#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8m n LEU 2 N 0.00 -0.67 -4.97 4.03 4.32 -1.26 -4.89 117.00 113.57 1z8m n LEU 2 Ca 0.00 1.49 -0.23 0.00 -0.02 0.00 0.00 56.01 57.25 1z8m n LEU 2 Cb 0.00 -4.02 0.07 0.00 -1.62 0.00 0.00 43.42 37.85 1z8m n LEU 2 CO 0.00 -3.13 0.49 -0.75 -1.22 0.00 0.00 177.39 172.78 1z8m s LYS 3 N -2.49 2.19 0.05 3.23 2.36 -1.26 -4.89 119.74 118.94 1z8m s LYS 3 Ca 0.00 -0.72 0.01 0.00 -2.55 0.00 0.00 55.97 52.72 1z8m s LYS 3 Cb 0.00 -2.35 -0.03 0.00 -1.05 0.00 0.00 37.83 34.40 1z8m s LYS 3 CO 0.00 -1.07 -0.06 -1.17 1.55 0.00 0.00 175.35 174.60 1z8m s LEU 4 N -5.01 2.35 0.31 5.43 0.20 -1.13 -2.26 118.68 118.57 1z8m s LEU 4 Ca 0.61 -0.72 -0.02 0.00 0.69 0.00 0.00 54.13 54.68 1z8m s LEU 4 Cb -0.09 -0.04 -0.01 0.00 -0.43 0.00 0.00 46.19 45.62 1z8m s LEU 4 CO 0.42 -0.35 0.41 0.21 -0.29 0.00 0.00 176.35 176.75 1z8m s ASN 5 N -2.12 0.78 -0.03 3.68 2.47 -0.96 -4.86 114.94 113.90 1z8m s ASN 5 Ca -0.03 -1.43 0.01 0.00 0.42 0.00 0.00 52.86 51.82 1z8m s ASN 5 Cb -0.04 0.60 0.02 0.00 -1.45 0.00 0.00 41.25 40.39 1z8m s ASN 5 CO -0.03 -1.19 -0.00 -0.76 -3.72 0.00 0.00 177.10 171.40 1z8m s LEU 6 N -3.22 1.29 0.35 3.21 1.43 -1.26 -2.24 118.68 118.24 1z8m s LEU 6 Ca 0.32 -0.03 0.07 0.00 -1.03 0.00 0.00 54.13 53.46 1z8m s LEU 6 Cb 0.01 -0.21 -0.02 0.00 0.03 0.00 0.00 46.19 46.00 1z8m s LEU 6 CO 0.19 -0.08 0.40 -0.54 0.23 0.00 0.00 176.35 176.54 1z8m s LYS 7 N 0.86 2.87 0.50 1.70 -0.14 -0.97 -4.93 119.74 119.64 1z8m s LYS 7 Ca -0.09 -1.20 0.15 0.00 -1.36 0.00 0.00 55.97 53.47 1z8m s LYS 7 Cb -0.12 -2.63 1.19 0.00 -1.68 0.00 0.00 37.83 34.59 1z8m s LYS 7 CO -0.01 0.02 2.12 0.87 -0.76 0.00 0.00 175.35 177.59 1z8m h LYS 8 N 1.03 0.12 0.03 1.68 1.79 -1.90 0.27 116.57 119.59 1z8m h LYS 8 Ca -0.44 -0.01 -0.23 0.00 -2.18 0.00 0.00 60.65 57.79 1z8m h LYS 8 Cb 1.26 -0.03 0.02 0.00 -1.58 0.00 0.00 32.23 31.90 1z8m h LYS 8 CO 0.55 0.08 -0.92 0.77 -1.08 0.00 0.00 179.45 178.84 1z8m h SER 9 N 0.12 0.75 0.16 0.86 0.02 -1.95 -3.14 113.55 110.37 1z8m h SER 9 Ca 0.05 -0.78 -0.15 0.00 -0.84 0.00 0.00 61.79 60.07 1z8m h SER 9 Cb 0.05 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1z8m h SER 9 CO -0.01 1.44 -0.57 0.15 -1.14 0.00 0.00 176.83 176.70 1z8m h PHE 10 N 0.16 0.54 -0.94 3.45 3.04 -0.31 0.10 116.94 122.98 1z8m h PHE 10 Ca -0.13 -0.20 0.01 0.00 3.98 0.00 0.00 57.97 61.64 1z8m h PHE 10 Cb 1.61 -0.10 -0.05 0.00 2.56 0.00 0.00 35.95 39.97 1z8m h PHE 10 CO 0.13 0.90 0.62 1.96 -2.02 0.00 0.00 178.31 179.90 1z8m h GLN 11 N 0.33 1.23 0.00 1.11 4.20 -0.56 0.14 115.11 121.56 1z8m h GLN 11 Ca 0.00 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1z8m h GLN 11 Cb 1.09 -0.28 0.00 0.00 0.30 0.00 0.00 27.48 28.60 1z8m h GLN 11 CO 0.10 0.81 -0.76 1.57 -0.67 0.00 0.00 178.83 179.88 1z8m h LYS 12 N 1.26 0.00 0.00 1.46 2.10 -1.49 -3.30 116.57 116.61 1z8m h LYS 12 Ca 0.35 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.00 1z8m h LYS 12 Cb -0.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.20 1z8m h LYS 12 CO -0.08 0.00 -0.58 -0.25 -2.00 0.00 0.00 179.45 176.54 1z8m n ASP 13 N -2.13 0.55 -0.02 7.07 9.92 0.02 -1.22 116.55 130.74 1z8m n ASP 13 Ca 0.03 -0.21 -0.01 0.00 -0.53 0.00 0.00 54.79 54.06 1z8m n ASP 13 Cb 0.45 0.30 -0.00 0.00 -0.64 0.00 0.00 41.12 41.23 1z8m n ASP 13 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1z8m n PHE 14 N -1.63 0.26 -0.02 1.24 -0.00 0.43 -4.13 117.46 113.60 1z8m n PHE 14 Ca 0.05 0.11 -0.14 0.00 -0.00 0.00 0.00 57.45 57.47 1z8m n PHE 14 Cb 0.36 -0.39 -0.14 0.00 -0.00 0.00 0.00 39.48 39.31 1z8m n PHE 14 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 1z8m n ASP 15 N -2.95 1.38 0.23 -2.13 8.00 -1.24 -3.67 116.55 116.16 1z8m n ASP 15 Ca -0.02 0.30 0.14 0.00 0.71 0.00 0.00 54.79 55.91 1z8m n ASP 15 Cb 0.08 -0.36 0.37 0.00 -0.02 0.00 0.00 41.12 41.19 1z8m n ASP 15 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1z8m h LYS 16 N 0.03 0.00 0.10 -1.24 1.63 -1.66 -3.13 116.57 112.29 1z8m h LYS 16 Ca -0.36 0.00 -0.28 0.00 -0.85 0.00 0.00 60.65 59.16 1z8m h LYS 16 Cb 2.03 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.65 1z8m h LYS 16 CO 0.08 0.00 -1.36 1.25 -3.45 0.00 0.00 179.45 175.97 1z8m h LEU 17 N 0.00 0.32 -0.52 5.20 5.85 -1.32 -3.19 115.31 121.65 1z8m h LEU 17 Ca 0.00 -0.40 0.10 0.00 0.84 0.00 0.00 57.88 58.43 1z8m h LEU 17 Cb 0.80 -0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.64 1z8m h LEU 17 CO 0.00 1.32 -0.02 -0.07 -0.34 0.00 0.00 178.44 179.33 1z8m h LEU 18 N 0.06 -0.26 -1.66 2.25 4.07 -1.62 0.21 115.31 118.35 1z8m h LEU 18 Ca -0.17 0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.92 1z8m h LEU 18 Cb 1.96 0.24 0.00 0.00 1.08 0.00 0.00 40.66 43.94 1z8m h LEU 18 CO 0.17 -0.09 0.00 0.18 -1.08 0.00 0.00 178.44 177.61 1z8m n LEU 19 N -5.26 2.43 -1.46 1.67 4.77 -1.25 -2.69 117.00 115.21 1z8m n LEU 19 Ca 0.06 -1.22 -0.11 0.00 -0.03 0.00 0.00 56.01 54.71 1z8m n LEU 19 Cb 0.29 -0.35 0.17 0.00 -2.33 0.00 0.00 43.42 41.20 1z8m n LEU 19 CO 0.14 0.49 0.77 -3.20 -1.33 0.00 0.00 177.39 174.26 1z8m n ASN 20 N 0.53 3.21 0.00 -1.43 4.05 0.70 -4.85 115.26 117.47 1z8m n ASN 20 Ca 0.13 -3.77 0.00 0.00 0.45 0.00 0.00 54.58 51.39 1z8m n ASN 20 Cb 0.44 -0.66 0.00 0.00 1.23 0.00 0.00 39.78 40.79 1z8m n ASN 20 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1z8m n GLY 21 N -1.08 1.06 3.42 8.20 0.00 -1.24 -4.99 105.19 110.57 1z8m n GLY 21 Ca 0.40 -0.26 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.00 2.50 -0.42 1.61 2.19 -1.09 -5.05 117.98 115.72 1z8m s PHE 22 Ca 0.00 -0.29 -0.20 0.00 0.33 0.00 0.00 56.93 56.76 1z8m s PHE 22 Cb 0.00 -1.47 0.02 0.00 -1.31 0.00 0.00 43.02 40.26 1z8m s PHE 22 CO 0.00 0.19 0.63 0.34 1.83 0.00 0.00 175.22 178.21 1z8m s ASP 23 N -1.24 6.33 0.57 6.13 -1.08 -1.26 -4.50 116.67 121.62 1z8m s ASP 23 Ca 0.13 -0.26 0.28 0.00 -0.52 0.00 0.00 52.55 52.19 1z8m s ASP 23 Cb -0.10 -2.31 1.49 0.00 -1.46 0.00 0.00 42.92 40.54 1z8m s ASP 23 CO 0.03 -0.73 1.97 -2.24 0.52 0.00 0.00 175.17 174.73 1z8m h ASP 24 N 8.78 0.00 0.07 -0.34 2.03 -1.97 0.18 116.42 125.18 1z8m h ASP 24 Ca -0.26 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.04 1z8m h ASP 24 Cb 1.10 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.60 1z8m h ASP 24 CO 0.87 0.00 0.00 -1.28 -1.03 0.00 0.00 179.24 177.80 1z8m h SER 25 N 0.00 0.00 0.14 4.15 0.87 -2.00 -2.33 113.55 114.37 1z8m h SER 25 Ca 0.21 0.00 -0.35 0.00 -1.23 0.00 0.00 61.79 60.42 1z8m h SER 25 Cb 1.02 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.97 1z8m h SER 25 CO -0.00 0.00 -1.86 0.58 -0.53 0.00 0.00 176.83 175.02 1z8m h VAL 26 N 0.00 0.75 -0.74 2.23 2.07 -1.05 -3.37 116.25 116.15 1z8m h VAL 26 Ca 0.00 -2.39 0.06 0.00 0.82 0.00 0.00 66.70 65.19 1z8m h VAL 26 Cb 0.04 2.59 -0.05 0.00 -1.52 0.00 0.00 31.29 32.35 1z8m h VAL 26 CO 0.00 0.85 0.48 0.17 0.02 0.00 0.00 177.57 179.10 1z8m h LEU 27 N 0.01 0.69 -1.89 2.57 8.10 -1.46 -0.39 115.31 122.94 1z8m h LEU 27 Ca -0.39 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.58 1z8m h LEU 27 Cb 2.00 -0.15 -0.00 0.00 -0.44 0.00 0.00 40.66 42.08 1z8m h LEU 27 CO 0.10 0.45 -0.11 -1.13 -4.11 0.00 0.00 178.44 173.64 1z8m h ASN 28 N 0.78 0.00 0.41 0.17 -0.73 -1.67 0.72 115.58 115.27 1z8m h ASN 28 Ca 0.32 0.00 -0.20 0.00 1.87 0.00 0.00 56.30 58.29 1z8m h ASN 28 Cb 0.24 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.82 1z8m h ASN 28 CO -0.10 0.11 -0.84 -0.33 -0.37 0.00 0.00 177.43 175.90 1z8m h GLU 29 N 0.00 0.31 0.04 6.67 5.08 -1.22 -2.82 114.58 122.64 1z8m h GLU 29 Ca -0.00 -0.31 -0.27 0.00 -1.00 0.00 0.00 59.36 57.78 1z8m h GLU 29 Cb 0.22 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 1z8m h GLU 29 CO 0.01 0.99 -1.47 -0.24 -1.00 0.00 0.00 179.01 177.30 1z8m h VAL 30 N 0.19 0.83 -0.10 3.13 3.04 -1.20 -3.33 116.25 118.81 1z8m h VAL 30 Ca -0.05 -2.22 0.03 0.00 -1.01 0.00 0.00 66.70 63.45 1z8m h VAL 30 Cb 1.45 2.29 -0.00 0.00 -2.01 0.00 0.00 31.29 33.01 1z8m h VAL 30 CO 0.14 0.47 0.12 0.40 -1.01 0.00 0.00 177.57 177.69 1z8m h ILE 31 N -0.71 0.46 0.12 3.17 5.03 0.30 -1.99 117.51 123.90 1z8m h ILE 31 Ca -0.37 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.36 1z8m h ILE 31 Cb 1.51 0.90 0.00 0.00 -3.03 0.00 0.00 36.82 36.20 1z8m h ILE 31 CO -0.13 0.00 -0.06 0.25 -0.68 0.00 0.00 178.15 177.53 1z8m h LEU 32 N 0.00 -0.14 -1.75 1.44 6.46 -1.64 0.93 115.31 120.61 1z8m h LEU 32 Ca 0.05 -0.39 -0.03 0.00 -0.12 0.00 0.00 57.88 57.39 1z8m h LEU 32 Cb 0.29 0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1z8m h LEU 32 CO -0.00 0.36 -0.13 0.74 -0.62 0.00 0.00 178.44 178.79 1z8m h THR 33 N -0.69 0.49 0.05 1.05 2.02 -1.54 -1.76 112.91 112.53 1z8m h THR 33 Ca -0.02 -0.64 -0.32 0.00 0.77 0.00 0.00 66.41 66.20 1z8m h THR 33 Cb 0.52 1.44 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 1z8m h THR 33 CO 0.03 0.13 -1.80 -0.07 0.37 0.00 0.00 175.52 174.18 1z8m h LEU 34 N 0.00 0.16 -3.44 2.58 3.38 -1.38 -3.33 115.31 113.28 1z8m h LEU 34 Ca -0.00 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 1z8m h LEU 34 Cb 0.43 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1z8m h LEU 34 CO 0.02 1.31 0.01 0.54 0.09 0.00 0.00 178.44 180.41 1z8m n ARG 35 N -3.21 4.66 -0.05 1.13 1.74 0.32 -4.45 116.66 116.80 1z8m n ARG 35 Ca -0.22 -2.99 -0.10 0.00 -0.77 0.00 0.00 57.85 53.77 1z8m n ARG 35 Cb 1.05 -2.23 -0.03 0.00 -1.02 0.00 0.00 32.46 30.23 1z8m n ARG 35 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1z8m n LYS 36 N 0.56 0.31 0.00 5.56 5.02 -0.68 -4.97 118.16 123.96 1z8m n LYS 36 Ca 0.27 0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.69 1z8m n LYS 36 Cb 1.16 -1.04 0.00 0.00 -0.02 0.00 0.00 35.03 35.13 1z8m n LYS 36 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1z8m n LYS 37 N -3.90 0.00 -1.88 1.97 2.85 -1.26 -5.12 118.16 110.82 1z8m n LYS 37 Ca -0.17 0.00 -0.42 0.00 -1.05 0.00 0.00 58.31 56.66 1z8m n LYS 37 Cb 0.47 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.82 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 0.00 4.19 0.90 -1.58 2.56 -1.25 -4.98 118.70 118.54 1z8m s GLU 38 Ca 0.00 2.40 -0.12 0.00 0.00 0.00 0.00 54.97 57.25 1z8m s GLU 38 Cb 0.00 -3.48 0.13 0.00 2.00 0.00 0.00 34.13 32.78 1z8m s GLU 38 CO 0.00 -0.73 1.13 -1.25 -0.56 0.00 0.00 175.26 173.85 1z8m s PRO 39 N 2.28 1.27 -0.20 4.30 0.04 -1.26 -4.66 135.00 136.76 1z8m s PRO 39 Ca 0.74 0.33 -0.14 0.00 0.04 0.00 0.00 61.00 61.97 1z8m s PRO 39 Cb -0.42 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 1z8m s PRO 39 CO 0.33 -2.12 0.33 -0.51 0.04 0.00 0.00 177.00 175.07 1z8m s LEU 40 N -5.99 4.16 0.79 -3.56 1.43 -1.26 -5.08 118.68 109.17 1z8m s LEU 40 Ca 0.63 0.43 -0.11 0.00 -1.03 0.00 0.00 54.13 54.06 1z8m s LEU 40 Cb -0.15 -2.41 0.06 0.00 0.03 0.00 0.00 46.19 43.73 1z8m s LEU 40 CO 0.53 -0.02 1.08 -1.81 0.23 0.00 0.00 176.35 176.37 1z8m s ASP 41 N 0.94 4.50 0.40 2.29 1.01 -1.26 -4.95 116.67 119.60 1z8m s ASP 41 Ca 0.16 1.58 0.18 0.00 0.71 0.00 0.00 52.55 55.18 1z8m s ASP 41 Cb -0.14 -2.33 0.83 0.00 1.01 0.00 0.00 42.92 42.29 1z8m s ASP 41 CO 0.06 -2.00 1.83 1.55 0.21 0.00 0.00 175.17 176.82 1z8m h PRO 42 N -1.11 0.00 0.00 8.23 0.13 -1.98 -2.69 132.00 134.59 1z8m h PRO 42 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1z8m h PRO 42 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1z8m h PRO 42 CO 0.55 0.34 0.00 1.96 -0.23 0.00 0.00 178.00 180.62 1z8m h GLN 43 N 0.00 0.00 0.00 0.86 1.08 -1.99 -1.65 115.11 113.41 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 0.70 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.13 1z8m h GLN 43 CO 0.04 0.00 0.00 1.19 -0.95 0.00 0.00 178.83 179.11 1z8m n PHE 44 N -2.38 0.00 -2.91 2.96 3.01 -1.01 -4.90 117.46 112.23 1z8m n PHE 44 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.35 1z8m n PHE 44 Cb 0.14 -0.01 0.05 0.00 -0.01 0.00 0.00 39.48 39.65 1z8m n PHE 44 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1z8m n GLN 45 N -1.01 -4.16 -2.90 -1.08 1.13 -0.62 -1.32 117.38 107.42 1z8m n GLN 45 Ca 0.23 0.52 -0.44 0.00 -1.94 0.00 0.00 57.00 55.37 1z8m n GLN 45 Cb 0.11 -4.55 -0.02 0.00 0.11 0.00 0.00 30.24 25.88 1z8m n GLN 45 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 1z8m s ASP 46 N -3.74 6.66 0.37 1.08 -4.77 -1.26 -4.16 116.67 110.86 1z8m s ASP 46 Ca 0.05 -2.10 -0.05 0.00 -3.30 0.00 0.00 52.55 47.15 1z8m s ASP 46 Cb -0.02 -2.41 0.02 0.00 -1.09 0.00 0.00 42.92 39.42 1z8m s ASP 46 CO 0.44 -1.06 0.58 0.00 0.70 0.00 0.00 175.17 175.83 1z8m n HIS 47 N 6.61 -1.71 -2.90 2.11 1.44 -1.07 -4.96 115.22 114.74 1z8m n HIS 47 Ca 0.26 -2.28 -0.41 0.00 -2.01 0.00 0.00 57.72 53.28 1z8m n HIS 47 Cb 0.49 0.66 -0.04 0.00 0.12 0.00 0.00 29.99 31.21 1z8m n HIS 47 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1z8m s ALA 48 N -2.63 3.46 1.16 1.59 0.00 -1.26 -0.68 121.76 123.41 1z8m s ALA 48 Ca 0.26 0.08 -0.17 0.00 0.00 0.00 0.00 51.96 52.14 1z8m s ALA 48 Cb -0.02 -3.19 0.25 0.00 0.00 0.00 0.00 23.12 20.16 1z8m s ALA 48 CO 0.19 -0.53 1.01 1.28 0.00 0.00 0.00 175.76 177.70 1z8m n LEU 49 N 4.91 0.00 -4.84 0.00 4.77 -0.94 -4.95 117.00 115.95 1z8m n LEU 49 Ca 0.04 -1.08 -0.24 0.00 -0.03 0.00 0.00 56.01 54.70 1z8m n LEU 49 Cb 0.49 -0.88 -0.04 0.00 -2.33 0.00 0.00 43.42 40.66 1z8m n LEU 49 CO 0.48 -1.85 -0.04 -0.54 -1.33 0.00 0.00 177.39 174.11 1z8m s LYS 50 N -5.26 2.34 7.59 3.23 1.02 -1.26 -3.56 119.74 123.85 1z8m s LYS 50 Ca 0.63 -1.79 0.00 0.00 0.02 0.00 0.00 55.97 54.83 1z8m s LYS 50 Cb -0.05 -2.16 0.00 0.00 -0.52 0.00 0.00 37.83 35.10 1z8m s LYS 50 CO 0.47 -0.30 0.00 0.41 -0.92 0.00 0.00 175.35 175.01 1z8m n GLY 51 N -1.51 2.27 0.10 -3.33 0.00 -1.26 -3.04 105.19 98.41 1z8m n GLY 51 Ca 0.00 -0.37 0.12 0.00 0.00 0.00 0.00 46.02 45.76 1z8m n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1z8m h LYS 52 N 0.00 0.00 -1.16 1.61 1.57 -2.05 -3.35 116.57 113.19 1z8m h LYS 52 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1z8m h LYS 52 Cb 0.00 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.07 1z8m h LYS 52 CO 0.00 0.00 0.68 0.91 -0.57 0.00 0.00 179.45 180.47 1z8m n TRP 53 N -2.46 2.60 -0.08 -1.35 8.01 -1.17 -4.47 117.44 118.52 1z8m n TRP 53 Ca 0.01 -2.47 -0.16 0.00 -1.31 0.00 0.00 57.50 53.58 1z8m n TRP 53 Cb 0.51 -1.20 -0.11 0.00 -2.01 0.00 0.00 31.31 28.50 1z8m n TRP 53 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1z8m h LYS 54 N 1.63 0.00 0.00 -0.99 1.57 -1.70 -2.49 116.57 114.59 1z8m h LYS 54 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1z8m h LYS 54 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1z8m h LYS 54 CO 1.23 0.91 0.00 -2.30 -0.57 0.00 0.00 179.45 178.71 1z8m n PRO 55 N -4.56 0.04 -1.66 3.15 -0.02 -1.26 -4.60 135.00 126.09 1z8m n PRO 55 Ca -0.17 0.30 -0.04 0.00 -2.02 0.00 0.00 63.50 61.56 1z8m n PRO 55 Cb 0.52 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 1z8m n PRO 55 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1z8m n PHE 56 N -1.44 -1.99 -3.91 6.00 3.01 -1.25 -4.89 117.46 112.98 1z8m n PHE 56 Ca 0.03 -0.38 -0.14 0.00 1.01 0.00 0.00 57.45 57.97 1z8m n PHE 56 Cb 0.10 -0.08 -0.15 0.00 -0.01 0.00 0.00 39.48 39.34 1z8m n PHE 56 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1z8m s ARG 57 N -2.41 0.12 0.30 -1.08 3.52 -0.47 -4.28 118.95 114.64 1z8m s ARG 57 Ca 0.07 0.02 0.07 0.00 -0.13 0.00 0.00 55.73 55.77 1z8m s ARG 57 Cb -0.01 -0.20 -0.03 0.00 -1.56 0.00 0.00 34.95 33.15 1z8m s ARG 57 CO 0.05 -0.04 0.25 -2.00 -0.81 0.00 0.00 175.30 172.74 1z8m s GLU 58 N 0.37 2.80 -0.30 5.12 2.56 0.15 -0.61 118.70 128.79 1z8m s GLU 58 Ca -0.03 -1.19 -0.09 0.00 0.00 0.00 0.00 54.97 53.65 1z8m s GLU 58 Cb -0.05 -2.51 0.15 0.00 2.00 0.00 0.00 34.13 33.72 1z8m s GLU 58 CO -0.01 0.23 0.73 0.00 -0.56 0.00 0.00 175.26 175.65 1z8m s HIS 60 N 2.80 3.19 0.47 0.00 3.76 -0.43 -2.17 115.29 122.91 1z8m s HIS 60 Ca 0.00 -1.48 0.13 0.00 -0.15 0.00 0.00 55.06 53.57 1z8m s HIS 60 Cb -0.11 -4.25 1.09 0.00 1.11 0.00 0.00 32.58 30.42 1z8m s HIS 60 CO -0.19 -1.45 2.10 0.82 -0.85 0.00 0.00 174.74 175.17 1z8m h ILE 61 N 5.69 1.05 -4.57 0.60 5.03 -1.77 -3.44 117.51 120.11 1z8m h ILE 61 Ca 0.16 -0.15 -0.29 0.00 -0.12 0.00 0.00 64.86 64.46 1z8m h ILE 61 Cb 1.02 0.88 -0.14 0.00 -3.03 0.00 0.00 36.82 35.55 1z8m h ILE 61 CO 1.09 0.06 -0.52 -0.54 -0.68 0.00 0.00 178.15 177.56 1z8m s LYS 62 N -5.15 1.41 0.00 2.37 1.02 -1.21 -4.99 119.74 113.19 1z8m s LYS 62 Ca -0.06 -1.71 0.10 0.00 0.02 0.00 0.00 55.97 54.33 1z8m s LYS 62 Cb 0.17 0.31 0.50 0.00 -0.52 0.00 0.00 37.83 38.29 1z8m s LYS 62 CO 0.69 -0.50 1.23 -2.30 -0.92 0.00 0.00 175.35 173.56 1z8m n PRO 63 N -0.39 0.12 -1.07 -1.68 -0.02 -1.26 -2.39 135.00 128.31 1z8m n PRO 63 Ca 0.03 0.21 0.02 0.00 -2.02 0.00 0.00 63.50 61.74 1z8m n PRO 63 Cb 0.64 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.63 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 -1.32 0.47 -3.87 2.55 5.68 -1.26 -4.85 116.55 113.96 1z8m n ASP 64 Ca 0.04 -1.96 -0.12 0.00 -0.50 0.00 0.00 54.79 52.26 1z8m n ASP 64 Cb 0.09 -0.21 -0.13 0.00 -1.14 0.00 0.00 41.12 39.72 1z8m n ASP 64 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1z8m s VAL 65 N 0.00 0.01 -0.29 2.12 1.01 -1.00 -3.87 120.40 118.37 1z8m s VAL 65 Ca 0.18 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 1z8m s VAL 65 Cb 0.21 -0.08 0.18 0.00 0.00 0.00 0.00 36.38 36.69 1z8m s VAL 65 CO -0.09 -0.04 0.58 -1.48 0.00 0.00 0.00 175.10 174.07 1z8m s LEU 66 N -0.11 -1.31 -0.14 3.92 2.34 -0.12 -2.71 118.68 120.56 1z8m s LEU 66 Ca -0.01 0.84 -0.04 0.00 0.06 0.00 0.00 54.13 54.98 1z8m s LEU 66 Cb -0.01 2.07 -0.03 0.00 -0.56 0.00 0.00 46.19 47.66 1z8m s LEU 66 CO 0.00 -0.26 -0.02 -1.48 -1.06 0.00 0.00 176.35 173.52 1z8m s LEU 67 N 2.83 3.35 0.09 1.48 0.05 -0.92 -1.68 118.68 123.88 1z8m s LEU 67 Ca 0.19 -0.07 -0.20 0.00 0.05 0.00 0.00 54.13 54.11 1z8m s LEU 67 Cb -0.15 -1.80 -0.07 0.00 -2.05 0.00 0.00 46.19 42.12 1z8m s LEU 67 CO -0.20 0.21 0.59 -0.69 -0.55 0.00 0.00 176.35 175.71 1z8m s VAL 68 N 0.13 4.70 0.08 1.48 1.01 0.29 -3.23 120.40 124.87 1z8m s VAL 68 Ca -0.00 1.25 -0.09 0.00 0.00 0.00 0.00 61.98 63.14 1z8m s VAL 68 Cb -0.13 -3.91 -0.00 0.00 0.00 0.00 0.00 36.38 32.33 1z8m s VAL 68 CO 0.02 0.52 0.19 -0.72 0.00 0.00 0.00 175.10 175.11 1z8m s TYR 69 N -1.15 0.15 0.45 5.22 -0.85 0.22 0.12 117.35 121.50 1z8m s TYR 69 Ca 0.31 -0.56 0.07 0.00 -0.52 0.00 0.00 57.07 56.37 1z8m s TYR 69 Cb -0.20 -0.06 -0.01 0.00 0.38 0.00 0.00 41.96 42.07 1z8m s TYR 69 CO 0.20 -0.53 0.34 -1.17 -1.52 0.00 0.00 175.55 172.87 1z8m s LEU 70 N -2.77 3.17 -0.30 -3.49 2.96 0.72 -1.37 118.68 117.60 1z8m s LEU 70 Ca 0.04 -0.94 0.02 0.00 -0.22 0.00 0.00 54.13 53.03 1z8m s LEU 70 Cb 0.04 -1.70 0.09 0.00 0.50 0.00 0.00 46.19 45.12 1z8m s LEU 70 CO -0.10 -0.73 0.01 -0.69 -1.32 0.00 0.00 176.35 173.52 1z8m s VAL 71 N -2.57 1.86 0.51 1.68 1.01 -1.26 -3.03 120.40 118.59 1z8m s VAL 71 Ca 0.43 -1.83 0.02 0.00 0.00 0.00 0.00 61.98 60.60 1z8m s VAL 71 Cb -0.01 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 34.13 1z8m s VAL 71 CO 0.25 -0.42 0.72 -0.75 0.00 0.00 0.00 175.10 174.90 1z8m s LYS 72 N 1.16 2.72 -0.41 2.72 2.20 0.29 -4.98 119.74 123.44 1z8m s LYS 72 Ca 0.04 -0.75 -0.27 0.00 -0.36 0.00 0.00 55.97 54.62 1z8m s LYS 72 Cb -0.19 -2.54 -0.07 0.00 -1.51 0.00 0.00 37.83 33.52 1z8m s LYS 72 CO -0.10 -0.53 2.35 -0.25 -0.36 0.00 0.00 175.35 176.46 1z8m n ASP 73 N -2.21 2.56 -1.70 1.43 8.00 -1.26 -1.63 116.55 121.74 1z8m n ASP 73 Ca 0.06 -0.20 -0.18 0.00 0.71 0.00 0.00 54.79 55.19 1z8m n ASP 73 Cb 0.59 -1.54 -0.06 0.00 -0.02 0.00 0.00 41.12 40.09 1z8m n ASP 73 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1z8m n ASP 74 N 13.99 -4.81 -3.76 -2.24 9.92 -1.26 -4.93 116.55 123.47 1z8m n ASP 74 Ca 0.36 0.36 -0.13 0.00 -0.53 0.00 0.00 54.79 54.86 1z8m n ASP 74 Cb 0.48 -4.25 -0.11 0.00 -0.64 0.00 0.00 41.12 36.59 1z8m n ASP 74 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1z8m s GLU 75 N -3.83 0.35 -0.01 -1.24 2.02 -0.64 -4.23 118.70 111.12 1z8m s GLU 75 Ca 0.00 0.47 0.01 0.00 0.02 0.00 0.00 54.97 55.47 1z8m s GLU 75 Cb 0.00 0.13 -0.04 0.00 0.10 0.00 0.00 34.13 34.33 1z8m s GLU 75 CO 0.00 -0.06 -0.01 -1.17 0.02 0.00 0.00 175.26 174.04 1z8m s LEU 76 N 0.37 3.49 -0.05 1.80 2.96 -0.96 0.10 118.68 126.39 1z8m s LEU 76 Ca -0.02 0.00 0.02 0.00 -0.22 0.00 0.00 54.13 53.91 1z8m s LEU 76 Cb -0.03 -1.97 0.02 0.00 0.50 0.00 0.00 46.19 44.71 1z8m s LEU 76 CO -0.01 0.30 -0.08 0.27 -1.32 0.00 0.00 176.35 175.50 1z8m s ILE 77 N -1.04 0.83 0.16 6.68 -5.25 -1.17 -2.27 121.20 119.14 1z8m s ILE 77 Ca 0.18 -0.30 -0.30 0.00 -0.99 0.00 0.00 60.65 59.24 1z8m s ILE 77 Cb -0.11 -0.79 -0.07 0.00 2.95 0.00 0.00 42.46 44.43 1z8m s ILE 77 CO 0.09 0.29 1.08 -0.76 -1.79 0.00 0.00 174.94 173.84 1z8m s LEU 78 N 0.74 4.49 -0.12 0.37 1.43 -0.95 -0.20 118.68 124.44 1z8m s LEU 78 Ca -0.13 2.03 -0.09 0.00 -1.03 0.00 0.00 54.13 54.91 1z8m s LEU 78 Cb -0.15 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.44 1z8m s LEU 78 CO 0.02 -0.20 -0.18 -0.11 0.23 0.00 0.00 176.35 176.10 1z8m n LEU 79 N 2.50 1.36 -3.62 1.79 -0.00 0.32 -2.28 117.00 117.07 1z8m n LEU 79 Ca 0.03 0.41 -0.07 0.00 -0.00 0.00 0.00 56.01 56.38 1z8m n LEU 79 Cb 0.47 -0.73 -0.02 0.00 -0.00 0.00 0.00 43.42 43.14 1z8m n LEU 79 CO 0.53 -0.42 0.65 0.00 -0.00 0.00 0.00 177.39 178.16 1z8m s ARG 80 N -2.12 1.08 -0.10 1.96 1.04 0.06 -0.79 118.95 120.09 1z8m s ARG 80 Ca -0.15 -0.51 0.02 0.00 -1.04 0.00 0.00 55.73 54.05 1z8m s ARG 80 Cb 0.02 0.43 0.01 0.00 -2.04 0.00 0.00 34.95 33.37 1z8m s ARG 80 CO 0.23 -0.49 -0.16 -1.17 -0.04 0.00 0.00 175.30 173.67 1z8m s LEU 81 N -2.72 1.76 0.00 -1.89 1.98 -1.26 0.11 118.68 116.65 1z8m s LEU 81 Ca 0.08 -0.42 0.00 0.00 -2.89 0.00 0.00 54.13 50.90 1z8m s LEU 81 Cb -0.01 -1.09 -0.00 0.00 0.66 0.00 0.00 46.19 45.75 1z8m s LEU 81 CO -0.04 0.04 0.22 0.61 -1.89 0.00 0.00 176.35 175.29 1z8m n GLY 82 N 4.05 2.84 3.85 7.98 0.00 -0.67 -4.78 105.19 118.47 1z8m n GLY 82 Ca -0.20 -1.57 -0.25 0.00 0.00 0.00 0.00 46.02 44.00 1z8m n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1z8m s SER 83 N -2.12 4.65 0.47 1.61 0.01 -1.26 -0.94 113.70 116.12 1z8m s SER 83 Ca 0.16 -1.11 0.24 0.00 1.31 0.00 0.00 55.95 56.56 1z8m s SER 83 Cb -0.00 -0.03 1.17 0.00 0.21 0.00 0.00 66.02 67.37 1z8m s SER 83 CO 0.12 -0.85 1.96 1.12 0.41 0.00 0.00 173.24 175.99 1z8m h HIS 84 N 1.00 0.00 0.00 2.43 2.07 -1.89 -2.15 115.15 116.61 1z8m h HIS 84 Ca -0.40 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.12 1z8m h HIS 84 Cb 1.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.26 1z8m h HIS 84 CO 0.81 0.19 -0.55 0.77 -3.07 0.00 0.00 177.93 176.08 1z8m h SER 85 N 0.00 0.00 0.00 3.10 0.02 -1.91 -2.93 113.55 111.83 1z8m h SER 85 Ca -0.00 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 1z8m h SER 85 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 1z8m h SER 85 CO 0.03 0.07 -0.02 -0.33 -1.14 0.00 0.00 176.83 175.43 1z8m h GLU 86 N 0.00 0.00 -0.71 3.45 4.39 -1.79 -3.40 114.58 116.52 1z8m h GLU 86 Ca 0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1z8m h GLU 86 Cb 0.80 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.42 1z8m h GLU 86 CO 0.00 0.00 0.29 -0.07 -1.16 0.00 0.00 179.01 178.07 1z8m h LEU 87 N -0.07 0.98 -1.71 1.33 4.07 -1.66 -3.49 115.31 114.75 1z8m h LEU 87 Ca 0.00 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.79 1z8m h LEU 87 Cb 0.02 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.51 1z8m h LEU 87 CO 0.00 0.88 0.00 0.49 -1.08 0.00 0.00 178.44 178.73