#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 4.53 1.01 4.03 1.02 -1.26 -5.01 118.68 123.00 1z8m s LEU 2 Ca 0.00 2.18 -0.12 0.00 0.02 0.00 0.00 54.13 56.21 1z8m s LEU 2 Cb 0.00 -3.62 0.17 0.00 0.02 0.00 0.00 46.19 42.76 1z8m s LEU 2 CO 0.00 -0.16 0.93 1.17 0.02 0.00 0.00 176.35 178.31 1z8m n LYS 3 N 1.71 -1.07 -4.57 1.70 0.00 -1.26 -4.59 118.16 110.08 1z8m n LYS 3 Ca 0.00 -0.26 -0.24 0.00 0.00 0.00 0.00 58.31 57.81 1z8m n LYS 3 Cb 0.45 -2.20 -0.14 0.00 0.00 0.00 0.00 35.03 33.14 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 -5.65 2.17 0.00 3.14 0.20 -1.23 0.14 118.68 117.46 1z8m s LEU 4 Ca 0.65 -0.52 0.04 0.00 0.69 0.00 0.00 54.13 54.99 1z8m s LEU 4 Cb -0.23 -0.90 -0.01 0.00 -0.43 0.00 0.00 46.19 44.62 1z8m s LEU 4 CO 0.62 0.13 0.14 -3.20 -0.29 0.00 0.00 176.35 173.75 1z8m n ASN 5 N 1.82 0.53 -3.77 3.68 5.15 0.47 -4.89 115.26 118.25 1z8m n ASN 5 Ca -0.17 -2.51 -0.13 0.00 -0.60 0.00 0.00 54.58 51.17 1z8m n ASN 5 Cb 0.54 0.88 -0.13 0.00 -0.53 0.00 0.00 39.78 40.54 1z8m n ASN 5 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1z8m s LEU 6 N 0.00 0.93 0.44 1.20 1.43 -1.26 -2.25 118.68 119.17 1z8m s LEU 6 Ca 0.19 0.44 0.08 0.00 -1.03 0.00 0.00 54.13 53.81 1z8m s LEU 6 Cb 0.01 0.68 0.00 0.00 0.03 0.00 0.00 46.19 46.91 1z8m s LEU 6 CO 0.14 -0.11 0.46 -0.54 0.23 0.00 0.00 176.35 176.53 1z8m s LYS 7 N 0.55 2.56 0.24 1.70 -0.14 -0.69 -4.90 119.74 119.06 1z8m s LYS 7 Ca -0.04 -1.51 0.02 0.00 -1.36 0.00 0.00 55.97 53.08 1z8m s LYS 7 Cb -0.05 -2.47 0.27 0.00 -1.68 0.00 0.00 37.83 33.90 1z8m s LYS 7 CO -0.03 -0.30 1.59 -0.22 -0.76 0.00 0.00 175.35 175.63 1z8m h LYS 8 N 0.84 0.38 -0.10 1.68 3.64 -1.89 -2.62 116.57 118.50 1z8m h LYS 8 Ca -0.40 -0.22 -0.07 0.00 -1.27 0.00 0.00 60.65 58.70 1z8m h LYS 8 Cb 1.27 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.10 1z8m h LYS 8 CO 0.53 0.79 -0.25 0.77 -2.27 0.00 0.00 179.45 179.02 1z8m h SER 9 N 0.30 0.17 0.65 4.20 0.02 -1.94 -2.43 113.55 114.52 1z8m h SER 9 Ca 0.01 -0.05 -0.21 0.00 -0.84 0.00 0.00 61.79 60.71 1z8m h SER 9 Cb 0.98 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 1z8m h SER 9 CO 0.08 0.43 -0.95 0.15 -1.14 0.00 0.00 176.83 175.40 1z8m h PHE 10 N 0.16 0.29 0.00 3.45 3.04 -1.13 -1.03 116.94 121.71 1z8m h PHE 10 Ca 0.03 -0.17 -0.09 0.00 3.98 0.00 0.00 57.97 61.71 1z8m h PHE 10 Cb 0.54 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 39.01 1z8m h PHE 10 CO 0.01 1.03 -0.45 1.96 -2.02 0.00 0.00 178.31 178.84 1z8m h GLN 11 N 0.09 0.00 0.00 1.11 1.08 -1.12 -2.56 115.11 113.71 1z8m h GLN 11 Ca -0.05 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 56.99 1z8m h GLN 11 Cb 1.62 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 29.02 1z8m h GLN 11 CO 0.14 0.45 -1.04 0.36 -0.95 0.00 0.00 178.83 177.79 1z8m n LYS 12 N -3.86 0.53 0.12 1.46 2.85 -0.95 -4.01 118.16 114.30 1z8m n LYS 12 Ca -0.01 0.56 0.20 0.00 -1.05 0.00 0.00 58.31 58.00 1z8m n LYS 12 Cb 0.49 -1.73 0.76 0.00 -0.65 0.00 0.00 35.03 33.91 1z8m n LYS 12 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 1z8m h ASP 13 N -1.00 0.00 0.00 -5.58 5.19 -1.28 1.26 116.42 115.01 1z8m h ASP 13 Ca -0.24 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.17 1z8m h ASP 13 Cb 1.05 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.56 1z8m h ASP 13 CO -0.15 0.00 0.00 0.33 -3.12 0.00 0.00 179.24 176.30 1z8m n PHE 14 N -3.69 0.00 0.22 4.55 7.35 -0.96 -0.36 117.46 124.56 1z8m n PHE 14 Ca 0.06 0.00 0.08 0.00 -0.76 0.00 0.00 57.45 56.83 1z8m n PHE 14 Cb 0.56 -0.44 0.51 0.00 0.35 0.00 0.00 39.48 40.46 1z8m n PHE 14 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1z8m h ASP 15 N 0.00 0.00 0.41 -2.13 5.19 -1.61 0.30 116.42 118.58 1z8m h ASP 15 Ca 0.00 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.30 1z8m h ASP 15 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 1z8m h ASP 15 CO 0.00 0.25 -0.49 0.50 -3.12 0.00 0.00 179.24 176.38 1z8m h LYS 16 N 0.00 0.10 0.12 3.56 3.64 0.16 -2.18 116.57 121.96 1z8m h LYS 16 Ca -0.00 -0.05 -0.36 0.00 -1.27 0.00 0.00 60.65 58.96 1z8m h LYS 16 Cb 0.59 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.40 1z8m h LYS 16 CO 0.03 0.57 -1.98 -0.11 -2.27 0.00 0.00 179.45 175.69 1z8m n LEU 17 N -3.96 2.62 -0.25 5.20 7.94 0.51 -3.22 117.00 125.85 1z8m n LEU 17 Ca -0.02 0.22 0.14 0.00 -1.11 0.00 0.00 56.01 55.24 1z8m n LEU 17 Cb 0.52 -1.12 0.43 0.00 0.53 0.00 0.00 43.42 43.78 1z8m n LEU 17 CO 0.41 0.84 1.22 -0.07 -1.11 0.00 0.00 177.39 178.68 1z8m h LEU 18 N 0.04 0.56 -0.01 -1.96 4.07 -0.39 0.22 115.31 117.83 1z8m h LEU 18 Ca -0.42 0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.58 1z8m h LEU 18 Cb 2.01 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 43.69 1z8m h LEU 18 CO 0.08 0.26 -0.50 0.00 -1.08 0.00 0.00 178.44 177.21 1z8m n LEU 19 N -4.55 0.52 -1.99 1.67 -0.00 -0.82 -2.90 117.00 108.92 1z8m n LEU 19 Ca 0.18 -0.01 -0.21 0.00 -0.00 0.00 0.00 56.01 55.96 1z8m n LEU 19 Cb 0.54 -0.25 0.07 0.00 -0.00 0.00 0.00 43.42 43.79 1z8m n LEU 19 CO 0.30 0.13 1.23 -3.20 -0.00 0.00 0.00 177.39 175.85 1z8m n ASN 20 N -1.48 5.97 0.00 1.45 5.15 0.73 -4.73 115.26 122.36 1z8m n ASN 20 Ca 0.06 -3.27 0.00 0.00 -0.60 0.00 0.00 54.58 50.77 1z8m n ASN 20 Cb 0.34 -0.94 0.00 0.00 -0.53 0.00 0.00 39.78 38.64 1z8m n ASN 20 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1z8m n GLY 21 N -0.27 0.74 3.15 8.20 0.00 -1.24 -5.00 105.19 110.77 1z8m n GLY 21 Ca 0.42 -0.63 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 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 3.18 0.53 1.61 2.19 -1.07 -5.04 117.98 117.38 1z8m s PHE 22 Ca 0.00 -1.90 -0.22 0.00 0.33 0.00 0.00 56.93 55.14 1z8m s PHE 22 Cb 0.00 -2.03 -0.06 0.00 -1.31 0.00 0.00 43.02 39.62 1z8m s PHE 22 CO 0.00 -0.81 1.21 -3.47 1.83 0.00 0.00 175.22 173.99 1z8m n ASP 23 N 4.58 2.04 0.02 6.13 2.03 -1.26 -4.15 116.55 125.93 1z8m n ASP 23 Ca -0.15 0.95 0.13 0.00 0.52 0.00 0.00 54.79 56.24 1z8m n ASP 23 Cb 0.44 -1.50 0.34 0.00 -0.72 0.00 0.00 41.12 39.69 1z8m n ASP 23 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1z8m n ASP 24 N -0.66 0.43 0.12 1.67 5.75 -1.26 -3.69 116.55 118.90 1z8m n ASP 24 Ca 0.11 0.08 -0.01 0.00 -0.01 0.00 0.00 54.79 54.96 1z8m n ASP 24 Cb 0.44 -0.04 0.02 0.00 -1.03 0.00 0.00 41.12 40.51 1z8m n ASP 24 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 1z8m h SER 25 N 0.00 0.00 1.26 -1.12 0.87 -2.01 -3.24 113.55 109.31 1z8m h SER 25 Ca 0.00 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.40 1z8m h SER 25 Cb 0.57 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 1z8m h SER 25 CO 0.00 0.68 -0.74 1.62 -0.53 0.00 0.00 176.83 177.85 1z8m h VAL 26 N 0.00 1.28 -0.88 2.23 3.04 -1.96 -3.29 116.25 116.67 1z8m h VAL 26 Ca -0.01 -2.80 0.03 0.00 -1.01 0.00 0.00 66.70 62.91 1z8m h VAL 26 Cb 1.45 2.63 -0.05 0.00 -2.01 0.00 0.00 31.29 33.31 1z8m h VAL 26 CO 0.09 0.73 0.58 0.17 -1.01 0.00 0.00 177.57 178.12 1z8m h LEU 27 N 0.00 0.96 -2.54 3.16 8.10 -1.68 -0.89 115.31 122.42 1z8m h LEU 27 Ca -0.01 -0.01 0.01 0.00 0.11 0.00 0.00 57.88 57.98 1z8m h LEU 27 Cb 1.57 -0.23 -0.00 0.00 -0.44 0.00 0.00 40.66 41.56 1z8m h LEU 27 CO 0.10 0.67 0.04 -1.13 -4.11 0.00 0.00 178.44 174.01 1z8m h ASN 28 N 1.12 0.00 0.12 0.17 -1.24 -1.68 0.48 115.58 114.55 1z8m h ASN 28 Ca 0.34 0.00 -0.16 0.00 0.71 0.00 0.00 56.30 57.19 1z8m h ASN 28 Cb -0.02 0.00 0.02 0.00 0.73 0.00 0.00 38.32 39.04 1z8m h ASN 28 CO -0.09 0.00 -0.70 -0.33 -1.29 0.00 0.00 177.43 175.01 1z8m h GLU 29 N 0.00 0.26 0.02 6.67 5.08 -1.34 -3.04 114.58 122.23 1z8m h GLU 29 Ca 0.01 -0.44 -0.05 0.00 -1.00 0.00 0.00 59.36 57.89 1z8m h GLU 29 Cb 0.10 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1z8m h GLU 29 CO -0.00 1.21 -0.20 -0.24 -1.00 0.00 0.00 179.01 178.78 1z8m h VAL 30 N -0.46 1.64 -0.29 3.13 3.04 -1.24 -3.23 116.25 118.84 1z8m h VAL 30 Ca -0.12 -2.14 0.08 0.00 -1.01 0.00 0.00 66.70 63.51 1z8m h VAL 30 Cb 1.55 3.05 -0.01 0.00 -2.01 0.00 0.00 31.29 33.87 1z8m h VAL 30 CO 0.13 0.57 0.21 0.40 -1.01 0.00 0.00 177.57 177.87 1z8m h ILE 31 N -0.69 0.83 0.39 3.17 5.03 -0.25 -2.75 117.51 123.23 1z8m h ILE 31 Ca -0.03 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.69 1z8m h ILE 31 Cb 1.05 0.85 0.00 0.00 -3.03 0.00 0.00 36.82 35.70 1z8m h ILE 31 CO 0.04 0.00 -0.19 0.25 -0.68 0.00 0.00 178.15 177.57 1z8m h LEU 32 N 0.00 -0.45 -1.39 1.44 6.46 -1.57 0.29 115.31 120.09 1z8m h LEU 32 Ca 0.14 0.02 0.17 0.00 -0.12 0.00 0.00 57.88 58.08 1z8m h LEU 32 Cb 0.56 0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.58 1z8m h LEU 32 CO -0.00 -0.31 0.82 0.74 -0.62 0.00 0.00 178.44 179.07 1z8m h THR 33 N -0.56 0.13 0.00 1.05 2.02 -1.51 1.57 112.91 115.62 1z8m h THR 33 Ca -0.05 0.00 -0.22 0.00 0.77 0.00 0.00 66.41 66.90 1z8m h THR 33 Cb 0.41 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1z8m h THR 33 CO 0.09 0.00 -1.21 -0.07 0.37 0.00 0.00 175.52 174.70 1z8m h LEU 34 N 0.00 0.01 0.00 2.58 3.38 -1.31 -2.29 115.31 117.68 1z8m h LEU 34 Ca 0.28 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1z8m h LEU 34 Cb 1.91 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.66 1z8m h LEU 34 CO -0.00 1.47 -0.27 0.03 0.09 0.00 0.00 178.44 179.76 1z8m h ARG 35 N -0.98 0.00 -0.68 1.13 3.08 0.11 -3.26 114.38 113.78 1z8m h ARG 35 Ca -0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.72 1z8m h ARG 35 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.35 1z8m h ARG 35 CO -0.19 0.00 0.00 1.63 -1.07 0.00 0.00 179.97 180.34 1z8m n LYS 36 N -2.50 3.66 -4.11 0.04 4.76 0.52 -4.92 118.16 115.62 1z8m n LYS 36 Ca 0.04 -2.25 -0.29 0.00 -2.87 0.00 0.00 58.31 52.94 1z8m n LYS 36 Cb 0.47 -1.99 -0.05 0.00 -1.84 0.00 0.00 35.03 31.63 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 0.52 -2.54 -3.32 1.97 2.85 -1.23 -4.93 118.16 111.49 1z8m n LYS 37 Ca 0.20 0.30 -0.38 0.00 -1.05 0.00 0.00 58.31 57.38 1z8m n LYS 37 Cb 0.89 -4.34 -0.06 0.00 -0.65 0.00 0.00 35.03 30.86 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 -6.86 4.18 0.27 -1.58 2.56 -0.86 -5.05 118.70 111.36 1z8m s GLU 38 Ca 0.13 0.60 -0.30 0.00 0.00 0.00 0.00 54.97 55.40 1z8m s GLU 38 Cb -0.07 -3.29 -0.10 0.00 2.00 0.00 0.00 34.13 32.67 1z8m s GLU 38 CO 0.93 0.50 1.32 -1.25 -0.56 0.00 0.00 175.26 176.20 1z8m s PRO 39 N -0.57 4.37 0.10 4.30 0.04 -1.26 -4.80 135.00 137.18 1z8m s PRO 39 Ca 0.28 2.15 -0.05 0.00 0.04 0.00 0.00 61.00 63.41 1z8m s PRO 39 Cb -0.18 -3.13 -0.05 0.00 0.04 0.00 0.00 34.50 31.18 1z8m s PRO 39 CO 0.16 -0.23 0.34 -0.51 0.04 0.00 0.00 177.00 176.80 1z8m s LEU 40 N -0.91 4.31 0.42 -3.56 1.43 -1.26 -5.11 118.68 114.00 1z8m s LEU 40 Ca 0.53 0.58 0.01 0.00 -1.03 0.00 0.00 54.13 54.22 1z8m s LEU 40 Cb -0.38 -3.11 -0.01 0.00 0.03 0.00 0.00 46.19 42.71 1z8m s LEU 40 CO 0.45 0.12 0.63 -1.81 0.23 0.00 0.00 176.35 175.96 1z8m s ASP 41 N -2.21 5.90 0.40 2.29 1.11 -1.26 -5.01 116.67 117.89 1z8m s ASP 41 Ca 0.37 0.23 0.14 0.00 0.18 0.00 0.00 52.55 53.47 1z8m s ASP 41 Cb -0.13 -1.54 0.83 0.00 1.07 0.00 0.00 42.92 43.15 1z8m s ASP 41 CO 0.22 -0.62 1.88 1.55 1.18 0.00 0.00 175.17 179.39 1z8m h PRO 42 N 0.51 0.00 0.00 8.23 0.13 -1.99 -2.43 132.00 136.45 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 0.57 0.31 0.00 -0.56 -0.23 0.00 0.00 178.00 178.09 1z8m h GLN 43 N 0.00 0.00 0.00 0.86 3.07 -1.99 -2.13 115.11 114.93 1z8m h GLN 43 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1z8m h GLN 43 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.12 1z8m h GLN 43 CO 0.04 0.00 0.00 0.74 0.09 0.00 0.00 178.83 179.70 1z8m h PHE 44 N 0.00 0.00 -3.93 0.06 -1.00 -1.69 -3.46 116.94 106.92 1z8m h PHE 44 Ca 0.00 0.00 -0.27 0.00 2.81 0.00 0.00 57.97 60.51 1z8m h PHE 44 Cb 0.22 0.00 0.08 0.00 3.61 0.00 0.00 35.95 39.86 1z8m h PHE 44 CO 0.00 0.00 -0.44 1.04 -1.61 0.00 0.00 178.31 177.30 1z8m n GLN 45 N -2.75 -4.78 -2.51 1.51 1.13 -0.80 -1.16 117.38 108.03 1z8m n GLN 45 Ca -0.01 0.57 -0.43 0.00 -1.94 0.00 0.00 57.00 55.19 1z8m n GLN 45 Cb 0.11 -4.78 -0.02 0.00 0.11 0.00 0.00 30.24 25.66 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 -3.10 7.04 0.16 1.08 -4.77 -1.26 -4.58 116.67 111.24 1z8m s ASP 46 Ca 0.34 1.65 -0.17 0.00 -3.30 0.00 0.00 52.55 51.07 1z8m s ASP 46 Cb -0.15 -2.55 0.06 0.00 -1.09 0.00 0.00 42.92 39.19 1z8m s ASP 46 CO 0.42 -0.66 0.83 0.00 0.70 0.00 0.00 175.17 176.47 1z8m n HIS 47 N 5.97 -1.27 -2.74 2.11 1.44 -1.11 -4.92 115.22 114.70 1z8m n HIS 47 Ca 0.12 -1.07 -0.41 0.00 -2.01 0.00 0.00 57.72 54.35 1z8m n HIS 47 Cb 0.46 0.52 -0.04 0.00 0.12 0.00 0.00 29.99 31.05 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 -1.85 3.25 1.16 1.59 0.00 -1.26 0.84 121.76 125.50 1z8m s ALA 48 Ca 0.18 0.57 -0.14 0.00 0.00 0.00 0.00 51.96 52.57 1z8m s ALA 48 Cb -0.02 -3.27 0.21 0.00 0.00 0.00 0.00 23.12 20.03 1z8m s ALA 48 CO 0.05 -0.02 0.75 1.28 0.00 0.00 0.00 175.76 177.82 1z8m n LEU 49 N 2.75 0.00 0.00 0.00 4.77 -1.23 -4.91 117.00 118.38 1z8m n LEU 49 Ca 0.02 -0.79 -0.24 0.00 -0.03 0.00 0.00 56.01 54.97 1z8m n LEU 49 Cb 0.49 -0.68 -0.02 0.00 -2.33 0.00 0.00 43.42 40.88 1z8m n LEU 49 CO 0.51 -1.77 -0.02 2.29 -1.33 0.00 0.00 177.39 177.07 1z8m n LYS 50 N -3.74 0.84 0.00 3.23 0.00 -1.26 -4.27 118.16 112.96 1z8m n LYS 50 Ca 0.10 -3.02 0.00 0.00 -0.00 0.00 0.00 58.31 55.39 1z8m n LYS 50 Cb 0.40 0.47 0.00 0.00 -0.00 0.00 0.00 35.03 35.90 1z8m n LYS 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1z8m n GLY 51 N -0.56 2.16 0.00 2.58 0.00 -1.26 -2.28 105.19 105.83 1z8m n GLY 51 Ca -0.07 -0.54 0.11 0.00 0.00 0.00 0.00 46.02 45.52 1z8m n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1z8m n LYS 52 N 12.79 0.18 -1.13 1.61 4.01 -1.26 -3.30 118.16 131.05 1z8m n LYS 52 Ca 0.00 0.10 -0.26 0.00 -0.51 0.00 0.00 58.31 57.63 1z8m n LYS 52 Cb 0.00 -1.50 0.08 0.00 -0.51 0.00 0.00 35.03 33.10 1z8m n LYS 52 CO 0.00 0.00 0.00 0.91 -1.11 0.00 0.00 177.40 177.20 1z8m n TRP 53 N -1.38 2.59 -0.01 2.13 5.03 -0.97 -4.56 117.44 120.27 1z8m n TRP 53 Ca 0.08 -2.39 -0.13 0.00 3.03 0.00 0.00 57.50 58.09 1z8m n TRP 53 Cb 0.21 -1.17 -0.10 0.00 -1.03 0.00 0.00 31.31 29.23 1z8m n TRP 53 CO 0.00 0.00 0.00 -0.22 -0.03 0.00 0.00 177.69 177.44 1z8m h LYS 54 N 1.57 -0.02 -2.43 -0.99 1.63 -1.70 -3.26 116.57 111.36 1z8m h LYS 54 Ca 0.50 0.00 -0.20 0.00 -0.85 0.00 0.00 60.65 60.10 1z8m h LYS 54 Cb 1.25 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.84 1z8m h LYS 54 CO 1.20 0.47 0.38 -0.35 -3.45 0.00 0.00 179.45 177.70 1z8m n PRO 55 N -4.86 1.66 -3.98 1.90 -0.04 -1.26 -4.48 135.00 123.94 1z8m n PRO 55 Ca -0.08 -0.89 -0.11 0.00 -0.04 0.00 0.00 63.50 62.37 1z8m n PRO 55 Cb 0.25 -1.98 -0.03 0.00 -0.04 0.00 0.00 33.50 31.71 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 1.77 0.54 0.02 0.54 0.08 -1.24 -5.03 117.98 114.65 1z8m s PHE 56 Ca 0.49 -0.94 0.02 0.00 0.12 0.00 0.00 56.93 56.62 1z8m s PHE 56 Cb 0.22 0.29 -0.01 0.00 -0.57 0.00 0.00 43.02 42.94 1z8m s PHE 56 CO -0.01 -1.22 -0.06 0.50 -0.10 0.00 0.00 175.22 174.34 1z8m s ARG 57 N -3.19 0.45 0.44 0.44 6.06 -1.17 -3.74 118.95 118.24 1z8m s ARG 57 Ca 0.23 -0.44 0.07 0.00 -2.50 0.00 0.00 55.73 53.09 1z8m s ARG 57 Cb -0.02 -0.33 -0.04 0.00 0.06 0.00 0.00 34.95 34.62 1z8m s ARG 57 CO 0.14 0.08 0.21 -2.00 -2.50 0.00 0.00 175.30 171.23 1z8m s GLU 58 N -0.79 2.25 -0.30 5.12 2.12 0.25 -1.72 118.70 125.62 1z8m s GLU 58 Ca -0.04 -1.88 -0.09 0.00 0.36 0.00 0.00 54.97 53.32 1z8m s GLU 58 Cb -0.06 -2.00 0.18 0.00 0.26 0.00 0.00 34.13 32.52 1z8m s GLU 58 CO 0.00 -0.20 0.88 0.00 -0.54 0.00 0.00 175.26 175.40 1z8m s HIS 60 N 2.89 3.04 0.57 0.00 3.76 -0.30 -1.37 115.29 123.87 1z8m s HIS 60 Ca 0.06 -1.62 0.28 0.00 -0.15 0.00 0.00 55.06 53.64 1z8m s HIS 60 Cb -0.12 -4.52 1.48 0.00 1.11 0.00 0.00 32.58 30.54 1z8m s HIS 60 CO -0.15 -1.64 1.96 0.82 -0.85 0.00 0.00 174.74 174.88 1z8m h ILE 61 N 5.53 0.52 -3.04 0.60 5.03 -1.83 -3.42 117.51 120.90 1z8m h ILE 61 Ca 0.31 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 65.11 1z8m h ILE 61 Cb 0.92 0.68 -0.05 0.00 -3.03 0.00 0.00 36.82 35.34 1z8m h ILE 61 CO 1.32 0.00 0.21 -1.59 -0.68 0.00 0.00 178.15 177.41 1z8m s LYS 62 N -4.79 1.76 0.00 2.37 0.00 -1.25 -5.02 119.74 112.81 1z8m s LYS 62 Ca -0.05 -0.99 0.06 0.00 0.00 0.00 0.00 55.97 54.99 1z8m s LYS 62 Cb 0.17 0.60 0.38 0.00 0.00 0.00 0.00 37.83 38.98 1z8m s LYS 62 CO 0.63 -0.80 0.81 -2.30 0.00 0.00 0.00 175.35 173.69 1z8m n PRO 63 N -0.45 0.44 -0.93 1.78 -0.02 -1.26 -2.37 135.00 132.18 1z8m n PRO 63 Ca -0.04 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.46 1z8m n PRO 63 Cb 0.59 -1.22 0.02 0.00 -0.02 0.00 0.00 33.50 32.87 1z8m n PRO 63 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1z8m n ASP 64 N -0.72 0.56 -3.65 2.55 9.92 -1.26 -4.74 116.55 119.20 1z8m n ASP 64 Ca 0.05 -2.08 -0.15 0.00 -0.53 0.00 0.00 54.79 52.08 1z8m n ASP 64 Cb 0.02 -0.26 -0.08 0.00 -0.64 0.00 0.00 41.12 40.16 1z8m n ASP 64 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1z8m s VAL 65 N -0.17 0.01 -0.21 2.53 1.01 -1.00 -4.55 120.40 118.02 1z8m s VAL 65 Ca 0.17 -0.12 -0.04 0.00 0.00 0.00 0.00 61.98 61.99 1z8m s VAL 65 Cb 0.19 -0.80 0.08 0.00 0.00 0.00 0.00 36.38 35.85 1z8m s VAL 65 CO -0.08 -0.07 0.14 -0.76 0.00 0.00 0.00 175.10 174.34 1z8m s LEU 66 N -0.59 0.23 -0.17 3.92 1.43 -0.69 -3.68 118.68 119.15 1z8m s LEU 66 Ca -0.07 -0.65 -0.09 0.00 -1.03 0.00 0.00 54.13 52.29 1z8m s LEU 66 Cb -0.03 -0.07 -0.05 0.00 0.03 0.00 0.00 46.19 46.08 1z8m s LEU 66 CO 0.05 -0.36 0.14 -0.22 0.23 0.00 0.00 176.35 176.18 1z8m s LEU 67 N 2.19 4.28 -0.22 1.79 1.98 -0.47 -0.51 118.68 127.73 1z8m s LEU 67 Ca 0.05 0.34 -0.03 0.00 -2.89 0.00 0.00 54.13 51.60 1z8m s LEU 67 Cb -0.16 -2.09 -0.00 0.00 0.66 0.00 0.00 46.19 44.59 1z8m s LEU 67 CO -0.16 0.27 -0.07 -0.69 -1.89 0.00 0.00 176.35 173.81 1z8m s VAL 68 N -0.20 3.18 0.10 1.68 1.01 -0.40 -0.94 120.40 124.83 1z8m s VAL 68 Ca 0.11 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.57 1z8m s VAL 68 Cb -0.11 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 1z8m s VAL 68 CO 0.01 0.44 -0.10 -0.72 0.00 0.00 0.00 175.10 174.72 1z8m s TYR 69 N 1.45 1.07 0.43 5.22 1.13 -0.70 0.10 117.35 126.06 1z8m s TYR 69 Ca 0.06 -0.67 0.07 0.00 -1.41 0.00 0.00 57.07 55.12 1z8m s TYR 69 Cb -0.14 -0.58 -0.02 0.00 -1.10 0.00 0.00 41.96 40.11 1z8m s TYR 69 CO -0.05 0.00 0.32 -1.17 -2.51 0.00 0.00 175.55 172.14 1z8m s LEU 70 N -2.50 3.21 -0.29 -3.49 2.96 0.18 -3.04 118.68 115.72 1z8m s LEU 70 Ca 0.06 -0.92 0.02 0.00 -0.22 0.00 0.00 54.13 53.08 1z8m s LEU 70 Cb -0.02 -1.74 0.08 0.00 0.50 0.00 0.00 46.19 45.01 1z8m s LEU 70 CO -0.00 -0.68 -0.01 -0.69 -1.32 0.00 0.00 176.35 173.65 1z8m s VAL 71 N -2.55 1.89 0.72 1.68 1.01 -1.26 -3.04 120.40 118.85 1z8m s VAL 71 Ca 0.44 -1.77 -0.11 0.00 0.00 0.00 0.00 61.98 60.53 1z8m s VAL 71 Cb -0.01 -2.24 0.02 0.00 0.00 0.00 0.00 36.38 34.16 1z8m s VAL 71 CO 0.25 -0.34 1.10 -0.75 0.00 0.00 0.00 175.10 175.35 1z8m s LYS 72 N 1.16 2.73 0.43 2.72 2.20 0.33 -4.91 119.74 124.41 1z8m s LYS 72 Ca 0.02 0.51 0.30 0.00 -0.36 0.00 0.00 55.97 56.43 1z8m s LYS 72 Cb -0.19 -2.00 1.42 0.00 -1.51 0.00 0.00 37.83 35.55 1z8m s LYS 72 CO -0.09 -1.14 1.62 -0.44 -0.36 0.00 0.00 175.35 174.94 1z8m h ASP 73 N -0.73 0.25 0.00 1.43 5.19 -2.03 -3.05 116.42 117.48 1z8m h ASP 73 Ca -0.45 0.14 -0.10 0.00 -0.62 0.00 0.00 57.03 56.00 1z8m h ASP 73 Cb 1.25 0.13 -0.12 0.00 0.18 0.00 0.00 39.33 40.77 1z8m h ASP 73 CO 0.63 -0.20 -0.31 -0.90 -3.12 0.00 0.00 179.24 175.34 1z8m n ASP 74 N -4.72 -0.57 -3.79 6.45 5.68 -1.26 -5.13 116.55 113.20 1z8m n ASP 74 Ca 0.37 -1.79 -0.10 0.00 -0.50 0.00 0.00 54.79 52.77 1z8m n ASP 74 Cb 1.43 0.17 -0.05 0.00 -1.14 0.00 0.00 41.12 41.52 1z8m n ASP 74 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1z8m s GLU 75 N 0.00 1.14 0.07 0.11 2.02 -1.15 -4.18 118.70 116.71 1z8m s GLU 75 Ca 0.03 -0.92 0.07 0.00 0.02 0.00 0.00 54.97 54.17 1z8m s GLU 75 Cb 0.04 0.44 -0.04 0.00 0.10 0.00 0.00 34.13 34.67 1z8m s GLU 75 CO -0.02 -0.44 -0.13 -1.17 0.02 0.00 0.00 175.26 173.52 1z8m s LEU 76 N -2.88 2.89 -0.05 1.80 2.96 0.38 0.12 118.68 123.91 1z8m s LEU 76 Ca 0.09 -0.38 -0.00 0.00 -0.22 0.00 0.00 54.13 53.62 1z8m s LEU 76 Cb 0.02 -1.70 0.03 0.00 0.50 0.00 0.00 46.19 45.04 1z8m s LEU 76 CO -0.06 0.22 -0.01 0.27 -1.32 0.00 0.00 176.35 175.45 1z8m s ILE 77 N -1.08 0.31 -0.34 6.68 -5.25 -1.17 -0.39 121.20 119.95 1z8m s ILE 77 Ca 0.18 0.06 -0.29 0.00 -0.99 0.00 0.00 60.65 59.62 1z8m s ILE 77 Cb -0.11 -0.41 0.02 0.00 2.95 0.00 0.00 42.46 44.91 1z8m s ILE 77 CO 0.10 0.20 1.07 -0.76 -1.79 0.00 0.00 174.94 173.76 1z8m s LEU 78 N 1.31 3.91 -0.01 0.37 1.43 -0.96 -0.64 118.68 124.09 1z8m s LEU 78 Ca -0.05 0.96 -0.05 0.00 -1.03 0.00 0.00 54.13 53.96 1z8m s LEU 78 Cb -0.13 -3.52 -0.03 0.00 0.03 0.00 0.00 46.19 42.54 1z8m s LEU 78 CO -0.02 -0.91 0.45 0.25 0.23 0.00 0.00 176.35 176.34 1z8m h LEU 79 N 10.20 -0.15 -7.93 1.79 5.85 0.35 -1.83 115.31 123.59 1z8m h LEU 79 Ca -0.21 0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.60 1z8m h LEU 79 Cb 1.06 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 1z8m h LEU 79 CO 1.04 0.00 0.40 0.00 -0.34 0.00 0.00 178.44 179.54 1z8m s ARG 80 N -2.25 1.70 -0.13 1.25 3.03 -0.88 -1.65 118.95 120.03 1z8m s ARG 80 Ca -0.03 -1.05 -0.01 0.00 2.03 0.00 0.00 55.73 56.67 1z8m s ARG 80 Cb 0.00 0.50 0.03 0.00 -1.03 0.00 0.00 34.95 34.46 1z8m s ARG 80 CO 0.08 -0.79 -0.03 -1.17 -1.13 0.00 0.00 175.30 172.25 1z8m s LEU 81 N -3.13 1.12 0.00 -1.89 1.98 -1.26 -1.27 118.68 114.22 1z8m s LEU 81 Ca 0.16 -0.40 0.00 0.00 -2.89 0.00 0.00 54.13 51.00 1z8m s LEU 81 Cb -0.04 -0.71 0.00 0.00 0.66 0.00 0.00 46.19 46.10 1z8m s LEU 81 CO 0.07 -0.18 0.00 0.61 -1.89 0.00 0.00 176.35 174.96 1z8m n GLY 82 N 5.00 7.36 3.13 7.98 0.00 0.34 -4.51 105.19 124.49 1z8m n GLY 82 Ca -0.10 -2.03 -0.14 0.00 0.00 0.00 0.00 46.02 43.75 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 0.77 1.21 0.56 1.61 0.01 -1.26 -1.70 113.70 114.90 1z8m s SER 83 Ca 0.00 -0.70 0.32 0.00 1.31 0.00 0.00 55.95 56.88 1z8m s SER 83 Cb 0.00 0.02 1.47 0.00 0.21 0.00 0.00 66.02 67.72 1z8m s SER 83 CO 0.00 -0.24 1.81 1.12 0.41 0.00 0.00 173.24 176.35 1z8m h HIS 84 N 3.97 0.00 0.00 2.43 2.07 -1.84 0.81 115.15 122.59 1z8m h HIS 84 Ca -0.37 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.13 1z8m h HIS 84 Cb 1.19 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.17 1z8m h HIS 84 CO 0.63 0.00 -1.07 0.45 -3.07 0.00 0.00 177.93 174.88 1z8m n SER 85 N -4.00 0.84 0.00 3.10 2.88 -1.26 -3.71 113.62 111.47 1z8m n SER 85 Ca 0.19 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 58.06 1z8m n SER 85 Cb 1.04 0.43 0.00 0.00 -0.75 0.00 0.00 64.21 64.93 1z8m n SER 85 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1z8m n GLU 86 N -2.70 0.00 -0.09 -1.46 4.07 0.27 -4.07 120.64 116.67 1z8m n GLU 86 Ca -0.01 0.43 0.26 0.00 -0.06 0.00 0.00 57.16 57.78 1z8m n GLU 86 Cb 0.58 -0.93 0.70 0.00 -0.06 0.00 0.00 31.44 31.74 1z8m n GLU 86 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1z8m h LEU 87 N 0.00 0.00 -1.54 4.31 4.07 -1.53 -3.48 115.31 117.15 1z8m h LEU 87 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1z8m h LEU 87 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1z8m h LEU 87 CO 0.00 0.00 0.00 0.49 -1.08 0.00 0.00 178.44 177.85