#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8m s LEU 2 N 0.00 3.06 0.57 -0.89 1.43 -1.26 -5.03 118.68 116.55 1z8m s LEU 2 Ca 0.00 0.50 -0.21 0.00 -1.03 0.00 0.00 54.13 53.39 1z8m s LEU 2 Cb 0.00 -3.25 -0.04 0.00 0.03 0.00 0.00 46.19 42.93 1z8m s LEU 2 CO 0.00 -1.31 1.35 1.17 0.23 0.00 0.00 176.35 177.80 1z8m n LYS 3 N -2.70 1.59 -4.49 1.70 0.00 -1.26 -4.81 118.16 108.20 1z8m n LYS 3 Ca 0.06 0.59 -0.30 0.00 0.00 0.00 0.00 58.31 58.67 1z8m n LYS 3 Cb 0.59 -2.57 -0.13 0.00 0.00 0.00 0.00 35.03 32.92 1z8m n LYS 3 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1z8m s LEU 4 N -3.63 2.46 0.28 3.14 2.96 -1.20 -1.39 118.68 121.30 1z8m s LEU 4 Ca 0.74 -0.61 0.02 0.00 -0.22 0.00 0.00 54.13 54.06 1z8m s LEU 4 Cb -0.41 -1.38 -0.05 0.00 0.50 0.00 0.00 46.19 44.85 1z8m s LEU 4 CO 0.47 0.20 0.10 0.21 -1.32 0.00 0.00 176.35 176.02 1z8m s ASN 5 N -1.85 1.49 -0.25 3.68 2.47 -1.02 -4.91 114.94 114.55 1z8m s ASN 5 Ca 0.15 -1.43 -0.04 0.00 0.42 0.00 0.00 52.86 51.97 1z8m s ASN 5 Cb -0.10 0.18 0.08 0.00 -1.45 0.00 0.00 41.25 39.97 1z8m s ASN 5 CO 0.07 -0.75 0.10 -0.76 -3.72 0.00 0.00 177.10 172.03 1z8m s LEU 6 N -3.36 0.84 0.76 3.21 1.43 -1.26 -2.79 118.68 117.51 1z8m s LEU 6 Ca 0.37 -1.09 -0.12 0.00 -1.03 0.00 0.00 54.13 52.26 1z8m s LEU 6 Cb 0.07 -0.44 0.05 0.00 0.03 0.00 0.00 46.19 45.90 1z8m s LEU 6 CO 0.15 -0.39 1.11 -0.54 0.23 0.00 0.00 176.35 176.91 1z8m s LYS 7 N 2.00 2.39 0.28 1.70 -0.14 -1.10 -4.79 119.74 120.08 1z8m s LYS 7 Ca 0.06 0.43 -0.04 0.00 -1.36 0.00 0.00 55.97 55.06 1z8m s LYS 7 Cb -0.16 -1.97 0.36 0.00 -1.68 0.00 0.00 37.83 34.38 1z8m s LYS 7 CO -0.24 -1.36 1.94 0.87 -0.76 0.00 0.00 175.35 175.80 1z8m h LYS 8 N -0.89 1.16 -0.07 1.68 1.57 -1.91 0.29 116.57 118.41 1z8m h LYS 8 Ca -0.46 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.13 1z8m h LYS 8 Cb 1.28 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 1z8m h LYS 8 CO 0.63 0.79 -0.42 1.03 -0.57 0.00 0.00 179.45 180.91 1z8m h SER 9 N 1.19 0.15 0.44 0.86 0.87 -1.94 -2.99 113.55 112.14 1z8m h SER 9 Ca 0.32 -0.06 -0.31 0.00 -1.23 0.00 0.00 61.79 60.51 1z8m h SER 9 Cb -0.10 -0.04 0.02 0.00 -0.44 0.00 0.00 62.40 61.84 1z8m h SER 9 CO -0.06 0.56 -1.41 0.15 -0.53 0.00 0.00 176.83 175.53 1z8m h PHE 10 N 0.12 0.70 -0.74 2.24 3.04 -0.34 -2.54 116.94 119.42 1z8m h PHE 10 Ca 0.01 -0.51 0.07 0.00 3.98 0.00 0.00 57.97 61.52 1z8m h PHE 10 Cb 0.80 -0.03 -0.05 0.00 2.56 0.00 0.00 35.95 39.23 1z8m h PHE 10 CO 0.01 1.43 0.49 1.96 -2.02 0.00 0.00 178.31 180.18 1z8m h GLN 11 N 0.10 0.72 0.00 1.11 4.20 -0.38 0.56 115.11 121.43 1z8m h GLN 11 Ca -0.21 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.46 1z8m h GLN 11 Cb 2.07 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.68 1z8m h GLN 11 CO 0.23 0.48 -0.90 1.63 -0.67 0.00 0.00 178.83 179.60 1z8m n LYS 12 N -4.49 0.48 0.07 1.46 5.02 -1.14 -3.33 118.16 116.24 1z8m n LYS 12 Ca 0.11 0.10 0.12 0.00 -2.02 0.00 0.00 58.31 56.62 1z8m n LYS 12 Cb 0.25 -1.76 0.06 0.00 -0.02 0.00 0.00 35.03 33.56 1z8m n LYS 12 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1z8m n ASP 13 N -2.43 0.73 -0.01 4.39 8.00 -0.42 0.75 116.55 127.56 1z8m n ASP 13 Ca 0.01 0.15 -0.01 0.00 0.71 0.00 0.00 54.79 55.65 1z8m n ASP 13 Cb 0.50 0.46 -0.00 0.00 -0.02 0.00 0.00 41.12 42.06 1z8m n ASP 13 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1z8m n PHE 14 N -2.34 0.13 -0.01 1.24 7.35 0.18 -4.25 117.46 119.76 1z8m n PHE 14 Ca 0.01 0.06 -0.21 0.00 -0.76 0.00 0.00 57.45 56.55 1z8m n PHE 14 Cb 0.49 -0.31 -0.14 0.00 0.35 0.00 0.00 39.48 39.88 1z8m n PHE 14 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1z8m n ASP 15 N -2.64 2.10 0.20 -2.13 2.03 -1.21 -3.88 116.55 111.02 1z8m n ASP 15 Ca -0.01 0.21 0.06 0.00 0.52 0.00 0.00 54.79 55.57 1z8m n ASP 15 Cb 0.05 -0.85 0.40 0.00 -0.72 0.00 0.00 41.12 40.00 1z8m n ASP 15 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 1z8m h LYS 16 N -0.03 0.00 -0.13 -0.67 3.64 -1.56 -2.63 116.57 115.19 1z8m h LYS 16 Ca -0.43 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 58.83 1z8m h LYS 16 Cb 1.96 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.77 1z8m h LYS 16 CO 0.05 0.33 -0.46 1.25 -2.27 0.00 0.00 179.45 178.36 1z8m h LEU 17 N 0.00 0.34 -1.79 5.20 5.85 0.16 -1.90 115.31 123.16 1z8m h LEU 17 Ca -0.00 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 1z8m h LEU 17 Cb 0.78 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1z8m h LEU 17 CO 0.04 0.75 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.80 1z8m h LEU 18 N 0.26 0.09 0.05 2.25 4.07 -1.58 -2.28 115.31 118.17 1z8m h LEU 18 Ca 0.02 -0.01 -0.29 0.00 0.08 0.00 0.00 57.88 57.68 1z8m h LEU 18 Cb 0.91 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 42.60 1z8m h LEU 18 CO 0.07 0.13 -1.54 -0.07 -1.08 0.00 0.00 178.44 175.95 1z8m h LEU 19 N 0.10 0.16 -2.72 1.67 3.38 -1.51 -3.09 115.31 113.30 1z8m h LEU 19 Ca 0.02 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1z8m h LEU 19 Cb 0.11 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1z8m h LEU 19 CO 0.00 1.23 0.00 -1.13 0.09 0.00 0.00 178.44 178.63 1z8m h ASN 20 N 0.03 0.00 0.00 -0.43 -1.24 -0.81 -3.43 115.58 109.70 1z8m h ASN 20 Ca -0.23 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.78 1z8m h ASN 20 Cb 1.97 0.00 0.00 0.00 0.73 0.00 0.00 38.32 41.02 1z8m h ASN 20 CO 0.12 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.87 1z8m n GLY 21 N -1.00 0.56 3.55 1.57 0.00 -1.11 -5.10 105.19 103.66 1z8m n GLY 21 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1z8m n GLY 21 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1z8m s PHE 22 N -0.70 2.74 -0.48 1.61 2.19 -0.92 -5.02 117.98 117.40 1z8m s PHE 22 Ca 0.00 -0.15 -0.19 0.00 0.33 0.00 0.00 56.93 56.93 1z8m s PHE 22 Cb 0.00 -1.50 0.05 0.00 -1.31 0.00 0.00 43.02 40.26 1z8m s PHE 22 CO 0.00 0.36 0.57 0.34 1.83 0.00 0.00 175.22 178.31 1z8m s ASP 23 N -1.70 6.22 0.60 6.13 2.15 -1.26 -4.52 116.67 124.28 1z8m s ASP 23 Ca 0.18 -0.85 0.28 0.00 0.43 0.00 0.00 52.55 52.59 1z8m s ASP 23 Cb -0.11 -2.27 1.46 0.00 -0.30 0.00 0.00 42.92 41.70 1z8m s ASP 23 CO 0.09 -0.79 1.87 -2.24 -0.17 0.00 0.00 175.17 173.92 1z8m h ASP 24 N 8.91 0.00 -0.79 -0.34 3.04 -1.97 -1.25 116.42 124.02 1z8m h ASP 24 Ca -0.27 0.00 0.16 0.00 -3.24 0.00 0.00 57.03 53.68 1z8m h ASP 24 Cb 1.10 0.00 -0.10 0.00 -1.04 0.00 0.00 39.33 39.29 1z8m h ASP 24 CO 0.92 0.00 0.31 0.28 -2.04 0.00 0.00 179.24 178.71 1z8m h SER 25 N 0.00 0.28 0.41 4.15 0.02 -2.01 0.11 113.55 116.52 1z8m h SER 25 Ca 0.19 0.12 -0.25 0.00 -0.84 0.00 0.00 61.79 61.01 1z8m h SER 25 Cb 1.18 0.10 0.01 0.00 0.14 0.00 0.00 62.40 63.82 1z8m h SER 25 CO -0.00 0.08 -1.06 0.58 -1.14 0.00 0.00 176.83 175.29 1z8m h VAL 26 N 0.43 1.42 -0.98 2.27 2.07 -1.65 -3.26 116.25 116.55 1z8m h VAL 26 Ca 0.44 -2.63 0.01 0.00 0.82 0.00 0.00 66.70 65.34 1z8m h VAL 26 Cb 0.71 2.60 -0.05 0.00 -1.52 0.00 0.00 31.29 33.03 1z8m h VAL 26 CO -0.43 0.78 0.65 0.25 0.02 0.00 0.00 177.57 178.84 1z8m h LEU 27 N 0.18 1.12 -0.81 2.57 5.85 -1.14 -2.35 115.31 120.73 1z8m h LEU 27 Ca -0.11 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.67 1z8m h LEU 27 Cb 1.72 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 42.41 1z8m h LEU 27 CO 0.18 0.80 0.47 -1.13 -0.34 0.00 0.00 178.44 178.43 1z8m h ASN 28 N 1.31 0.70 0.15 1.25 -1.24 -0.89 0.92 115.58 117.78 1z8m h ASN 28 Ca 0.36 0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.41 1z8m h ASN 28 Cb -0.13 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 38.82 1z8m h ASN 28 CO -0.08 0.42 0.00 -0.33 -1.29 0.00 0.00 177.43 176.15 1z8m h GLU 29 N 0.82 0.00 0.00 6.67 4.39 -1.51 -2.14 114.58 122.81 1z8m h GLU 29 Ca 0.38 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.08 1z8m h GLU 29 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1z8m h GLU 29 CO -0.22 0.00 0.00 0.28 -1.16 0.00 0.00 179.01 177.91 1z8m n VAL 30 N -2.55 0.00 -0.30 3.13 0.31 0.28 -4.18 118.33 115.03 1z8m n VAL 30 Ca -0.01 0.48 0.19 0.00 -0.01 0.00 0.00 64.34 64.99 1z8m n VAL 30 Cb 0.08 -1.46 0.47 0.00 -0.91 0.00 0.00 33.84 32.03 1z8m n VAL 30 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1z8m h ILE 31 N 0.00 0.62 0.00 2.52 5.03 -1.50 0.51 117.51 124.69 1z8m h ILE 31 Ca 0.00 -0.16 0.00 0.00 -0.12 0.00 0.00 64.86 64.58 1z8m h ILE 31 Cb 0.00 0.11 0.00 0.00 -3.03 0.00 0.00 36.82 33.90 1z8m h ILE 31 CO 0.00 0.09 0.00 0.00 -0.68 0.00 0.00 178.15 177.56 1z8m n LEU 32 N -4.60 0.16 -0.01 1.44 -0.00 -0.81 -1.17 117.00 112.01 1z8m n LEU 32 Ca 0.22 0.55 -0.16 0.00 -0.00 0.00 0.00 56.01 56.62 1z8m n LEU 32 Cb 0.75 -0.54 -0.14 0.00 -0.00 0.00 0.00 43.42 43.49 1z8m n LEU 32 CO 0.27 -0.41 -0.71 0.41 -0.00 0.00 0.00 177.39 176.95 1z8m n THR 33 N -1.69 1.70 -0.03 1.47 -1.04 0.18 -4.02 114.28 110.85 1z8m n THR 33 Ca 0.02 -0.71 -0.02 0.00 -2.04 0.00 0.00 64.05 61.29 1z8m n THR 33 Cb 0.14 -1.43 -0.01 0.00 -1.82 0.00 0.00 70.33 67.21 1z8m n THR 33 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1z8m n LEU 34 N -3.29 0.90 0.22 -4.42 4.77 -0.98 -2.74 117.00 111.45 1z8m n LEU 34 Ca -0.26 0.44 0.15 0.00 -0.03 0.00 0.00 56.01 56.31 1z8m n LEU 34 Cb 1.05 -0.69 0.62 0.00 -2.33 0.00 0.00 43.42 42.07 1z8m n LEU 34 CO 0.43 -0.49 1.13 0.03 -1.33 0.00 0.00 177.39 177.17 1z8m h ARG 35 N -0.50 0.00 -0.81 3.23 3.08 -1.42 0.49 114.38 118.46 1z8m h ARG 35 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1z8m h ARG 35 Cb 0.25 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1z8m h ARG 35 CO 0.00 0.00 0.04 1.63 -1.07 0.00 0.00 179.97 180.57 1z8m n LYS 36 N -3.06 2.89 -3.80 0.04 4.76 -1.26 -4.92 118.16 112.82 1z8m n LYS 36 Ca 0.03 -1.66 -0.35 0.00 -2.87 0.00 0.00 58.31 53.47 1z8m n LYS 36 Cb 0.67 -1.87 0.03 0.00 -1.84 0.00 0.00 35.03 32.01 1z8m n LYS 36 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1z8m n LYS 37 N 0.24 -0.92 -4.91 1.97 2.85 0.17 -4.98 118.16 112.57 1z8m n LYS 37 Ca 0.17 0.41 -0.30 0.00 -1.05 0.00 0.00 58.31 57.54 1z8m n LYS 37 Cb 0.80 -3.44 -0.15 0.00 -0.65 0.00 0.00 35.03 31.59 1z8m n LYS 37 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 1z8m s GLU 38 N -6.21 1.86 0.34 -1.58 2.12 -1.11 -5.04 118.70 109.07 1z8m s GLU 38 Ca 0.41 -1.08 -0.28 0.00 0.36 0.00 0.00 54.97 54.38 1z8m s GLU 38 Cb -0.18 -2.01 -0.09 0.00 0.26 0.00 0.00 34.13 32.11 1z8m s GLU 38 CO 0.90 0.52 1.18 -1.25 -0.54 0.00 0.00 175.26 176.07 1z8m s PRO 39 N -1.21 4.35 0.17 4.30 0.04 -1.26 -4.71 135.00 136.68 1z8m s PRO 39 Ca 0.12 1.92 -0.24 0.00 0.04 0.00 0.00 61.00 62.84 1z8m s PRO 39 Cb -0.10 -2.96 -0.08 0.00 0.04 0.00 0.00 34.50 31.40 1z8m s PRO 39 CO 0.02 -0.09 0.75 -0.51 0.04 0.00 0.00 177.00 177.22 1z8m s LEU 40 N -1.93 4.53 0.65 -3.56 1.43 -1.26 -5.06 118.68 113.47 1z8m s LEU 40 Ca 0.50 1.57 -0.11 0.00 -1.03 0.00 0.00 54.13 55.06 1z8m s LEU 40 Cb -0.33 -3.34 -0.02 0.00 0.03 0.00 0.00 46.19 42.52 1z8m s LEU 40 CO 0.43 0.17 1.04 -1.81 0.23 0.00 0.00 176.35 176.42 1z8m s ASP 41 N -1.26 5.82 0.54 2.29 1.11 -1.26 -4.95 116.67 118.95 1z8m s ASP 41 Ca 0.37 1.54 0.24 0.00 0.18 0.00 0.00 52.55 54.88 1z8m s ASP 41 Cb -0.21 -2.49 1.49 0.00 1.07 0.00 0.00 42.92 42.78 1z8m s ASP 41 CO 0.24 -1.15 2.15 1.55 1.18 0.00 0.00 175.17 179.15 1z8m h PRO 42 N -0.42 0.00 0.00 8.23 0.13 -2.01 -1.67 132.00 136.26 1z8m h PRO 42 Ca -0.44 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.66 1z8m h PRO 42 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1z8m h PRO 42 CO 0.59 0.05 -0.14 1.96 -0.23 0.00 0.00 178.00 180.24 1z8m h GLN 43 N 0.00 0.00 0.24 0.86 1.08 -1.94 -2.95 115.11 112.39 1z8m h GLN 43 Ca -0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1z8m h GLN 43 Cb 0.12 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.54 1z8m h GLN 43 CO 0.01 0.14 -0.19 0.74 -0.95 0.00 0.00 178.83 178.57 1z8m h PHE 44 N 0.00 -0.50 -5.13 2.96 -1.00 -1.46 -3.47 116.94 108.35 1z8m h PHE 44 Ca -0.00 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1z8m h PHE 44 Cb 0.32 0.19 0.00 0.00 3.61 0.00 0.00 35.95 40.06 1z8m h PHE 44 CO 0.00 -0.29 -0.65 1.04 -1.61 0.00 0.00 178.31 176.80 1z8m n GLN 45 N -5.32 -2.67 -3.09 1.51 6.02 -1.12 -2.86 117.38 109.86 1z8m n GLN 45 Ca -0.09 2.29 -0.44 0.00 -0.01 0.00 0.00 57.00 58.76 1z8m n GLN 45 Cb 0.23 -5.40 -0.06 0.00 1.02 0.00 0.00 30.24 26.03 1z8m n GLN 45 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 1z8m s ASP 46 N -2.19 6.25 0.31 1.08 -4.77 -1.26 -4.30 116.67 111.78 1z8m s ASP 46 Ca 0.15 -0.81 0.03 0.00 -3.30 0.00 0.00 52.55 48.63 1z8m s ASP 46 Cb -0.04 -2.32 -0.01 0.00 -1.09 0.00 0.00 42.92 39.45 1z8m s ASP 46 CO 0.74 -0.97 0.11 1.41 0.70 0.00 0.00 175.17 177.16 1z8m n HIS 47 N 6.46 0.10 -3.56 2.11 8.25 -1.23 -4.92 115.22 122.42 1z8m n HIS 47 Ca -0.05 -1.98 -0.37 0.00 -0.26 0.00 0.00 57.72 55.06 1z8m n HIS 47 Cb 0.46 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.50 1z8m n HIS 47 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1z8m s ALA 48 N -2.84 3.68 1.00 -1.41 0.00 -1.26 0.76 121.76 121.69 1z8m s ALA 48 Ca 0.16 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 51.77 1z8m s ALA 48 Cb 0.01 -2.34 0.00 0.00 0.00 0.00 0.00 23.12 20.79 1z8m s ALA 48 CO 0.11 0.37 0.00 1.28 0.00 0.00 0.00 175.76 177.52 1z8m n LEU 49 N 2.45 0.00 -4.03 0.00 4.32 -1.19 -4.89 117.00 113.66 1z8m n LEU 49 Ca -0.14 0.00 -0.11 0.00 -0.02 0.00 0.00 56.01 55.74 1z8m n LEU 49 Cb 0.53 0.00 -0.11 0.00 -1.62 0.00 0.00 43.42 42.21 1z8m n LEU 49 CO 0.37 -0.87 -0.38 -0.54 -1.22 0.00 0.00 177.39 174.75 1z8m s LYS 50 N -2.51 0.44 0.03 3.23 -0.14 -1.25 -4.28 119.74 115.26 1z8m s LYS 50 Ca 0.00 -0.71 0.00 0.00 -1.36 0.00 0.00 55.97 53.90 1z8m s LYS 50 Cb 0.00 -0.11 0.00 0.00 -1.68 0.00 0.00 37.83 36.04 1z8m s LYS 50 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 175.35 175.00 1z8m n GLY 51 N 1.47 -5.84 4.78 -3.33 0.00 -1.26 -3.98 105.19 97.04 1z8m n GLY 51 Ca -0.23 0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1z8m n GLY 51 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1z8m n LYS 52 N 1.83 0.00 -1.20 1.61 3.00 -1.26 -4.40 118.16 117.74 1z8m n LYS 52 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 58.05 1z8m n LYS 52 Cb 0.00 -0.11 0.14 0.00 0.00 0.00 0.00 35.03 35.06 1z8m n LYS 52 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.40 178.31 1z8m n TRP 53 N 0.00 2.97 -0.02 5.64 7.02 -1.26 -4.56 117.44 127.23 1z8m n TRP 53 Ca 0.00 -2.15 -0.13 0.00 -1.02 0.00 0.00 57.50 54.20 1z8m n TRP 53 Cb 0.00 -1.07 -0.10 0.00 -2.42 0.00 0.00 31.31 27.72 1z8m n TRP 53 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 1z8m h LYS 54 N 1.27 0.06 0.00 -0.99 3.64 -1.77 -3.13 116.57 115.65 1z8m h LYS 54 Ca 0.60 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.95 1z8m h LYS 54 Cb 2.14 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.96 1z8m h LYS 54 CO 1.20 0.54 0.00 -0.35 -2.27 0.00 0.00 179.45 178.58 1z8m n PRO 55 N -4.80 0.87 -3.85 1.90 -0.04 -1.26 -4.58 135.00 123.23 1z8m n PRO 55 Ca -0.08 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.14 1z8m n PRO 55 Cb 0.28 -1.21 -0.03 0.00 -0.04 0.00 0.00 33.50 32.49 1z8m n PRO 55 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1z8m s PHE 56 N -2.00 2.26 0.03 0.54 0.40 -1.19 -4.99 117.98 113.03 1z8m s PHE 56 Ca 0.17 -0.66 0.05 0.00 -0.60 0.00 0.00 56.93 55.90 1z8m s PHE 56 Cb 0.08 -2.01 -0.02 0.00 0.51 0.00 0.00 43.02 41.58 1z8m s PHE 56 CO 0.13 -0.17 -0.15 0.50 0.70 0.00 0.00 175.22 176.23 1z8m s ARG 57 N -4.12 1.04 0.57 0.44 6.06 -1.17 -3.47 118.95 118.30 1z8m s ARG 57 Ca 0.40 -0.74 0.07 0.00 -2.50 0.00 0.00 55.73 52.96 1z8m s ARG 57 Cb -0.01 -1.06 0.06 0.00 0.06 0.00 0.00 34.95 34.00 1z8m s ARG 57 CO 0.24 0.27 0.55 -2.00 -2.50 0.00 0.00 175.30 171.86 1z8m s GLU 58 N -0.99 2.25 -0.30 5.12 2.12 0.23 -1.64 118.70 125.48 1z8m s GLU 58 Ca 0.03 -1.92 -0.16 0.00 0.36 0.00 0.00 54.97 53.28 1z8m s GLU 58 Cb -0.08 -2.28 0.17 0.00 0.26 0.00 0.00 34.13 32.20 1z8m s GLU 58 CO 0.01 -0.75 1.02 0.00 -0.54 0.00 0.00 175.26 175.00 1z8m n HIS 60 N 4.80 4.87 0.25 0.00 -0.00 -1.14 0.10 115.22 124.10 1z8m n HIS 60 Ca -0.10 -3.70 0.10 0.00 -0.00 0.00 0.00 57.72 54.02 1z8m n HIS 60 Cb 0.53 -1.69 0.69 0.00 -0.00 0.00 0.00 29.99 29.53 1z8m n HIS 60 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.34 177.16 1z8m h ILE 61 N 3.68 0.90 -3.96 1.59 5.03 -1.84 -3.36 117.51 119.54 1z8m h ILE 61 Ca 0.19 0.00 -0.31 0.00 -0.12 0.00 0.00 64.86 64.63 1z8m h ILE 61 Cb 0.84 0.98 -0.15 0.00 -3.03 0.00 0.00 36.82 35.46 1z8m h ILE 61 CO 1.08 0.00 -0.63 -0.54 -0.68 0.00 0.00 178.15 177.38 1z8m s LYS 62 N -4.99 1.29 0.00 2.37 1.02 -1.26 -4.93 119.74 113.25 1z8m s LYS 62 Ca -0.05 -1.68 0.16 0.00 0.02 0.00 0.00 55.97 54.42 1z8m s LYS 62 Cb 0.17 -0.14 0.92 0.00 -0.52 0.00 0.00 37.83 38.26 1z8m s LYS 62 CO 0.65 -0.28 1.38 -2.30 -0.92 0.00 0.00 175.35 173.88 1z8m n PRO 63 N -0.37 0.45 -1.11 -1.68 -0.02 -1.26 -2.59 135.00 128.41 1z8m n PRO 63 Ca -0.01 0.03 0.02 0.00 -2.02 0.00 0.00 63.50 61.51 1z8m n PRO 63 Cb 0.66 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.64 1z8m n PRO 63 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1z8m n ASP 64 N -1.05 0.46 -4.05 2.55 5.75 -1.26 -4.97 116.55 113.99 1z8m n ASP 64 Ca 0.11 -1.95 -0.12 0.00 -0.01 0.00 0.00 54.79 52.83 1z8m n ASP 64 Cb 0.07 -0.20 -0.11 0.00 -1.03 0.00 0.00 41.12 39.85 1z8m n ASP 64 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1z8m s VAL 65 N 0.00 0.42 -0.39 2.12 1.01 -1.07 -4.41 120.40 118.08 1z8m s VAL 65 Ca 0.19 -1.11 0.04 0.00 0.00 0.00 0.00 61.98 61.10 1z8m s VAL 65 Cb 0.22 -0.60 0.16 0.00 0.00 0.00 0.00 36.38 36.16 1z8m s VAL 65 CO -0.10 -0.47 0.41 -0.76 0.00 0.00 0.00 175.10 174.18 1z8m s LEU 66 N -1.68 0.04 0.06 3.92 1.43 0.36 -4.04 118.68 118.78 1z8m s LEU 66 Ca -0.10 -1.86 -0.27 0.00 -1.03 0.00 0.00 54.13 50.88 1z8m s LEU 66 Cb -0.08 0.53 -0.05 0.00 0.03 0.00 0.00 46.19 46.61 1z8m s LEU 66 CO -0.01 -0.22 0.84 -0.22 0.23 0.00 0.00 176.35 176.97 1z8m s LEU 67 N 1.13 4.46 -0.05 1.79 2.96 0.28 -2.22 118.68 127.03 1z8m s LEU 67 Ca 0.21 1.57 0.03 0.00 -0.22 0.00 0.00 54.13 55.72 1z8m s LEU 67 Cb -0.11 -3.37 -0.03 0.00 0.50 0.00 0.00 46.19 43.19 1z8m s LEU 67 CO -0.05 -0.03 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.14 1z8m s VAL 68 N 0.02 3.20 0.17 1.68 1.01 0.13 0.10 120.40 126.71 1z8m s VAL 68 Ca 0.42 -0.69 -0.18 0.00 0.00 0.00 0.00 61.98 61.53 1z8m s VAL 68 Cb -0.21 -2.27 0.03 0.00 0.00 0.00 0.00 36.38 33.93 1z8m s VAL 68 CO 0.25 0.58 0.49 -0.72 0.00 0.00 0.00 175.10 175.71 1z8m s TYR 69 N -0.76 -0.18 0.46 5.22 -0.85 -0.65 0.11 117.35 120.70 1z8m s TYR 69 Ca 0.12 -0.14 0.06 0.00 -0.52 0.00 0.00 57.07 56.59 1z8m s TYR 69 Cb -0.11 0.37 -0.02 0.00 0.38 0.00 0.00 41.96 42.58 1z8m s TYR 69 CO 0.01 -0.85 0.25 -1.17 -1.52 0.00 0.00 175.55 172.28 1z8m s LEU 70 N -2.84 2.97 -0.30 -3.49 2.96 0.19 -3.04 118.68 115.12 1z8m s LEU 70 Ca 0.07 -1.13 0.01 0.00 -0.22 0.00 0.00 54.13 52.85 1z8m s LEU 70 Cb -0.00 -1.39 0.09 0.00 0.50 0.00 0.00 46.19 45.39 1z8m s LEU 70 CO -0.06 -0.74 0.05 -0.69 -1.32 0.00 0.00 176.35 173.59 1z8m s VAL 71 N -2.65 1.39 0.79 1.68 1.01 -1.26 -2.95 120.40 118.41 1z8m s VAL 71 Ca 0.37 -1.60 -0.11 0.00 0.00 0.00 0.00 61.98 60.63 1z8m s VAL 71 Cb 0.01 -1.96 0.06 0.00 0.00 0.00 0.00 36.38 34.49 1z8m s VAL 71 CO 0.21 -0.53 1.10 -0.75 0.00 0.00 0.00 175.10 175.13 1z8m s LYS 72 N 1.38 2.17 0.31 2.72 2.20 0.35 -4.92 119.74 123.94 1z8m s LYS 72 Ca 0.07 0.64 0.06 0.00 -0.36 0.00 0.00 55.97 56.37 1z8m s LYS 72 Cb -0.18 -1.93 0.85 0.00 -1.51 0.00 0.00 37.83 35.06 1z8m s LYS 72 CO -0.16 -1.56 1.62 -0.44 -0.36 0.00 0.00 175.35 174.45 1z8m h ASP 73 N -1.04 -0.02 0.00 1.43 5.19 -2.04 -3.06 116.42 116.89 1z8m h ASP 73 Ca -0.47 0.23 -0.11 0.00 -0.62 0.00 0.00 57.03 56.06 1z8m h ASP 73 Cb 1.27 0.31 -0.21 0.00 0.18 0.00 0.00 39.33 40.88 1z8m h ASP 73 CO 0.59 -0.24 -0.68 0.47 -3.12 0.00 0.00 179.24 176.27 1z8m n ASP 74 N -5.28 0.31 -3.95 6.45 8.00 -1.26 -5.11 116.55 115.72 1z8m n ASP 74 Ca 0.25 -1.91 -0.09 0.00 0.71 0.00 0.00 54.79 53.75 1z8m n ASP 74 Cb 0.82 -0.15 -0.06 0.00 -0.02 0.00 0.00 41.12 41.71 1z8m n ASP 74 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1z8m s GLU 75 N 0.00 1.36 -0.05 -1.24 2.02 -1.16 -4.67 118.70 114.98 1z8m s GLU 75 Ca 0.16 -1.17 0.04 0.00 0.02 0.00 0.00 54.97 54.02 1z8m s GLU 75 Cb 0.19 0.44 -0.00 0.00 0.10 0.00 0.00 34.13 34.85 1z8m s GLU 75 CO -0.08 -0.54 -0.17 -1.17 0.02 0.00 0.00 175.26 173.32 1z8m s LEU 76 N -2.98 1.90 -0.06 1.80 0.20 -0.49 0.13 118.68 119.18 1z8m s LEU 76 Ca 0.19 -0.35 0.04 0.00 0.69 0.00 0.00 54.13 54.69 1z8m s LEU 76 Cb 0.01 -0.96 0.00 0.00 -0.43 0.00 0.00 46.19 44.81 1z8m s LEU 76 CO 0.04 0.14 -0.17 0.27 -0.29 0.00 0.00 176.35 176.34 1z8m s ILE 77 N 0.09 1.46 0.24 6.68 -5.25 -1.15 -2.42 121.20 120.84 1z8m s ILE 77 Ca -0.05 -0.70 -0.30 0.00 -0.99 0.00 0.00 60.65 58.62 1z8m s ILE 77 Cb -0.12 -1.27 -0.09 0.00 2.95 0.00 0.00 42.46 43.93 1z8m s ILE 77 CO 0.02 0.42 1.01 -0.76 -1.79 0.00 0.00 174.94 173.84 1z8m s LEU 78 N 0.30 4.60 -0.08 0.37 1.43 -1.12 0.53 118.68 124.70 1z8m s LEU 78 Ca -0.10 2.05 -0.07 0.00 -1.03 0.00 0.00 54.13 54.98 1z8m s LEU 78 Cb -0.14 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.44 1z8m s LEU 78 CO 0.04 0.02 -0.13 -0.11 0.23 0.00 0.00 176.35 176.39 1z8m n LEU 79 N 1.56 1.01 -3.75 1.79 -0.00 0.31 -2.70 117.00 115.21 1z8m n LEU 79 Ca -0.01 0.35 -0.02 0.00 -0.00 0.00 0.00 56.01 56.33 1z8m n LEU 79 Cb 0.46 -0.67 -0.01 0.00 -0.00 0.00 0.00 43.42 43.20 1z8m n LEU 79 CO 0.52 -0.44 0.81 0.00 -0.00 0.00 0.00 177.39 178.27 1z8m s ARG 80 N -1.82 1.05 -0.11 1.96 1.04 -0.78 -1.32 118.95 118.97 1z8m s ARG 80 Ca -0.11 -0.60 0.00 0.00 -1.04 0.00 0.00 55.73 53.98 1z8m s ARG 80 Cb 0.02 0.34 0.02 0.00 -2.04 0.00 0.00 34.95 33.29 1z8m s ARG 80 CO 0.16 -0.48 -0.09 -1.17 -0.04 0.00 0.00 175.30 173.68 1z8m s LEU 81 N -3.03 1.34 0.00 -1.89 1.98 -1.26 0.18 118.68 115.99 1z8m s LEU 81 Ca 0.14 -0.33 0.00 0.00 -2.89 0.00 0.00 54.13 51.05 1z8m s LEU 81 Cb -0.00 -0.90 0.00 0.00 0.66 0.00 0.00 46.19 45.95 1z8m s LEU 81 CO 0.02 -0.08 0.00 0.61 -1.89 0.00 0.00 176.35 175.00 1z8m n GLY 82 N 4.73 4.65 0.56 7.98 0.00 -0.94 -4.80 105.19 117.36 1z8m n GLY 82 Ca -0.15 -1.64 -0.02 0.00 0.00 0.00 0.00 46.02 44.21 1z8m n GLY 82 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1z8m n SER 83 N -1.64 -0.27 0.15 1.61 7.64 -1.26 -0.49 113.62 119.36 1z8m n SER 83 Ca 0.00 -1.29 0.01 0.00 1.01 0.00 0.00 58.87 58.60 1z8m n SER 83 Cb 0.00 0.47 0.19 0.00 -1.01 0.00 0.00 64.21 63.86 1z8m n SER 83 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 1z8m h HIS 84 N 1.16 0.00 0.00 1.43 2.76 -1.91 -0.63 115.15 117.96 1z8m h HIS 84 Ca -0.05 0.00 -0.09 0.00 -2.20 0.00 0.00 60.37 58.03 1z8m h HIS 84 Cb 0.19 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.14 1z8m h HIS 84 CO 0.00 0.57 -1.17 1.03 -1.30 0.00 0.00 177.93 177.05 1z8m h SER 85 N 0.00 0.00 0.00 3.26 0.87 -1.93 -3.12 113.55 112.63 1z8m h SER 85 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1z8m h SER 85 Cb 1.11 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1z8m h SER 85 CO 0.07 0.32 -0.06 -0.33 -0.53 0.00 0.00 176.83 176.30 1z8m h GLU 86 N 0.00 0.00 -0.74 2.24 4.39 -1.92 -3.40 114.58 115.15 1z8m h GLU 86 Ca -0.09 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.64 1z8m h GLU 86 Cb 1.32 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.93 1z8m h GLU 86 CO 0.03 0.00 0.47 -0.07 -1.16 0.00 0.00 179.01 178.28 1z8m h LEU 87 N -0.12 0.79 -1.56 1.33 3.38 -1.35 -3.46 115.31 114.31 1z8m h LEU 87 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1z8m h LEU 87 Cb 0.06 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1z8m h LEU 87 CO 0.00 0.56 0.00 0.49 0.09 0.00 0.00 178.44 179.58