#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 -0.92 -4.70 4.03 4.77 -1.26 -4.80 117.00 114.12 1z8m n LEU 2 Ca 0.00 2.12 -0.37 0.00 -0.03 0.00 0.00 56.01 57.74 1z8m n LEU 2 Cb 0.00 -3.91 0.07 0.00 -2.33 0.00 0.00 43.42 37.26 1z8m n LEU 2 CO 0.00 -2.59 0.82 1.17 -1.33 0.00 0.00 177.39 175.47 1z8m n LYS 3 N -4.27 1.00 -4.68 3.23 0.00 -1.26 -4.65 118.16 107.53 1z8m n LYS 3 Ca -0.06 0.40 -0.31 0.00 0.00 0.00 0.00 58.31 58.34 1z8m n LYS 3 Cb 0.66 -2.46 -0.13 0.00 0.00 0.00 0.00 35.03 33.11 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 -4.01 2.61 0.00 3.14 0.20 -1.19 0.44 118.68 119.87 1z8m s LEU 4 Ca 0.81 -0.41 0.02 0.00 0.69 0.00 0.00 54.13 55.23 1z8m s LEU 4 Cb -0.38 -1.52 -0.01 0.00 -0.43 0.00 0.00 46.19 43.85 1z8m s LEU 4 CO 0.42 0.26 0.06 -3.20 -0.29 0.00 0.00 176.35 173.60 1z8m n ASN 5 N 1.59 0.62 -3.83 3.68 2.85 -0.89 -4.91 115.26 114.38 1z8m n ASN 5 Ca -0.16 -1.69 -0.12 0.00 -0.11 0.00 0.00 54.58 52.50 1z8m n ASN 5 Cb 0.52 0.39 -0.12 0.00 1.24 0.00 0.00 39.78 41.81 1z8m n ASN 5 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1z8m s LEU 6 N 0.00 1.48 0.35 1.20 1.02 -1.26 -2.81 118.68 118.65 1z8m s LEU 6 Ca 0.08 0.24 0.08 0.00 0.02 0.00 0.00 54.13 54.56 1z8m s LEU 6 Cb 0.00 0.49 -0.04 0.00 0.02 0.00 0.00 46.19 46.66 1z8m s LEU 6 CO 0.06 -0.07 0.15 -0.54 0.02 0.00 0.00 176.35 175.96 1z8m s LYS 7 N -0.04 2.35 0.47 1.70 -0.14 -1.07 -4.89 119.74 118.12 1z8m s LYS 7 Ca -0.01 -1.58 0.13 0.00 -1.36 0.00 0.00 55.97 53.15 1z8m s LYS 7 Cb -0.02 -2.16 1.08 0.00 -1.68 0.00 0.00 37.83 35.06 1z8m s LYS 7 CO 0.00 0.09 2.08 0.87 -0.76 0.00 0.00 175.35 177.63 1z8m h LYS 8 N 1.53 0.17 -0.02 1.68 1.79 -1.91 -1.18 116.57 118.63 1z8m h LYS 8 Ca -0.43 -0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 57.97 1z8m h LYS 8 Cb 1.25 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 1z8m h LYS 8 CO 0.64 0.16 -0.20 1.03 -1.08 0.00 0.00 179.45 179.99 1z8m h SER 9 N 0.18 0.21 -0.82 0.86 0.87 -1.95 -3.15 113.55 109.74 1z8m h SER 9 Ca 0.05 -0.72 0.02 0.00 -1.23 0.00 0.00 61.79 59.90 1z8m h SER 9 Cb 0.06 -0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 61.91 1z8m h SER 9 CO -0.00 0.90 0.54 0.15 -0.53 0.00 0.00 176.83 177.89 1z8m h PHE 10 N -0.46 1.01 -0.49 2.24 3.57 -0.87 0.04 116.94 121.98 1z8m h PHE 10 Ca -0.02 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1z8m h PHE 10 Cb 0.91 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 1z8m h PHE 10 CO 0.16 0.62 0.29 1.96 -2.23 0.00 0.00 178.31 179.11 1z8m h GLN 11 N 1.08 0.67 0.00 1.11 4.20 -1.28 0.14 115.11 121.03 1z8m h GLN 11 Ca 0.31 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.96 1z8m h GLN 11 Cb -0.07 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.57 1z8m h GLN 11 CO -0.08 0.48 -0.59 0.87 -0.67 0.00 0.00 178.83 178.84 1z8m h LYS 12 N 0.68 0.00 0.00 1.46 1.57 -1.26 -3.23 116.57 115.79 1z8m h LYS 12 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1z8m h LYS 12 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1z8m h LYS 12 CO -0.03 0.00 -0.61 -0.25 -0.57 0.00 0.00 179.45 177.99 1z8m n ASP 13 N -2.85 0.57 -0.02 0.86 9.92 -0.09 -1.10 116.55 123.83 1z8m n ASP 13 Ca 0.02 -0.20 -0.01 0.00 -0.53 0.00 0.00 54.79 54.06 1z8m n ASP 13 Cb 0.54 0.33 -0.00 0.00 -0.64 0.00 0.00 41.12 41.35 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 -1.67 0.27 -0.02 1.24 7.35 0.42 -4.09 117.46 120.95 1z8m n PHE 14 Ca 0.05 0.12 -0.11 0.00 -0.76 0.00 0.00 57.45 56.74 1z8m n PHE 14 Cb 0.37 -0.40 -0.14 0.00 0.35 0.00 0.00 39.48 39.66 1z8m n PHE 14 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1z8m n ASP 15 N -2.98 1.09 0.13 -2.13 8.00 -1.22 -3.77 116.55 115.68 1z8m n ASP 15 Ca -0.02 0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.82 1z8m n ASP 15 Cb 0.08 -0.17 0.07 0.00 -0.02 0.00 0.00 41.12 41.09 1z8m n ASP 15 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1z8m h LYS 16 N 0.01 0.00 -0.06 -1.24 1.79 -1.64 -3.17 116.57 112.26 1z8m h LYS 16 Ca -0.33 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 57.96 1z8m h LYS 16 Cb 2.03 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.67 1z8m h LYS 16 CO 0.08 0.63 -0.71 1.25 -1.08 0.00 0.00 179.45 179.62 1z8m h LEU 17 N 0.00 0.35 -0.81 2.94 6.46 -1.26 -3.08 115.31 119.90 1z8m h LEU 17 Ca -0.01 -0.23 0.10 0.00 -0.12 0.00 0.00 57.88 57.62 1z8m h LEU 17 Cb 1.35 -0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 41.11 1z8m h LEU 17 CO 0.08 0.95 0.46 -0.07 -0.62 0.00 0.00 178.44 179.23 1z8m h LEU 18 N 0.20 0.64 -0.19 2.25 4.07 -1.64 0.12 115.31 120.77 1z8m h LEU 18 Ca -0.02 0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1z8m h LEU 18 Cb 1.27 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.94 1z8m h LEU 18 CO 0.11 0.36 -0.05 0.18 -1.08 0.00 0.00 178.44 177.97 1z8m n LEU 19 N -4.76 0.34 -2.16 1.67 4.77 -1.20 -2.35 117.00 113.30 1z8m n LEU 19 Ca 0.14 0.02 -0.27 0.00 -0.03 0.00 0.00 56.01 55.86 1z8m n LEU 19 Cb 0.29 -0.14 0.09 0.00 -2.33 0.00 0.00 43.42 41.33 1z8m n LEU 19 CO 0.26 0.06 1.33 -3.20 -1.33 0.00 0.00 177.39 174.52 1z8m n ASN 20 N -0.93 6.41 0.00 -1.43 4.05 0.41 -4.77 115.26 119.00 1z8m n ASN 20 Ca 0.17 -3.53 0.00 0.00 0.45 0.00 0.00 54.58 51.68 1z8m n ASN 20 Cb 0.23 -0.95 0.00 0.00 1.23 0.00 0.00 39.78 40.29 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 -0.64 0.54 3.34 8.20 0.00 -1.25 -5.02 105.19 110.36 1z8m n GLY 21 Ca 0.53 -0.84 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 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 2.68 -0.18 1.61 2.19 -0.99 -5.06 117.98 116.24 1z8m s PHE 22 Ca 0.00 -0.68 -0.23 0.00 0.33 0.00 0.00 56.93 56.35 1z8m s PHE 22 Cb 0.00 -1.75 -0.02 0.00 -1.31 0.00 0.00 43.02 39.94 1z8m s PHE 22 CO 0.00 -0.20 0.70 0.34 1.83 0.00 0.00 175.22 177.89 1z8m s ASP 23 N 0.12 6.80 0.56 6.13 -1.08 -1.26 -4.42 116.67 123.52 1z8m s ASP 23 Ca -0.09 0.98 0.26 0.00 -0.52 0.00 0.00 52.55 53.19 1z8m s ASP 23 Cb -0.15 -2.39 1.52 0.00 -1.46 0.00 0.00 42.92 40.44 1z8m s ASP 23 CO 0.05 -0.30 2.05 -2.24 0.52 0.00 0.00 175.17 175.25 1z8m h ASP 24 N 7.36 0.00 -0.08 -0.34 2.03 -1.98 0.17 116.42 123.59 1z8m h ASP 24 Ca -0.32 0.00 0.02 0.00 -0.73 0.00 0.00 57.03 56.01 1z8m h ASP 24 Cb 1.14 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.64 1z8m h ASP 24 CO 0.79 0.00 0.16 0.28 -1.03 0.00 0.00 179.24 179.45 1z8m h SER 25 N 0.00 0.00 0.09 4.15 0.02 -2.01 -1.82 113.55 113.99 1z8m h SER 25 Ca 0.14 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.89 1z8m h SER 25 Cb 0.68 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.22 1z8m h SER 25 CO -0.00 0.00 -0.99 0.58 -1.14 0.00 0.00 176.83 175.28 1z8m h VAL 26 N 0.00 1.29 -0.61 2.27 2.07 -1.36 -3.35 116.25 116.56 1z8m h VAL 26 Ca 0.04 -2.41 0.03 0.00 0.82 0.00 0.00 66.70 65.18 1z8m h VAL 26 Cb 0.36 2.92 -0.03 0.00 -1.52 0.00 0.00 31.29 33.02 1z8m h VAL 26 CO -0.00 0.65 0.40 0.17 0.02 0.00 0.00 177.57 178.81 1z8m h LEU 27 N -0.51 0.63 -2.19 2.57 8.10 -1.42 -0.72 115.31 121.77 1z8m h LEU 27 Ca -0.21 -0.01 0.05 0.00 0.11 0.00 0.00 57.88 57.82 1z8m h LEU 27 Cb 1.55 -0.15 -0.01 0.00 -0.44 0.00 0.00 40.66 41.62 1z8m h LEU 27 CO 0.05 0.44 0.18 -1.13 -4.11 0.00 0.00 178.44 173.87 1z8m h ASN 28 N 0.74 0.00 -0.06 0.17 -0.73 -1.51 0.69 115.58 114.88 1z8m h ASN 28 Ca 0.24 0.00 -0.11 0.00 1.87 0.00 0.00 56.30 58.30 1z8m h ASN 28 Cb 0.05 0.00 0.01 0.00 0.27 0.00 0.00 38.32 38.64 1z8m h ASN 28 CO -0.06 0.00 -0.39 -0.33 -0.37 0.00 0.00 177.43 176.28 1z8m h GLU 29 N 0.00 0.37 0.04 6.67 5.08 -1.27 -2.96 114.58 122.50 1z8m h GLU 29 Ca 0.09 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 58.07 1z8m h GLU 29 Cb 0.44 0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.77 1z8m h GLU 29 CO -0.00 0.96 -0.27 -0.24 -1.00 0.00 0.00 179.01 178.46 1z8m h VAL 30 N -0.13 1.65 -1.00 3.13 3.04 -1.28 -3.29 116.25 118.37 1z8m h VAL 30 Ca -0.03 -2.27 0.24 0.00 -1.01 0.00 0.00 66.70 63.63 1z8m h VAL 30 Cb 1.05 3.17 -0.08 0.00 -2.01 0.00 0.00 31.29 33.41 1z8m h VAL 30 CO 0.08 0.61 0.65 0.40 -1.01 0.00 0.00 177.57 178.30 1z8m h ILE 31 N -0.70 0.58 0.21 3.17 5.03 0.22 -1.66 117.51 124.36 1z8m h ILE 31 Ca -0.04 -0.14 0.00 0.00 -0.12 0.00 0.00 64.86 64.56 1z8m h ILE 31 Cb 1.16 0.14 -0.03 0.00 -3.03 0.00 0.00 36.82 35.05 1z8m h ILE 31 CO 0.05 0.07 -0.39 0.25 -0.68 0.00 0.00 178.15 177.46 1z8m h LEU 32 N 0.41 -1.13 -1.88 1.44 6.46 -1.59 -0.34 115.31 118.69 1z8m h LEU 32 Ca 0.55 0.11 0.14 0.00 -0.12 0.00 0.00 57.88 58.56 1z8m h LEU 32 Cb 1.38 0.40 -0.02 0.00 -0.73 0.00 0.00 40.66 41.69 1z8m h LEU 32 CO -0.25 -0.45 0.54 0.74 -0.62 0.00 0.00 178.44 178.39 1z8m h THR 33 N -0.65 0.33 0.11 1.05 2.02 -1.42 0.31 112.91 114.66 1z8m h THR 33 Ca -0.02 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 1z8m h THR 33 Cb 0.61 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 1z8m h THR 33 CO -0.14 0.00 -0.05 -0.07 0.37 0.00 0.00 175.52 175.62 1z8m h LEU 34 N 0.00 -0.13 0.20 2.58 3.38 -0.86 0.88 115.31 121.36 1z8m h LEU 34 Ca 0.23 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1z8m h LEU 34 Cb 1.31 0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1z8m h LEU 34 CO -0.00 0.03 -0.10 0.03 0.09 0.00 0.00 178.44 178.49 1z8m h ARG 35 N -0.39 -0.26 0.00 1.13 3.08 -0.83 -1.88 114.38 115.23 1z8m h ARG 35 Ca -0.02 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1z8m h ARG 35 Cb 0.12 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1z8m h ARG 35 CO 0.03 -0.17 0.00 0.36 -1.07 0.00 0.00 179.97 179.12 1z8m n LYS 36 N -5.20 0.17 -3.38 0.04 -0.00 0.10 -4.92 118.16 104.97 1z8m n LYS 36 Ca -0.09 0.45 -0.12 0.00 -0.00 0.00 0.00 58.31 58.55 1z8m n LYS 36 Cb 0.13 -1.86 0.00 0.00 -0.00 0.00 0.00 35.03 33.31 1z8m n LYS 36 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1z8m n LYS 37 N -2.18 -1.41 -2.69 -1.58 2.85 -0.19 -4.94 118.16 108.01 1z8m n LYS 37 Ca 0.02 1.14 -0.41 0.00 -1.05 0.00 0.00 58.31 58.01 1z8m n LYS 37 Cb 0.19 -4.35 -0.05 0.00 -0.65 0.00 0.00 35.03 30.17 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 -3.96 4.72 -0.38 -1.58 2.12 0.13 -4.85 118.70 114.90 1z8m s GLU 38 Ca 0.04 1.51 -0.28 0.00 0.36 0.00 0.00 54.97 56.60 1z8m s GLU 38 Cb -0.01 -3.33 -0.07 0.00 0.26 0.00 0.00 34.13 30.97 1z8m s GLU 38 CO 0.81 0.26 2.33 -0.35 -0.54 0.00 0.00 175.26 177.78 1z8m n PRO 39 N 2.39 1.40 -2.08 4.30 -0.04 -1.26 -4.91 135.00 134.80 1z8m n PRO 39 Ca 0.01 0.24 -0.42 0.00 -0.04 0.00 0.00 63.50 63.29 1z8m n PRO 39 Cb 0.48 -3.26 -0.03 0.00 -0.04 0.00 0.00 33.50 30.65 1z8m n PRO 39 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1z8m s LEU 40 N 10.27 4.36 0.56 1.53 1.43 -1.26 -5.00 118.68 130.56 1z8m s LEU 40 Ca 1.01 2.37 -0.12 0.00 -1.03 0.00 0.00 54.13 56.36 1z8m s LEU 40 Cb -0.31 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.28 1z8m s LEU 40 CO 0.32 -0.76 0.98 -1.81 0.23 0.00 0.00 176.35 175.31 1z8m s ASP 41 N 1.60 6.38 0.49 2.29 1.01 -1.26 -4.97 116.67 122.20 1z8m s ASP 41 Ca 0.68 1.42 0.22 0.00 0.71 0.00 0.00 52.55 55.57 1z8m s ASP 41 Cb -0.38 -2.46 1.25 0.00 1.01 0.00 0.00 42.92 42.35 1z8m s ASP 41 CO 0.30 -0.73 2.03 1.55 0.21 0.00 0.00 175.17 178.53 1z8m h PRO 42 N 0.21 0.00 0.00 8.23 0.13 -2.01 -2.26 132.00 136.30 1z8m h PRO 42 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 1z8m h PRO 42 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1z8m h PRO 42 CO 0.62 0.16 -0.04 1.96 -0.23 0.00 0.00 178.00 180.46 1z8m h GLN 43 N 0.00 0.00 0.00 0.86 1.08 -2.02 -1.46 115.11 113.57 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 0.34 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1z8m h GLN 43 CO 0.02 0.04 0.00 0.74 -0.95 0.00 0.00 178.83 178.68 1z8m h PHE 44 N 0.00 0.00 -4.93 2.96 -1.00 -1.72 -3.46 116.94 108.79 1z8m h PHE 44 Ca -0.00 0.00 -0.31 0.00 2.81 0.00 0.00 57.97 60.47 1z8m h PHE 44 Cb 0.14 0.00 0.12 0.00 3.61 0.00 0.00 35.95 39.82 1z8m h PHE 44 CO 0.00 0.00 -0.56 1.04 -1.61 0.00 0.00 178.31 177.18 1z8m n GLN 45 N -2.84 -6.28 -2.43 1.51 1.13 -0.55 -3.78 117.38 104.13 1z8m n GLN 45 Ca -0.02 0.67 -0.38 0.00 -1.94 0.00 0.00 57.00 55.34 1z8m n GLN 45 Cb 0.11 -5.24 -0.03 0.00 0.11 0.00 0.00 30.24 25.19 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 -3.41 6.21 0.30 1.08 -4.77 -1.26 -4.69 116.67 110.14 1z8m s ASP 46 Ca 0.39 -1.52 0.04 0.00 -3.30 0.00 0.00 52.55 48.17 1z8m s ASP 46 Cb -0.17 -2.57 -0.02 0.00 -1.09 0.00 0.00 42.92 39.07 1z8m s ASP 46 CO 0.59 -1.78 0.16 0.00 0.70 0.00 0.00 175.17 174.84 1z8m n HIS 47 N 10.12 -0.21 -3.19 2.11 1.44 -1.04 -4.93 115.22 119.52 1z8m n HIS 47 Ca 0.38 -2.15 -0.40 0.00 -2.01 0.00 0.00 57.72 53.55 1z8m n HIS 47 Cb 0.49 0.10 -0.06 0.00 0.12 0.00 0.00 29.99 30.63 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 -2.97 3.54 1.21 1.59 0.00 -1.26 0.16 121.76 124.03 1z8m s ALA 48 Ca 0.23 -0.32 -0.16 0.00 0.00 0.00 0.00 51.96 51.71 1z8m s ALA 48 Cb 0.01 -2.88 0.24 0.00 0.00 0.00 0.00 23.12 20.49 1z8m s ALA 48 CO 0.16 -0.47 0.80 1.28 0.00 0.00 0.00 175.76 177.53 1z8m n LEU 49 N 4.84 0.00 -4.35 0.00 4.77 -1.00 -4.92 117.00 116.35 1z8m n LEU 49 Ca -0.03 -0.84 -0.21 0.00 -0.03 0.00 0.00 56.01 54.89 1z8m n LEU 49 Cb 0.50 -0.75 -0.11 0.00 -2.33 0.00 0.00 43.42 40.73 1z8m n LEU 49 CO 0.43 -1.97 -0.47 -0.54 -1.33 0.00 0.00 177.39 173.51 1z8m s LYS 50 N -4.83 1.32 7.37 3.23 -0.14 -1.20 -3.67 119.74 121.82 1z8m s LYS 50 Ca 0.53 -1.49 0.00 0.00 -1.36 0.00 0.00 55.97 53.65 1z8m s LYS 50 Cb -0.06 -1.30 0.00 0.00 -1.68 0.00 0.00 37.83 34.79 1z8m s LYS 50 CO 0.41 0.25 0.00 0.41 -0.76 0.00 0.00 175.35 175.66 1z8m n GLY 51 N 0.03 2.13 0.25 -3.33 0.00 -1.26 -3.44 105.19 99.57 1z8m n GLY 51 Ca -0.11 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.60 1z8m n GLY 51 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1z8m h LYS 52 N 0.00 0.03 -1.48 1.61 1.63 -2.05 -2.70 116.57 113.62 1z8m h LYS 52 Ca 0.00 -0.00 -0.63 0.00 -0.85 0.00 0.00 60.65 59.17 1z8m h LYS 52 Cb 0.00 -0.01 -0.38 0.00 -0.60 0.00 0.00 32.23 31.24 1z8m h LYS 52 CO 0.00 0.08 -0.25 0.91 -3.45 0.00 0.00 179.45 176.74 1z8m n TRP 53 N -4.47 3.21 -0.06 1.91 8.01 -1.22 -4.77 117.44 120.05 1z8m n TRP 53 Ca -0.03 -2.80 -0.13 0.00 -1.31 0.00 0.00 57.50 53.24 1z8m n TRP 53 Cb 0.14 -0.45 -0.12 0.00 -2.01 0.00 0.00 31.31 28.88 1z8m n TRP 53 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.69 176.46 1z8m h LYS 54 N 2.58 -0.00 -0.19 -0.99 3.64 -1.55 -2.64 116.57 117.41 1z8m h LYS 54 Ca 0.39 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 1z8m h LYS 54 Cb 0.81 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 1z8m h LYS 54 CO 1.01 0.88 0.00 -0.35 -2.27 0.00 0.00 179.45 178.72 1z8m n PRO 55 N -4.64 1.23 -4.57 1.90 -0.04 -1.26 -4.62 135.00 123.00 1z8m n PRO 55 Ca -0.09 -0.32 -0.30 0.00 -0.04 0.00 0.00 63.50 62.75 1z8m n PRO 55 Cb 0.43 -1.13 -0.08 0.00 -0.04 0.00 0.00 33.50 32.67 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 -1.80 2.15 -0.10 0.54 0.08 -1.25 -4.90 117.98 112.70 1z8m s PHE 56 Ca 0.06 -0.81 0.02 0.00 0.12 0.00 0.00 56.93 56.32 1z8m s PHE 56 Cb 0.03 -1.73 0.01 0.00 -0.57 0.00 0.00 43.02 40.76 1z8m s PHE 56 CO 0.04 0.24 -0.16 0.50 -0.10 0.00 0.00 175.22 175.74 1z8m s ARG 57 N -3.86 2.20 0.25 0.44 6.06 -0.90 -3.61 118.95 119.53 1z8m s ARG 57 Ca 0.22 -0.57 -0.00 0.00 -2.50 0.00 0.00 55.73 52.88 1z8m s ARG 57 Cb 0.04 -1.82 -0.04 0.00 0.06 0.00 0.00 34.95 33.19 1z8m s ARG 57 CO 0.12 -0.01 0.45 -2.00 -2.50 0.00 0.00 175.30 171.35 1z8m s GLU 58 N 0.82 3.52 -0.28 5.12 2.12 0.12 -1.19 118.70 128.93 1z8m s GLU 58 Ca -0.10 -0.34 -0.18 0.00 0.36 0.00 0.00 54.97 54.71 1z8m s GLU 58 Cb -0.16 -2.78 0.08 0.00 0.26 0.00 0.00 34.13 31.54 1z8m s GLU 58 CO 0.01 0.32 0.70 0.00 -0.54 0.00 0.00 175.26 175.75 1z8m s HIS 60 N 1.39 3.45 0.60 0.00 0.09 -1.25 -0.18 115.29 119.40 1z8m s HIS 60 Ca -0.08 -2.62 0.30 0.00 -0.00 0.00 0.00 55.06 52.66 1z8m s HIS 60 Cb -0.05 -3.27 1.65 0.00 -0.00 0.00 0.00 32.58 30.91 1z8m s HIS 60 CO -0.16 -0.86 2.04 0.82 -0.00 0.00 0.00 174.74 176.58 1z8m h ILE 61 N 5.26 0.36 -3.38 0.60 5.03 -1.90 -3.44 117.51 120.03 1z8m h ILE 61 Ca -0.01 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.73 1z8m h ILE 61 Cb 0.97 0.77 -0.08 0.00 -3.03 0.00 0.00 36.82 35.45 1z8m h ILE 61 CO 0.72 0.00 0.02 -1.59 -0.68 0.00 0.00 178.15 176.62 1z8m s LYS 62 N -4.54 1.64 0.00 2.37 -2.85 -1.26 -5.02 119.74 110.08 1z8m s LYS 62 Ca -0.04 -1.14 0.08 0.00 -1.00 0.00 0.00 55.97 53.87 1z8m s LYS 62 Cb 0.14 0.53 0.49 0.00 -2.06 0.00 0.00 37.83 36.93 1z8m s LYS 62 CO 0.50 -0.71 0.91 -2.30 0.10 0.00 0.00 175.35 173.86 1z8m n PRO 63 N -0.41 0.41 -1.48 1.78 -0.02 -1.26 -2.42 135.00 131.61 1z8m n PRO 63 Ca -0.03 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.49 1z8m n PRO 63 Cb 0.61 -1.31 0.04 0.00 -0.02 0.00 0.00 33.50 32.81 1z8m n PRO 63 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1z8m n ASP 64 N -0.81 1.09 -3.61 2.55 2.03 -1.26 -4.97 116.55 111.57 1z8m n ASP 64 Ca 0.06 -2.16 -0.14 0.00 0.52 0.00 0.00 54.79 53.07 1z8m n ASP 64 Cb 0.03 -0.33 -0.06 0.00 -0.72 0.00 0.00 41.12 40.04 1z8m n ASP 64 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1z8m s VAL 65 N -0.41 0.03 -0.41 5.18 1.01 -1.02 -4.71 120.40 120.09 1z8m s VAL 65 Ca 0.34 -0.28 0.05 0.00 0.00 0.00 0.00 61.98 62.08 1z8m s VAL 65 Cb 0.39 -0.93 0.17 0.00 0.00 0.00 0.00 36.38 36.00 1z8m s VAL 65 CO -0.16 -0.16 0.46 -0.76 0.00 0.00 0.00 175.10 174.49 1z8m s LEU 66 N -1.80 -0.25 -0.48 3.92 1.43 0.27 -4.02 118.68 117.74 1z8m s LEU 66 Ca -0.07 -1.74 -0.25 0.00 -1.03 0.00 0.00 54.13 51.04 1z8m s LEU 66 Cb -0.01 0.81 0.03 0.00 0.03 0.00 0.00 46.19 47.05 1z8m s LEU 66 CO 0.00 -0.20 0.93 -0.22 0.23 0.00 0.00 176.35 177.09 1z8m s LEU 67 N 1.17 4.03 0.06 1.79 2.96 0.75 -2.81 118.68 126.64 1z8m s LEU 67 Ca 0.21 0.00 -0.25 0.00 -0.22 0.00 0.00 54.13 53.88 1z8m s LEU 67 Cb -0.09 -3.10 -0.06 0.00 0.50 0.00 0.00 46.19 43.44 1z8m s LEU 67 CO -0.06 -1.09 0.77 -0.69 -1.32 0.00 0.00 176.35 173.96 1z8m s VAL 68 N 3.79 4.68 0.04 1.68 1.01 -0.42 -3.22 120.40 127.96 1z8m s VAL 68 Ca 0.35 1.64 -0.05 0.00 0.00 0.00 0.00 61.98 63.93 1z8m s VAL 68 Cb -0.11 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 1z8m s VAL 68 CO 0.25 0.38 0.08 -0.72 0.00 0.00 0.00 175.10 175.09 1z8m s TYR 69 N -0.20 0.23 0.04 5.22 -0.85 -0.34 0.13 117.35 121.58 1z8m s TYR 69 Ca 0.38 -0.55 0.02 0.00 -0.52 0.00 0.00 57.07 56.40 1z8m s TYR 69 Cb -0.21 -0.16 -0.04 0.00 0.38 0.00 0.00 41.96 41.93 1z8m s TYR 69 CO 0.23 -0.36 0.05 -1.17 -1.52 0.00 0.00 175.55 172.78 1z8m s LEU 70 N -2.16 3.70 -0.31 -3.49 0.20 0.23 -2.12 118.68 114.73 1z8m s LEU 70 Ca -0.05 0.01 -0.11 0.00 0.69 0.00 0.00 54.13 54.67 1z8m s LEU 70 Cb -0.01 -2.26 -0.02 0.00 -0.43 0.00 0.00 46.19 43.47 1z8m s LEU 70 CO -0.05 0.23 0.20 -0.69 -0.29 0.00 0.00 176.35 175.75 1z8m s VAL 71 N -1.24 5.05 0.43 1.68 1.01 -1.26 -1.47 120.40 124.59 1z8m s VAL 71 Ca 0.24 -0.19 -0.00 0.00 0.00 0.00 0.00 61.98 62.03 1z8m s VAL 71 Cb -0.12 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 1z8m s VAL 71 CO 0.16 0.09 0.66 -0.75 0.00 0.00 0.00 175.10 175.26 1z8m s LYS 72 N 1.69 3.23 0.25 2.72 2.36 0.35 -4.99 119.74 125.35 1z8m s LYS 72 Ca 0.06 -0.35 -0.08 0.00 -2.55 0.00 0.00 55.97 53.04 1z8m s LYS 72 Cb -0.17 -2.56 0.42 0.00 -1.05 0.00 0.00 37.83 34.48 1z8m s LYS 72 CO 0.09 -0.17 1.60 0.22 1.55 0.00 0.00 175.35 178.65 1z8m h ASP 73 N 0.45 -0.60 0.00 1.43 1.82 -2.03 -3.08 116.42 114.41 1z8m h ASP 73 Ca -0.47 0.23 -0.17 0.00 -0.39 0.00 0.00 57.03 56.23 1z8m h ASP 73 Cb 1.24 0.45 -0.36 0.00 0.68 0.00 0.00 39.33 41.34 1z8m h ASP 73 CO 0.59 -0.25 -1.00 0.47 -1.61 0.00 0.00 179.24 177.44 1z8m n ASP 74 N -5.47 1.00 -3.71 2.28 9.92 -1.26 -5.10 116.55 114.21 1z8m n ASP 74 Ca 0.14 -2.07 -0.07 0.00 -0.53 0.00 0.00 54.79 52.25 1z8m n ASP 74 Cb 0.47 -0.31 -0.01 0.00 -0.64 0.00 0.00 41.12 40.63 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 -0.12 1.83 0.06 -1.24 8.01 -1.17 -4.53 118.70 121.54 1z8m s GLU 75 Ca 0.33 -1.04 0.05 0.00 0.01 0.00 0.00 54.97 54.32 1z8m s GLU 75 Cb 0.38 0.60 -0.03 0.00 -4.31 0.00 0.00 34.13 30.77 1z8m s GLU 75 CO -0.16 -0.84 -0.14 -1.17 0.01 0.00 0.00 175.26 172.96 1z8m s LEU 76 N -2.95 2.24 -0.01 1.80 2.96 0.17 0.13 118.68 123.02 1z8m s LEU 76 Ca 0.12 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.49 1z8m s LEU 76 Cb -0.06 -0.52 0.00 0.00 0.50 0.00 0.00 46.19 46.12 1z8m s LEU 76 CO 0.07 -0.05 -0.06 0.27 -1.32 0.00 0.00 176.35 175.27 1z8m s ILE 77 N -1.14 0.48 0.06 6.68 -5.25 -0.54 -2.10 121.20 119.39 1z8m s ILE 77 Ca -0.01 -0.22 -0.28 0.00 -0.99 0.00 0.00 60.65 59.14 1z8m s ILE 77 Cb -0.09 -0.42 -0.05 0.00 2.95 0.00 0.00 42.46 44.84 1z8m s ILE 77 CO 0.02 0.15 0.90 -0.76 -1.79 0.00 0.00 174.94 173.45 1z8m s LEU 78 N 0.08 4.45 0.00 0.37 1.43 -1.12 0.74 118.68 124.63 1z8m s LEU 78 Ca -0.01 1.64 0.00 0.00 -1.03 0.00 0.00 54.13 54.74 1z8m s LEU 78 Cb -0.05 -3.46 0.00 0.00 0.03 0.00 0.00 46.19 42.71 1z8m s LEU 78 CO -0.00 -0.08 0.00 -0.11 0.23 0.00 0.00 176.35 176.39 1z8m n LEU 79 N 3.03 0.07 -3.85 1.79 7.94 0.34 -2.59 117.00 123.74 1z8m n LEU 79 Ca 0.01 0.27 -0.10 0.00 -1.11 0.00 0.00 56.01 55.08 1z8m n LEU 79 Cb 0.50 -0.48 0.02 0.00 0.53 0.00 0.00 43.42 43.99 1z8m n LEU 79 CO 0.50 -0.48 0.47 0.00 -1.11 0.00 0.00 177.39 176.77 1z8m s ARG 80 N -0.96 2.22 -0.06 1.96 1.04 -0.89 -1.31 118.95 120.96 1z8m s ARG 80 Ca 0.00 -1.52 0.01 0.00 -1.04 0.00 0.00 55.73 53.18 1z8m s ARG 80 Cb 0.00 0.60 0.02 0.00 -2.04 0.00 0.00 34.95 33.53 1z8m s ARG 80 CO 0.00 -1.03 -0.06 -1.17 -0.04 0.00 0.00 175.30 173.00 1z8m s LEU 81 N -3.11 1.33 0.13 -1.89 1.98 -1.26 -1.30 118.68 114.55 1z8m s LEU 81 Ca 0.18 -0.17 -0.26 0.00 -2.89 0.00 0.00 54.13 50.99 1z8m s LEU 81 Cb -0.04 -0.56 0.07 0.00 0.66 0.00 0.00 46.19 46.32 1z8m s LEU 81 CO 0.13 -0.05 0.96 -0.83 -1.89 0.00 0.00 176.35 174.67 1z8m s GLY 82 N 1.00 -0.27 0.53 7.98 0.00 -1.12 -4.80 107.32 110.64 1z8m s GLY 82 Ca -0.09 0.25 0.06 0.00 0.00 0.00 0.00 44.72 44.93 1z8m s GLY 82 CO -0.00 0.05 0.39 -1.35 0.00 0.00 0.00 173.10 172.19 1z8m s SER 83 N -2.88 4.65 0.56 1.64 1.04 -1.26 0.96 113.70 118.40 1z8m s SER 83 Ca 0.11 -1.20 0.25 0.00 0.48 0.00 0.00 55.95 55.59 1z8m s SER 83 Cb -0.01 0.30 1.60 0.00 0.10 0.00 0.00 66.02 68.01 1z8m s SER 83 CO 0.01 -1.04 2.20 -0.74 0.98 0.00 0.00 173.24 174.64 1z8m h HIS 84 N 0.81 0.00 0.00 5.02 2.76 -1.89 0.21 115.15 122.06 1z8m h HIS 84 Ca -0.37 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 57.64 1z8m h HIS 84 Cb 1.30 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.23 1z8m h HIS 84 CO 0.93 0.02 -0.76 1.03 -1.30 0.00 0.00 177.93 177.85 1z8m h SER 85 N 0.00 0.00 0.00 3.26 0.87 -1.95 -2.33 113.55 113.40 1z8m h SER 85 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1z8m h SER 85 Cb 0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1z8m h SER 85 CO 0.00 0.76 0.00 -0.62 -0.53 0.00 0.00 176.83 176.45 1z8m n GLU 86 N -3.45 0.00 -0.26 2.24 -0.58 -0.43 -4.55 120.64 113.60 1z8m n GLU 86 Ca 0.00 0.21 -0.03 0.00 -0.42 0.00 0.00 57.16 56.92 1z8m n GLU 86 Cb 0.79 -0.66 0.09 0.00 -0.57 0.00 0.00 31.44 31.08 1z8m n GLU 86 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1z8m h LEU 87 N 0.00 0.75 -1.68 -4.62 3.38 -1.22 -3.48 115.31 108.44 1z8m h LEU 87 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1z8m h LEU 87 Cb 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1z8m h LEU 87 CO 0.00 0.51 0.00 0.49 0.09 0.00 0.00 178.44 179.53