02 -1.26 -4.62 118.16 115.46 1ude n LYS 141 Ca -0.03 -1.39 0.02 0.00 -2.02 0.00 0.00 58.31 54.90 1ude n LYS 141 Cb 0.08 -1.21 0.13 0.00 -0.02 0.00 0.00 35.03 34.01 1ude n LYS 141 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1ude h GLU 142 N 1.90 0.17 0.00 1.97 4.81 -1.24 0.79 114.58 122.98 1ude h GLU 142 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1ude h GLU 142 Cb 0.51 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1ude h GLU 142 CO 0.00 0.11 0.00 1.28 -0.73 0.00 0.00 179.01 179.67 1ude n LEU 143 N -5.23 0.04 -1.55 1.64 4.77 -1.26 -0.89 117.00 114.52 1ude n LEU 143 Ca 0.11 0.51 -0.02 0.00 -0.03 0.00 0.00 56.01 56.58 1ude n LEU 143 Cb 0.39 -0.51 0.22 0.00 -2.33 0.00 0.00 43.42 41.19 1ude n LEU 143 CO 0.12 -0.29 0.78 -0.62 -1.33 0.00 0.00 177.39 176.04 1ude n GLU 144 N -1.55 3.06 -1.28 3.23 1.02 0.27 -4.88 120.64 120.51 1ude n GLU 144 Ca 0.03 -2.07 -0.10 0.00 -0.02 0.00 0.00 57.16 55.01 1ude n GLU 144 Cb 0.16 -1.94 -0.04 0.00 -0.02 0.00 0.00 31.44 29.59 1ude n GLU 144 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ude n GLY 146 N 0.10 0.98 3.34 0.62 0.00 -0.06 -4.97 105.19 105.20 1ude n GLY 146 Ca 0.25 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 1ude n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ude s LYS 147 N -2.68 2.52 0.05 1.61 1.02 -1.10 -5.03 119.74 116.13 1ude s LYS 147 Ca 0.00 -0.83 0.07 0.00 0.02 0.00 0.00 55.97 55.22 1ude s LYS 147 Cb 0.00 -2.24 -0.03 0.00 -0.52 0.00 0.00 37.83 35.05 1ude s LYS 147 CO 0.00 0.47 -0.20 -2.00 -0.92 0.00 0.00 175.35 172.70 1ude s GLU 148 N -0.36 1.29 0.33 1.68 2.56 -1.26 -2.93 118.70 120.01 1ude s GLU 148 Ca 0.03 -0.93 0.08 0.00 0.00 0.00 0.00 54.97 54.15 1ude s GLU 148 Cb -0.12 -1.40 -0.06 0.00 2.00 0.00 0.00 34.13 34.55 1ude s GLU 148 CO 0.02 0.35 -0.07 -1.50 -0.56 0.00 0.00 175.26 173.50 1ude s ILE 149 N -0.84 2.02 -0.19 -3.70 2.07 -1.26 -4.90 121.20 114.39 1ude s ILE 149 Ca 0.06 -2.15 -0.02 0.00 -1.41 0.00 0.00 60.65 57.13 1ude s ILE 149 Cb -0.09 -2.64 -0.01 0.00 0.13 0.00 0.00 42.46 39.85 1ude s ILE 149 CO 0.02 -0.20 -0.09 -0.51 -1.91 0.00 0.00 174.94 172.26 1ude s ILE 150 N -2.75 3.13 -0.16 2.00 -1.16 -0.63 -4.98 121.20 116.64 1ude s ILE 150 Ca 0.32 -0.59 -0.15 0.00 -0.51 0.00 0.00 60.65 59.72 1ude s ILE 150 Cb 0.04 -2.39 -0.04 0.00 0.61 0.00 0.00 42.46 40.68 1ude s ILE 150 CO 0.15 0.47 0.34 -0.69 -2.81 0.00 0.00 174.94 172.40 1ude s VAL 151 N 1.15 5.27 -0.24 4.00 1.01 -1.26 -0.71 120.40 129.62 1ude s VAL 151 Ca 0.01 0.63 -0.15 0.00 0.00 0.00 0.00 61.98 62.47 1ude s VAL 151 Cb -0.14 -3.67 -0.16 0.00 0.00 0.00 0.00 36.38 32.40 1ude s VAL 151 CO -0.02 0.35 -0.07 -0.62 0.00 0.00 0.00 175.10 174.74 1ude n GLU 152 N 3.76 0.60 -1.08 2.72 1.02 0.34 -4.99 120.64 123.01 1ude n GLU 152 Ca -0.11 0.38 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 1ude n GLU 152 Cb 0.52 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 1ude n GLU 152 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ude n GLY 153 N 1.45 -0.18 3.60 0.62 0.00 -0.96 -5.01 105.19 104.71 1ude n GLY 153 Ca -0.43 -1.09 -0.27 0.00 0.00 0.00 0.00 46.02 44.22 1ude n GLY 153 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ude s TRP 154 N -3.65 2.09 0.01 1.61 0.52 -1.26 0.00 118.94 118.26 1ude s TRP 154 Ca 0.00 -0.92 -0.12 0.00 0.02 0.00 0.00 56.10 55.09 1ude s TRP 154 Cb 0.00 -1.52 0.01 0.00 -1.15 0.00 0.00 33.47 30.82 1ude s TRP 154 CO 0.00 0.16 0.25 -1.21 0.02 0.00 0.00 176.95 176.17 1ude s GLU 155 N -3.80 0.64 0.00 4.98 2.02 -0.60 -4.91 118.70 117.03 1ude s GLU 155 Ca 0.26 -0.36 0.00 0.00 0.02 0.00 0.00 54.97 54.89 1ude s GLU 155 Cb 0.06 0.28 0.00 0.00 0.10 0.00 0.00 34.13 34.57 1ude s GLU 155 CO 0.13 -0.18 0.00 0.41 0.02 0.00 0.00 175.26 175.64 1ude n GLY 156 N 1.13 -1.94 0.41 -1.39 0.00 -1.26 0.71 105.19 102.85 1ude n GLY 156 Ca -0.21 -1.48 -0.15 0.00 0.00 0.00 0.00 46.02 44.17 1ude n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ude h ALA 157 N -2.00 -1.13 -0.99 4.61 0.00 -1.78 -2.82 119.26 115.15 1ude h ALA 157 Ca 0.00 -0.18 0.17 0.00 0.00 0.00 0.00 54.91 54.91 1ude h ALA 157 Cb 0.00 0.59 -0.17 0.00 0.00 0.00 0.00 17.79 18.20 1ude h ALA 157 CO 0.00 -1.13 -0.32 0.93 0.00 0.00 0.00 179.25 178.73 1ude h GLU 158 N -0.88 -0.00 -0.23 0.00 5.08 -1.93 1.09 114.58 117.71 1ude h GLU 158 Ca -0.07 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1ude h GLU 158 Cb 0.74 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.94 1ude h GLU 158 CO 0.01 -0.00 -0.08 0.00 -1.00 0.00 0.00 179.01 177.93 1ude h ALA 159 N 1.65 0.11 -0.01 3.43 0.00 -1.89 1.23 119.26 123.78 1ude h ALA 159 Ca 0.40 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.42 1ude h ALA 159 Cb 0.65 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 1ude h ALA 159 CO -1.00 -0.50 -0.35 0.00 0.00 0.00 0.00 179.25 177.40 1ude h ALA 160 N 1.17 -0.79 -0.94 0.00 0.00 0.13 0.63 119.26 119.45 1ude h ALA 160 Ca 0.12 -0.05 0.20 0.00 0.00 0.00 0.00 54.91 55.17 1ude h ALA 160 Cb 0.22 0.81 -0.11 0.00 0.00 0.00 0.00 17.79 18.71 1ude h ALA 160 CO -0.26 -0.89 0.52 0.87 0.00 0.00 0.00 179.25 179.49 1ude h LYS 161 N -0.43 0.61 0.15 0.00 1.57 0.10 0.17 116.57 118.73 1ude h LYS 161 Ca 0.01 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1ude h LYS 161 Cb 0.47 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1ude h LYS 161 CO -0.24 0.40 -0.13 -0.09 -0.57 0.00 0.00 179.45 178.82 1ude h ARG 162 N 0.62 -0.29 -0.51 3.15 2.43 0.29 -0.36 114.38 119.71 1ude h ARG 162 Ca 0.56 0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.70 1ude h ARG 162 Cb 0.93 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.53 1ude h ARG 162 CO -0.42 -0.19 0.13 0.93 -1.51 0.00 0.00 179.97 178.91 1ude h GLU 163 N -0.30 0.82 0.43 0.20 4.39 0.20 -2.84 114.58 117.47 1ude h GLU 163 Ca -0.00 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.49 1ude h GLU 163 Cb 0.28 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 1ude h GLU 163 CO -0.02 0.78 -0.40 0.82 -1.16 0.00 0.00 179.01 179.02 1ude h ILE 164 N 0.71 0.00 -0.94 3.13 2.04 -0.51 0.73 117.51 122.67 1ude h ILE 164 Ca 0.16 0.00 0.28 0.00 1.00 0.00 0.00 64.86 66.30 1ude h ILE 164 Cb 0.32 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.25 1ude h ILE 164 CO -0.00 0.00 0.35 -0.07 0.00 0.00 0.00 178.15 178.43 1ude h LEU 165 N -0.82 0.16 0.00 1.44 3.38 -1.10 -0.49 115.31 117.88 1ude h LEU 165 Ca -0.05 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1ude h LEU 165 Cb 0.71 0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1ude h LEU 165 CO -0.04 -0.18 0.00 -1.14 0.09 0.00 0.00 178.44 177.17 1ude n ARG 166 N -5.19 0.00 -0.50 1.13 0.63 -0.96 -1.98 116.66 109.79 1ude n ARG 166 Ca 0.26 0.49 0.39 0.00 -0.92 0.00 0.00 57.85 58.07 1ude n ARG 166 Cb 0.83 -1.42 0.63 0.00 0.45 0.00 0.00 32.46 32.96 1ude n ARG 166 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ude n ALA 167 N -1.96 1.37 -0.05 5.13 0.00 0.21 0.26 120.51 125.48 1ude n ALA 167 Ca 0.00 0.65 -0.14 0.00 0.00 0.00 0.00 53.44 53.95 1ude n ALA 167 Cb 0.00 -0.93 -0.12 0.00 0.00 0.00 0.00 19.45 18.40 1ude n ALA 167 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1ude h ILE 168 N 0.00 1.65 -0.07 0.00 2.04 -1.04 0.60 117.51 120.69 1ude h ILE 168 Ca 0.77 -1.92 -0.08 0.00 1.00 0.00 0.00 64.86 64.63 1ude h ILE 168 Cb 2.79 2.95 -0.01 0.00 -0.74 0.00 0.00 36.82 41.80 1ude h ILE 168 CO -0.21 0.50 -0.32 -0.08 0.00 0.00 0.00 178.15 178.04 1ude h GLU 169 N -0.80 0.12 0.00 2.37 4.22 0.46 -0.06 114.58 120.89 1ude h GLU 169 Ca -0.00 -0.04 -0.05 0.00 0.08 0.00 0.00 59.36 59.34 1ude h GLU 169 Cb 0.83 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1ude h GLU 169 CO 0.00 0.44 -0.23 1.98 -2.18 0.00 0.00 179.01 179.01 1ude h MET 170 N 0.11 0.00 0.00 1.92 4.05 -0.65 -3.51 114.93 116.85 1ude h MET 170 Ca 0.01 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 1ude h MET 170 Cb 0.63 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.43 1ude h MET 170 CO 0.05 0.23 0.00 0.98 0.23 0.00 0.00 176.91 178.40