#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 3.99 0.84 -0.89 1.43 -1.26 -5.09 118.68 117.71 1z8m s LEU 2 Ca 0.00 0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 53.21 1z8m s LEU 2 Cb 0.00 -3.08 0.10 0.00 0.03 0.00 0.00 46.19 43.24 1z8m s LEU 2 CO 0.00 -0.36 1.11 -0.75 0.23 0.00 0.00 176.35 176.57 1z8m s LYS 3 N -4.27 1.64 0.04 1.70 2.36 -1.26 -4.79 119.74 115.15 1z8m s LYS 3 Ca 0.41 1.24 0.05 0.00 -2.55 0.00 0.00 55.97 55.13 1z8m s LYS 3 Cb -0.10 -1.82 -0.02 0.00 -1.05 0.00 0.00 37.83 34.84 1z8m s LYS 3 CO 0.34 -2.09 -0.16 -1.17 1.55 0.00 0.00 175.35 173.82 1z8m s LEU 4 N -6.22 2.16 0.11 5.43 0.20 -1.18 -1.05 118.68 118.13 1z8m s LEU 4 Ca 0.63 -0.45 -0.03 0.00 0.69 0.00 0.00 54.13 54.98 1z8m s LEU 4 Cb -0.19 -0.71 -0.03 0.00 -0.43 0.00 0.00 46.19 44.83 1z8m s LEU 4 CO 0.57 0.08 0.07 0.21 -0.29 0.00 0.00 176.35 176.99 1z8m s ASN 5 N -1.07 0.31 -0.11 3.68 3.84 -0.44 -4.90 114.94 116.25 1z8m s ASN 5 Ca 0.03 -1.06 0.02 0.00 0.21 0.00 0.00 52.86 52.06 1z8m s ASN 5 Cb -0.08 0.29 0.01 0.00 -0.55 0.00 0.00 41.25 40.92 1z8m s ASN 5 CO 0.01 -0.71 -0.16 -0.76 -2.79 0.00 0.00 177.10 172.69 1z8m s LEU 6 N -2.99 1.77 0.55 3.21 1.02 -1.26 0.88 118.68 121.87 1z8m s LEU 6 Ca 0.17 -0.45 -0.00 0.00 0.02 0.00 0.00 54.13 53.87 1z8m s LEU 6 Cb 0.07 -1.13 0.03 0.00 0.02 0.00 0.00 46.19 45.18 1z8m s LEU 6 CO -0.03 0.03 0.79 -0.54 0.02 0.00 0.00 176.35 176.62 1z8m s LYS 7 N 0.95 2.60 0.45 1.70 -0.14 -0.89 -4.93 119.74 119.48 1z8m s LYS 7 Ca -0.07 -0.65 0.11 0.00 -1.36 0.00 0.00 55.97 54.00 1z8m s LYS 7 Cb -0.15 -2.46 1.02 0.00 -1.68 0.00 0.00 37.83 34.57 1z8m s LYS 7 CO -0.01 -0.70 2.09 0.87 -0.76 0.00 0.00 175.35 176.83 1z8m h LYS 8 N 0.04 0.29 -0.08 1.68 1.57 -1.89 -1.04 116.57 117.13 1z8m h LYS 8 Ca -0.43 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.28 1z8m h LYS 8 Cb 1.29 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.53 1z8m h LYS 8 CO 0.54 0.21 -0.13 0.77 -0.57 0.00 0.00 179.45 180.28 1z8m h SER 9 N 0.30 0.25 0.13 0.86 0.02 -1.94 -3.02 113.55 110.15 1z8m h SER 9 Ca 0.08 -0.53 -0.04 0.00 -0.84 0.00 0.00 61.79 60.45 1z8m h SER 9 Cb -0.00 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1z8m h SER 9 CO -0.01 0.74 -0.16 0.15 -1.14 0.00 0.00 176.83 176.40 1z8m h PHE 10 N -0.23 0.08 -0.31 3.45 3.57 -0.09 -0.13 116.94 123.28 1z8m h PHE 10 Ca 0.01 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 1z8m h PHE 10 Cb 0.68 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 1z8m h PHE 10 CO 0.10 0.25 0.12 1.96 -2.23 0.00 0.00 178.31 178.51 1z8m h GLN 11 N 0.08 0.46 -0.00 1.11 4.20 -1.16 -2.27 115.11 117.53 1z8m h GLN 11 Ca 0.02 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1z8m h GLN 11 Cb 0.34 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1z8m h GLN 11 CO 0.02 0.47 -0.20 0.36 -0.67 0.00 0.00 178.83 178.82 1z8m n LYS 12 N -4.73 0.65 0.06 1.46 2.85 -1.06 -3.56 118.16 113.83 1z8m n LYS 12 Ca -0.02 -0.30 0.12 0.00 -1.05 0.00 0.00 58.31 57.06 1z8m n LYS 12 Cb 0.14 -1.49 0.09 0.00 -0.65 0.00 0.00 35.03 33.11 1z8m n LYS 12 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1z8m n ASP 13 N -0.91 0.68 0.00 -5.58 8.00 -0.09 -2.73 116.55 115.92 1z8m n ASP 13 Ca 0.12 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.67 1z8m n ASP 13 Cb 0.31 0.45 0.00 0.00 -0.02 0.00 0.00 41.12 41.87 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 -2.16 0.00 0.09 1.24 7.35 -0.89 -4.05 117.46 119.04 1z8m n PHE 14 Ca 0.02 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.59 1z8m n PHE 14 Cb 0.46 -0.13 -0.12 0.00 0.35 0.00 0.00 39.48 40.04 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 0.25 1.28 -2.13 5.19 -1.81 -2.78 116.42 116.42 1z8m h ASP 15 Ca 0.00 -0.26 0.00 0.00 -0.62 0.00 0.00 57.03 56.15 1z8m h ASP 15 Cb 0.00 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.43 1z8m h ASP 15 CO 0.00 1.19 0.00 0.11 -3.12 0.00 0.00 179.24 177.42 1z8m h LYS 16 N 0.05 0.00 0.09 3.56 1.57 -1.73 -3.14 116.57 116.97 1z8m h LYS 16 Ca -0.08 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.35 1z8m h LYS 16 Cb 1.86 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.14 1z8m h LYS 16 CO 0.17 0.00 -1.92 -0.11 -0.57 0.00 0.00 179.45 177.02 1z8m n LEU 17 N -2.55 2.18 -0.29 2.94 7.94 -1.11 -3.53 117.00 122.58 1z8m n LEU 17 Ca 0.03 0.27 0.08 0.00 -1.11 0.00 0.00 56.01 55.29 1z8m n LEU 17 Cb 0.37 -0.79 0.24 0.00 0.53 0.00 0.00 43.42 43.77 1z8m n LEU 17 CO 0.27 0.73 1.07 -0.07 -1.11 0.00 0.00 177.39 178.29 1z8m h LEU 18 N 0.05 0.42 -0.92 -1.96 4.07 -1.44 0.32 115.31 115.85 1z8m h LEU 18 Ca -0.39 0.11 0.00 0.00 0.08 0.00 0.00 57.88 57.69 1z8m h LEU 18 Cb 2.03 0.06 0.00 0.00 1.08 0.00 0.00 40.66 43.83 1z8m h LEU 18 CO 0.09 0.14 0.00 0.00 -1.08 0.00 0.00 178.44 177.59 1z8m n LEU 19 N -4.94 1.43 -2.14 1.67 -0.00 -1.23 -2.94 117.00 108.84 1z8m n LEU 19 Ca 0.18 -0.50 -0.24 0.00 -0.00 0.00 0.00 56.01 55.45 1z8m n LEU 19 Cb 0.49 -0.02 0.14 0.00 -0.00 0.00 0.00 43.42 44.04 1z8m n LEU 19 CO 0.18 0.25 1.25 -3.20 -0.00 0.00 0.00 177.39 175.88 1z8m n ASN 20 N 0.12 4.46 0.00 1.45 5.15 0.11 -4.79 115.26 121.76 1z8m n ASN 20 Ca 0.19 -3.49 0.00 0.00 -0.60 0.00 0.00 54.58 50.67 1z8m n ASN 20 Cb 0.33 -0.85 0.00 0.00 -0.53 0.00 0.00 39.78 38.74 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 -0.93 0.74 3.69 8.20 0.00 -1.24 -5.01 105.19 110.64 1z8m n GLY 21 Ca 0.55 -0.63 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 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 3.15 -0.58 1.61 2.19 -1.13 -5.06 117.98 116.15 1z8m s PHE 22 Ca 0.00 0.16 -0.28 0.00 0.33 0.00 0.00 56.93 57.14 1z8m s PHE 22 Cb 0.00 -1.75 0.03 0.00 -1.31 0.00 0.00 43.02 39.98 1z8m s PHE 22 CO 0.00 0.47 1.26 0.34 1.83 0.00 0.00 175.22 179.13 1z8m s ASP 23 N -1.14 6.34 0.26 6.13 2.15 -1.26 -4.59 116.67 124.56 1z8m s ASP 23 Ca 0.16 0.14 0.21 0.00 0.43 0.00 0.00 52.55 53.49 1z8m s ASP 23 Cb -0.11 -2.55 1.00 0.00 -0.30 0.00 0.00 42.92 40.95 1z8m s ASP 23 CO 0.05 -1.57 1.64 -0.90 -0.17 0.00 0.00 175.17 174.23 1z8m n ASP 24 N 8.82 0.56 0.23 -0.34 5.68 -1.26 -1.74 116.55 128.49 1z8m n ASP 24 Ca 0.09 0.69 0.12 0.00 -0.50 0.00 0.00 54.79 55.20 1z8m n ASP 24 Cb 0.49 -0.79 0.36 0.00 -1.14 0.00 0.00 41.12 40.04 1z8m n ASP 24 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 1z8m h SER 25 N 0.00 0.00 0.72 -1.12 0.87 -2.00 -3.19 113.55 108.84 1z8m h SER 25 Ca 0.00 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.36 1z8m h SER 25 Cb 0.18 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.10 1z8m h SER 25 CO 0.00 0.08 -1.40 1.62 -0.53 0.00 0.00 176.83 176.60 1z8m h VAL 26 N 0.00 0.69 -0.82 2.23 3.04 -1.75 -3.35 116.25 116.28 1z8m h VAL 26 Ca -0.00 -2.29 0.03 0.00 -1.01 0.00 0.00 66.70 63.43 1z8m h VAL 26 Cb 0.85 2.21 -0.04 0.00 -2.01 0.00 0.00 31.29 32.30 1z8m h VAL 26 CO 0.01 0.39 0.54 0.17 -1.01 0.00 0.00 177.57 177.67 1z8m h LEU 27 N 0.00 0.89 -2.27 3.16 8.10 -1.59 -1.04 115.31 122.56 1z8m h LEU 27 Ca -0.18 -0.01 0.04 0.00 0.11 0.00 0.00 57.88 57.84 1z8m h LEU 27 Cb 1.70 -0.21 -0.01 0.00 -0.44 0.00 0.00 40.66 41.70 1z8m h LEU 27 CO 0.06 0.62 0.19 -1.13 -4.11 0.00 0.00 178.44 174.07 1z8m h ASN 28 N 1.04 0.00 0.09 0.17 -1.24 -1.70 0.82 115.58 114.76 1z8m h ASN 28 Ca 0.32 0.00 -0.17 0.00 0.71 0.00 0.00 56.30 57.16 1z8m h ASN 28 Cb -0.01 0.00 0.02 0.00 0.73 0.00 0.00 38.32 39.06 1z8m h ASN 28 CO -0.09 0.00 -0.71 -0.33 -1.29 0.00 0.00 177.43 175.01 1z8m h GLU 29 N 0.00 0.32 0.03 6.67 4.39 -1.40 -3.00 114.58 121.58 1z8m h GLU 29 Ca 0.07 -0.47 -0.05 0.00 0.34 0.00 0.00 59.36 59.26 1z8m h GLU 29 Cb 0.45 0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1z8m h GLU 29 CO -0.00 1.19 -0.22 -0.24 -1.16 0.00 0.00 179.01 178.57 1z8m h VAL 30 N -0.32 1.70 -0.79 3.13 3.04 -1.25 -3.31 116.25 118.45 1z8m h VAL 30 Ca -0.12 -2.38 0.16 0.00 -1.01 0.00 0.00 66.70 63.35 1z8m h VAL 30 Cb 1.51 3.30 -0.05 0.00 -2.01 0.00 0.00 31.29 34.04 1z8m h VAL 30 CO 0.14 0.62 0.52 0.40 -1.01 0.00 0.00 177.57 178.23 1z8m h ILE 31 N -0.88 0.78 0.19 3.17 5.03 0.45 -2.16 117.51 124.10 1z8m h ILE 31 Ca -0.05 -0.15 0.00 0.00 -0.12 0.00 0.00 64.86 64.55 1z8m h ILE 31 Cb 1.14 0.31 -0.04 0.00 -3.03 0.00 0.00 36.82 35.20 1z8m h ILE 31 CO 0.02 0.08 -0.46 0.25 -0.68 0.00 0.00 178.15 177.36 1z8m h LEU 32 N 0.44 -1.35 -2.04 1.44 6.46 -1.61 -0.37 115.31 118.28 1z8m h LEU 32 Ca 0.39 0.13 0.11 0.00 -0.12 0.00 0.00 57.88 58.40 1z8m h LEU 32 Cb 0.88 0.49 -0.02 0.00 -0.73 0.00 0.00 40.66 41.28 1z8m h LEU 32 CO -0.13 -0.51 0.37 0.74 -0.62 0.00 0.00 178.44 178.29 1z8m h THR 33 N -0.72 0.48 -0.02 1.05 2.02 -1.49 0.30 112.91 114.53 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 0.69 0.71 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1z8m h THR 33 CO -0.20 0.00 -0.02 -0.07 0.37 0.00 0.00 175.52 175.60 1z8m h LEU 34 N 0.00 0.05 0.08 2.58 3.38 -0.87 0.01 115.31 120.54 1z8m h LEU 34 Ca 0.19 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.63 1z8m h LEU 34 Cb 0.93 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1z8m h LEU 34 CO -0.00 0.56 -0.04 0.03 0.09 0.00 0.00 178.44 179.08 1z8m h ARG 35 N -0.46 -0.10 0.00 1.13 3.08 -0.34 -3.28 114.38 114.41 1z8m h ARG 35 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1z8m h ARG 35 Cb 0.55 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.62 1z8m h ARG 35 CO 0.01 0.29 0.00 1.57 -1.07 0.00 0.00 179.97 180.76 1z8m h LYS 36 N -0.97 0.00 -5.80 0.04 5.09 -0.61 -3.47 116.57 110.85 1z8m h LYS 36 Ca -0.01 0.00 -0.16 0.00 0.09 0.00 0.00 60.65 60.57 1z8m h LYS 36 Cb 0.44 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.77 1z8m h LYS 36 CO 0.02 0.00 -0.49 0.36 -2.09 0.00 0.00 179.45 177.25 1z8m n LYS 37 N -2.56 -1.65 -2.98 0.07 2.85 -0.05 -4.97 118.16 108.87 1z8m n LYS 37 Ca -0.01 1.45 -0.39 0.00 -1.05 0.00 0.00 58.31 58.30 1z8m n LYS 37 Cb 0.13 -4.55 -0.06 0.00 -0.65 0.00 0.00 35.03 29.91 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 -3.32 4.56 -0.38 -1.58 2.12 -0.95 -4.97 118.70 114.17 1z8m s GLU 38 Ca 0.09 1.15 -0.28 0.00 0.36 0.00 0.00 54.97 56.29 1z8m s GLU 38 Cb -0.02 -3.28 -0.07 0.00 0.26 0.00 0.00 34.13 31.02 1z8m s GLU 38 CO 0.80 0.52 2.33 -0.35 -0.54 0.00 0.00 175.26 178.03 1z8m n PRO 39 N 1.79 1.39 -0.46 4.30 -0.04 -1.26 -4.95 135.00 135.78 1z8m n PRO 39 Ca -0.05 0.24 -0.31 0.00 -0.04 0.00 0.00 63.50 63.35 1z8m n PRO 39 Cb 0.49 -3.22 0.28 0.00 -0.04 0.00 0.00 33.50 31.01 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 10.14 -0.93 0.10 1.53 1.43 -1.26 -5.08 118.68 124.62 1z8m s LEU 40 Ca 1.02 0.81 -0.01 0.00 -1.03 0.00 0.00 54.13 54.92 1z8m s LEU 40 Cb -0.33 -2.26 -0.04 0.00 0.03 0.00 0.00 46.19 43.59 1z8m s LEU 40 CO 0.32 -5.26 0.03 -1.81 0.23 0.00 0.00 176.35 169.87 1z8m s ASP 41 N -3.26 0.36 0.47 2.29 1.01 -1.26 -5.05 116.67 111.25 1z8m s ASP 41 Ca 0.69 -1.13 0.20 0.00 0.71 0.00 0.00 52.55 53.01 1z8m s ASP 41 Cb -0.12 0.27 1.18 0.00 1.01 0.00 0.00 42.92 45.25 1z8m s ASP 41 CO 0.58 -0.69 2.02 1.55 0.21 0.00 0.00 175.17 178.84 1z8m h PRO 42 N 2.96 0.00 0.00 8.23 0.13 -1.99 -2.06 132.00 139.27 1z8m h PRO 42 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1z8m h PRO 42 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1z8m h PRO 42 CO 0.61 0.17 0.00 -0.56 -0.23 0.00 0.00 178.00 177.99 1z8m h GLN 43 N 0.00 0.00 0.00 0.86 3.07 -1.99 -2.04 115.11 115.01 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 0.34 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.90 1z8m h GLN 43 CO 0.02 0.00 0.00 1.19 0.09 0.00 0.00 178.83 180.13 1z8m n PHE 44 N -2.76 0.12 -3.14 0.06 3.01 -0.77 -4.87 117.46 109.11 1z8m n PHE 44 Ca -0.01 0.05 -0.21 0.00 1.01 0.00 0.00 57.45 58.29 1z8m n PHE 44 Cb 0.17 -0.58 0.05 0.00 -0.01 0.00 0.00 39.48 39.11 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 -1.61 -5.47 -2.36 -1.08 6.02 -0.77 -1.59 117.38 110.52 1z8m n GLN 45 Ca 0.03 0.80 -0.36 0.00 -0.01 0.00 0.00 57.00 57.47 1z8m n GLN 45 Cb 0.17 -5.54 -0.03 0.00 1.02 0.00 0.00 30.24 25.86 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 -2.93 6.02 0.26 1.08 -4.77 -1.26 -4.56 116.67 110.51 1z8m s ASP 46 Ca 0.37 -1.69 0.06 0.00 -3.30 0.00 0.00 52.55 47.98 1z8m s ASP 46 Cb -0.16 -2.58 -0.02 0.00 -1.09 0.00 0.00 42.92 39.07 1z8m s ASP 46 CO 0.46 -1.99 0.23 1.41 0.70 0.00 0.00 175.17 175.98 1z8m n HIS 47 N 10.93 -0.66 -1.89 2.11 8.25 -1.18 -4.94 115.22 127.84 1z8m n HIS 47 Ca 0.42 -2.17 -0.32 0.00 -0.26 0.00 0.00 57.72 55.39 1z8m n HIS 47 Cb 0.48 0.24 0.02 0.00 1.12 0.00 0.00 29.99 31.85 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 -3.03 2.80 0.49 -1.41 0.00 -1.26 -0.67 121.76 118.68 1z8m s ALA 48 Ca 0.31 0.20 0.06 0.00 0.00 0.00 0.00 51.96 52.53 1z8m s ALA 48 Cb 0.01 -3.18 0.06 0.00 0.00 0.00 0.00 23.12 20.02 1z8m s ALA 48 CO 0.22 -0.88 0.51 1.28 0.00 0.00 0.00 175.76 176.89 1z8m n LEU 49 N -2.46 0.00 -4.74 0.00 4.77 -1.15 -4.81 117.00 108.61 1z8m n LEU 49 Ca 0.08 -2.32 -0.30 0.00 -0.03 0.00 0.00 56.01 53.43 1z8m n LEU 49 Cb 0.53 -0.19 -0.08 0.00 -2.33 0.00 0.00 43.42 41.36 1z8m n LEU 49 CO 0.51 -0.61 -0.22 -0.54 -1.33 0.00 0.00 177.39 175.21 1z8m s LYS 50 N -4.09 2.14 5.18 3.23 -0.14 -1.25 -3.92 119.74 120.90 1z8m s LYS 50 Ca 0.39 -2.21 0.00 0.00 -1.36 0.00 0.00 55.97 52.78 1z8m s LYS 50 Cb -0.03 -1.68 0.00 0.00 -1.68 0.00 0.00 37.83 34.44 1z8m s LYS 50 CO 0.25 -0.28 0.00 0.41 -0.76 0.00 0.00 175.35 174.97 1z8m n GLY 51 N -1.24 1.47 0.25 -3.33 0.00 -1.26 -2.93 105.19 98.15 1z8m n GLY 51 Ca -0.11 -0.66 0.09 0.00 0.00 0.00 0.00 46.02 45.34 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 0.00 -1.12 1.61 1.63 -2.05 -2.23 116.57 114.40 1z8m h LYS 52 Ca 0.00 0.00 -0.58 0.00 -0.85 0.00 0.00 60.65 59.22 1z8m h LYS 52 Cb 0.00 0.00 -0.25 0.00 -0.60 0.00 0.00 32.23 31.38 1z8m h LYS 52 CO 0.00 0.09 0.75 0.91 -3.45 0.00 0.00 179.45 177.75 1z8m n TRP 53 N -4.17 2.80 0.03 1.91 5.03 -1.15 -4.59 117.44 117.29 1z8m n TRP 53 Ca -0.03 -2.69 -0.13 0.00 3.03 0.00 0.00 57.50 57.69 1z8m n TRP 53 Cb 0.17 -1.30 -0.09 0.00 -1.03 0.00 0.00 31.31 29.06 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 1.79 -0.10 0.00 -0.99 3.11 -1.51 -3.12 116.57 115.75 1z8m h LYS 54 Ca 0.53 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 58.38 1z8m h LYS 54 Cb 0.97 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 32.22 1z8m h LYS 54 CO 1.35 0.35 0.00 -0.35 -2.81 0.00 0.00 179.45 177.99 1z8m n PRO 55 N -4.92 0.93 -3.47 1.90 -0.04 -1.26 -4.29 135.00 123.85 1z8m n PRO 55 Ca -0.08 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.16 1z8m n PRO 55 Cb 0.25 -1.17 -0.00 0.00 -0.04 0.00 0.00 33.50 32.54 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 0.01 0.54 0.40 -1.18 -4.93 117.98 113.07 1z8m s PHE 56 Ca 0.15 -0.60 0.04 0.00 -0.60 0.00 0.00 56.93 55.92 1z8m s PHE 56 Cb 0.07 -2.15 -0.01 0.00 0.51 0.00 0.00 43.02 41.44 1z8m s PHE 56 CO 0.12 -0.42 -0.11 0.50 0.70 0.00 0.00 175.22 176.00 1z8m s ARG 57 N -4.29 0.84 0.44 0.44 3.52 -1.17 -2.92 118.95 115.82 1z8m s ARG 57 Ca 0.48 -0.54 0.07 0.00 -0.13 0.00 0.00 55.73 55.62 1z8m s ARG 57 Cb -0.04 -0.81 -0.02 0.00 -1.56 0.00 0.00 34.95 32.52 1z8m s ARG 57 CO 0.29 0.21 0.29 -2.00 -0.81 0.00 0.00 175.30 173.28 1z8m s GLU 58 N -0.67 2.34 -0.30 5.12 2.12 0.16 -0.99 118.70 126.47 1z8m s GLU 58 Ca 0.02 -1.78 -0.09 0.00 0.36 0.00 0.00 54.97 53.48 1z8m s GLU 58 Cb -0.06 -2.14 0.14 0.00 0.26 0.00 0.00 34.13 32.34 1z8m s GLU 58 CO 0.00 -0.24 0.67 0.00 -0.54 0.00 0.00 175.26 175.15 1z8m n HIS 60 N 5.42 4.79 0.18 0.00 -0.00 -0.62 0.10 115.22 125.09 1z8m n HIS 60 Ca -0.10 -3.50 0.16 0.00 -0.00 0.00 0.00 57.72 54.28 1z8m n HIS 60 Cb 0.50 -1.92 0.78 0.00 -0.00 0.00 0.00 29.99 29.34 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 4.10 0.61 -4.47 1.59 5.03 -1.83 -3.43 117.51 119.11 1z8m h ILE 61 Ca 0.26 0.00 -0.24 0.00 -0.12 0.00 0.00 64.86 64.76 1z8m h ILE 61 Cb 0.84 0.85 -0.15 0.00 -3.03 0.00 0.00 36.82 35.33 1z8m h ILE 61 CO 1.19 0.00 -0.62 -0.54 -0.68 0.00 0.00 178.15 177.49 1z8m s LYS 62 N -4.78 1.18 0.00 2.37 1.02 -1.26 -5.00 119.74 113.28 1z8m s LYS 62 Ca -0.05 -1.62 0.14 0.00 0.02 0.00 0.00 55.97 54.47 1z8m s LYS 62 Cb 0.16 0.20 0.78 0.00 -0.52 0.00 0.00 37.83 38.45 1z8m s LYS 62 CO 0.60 -0.36 1.34 -2.30 -0.92 0.00 0.00 175.35 173.71 1z8m n PRO 63 N -0.26 0.31 -1.08 -1.68 -0.02 -1.26 -2.55 135.00 128.45 1z8m n PRO 63 Ca 0.01 0.09 0.02 0.00 -2.02 0.00 0.00 63.50 61.60 1z8m n PRO 63 Cb 0.66 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.65 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 -1.17 0.52 -4.02 2.55 9.92 -1.26 -4.94 116.55 118.16 1z8m n ASP 64 Ca 0.08 -1.97 -0.13 0.00 -0.53 0.00 0.00 54.79 52.24 1z8m n ASP 64 Cb 0.09 -0.23 -0.12 0.00 -0.64 0.00 0.00 41.12 40.21 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 0.00 0.43 -0.30 2.53 1.01 -1.06 -4.34 120.40 118.67 1z8m s VAL 65 Ca 0.19 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1z8m s VAL 65 Cb 0.22 -0.48 0.13 0.00 0.00 0.00 0.00 36.38 36.25 1z8m s VAL 65 CO -0.10 -0.26 0.24 -0.76 0.00 0.00 0.00 175.10 174.23 1z8m s LEU 66 N -1.14 0.14 -0.17 3.92 1.43 -0.90 -3.89 118.68 118.07 1z8m s LEU 66 Ca -0.07 -1.15 -0.16 0.00 -1.03 0.00 0.00 54.13 51.71 1z8m s LEU 66 Cb -0.08 0.16 -0.04 0.00 0.03 0.00 0.00 46.19 46.26 1z8m s LEU 66 CO 0.00 -0.38 0.39 -0.22 0.23 0.00 0.00 176.35 176.37 1z8m s LEU 67 N 2.05 4.21 -0.12 1.79 2.96 0.28 -1.60 118.68 128.25 1z8m s LEU 67 Ca 0.11 0.59 -0.04 0.00 -0.22 0.00 0.00 54.13 54.57 1z8m s LEU 67 Cb -0.16 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 1z8m s LEU 67 CO -0.28 -0.01 0.04 -0.69 -1.32 0.00 0.00 176.35 174.09 1z8m s VAL 68 N 0.91 4.61 0.03 1.68 1.01 0.31 0.55 120.40 129.49 1z8m s VAL 68 Ca 0.20 -0.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.95 1z8m s VAL 68 Cb -0.14 -2.99 0.01 0.00 0.00 0.00 0.00 36.38 33.25 1z8m s VAL 68 CO 0.07 0.56 0.24 -0.72 0.00 0.00 0.00 175.10 175.25 1z8m s TYR 69 N -0.46 -0.03 0.49 5.22 -0.85 -0.17 0.88 117.35 122.45 1z8m s TYR 69 Ca 0.09 -0.11 0.08 0.00 -0.52 0.00 0.00 57.07 56.61 1z8m s TYR 69 Cb -0.12 0.02 0.04 0.00 0.38 0.00 0.00 41.96 42.29 1z8m s TYR 69 CO 0.02 -0.43 0.68 -1.17 -1.52 0.00 0.00 175.55 173.12 1z8m s LEU 70 N -1.90 3.42 -0.31 -3.49 2.96 0.10 -3.02 118.68 116.44 1z8m s LEU 70 Ca -0.07 -0.53 0.02 0.00 -0.22 0.00 0.00 54.13 53.33 1z8m s LEU 70 Cb -0.02 -2.31 0.09 0.00 0.50 0.00 0.00 46.19 44.45 1z8m s LEU 70 CO -0.02 -1.02 0.02 -0.69 -1.32 0.00 0.00 176.35 173.32 1z8m s VAL 71 N -2.52 1.82 0.77 1.68 1.01 -1.26 -3.01 120.40 118.89 1z8m s VAL 71 Ca 0.58 -1.85 -0.11 0.00 0.00 0.00 0.00 61.98 60.59 1z8m s VAL 71 Cb -0.08 -2.25 0.05 0.00 0.00 0.00 0.00 36.38 34.09 1z8m s VAL 71 CO 0.36 -0.46 1.08 -0.75 0.00 0.00 0.00 175.10 175.33 1z8m s LYS 72 N 1.17 2.31 0.30 2.72 2.47 0.34 -4.92 119.74 124.14 1z8m s LYS 72 Ca 0.05 0.86 0.06 0.00 -1.56 0.00 0.00 55.97 55.38 1z8m s LYS 72 Cb -0.19 -1.93 0.82 0.00 -1.46 0.00 0.00 37.83 35.08 1z8m s LYS 72 CO -0.11 -1.52 1.65 -0.44 0.16 0.00 0.00 175.35 175.09 1z8m h ASP 73 N -1.02 0.12 0.00 1.43 3.32 -2.03 -3.08 116.42 115.16 1z8m h ASP 73 Ca -0.46 0.20 -0.16 0.00 0.02 0.00 0.00 57.03 56.63 1z8m h ASP 73 Cb 1.24 0.24 -0.31 0.00 0.22 0.00 0.00 39.33 40.73 1z8m h ASP 73 CO 0.56 -0.17 -0.82 -0.67 -1.72 0.00 0.00 179.24 176.43 1z8m n ASP 74 N -5.19 0.45 -3.82 6.45 2.03 -1.26 -5.11 116.55 110.09 1z8m n ASP 74 Ca 0.24 -1.99 -0.08 0.00 0.52 0.00 0.00 54.79 53.48 1z8m n ASP 74 Cb 0.78 -0.14 -0.03 0.00 -0.72 0.00 0.00 41.12 41.01 1z8m n ASP 74 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1z8m s GLU 75 N 0.00 1.61 -0.03 -0.67 8.01 -1.16 -4.60 118.70 121.86 1z8m s GLU 75 Ca 0.24 -0.97 0.08 0.00 0.01 0.00 0.00 54.97 54.33 1z8m s GLU 75 Cb 0.28 0.56 -0.02 0.00 -4.31 0.00 0.00 34.13 30.64 1z8m s GLU 75 CO -0.12 -0.71 -0.26 -1.17 0.01 0.00 0.00 175.26 173.01 1z8m s LEU 76 N -2.92 2.05 -0.06 1.80 2.96 -0.22 0.13 118.68 122.43 1z8m s LEU 76 Ca 0.12 -0.47 0.03 0.00 -0.22 0.00 0.00 54.13 53.58 1z8m s LEU 76 Cb -0.03 -1.33 0.01 0.00 0.50 0.00 0.00 46.19 45.33 1z8m s LEU 76 CO 0.04 0.30 -0.12 0.27 -1.32 0.00 0.00 176.35 175.51 1z8m s ILE 77 N -0.52 1.13 0.22 6.68 -5.25 -1.16 -1.33 121.20 120.96 1z8m s ILE 77 Ca 0.07 -0.50 -0.30 0.00 -0.99 0.00 0.00 60.65 58.94 1z8m s ILE 77 Cb -0.11 -1.02 -0.09 0.00 2.95 0.00 0.00 42.46 44.20 1z8m s ILE 77 CO -0.00 0.35 1.15 -0.76 -1.79 0.00 0.00 174.94 173.88 1z8m s LEU 78 N 0.50 4.49 0.00 0.37 1.43 0.25 0.03 118.68 125.77 1z8m s LEU 78 Ca -0.11 2.23 0.00 0.00 -1.03 0.00 0.00 54.13 55.22 1z8m s LEU 78 Cb -0.14 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.46 1z8m s LEU 78 CO 0.03 -0.26 0.00 -0.11 0.23 0.00 0.00 176.35 176.24 1z8m n LEU 79 N 1.95 0.18 -3.84 1.79 -0.00 0.26 -2.10 117.00 115.23 1z8m n LEU 79 Ca 0.02 0.12 -0.06 0.00 -0.00 0.00 0.00 56.01 56.08 1z8m n LEU 79 Cb 0.45 -0.40 -0.02 0.00 -0.00 0.00 0.00 43.42 43.45 1z8m n LEU 79 CO 0.55 -0.40 0.52 0.00 -0.00 0.00 0.00 177.39 178.06 1z8m s ARG 80 N -0.80 1.71 -0.12 1.96 3.03 -0.63 -0.11 118.95 123.99 1z8m s ARG 80 Ca 0.00 -0.96 0.02 0.00 2.03 0.00 0.00 55.73 56.83 1z8m s ARG 80 Cb 0.00 0.58 0.01 0.00 -1.03 0.00 0.00 34.95 34.51 1z8m s ARG 80 CO 0.00 -0.78 -0.18 -1.17 -1.13 0.00 0.00 175.30 172.03 1z8m s LEU 81 N -2.94 1.90 0.00 -1.89 1.98 -1.26 -0.53 118.68 115.95 1z8m s LEU 81 Ca 0.12 -0.51 0.00 0.00 -2.89 0.00 0.00 54.13 50.84 1z8m s LEU 81 Cb -0.05 -1.26 0.00 0.00 0.66 0.00 0.00 46.19 45.54 1z8m s LEU 81 CO 0.06 0.05 0.00 0.61 -1.89 0.00 0.00 176.35 175.18 1z8m n GLY 82 N 4.13 5.43 3.21 7.98 0.00 -0.63 -4.87 105.19 120.44 1z8m n GLY 82 Ca -0.19 -1.61 -0.11 0.00 0.00 0.00 0.00 46.02 44.11 1z8m n GLY 82 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1z8m s SER 83 N 0.58 -0.03 0.56 1.61 1.04 -1.26 -2.11 113.70 114.09 1z8m s SER 83 Ca 0.00 -0.32 0.32 0.00 0.48 0.00 0.00 55.95 56.44 1z8m s SER 83 Cb 0.00 0.32 1.45 0.00 0.10 0.00 0.00 66.02 67.90 1z8m s SER 83 CO 0.00 -0.60 1.79 1.12 0.98 0.00 0.00 173.24 176.54 1z8m h HIS 84 N 3.30 0.00 0.00 5.02 2.07 -1.88 0.86 115.15 124.51 1z8m h HIS 84 Ca -0.32 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.14 1z8m h HIS 84 Cb 1.20 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.17 1z8m h HIS 84 CO 0.47 0.00 -1.16 0.45 -3.07 0.00 0.00 177.93 174.63 1z8m n SER 85 N -3.94 0.85 0.00 3.10 2.88 -1.26 -3.51 113.62 111.75 1z8m n SER 85 Ca 0.19 0.35 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1z8m n SER 85 Cb 1.05 0.34 0.00 0.00 -0.75 0.00 0.00 64.21 64.85 1z8m n SER 85 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1z8m n GLU 86 N -2.76 0.00 -0.24 -1.46 1.02 0.28 -4.28 120.64 113.22 1z8m n GLU 86 Ca -0.04 0.28 0.22 0.00 -0.02 0.00 0.00 57.16 57.60 1z8m n GLU 86 Cb 0.66 -0.75 0.57 0.00 -0.02 0.00 0.00 31.44 31.89 1z8m n GLU 86 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1z8m h LEU 87 N 0.00 0.30 -1.46 -4.62 4.07 -1.44 -3.47 115.31 108.70 1z8m h LEU 87 Ca 0.00 0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.00 1z8m h LEU 87 Cb 0.00 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.72 1z8m h LEU 87 CO 0.00 0.11 0.00 0.49 -1.08 0.00 0.00 178.44 177.96