#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 3.28 0.60 -0.89 1.43 -1.26 -4.99 118.68 116.85 1z8m s LEU 2 Ca 0.00 1.74 -0.20 0.00 -1.03 0.00 0.00 54.13 54.64 1z8m s LEU 2 Cb 0.00 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.68 1z8m s LEU 2 CO 0.00 -1.40 1.33 -0.75 0.23 0.00 0.00 176.35 175.76 1z8m s LYS 3 N -4.59 2.82 0.19 1.70 2.36 -1.26 -4.78 119.74 116.17 1z8m s LYS 3 Ca 0.61 2.16 0.11 0.00 -2.55 0.00 0.00 55.97 56.30 1z8m s LYS 3 Cb -0.15 -2.04 -0.04 0.00 -1.05 0.00 0.00 37.83 34.54 1z8m s LYS 3 CO 0.47 -1.42 -0.22 -1.17 1.55 0.00 0.00 175.35 174.56 1z8m s LEU 4 N -3.97 2.44 0.22 5.43 0.20 -1.18 -0.27 118.68 121.55 1z8m s LEU 4 Ca 0.78 -0.88 -0.00 0.00 0.69 0.00 0.00 54.13 54.72 1z8m s LEU 4 Cb -0.39 -1.06 -0.04 0.00 -0.43 0.00 0.00 46.19 44.27 1z8m s LEU 4 CO 0.44 0.07 0.16 0.21 -0.29 0.00 0.00 176.35 176.94 1z8m s ASN 5 N -2.72 0.34 -0.02 3.68 2.47 -0.90 -4.88 114.94 112.90 1z8m s ASN 5 Ca 0.20 -1.42 -0.00 0.00 0.42 0.00 0.00 52.86 52.05 1z8m s ASN 5 Cb -0.07 0.41 0.03 0.00 -1.45 0.00 0.00 41.25 40.17 1z8m s ASN 5 CO 0.09 -0.88 0.03 -0.76 -3.72 0.00 0.00 177.10 171.86 1z8m s LEU 6 N -3.18 1.02 0.41 3.21 1.02 -1.26 -2.38 118.68 117.52 1z8m s LEU 6 Ca 0.39 0.03 0.08 0.00 0.02 0.00 0.00 54.13 54.65 1z8m s LEU 6 Cb 0.06 -0.10 0.00 0.00 0.02 0.00 0.00 46.19 46.18 1z8m s LEU 6 CO 0.14 -0.13 0.52 -0.54 0.02 0.00 0.00 176.35 176.36 1z8m s LYS 7 N 1.14 2.80 0.52 1.70 -0.14 -1.15 -4.92 119.74 119.70 1z8m s LYS 7 Ca -0.08 -1.28 0.18 0.00 -1.36 0.00 0.00 55.97 53.44 1z8m s LYS 7 Cb -0.13 -2.69 1.31 0.00 -1.68 0.00 0.00 37.83 34.64 1z8m s LYS 7 CO -0.03 -0.22 2.12 0.87 -0.76 0.00 0.00 175.35 177.33 1z8m h LYS 8 N 0.75 0.00 0.10 1.68 6.56 -1.92 0.97 116.57 124.70 1z8m h LYS 8 Ca -0.41 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.18 1z8m h LYS 8 Cb 1.27 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.94 1z8m h LYS 8 CO 0.48 0.00 -0.05 0.77 -2.06 0.00 0.00 179.45 178.60 1z8m h SER 9 N 0.00 -0.11 -0.48 0.86 0.02 -1.95 -3.16 113.55 108.73 1z8m h SER 9 Ca 0.06 -0.29 0.05 0.00 -0.84 0.00 0.00 61.79 60.77 1z8m h SER 9 Cb 0.24 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.78 1z8m h SER 9 CO -0.00 0.50 0.32 0.15 -1.14 0.00 0.00 176.83 176.66 1z8m h PHE 10 N -0.98 0.44 -0.66 3.45 3.57 -1.01 0.42 116.94 122.16 1z8m h PHE 10 Ca -0.01 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1z8m h PHE 10 Cb 0.40 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1z8m h PHE 10 CO 0.08 0.24 0.38 1.96 -2.23 0.00 0.00 178.31 178.74 1z8m h GLN 11 N 0.44 0.92 0.00 1.11 4.20 -0.91 0.13 115.11 121.00 1z8m h GLN 11 Ca 0.20 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1z8m h GLN 11 Cb 0.25 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1z8m h GLN 11 CO -0.05 0.67 -0.84 1.63 -0.67 0.00 0.00 178.83 179.57 1z8m n LYS 12 N -4.54 0.40 0.01 1.46 5.02 -0.73 -3.75 118.16 116.03 1z8m n LYS 12 Ca 0.05 0.08 0.12 0.00 -2.02 0.00 0.00 58.31 56.54 1z8m n LYS 12 Cb 0.07 -1.71 0.19 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 -2.27 0.57 -0.02 4.39 8.00 0.14 -1.18 116.55 126.17 1z8m n ASP 13 Ca 0.02 -0.24 -0.01 0.00 0.71 0.00 0.00 54.79 55.27 1z8m n ASP 13 Cb 0.48 0.34 -0.00 0.00 -0.02 0.00 0.00 41.12 41.91 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 -1.63 0.21 -0.02 1.24 -0.00 0.42 -4.12 117.46 113.56 1z8m n PHE 14 Ca 0.05 0.09 -0.13 0.00 -0.00 0.00 0.00 57.45 57.46 1z8m n PHE 14 Cb 0.36 -0.36 -0.14 0.00 -0.00 0.00 0.00 39.48 39.34 1z8m n PHE 14 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1z8m n ASP 15 N -2.84 1.22 0.14 -2.13 -0.08 -1.25 -3.76 116.55 107.86 1z8m n ASP 15 Ca -0.02 0.33 0.01 0.00 -1.51 0.00 0.00 54.79 53.59 1z8m n ASP 15 Cb 0.07 -0.26 0.16 0.00 2.34 0.00 0.00 41.12 43.43 1z8m n ASP 15 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1z8m h LYS 16 N 0.02 0.00 -0.18 -0.67 1.57 -1.67 -3.05 116.57 112.59 1z8m h LYS 16 Ca -0.34 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.28 1z8m h LYS 16 Cb 2.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.33 1z8m h LYS 16 CO 0.08 0.58 -0.53 1.25 -0.57 0.00 0.00 179.45 180.27 1z8m h LEU 17 N 0.00 0.57 -1.69 2.94 5.85 -1.30 -2.58 115.31 119.11 1z8m h LEU 17 Ca -0.01 -0.30 0.06 0.00 0.84 0.00 0.00 57.88 58.47 1z8m h LEU 17 Cb 1.18 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 1z8m h LEU 17 CO 0.08 0.99 0.31 -0.07 -0.34 0.00 0.00 178.44 179.41 1z8m h LEU 18 N 0.41 0.34 -0.30 2.25 4.07 -1.62 0.68 115.31 121.13 1z8m h LEU 18 Ca 0.01 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1z8m h LEU 18 Cb 1.05 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.72 1z8m h LEU 18 CO 0.10 0.23 -0.34 0.18 -1.08 0.00 0.00 178.44 177.52 1z8m n LEU 19 N -4.48 0.82 -1.89 1.67 4.77 -1.09 -2.94 117.00 113.86 1z8m n LEU 19 Ca 0.06 -0.16 -0.12 0.00 -0.03 0.00 0.00 56.01 55.76 1z8m n LEU 19 Cb 0.24 -0.17 0.20 0.00 -2.33 0.00 0.00 43.42 41.36 1z8m n LEU 19 CO 0.35 0.17 1.03 -3.20 -1.33 0.00 0.00 177.39 174.40 1z8m n ASN 20 N -0.97 3.96 0.00 -1.43 2.85 0.21 -4.79 115.26 115.08 1z8m n ASN 20 Ca 0.10 -3.14 0.00 0.00 -0.11 0.00 0.00 54.58 51.43 1z8m n ASN 20 Cb 0.34 -0.74 0.00 0.00 1.24 0.00 0.00 39.78 40.62 1z8m n ASN 20 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1z8m n GLY 21 N -0.45 1.10 3.23 8.20 0.00 -1.23 -5.03 105.19 111.01 1z8m n GLY 21 Ca 0.41 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 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 2.81 0.12 1.61 2.19 -1.07 -5.04 117.98 116.60 1z8m s PHE 22 Ca 0.00 -1.19 -0.31 0.00 0.33 0.00 0.00 56.93 55.76 1z8m s PHE 22 Cb 0.00 -1.93 -0.09 0.00 -1.31 0.00 0.00 43.02 39.69 1z8m s PHE 22 CO 0.00 -0.58 1.50 0.34 1.83 0.00 0.00 175.22 178.31 1z8m s ASP 23 N 1.06 6.70 0.00 6.13 -1.08 -1.26 -4.18 116.67 124.04 1z8m s ASP 23 Ca -0.01 2.45 0.28 0.00 -0.52 0.00 0.00 52.55 54.75 1z8m s ASP 23 Cb -0.14 -2.58 1.53 0.00 -1.46 0.00 0.00 42.92 40.27 1z8m s ASP 23 CO -0.04 -0.76 1.99 -0.90 0.52 0.00 0.00 175.17 175.98 1z8m n ASP 24 N 4.33 0.00 0.08 -0.34 5.75 -1.26 -3.13 116.55 121.98 1z8m n ASP 24 Ca 0.13 -0.45 -0.02 0.00 -0.01 0.00 0.00 54.79 54.44 1z8m n ASP 24 Cb 0.41 -0.16 -0.06 0.00 -1.03 0.00 0.00 41.12 40.28 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 0.49 -1.12 0.87 -2.01 -3.32 113.55 108.47 1z8m h SER 25 Ca 0.00 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.26 1z8m h SER 25 Cb 0.14 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.12 1z8m h SER 25 CO 0.00 0.73 -1.36 0.58 -0.53 0.00 0.00 176.83 176.25 1z8m h VAL 26 N 0.00 1.39 -0.82 2.23 2.07 -1.95 -3.31 116.25 115.86 1z8m h VAL 26 Ca -0.05 -2.92 0.07 0.00 0.82 0.00 0.00 66.70 64.63 1z8m h VAL 26 Cb 1.60 2.96 -0.05 0.00 -1.52 0.00 0.00 31.29 34.27 1z8m h VAL 26 CO 0.09 0.86 0.53 0.17 0.02 0.00 0.00 177.57 179.24 1z8m h LEU 27 N 0.10 0.76 -2.39 2.57 8.10 -1.67 -0.11 115.31 122.67 1z8m h LEU 27 Ca -0.19 0.01 0.03 0.00 0.11 0.00 0.00 57.88 57.84 1z8m h LEU 27 Cb 2.04 -0.15 -0.00 0.00 -0.44 0.00 0.00 40.66 42.10 1z8m h LEU 27 CO 0.22 0.48 0.13 -1.13 -4.11 0.00 0.00 178.44 174.04 1z8m h ASN 28 N 0.86 0.00 0.52 0.17 -0.73 -1.65 0.87 115.58 115.63 1z8m h ASN 28 Ca 0.36 0.00 -0.26 0.00 1.87 0.00 0.00 56.30 58.27 1z8m h ASN 28 Cb 0.29 0.00 0.01 0.00 0.27 0.00 0.00 38.32 38.88 1z8m h ASN 28 CO -0.13 0.00 -1.15 -0.33 -0.37 0.00 0.00 177.43 175.45 1z8m h GLU 29 N 0.00 0.32 0.08 6.67 5.08 -1.18 -3.00 114.58 122.56 1z8m h GLU 29 Ca 0.04 -0.47 -0.32 0.00 -1.00 0.00 0.00 59.36 57.61 1z8m h GLU 29 Cb 0.31 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1z8m h GLU 29 CO -0.00 1.19 -1.75 1.55 -1.00 0.00 0.00 179.01 179.00 1z8m n VAL 30 N -3.61 1.70 0.01 3.13 3.14 -0.33 -4.03 118.33 118.34 1z8m n VAL 30 Ca -0.08 -0.44 0.08 0.00 -2.96 0.00 0.00 64.34 60.94 1z8m n VAL 30 Cb 0.96 -1.85 0.50 0.00 -1.06 0.00 0.00 33.84 32.40 1z8m n VAL 30 CO 0.00 0.00 0.00 0.40 -6.46 0.00 0.00 176.83 170.77 1z8m h ILE 31 N -0.30 0.99 0.68 1.55 5.03 0.55 -2.65 117.51 123.36 1z8m h ILE 31 Ca -0.40 -0.13 -0.03 0.00 -0.12 0.00 0.00 64.86 64.18 1z8m h ILE 31 Cb 1.79 0.58 0.01 0.00 -3.03 0.00 0.00 36.82 36.16 1z8m h ILE 31 CO -0.02 0.07 -0.32 0.25 -0.68 0.00 0.00 178.15 177.45 1z8m h LEU 32 N 0.38 -0.77 -2.20 1.44 6.46 -1.68 0.17 115.31 119.11 1z8m h LEU 32 Ca 0.18 0.03 0.05 0.00 -0.12 0.00 0.00 57.88 58.01 1z8m h LEU 32 Cb 0.22 0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.35 1z8m h LEU 32 CO -0.04 -0.55 0.26 0.74 -0.62 0.00 0.00 178.44 178.23 1z8m h THR 33 N -0.91 0.32 0.08 1.05 2.02 -1.62 0.43 112.91 114.28 1z8m h THR 33 Ca -0.09 0.00 -0.30 0.00 0.77 0.00 0.00 66.41 66.78 1z8m h THR 33 Cb 0.70 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 1z8m h THR 33 CO 0.15 0.00 -1.62 -0.07 0.37 0.00 0.00 175.52 174.36 1z8m h LEU 34 N 0.00 0.25 -3.48 2.58 3.38 -1.17 -3.35 115.31 113.53 1z8m h LEU 34 Ca 0.08 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1z8m h LEU 34 Cb 0.60 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1z8m h LEU 34 CO -0.00 1.36 0.01 0.54 0.09 0.00 0.00 178.44 180.43 1z8m n ARG 35 N -3.33 4.23 -0.29 1.13 1.74 0.54 -4.33 116.66 116.34 1z8m n ARG 35 Ca -0.18 -3.07 0.08 0.00 -0.77 0.00 0.00 57.85 53.92 1z8m n ARG 35 Cb 1.04 -2.13 0.19 0.00 -1.02 0.00 0.00 32.46 30.54 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 0.22 1.96 -2.71 5.56 4.76 0.13 -4.96 118.16 123.12 1z8m n LYS 36 Ca 0.26 -2.76 -0.09 0.00 -2.87 0.00 0.00 58.31 52.86 1z8m n LYS 36 Cb 1.11 -1.66 -0.01 0.00 -1.84 0.00 0.00 35.03 32.63 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 -1.05 -2.67 -3.48 1.97 2.85 -1.26 -4.90 118.16 109.63 1z8m n LYS 37 Ca 0.19 0.21 -0.38 0.00 -1.05 0.00 0.00 58.31 57.29 1z8m n LYS 37 Cb 0.76 -4.77 -0.06 0.00 -0.65 0.00 0.00 35.03 30.32 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 -5.26 4.07 0.23 -1.58 2.12 -1.26 -5.02 118.70 112.01 1z8m s GLU 38 Ca 0.10 0.33 -0.30 0.00 0.36 0.00 0.00 54.97 55.46 1z8m s GLU 38 Cb -0.05 -3.32 -0.09 0.00 0.26 0.00 0.00 34.13 30.93 1z8m s GLU 38 CO 0.12 0.47 1.10 -1.25 -0.54 0.00 0.00 175.26 175.16 1z8m s PRO 39 N -0.33 4.62 -0.17 4.30 0.04 -1.26 -4.89 135.00 137.31 1z8m s PRO 39 Ca 0.22 1.77 -0.20 0.00 0.04 0.00 0.00 61.00 62.83 1z8m s PRO 39 Cb -0.15 -3.23 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 1z8m s PRO 39 CO 0.10 0.15 0.57 -0.51 0.04 0.00 0.00 177.00 177.35 1z8m s LEU 40 N -0.94 4.18 0.67 -3.56 1.43 -1.26 -5.06 118.68 114.14 1z8m s LEU 40 Ca 0.47 0.81 -0.15 0.00 -1.03 0.00 0.00 54.13 54.23 1z8m s LEU 40 Cb -0.31 -2.82 0.01 0.00 0.03 0.00 0.00 46.19 43.10 1z8m s LEU 40 CO 0.38 -0.18 1.12 -1.81 0.23 0.00 0.00 176.35 176.09 1z8m s ASP 41 N 1.05 5.00 0.01 2.29 1.01 -1.26 -4.91 116.67 119.86 1z8m s ASP 41 Ca 0.28 2.02 0.13 0.00 0.71 0.00 0.00 52.55 55.68 1z8m s ASP 41 Cb -0.16 -2.55 0.56 0.00 1.01 0.00 0.00 42.92 41.78 1z8m s ASP 41 CO 0.11 -1.70 1.42 -0.81 0.21 0.00 0.00 175.17 174.39 1z8m n PRO 42 N -2.50 0.01 -0.09 8.23 -0.04 -1.26 -2.26 135.00 137.09 1z8m n PRO 42 Ca 0.10 0.29 0.07 0.00 -0.04 0.00 0.00 63.50 63.92 1z8m n PRO 42 Cb 0.52 -1.52 0.25 0.00 -0.04 0.00 0.00 33.50 32.71 1z8m n PRO 42 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1z8m n GLN 43 N -1.54 1.51 -0.38 0.54 -0.00 -1.26 -3.71 117.38 112.54 1z8m n GLN 43 Ca 0.03 -0.79 0.07 0.00 -0.00 0.00 0.00 57.00 56.31 1z8m n GLN 43 Cb 0.15 -1.26 0.23 0.00 -0.00 0.00 0.00 30.24 29.37 1z8m n GLN 43 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1z8m n PHE 44 N 0.08 0.93 -3.67 2.61 3.72 -0.96 -4.91 117.46 115.26 1z8m n PHE 44 Ca 0.11 -0.38 -0.25 0.00 -0.05 0.00 0.00 57.45 56.88 1z8m n PHE 44 Cb 0.21 -0.15 0.07 0.00 -0.94 0.00 0.00 39.48 38.67 1z8m n PHE 44 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1z8m n GLN 45 N 0.72 -7.14 -2.91 -1.08 3.00 -1.24 -1.69 117.38 107.03 1z8m n GLN 45 Ca 0.17 0.76 -0.43 0.00 -0.01 0.00 0.00 57.00 57.50 1z8m n GLN 45 Cb 0.59 -5.76 -0.05 0.00 0.00 0.00 0.00 30.24 25.02 1z8m n GLN 45 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.06 177.22 1z8m s ASP 46 N -3.44 6.50 0.24 1.08 -4.77 -1.26 -4.26 116.67 110.75 1z8m s ASP 46 Ca 0.54 0.15 -0.16 0.00 -3.30 0.00 0.00 52.55 49.78 1z8m s ASP 46 Cb -0.25 -2.41 0.06 0.00 -1.09 0.00 0.00 42.92 39.23 1z8m s ASP 46 CO 0.76 -0.89 0.78 1.41 0.70 0.00 0.00 175.17 177.94 1z8m n HIS 47 N 6.74 -1.65 -2.83 2.11 8.25 -1.20 -5.00 115.22 121.63 1z8m n HIS 47 Ca 0.04 -1.30 -0.29 0.00 -0.26 0.00 0.00 57.72 55.91 1z8m n HIS 47 Cb 0.48 0.64 -0.02 0.00 1.12 0.00 0.00 29.99 32.21 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 -1.89 3.39 0.52 -1.41 0.00 -1.26 -0.26 121.76 120.85 1z8m s ALA 48 Ca 0.17 -0.34 0.06 0.00 0.00 0.00 0.00 51.96 51.85 1z8m s ALA 48 Cb -0.03 -2.62 0.03 0.00 0.00 0.00 0.00 23.12 20.49 1z8m s ALA 48 CO 0.07 -0.10 0.41 -0.51 0.00 0.00 0.00 175.76 175.64 1z8m s LEU 49 N -4.11 2.84 0.14 0.00 1.43 -1.14 -4.86 118.68 112.97 1z8m s LEU 49 Ca 0.49 -1.14 0.08 0.00 -1.03 0.00 0.00 54.13 52.53 1z8m s LEU 49 Cb -0.10 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.73 1z8m s LEU 49 CO 0.36 -1.03 -0.20 -0.54 0.23 0.00 0.00 176.35 175.17 1z8m s LYS 50 N -4.26 1.21 0.04 1.70 3.01 -1.25 -3.67 119.74 116.52 1z8m s LYS 50 Ca 0.38 -1.30 0.00 0.00 -1.01 0.00 0.00 55.97 54.05 1z8m s LYS 50 Cb -0.02 -1.39 0.00 0.00 -1.01 0.00 0.00 37.83 35.41 1z8m s LYS 50 CO 0.23 0.30 0.00 0.41 0.51 0.00 0.00 175.35 176.80 1z8m n GLY 51 N 0.67 -5.74 4.70 -3.33 0.00 -1.26 -4.01 105.19 96.23 1z8m n GLY 51 Ca -0.16 0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 1.79 0.00 -1.34 1.61 3.00 -1.26 -4.40 118.16 117.57 1z8m n LYS 52 Ca 0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 58.04 1z8m n LYS 52 Cb 0.00 -0.14 0.11 0.00 0.00 0.00 0.00 35.03 35.00 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 2.85 -0.04 5.64 8.01 -1.26 -4.62 117.44 128.02 1z8m n TRP 53 Ca 0.00 -2.45 -0.13 0.00 -1.31 0.00 0.00 57.50 53.61 1z8m n TRP 53 Cb 0.00 -1.05 -0.11 0.00 -2.01 0.00 0.00 31.31 28.14 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 1.65 0.00 -0.99 -0.99 3.11 -1.77 -3.03 116.57 114.56 1z8m h LYS 54 Ca 0.53 -0.00 -0.11 0.00 -2.81 0.00 0.00 60.65 58.26 1z8m h LYS 54 Cb 1.53 0.00 -0.07 0.00 -1.00 0.00 0.00 32.23 32.70 1z8m h LYS 54 CO 1.20 0.73 0.14 -0.35 -2.81 0.00 0.00 179.45 178.36 1z8m n PRO 55 N -4.74 1.36 -4.21 1.90 -0.04 -1.26 -4.60 135.00 123.41 1z8m n PRO 55 Ca -0.09 -0.71 -0.12 0.00 -0.04 0.00 0.00 63.50 62.53 1z8m n PRO 55 Cb 0.36 -1.32 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 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 -0.84 1.20 -0.02 0.54 0.08 -1.24 -5.03 117.98 112.68 1z8m s PHE 56 Ca 0.13 -1.39 0.04 0.00 0.12 0.00 0.00 56.93 55.84 1z8m s PHE 56 Cb 0.11 -0.58 -0.01 0.00 -0.57 0.00 0.00 43.02 41.97 1z8m s PHE 56 CO 0.03 -0.64 -0.14 0.50 -0.10 0.00 0.00 175.22 174.86 1z8m s ARG 57 N -4.12 1.23 0.52 0.44 3.52 -1.24 -3.50 118.95 115.80 1z8m s ARG 57 Ca 0.39 -0.52 0.06 0.00 -0.13 0.00 0.00 55.73 55.53 1z8m s ARG 57 Cb 0.07 -1.17 0.05 0.00 -1.56 0.00 0.00 34.95 32.34 1z8m s ARG 57 CO 0.13 0.29 0.72 -2.00 -0.81 0.00 0.00 175.30 173.63 1z8m s GLU 58 N -0.27 2.49 -0.30 5.12 2.12 0.64 -2.38 118.70 126.12 1z8m s GLU 58 Ca 0.04 -1.24 -0.10 0.00 0.36 0.00 0.00 54.97 54.04 1z8m s GLU 58 Cb -0.06 -2.62 0.18 0.00 0.26 0.00 0.00 34.13 31.88 1z8m s GLU 58 CO -0.00 -0.66 0.92 0.00 -0.54 0.00 0.00 175.26 174.98 1z8m n HIS 60 N 5.46 4.61 0.05 0.00 8.25 -0.68 -0.92 115.22 131.99 1z8m n HIS 60 Ca -0.05 -3.16 -0.11 0.00 -0.26 0.00 0.00 57.72 54.13 1z8m n HIS 60 Cb 0.53 -2.27 -0.06 0.00 1.12 0.00 0.00 29.99 29.31 1z8m n HIS 60 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1z8m h ILE 61 N 4.71 0.82 -1.38 1.59 5.03 -1.79 -3.44 117.51 123.05 1z8m h ILE 61 Ca 0.37 0.00 -0.60 0.00 -0.12 0.00 0.00 64.86 64.51 1z8m h ILE 61 Cb 0.83 0.82 -0.10 0.00 -3.03 0.00 0.00 36.82 35.35 1z8m h ILE 61 CO 1.36 0.00 -0.51 -0.54 -0.68 0.00 0.00 178.15 177.78 1z8m s LYS 62 N -6.17 2.15 0.00 2.37 -0.14 -1.26 -5.00 119.74 111.69 1z8m s LYS 62 Ca -0.14 -2.00 0.14 0.00 -1.36 0.00 0.00 55.97 52.61 1z8m s LYS 62 Cb 0.07 -1.84 0.78 0.00 -1.68 0.00 0.00 37.83 35.16 1z8m s LYS 62 CO 0.66 -0.17 1.29 -2.30 -0.76 0.00 0.00 175.35 174.08 1z8m n PRO 63 N -1.21 0.34 -1.31 -1.68 -0.02 -1.26 -2.64 135.00 127.22 1z8m n PRO 63 Ca -0.04 0.06 0.01 0.00 -2.02 0.00 0.00 63.50 61.50 1z8m n PRO 63 Cb 0.65 -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 -3.47 1.98 0.00 0.00 175.50 174.01 1z8m n ASP 64 N -1.11 0.39 -3.96 2.55 -0.08 -1.26 -4.89 116.55 108.19 1z8m n ASP 64 Ca 0.09 -1.99 -0.10 0.00 -1.51 0.00 0.00 54.79 51.28 1z8m n ASP 64 Cb 0.07 -0.13 -0.12 0.00 2.34 0.00 0.00 41.12 43.29 1z8m n ASP 64 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1z8m s VAL 65 N 0.00 0.14 -0.35 5.18 1.01 -1.08 -4.23 120.40 121.06 1z8m s VAL 65 Ca 0.23 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.53 1z8m s VAL 65 Cb 0.26 -0.24 0.15 0.00 0.00 0.00 0.00 36.38 36.55 1z8m s VAL 65 CO -0.11 -0.35 0.35 -0.76 0.00 0.00 0.00 175.10 174.22 1z8m s LEU 66 N -1.09 -0.02 -0.02 3.92 1.43 -0.96 -3.55 118.68 118.39 1z8m s LEU 66 Ca -0.11 -1.47 -0.25 0.00 -1.03 0.00 0.00 54.13 51.27 1z8m s LEU 66 Cb -0.07 0.49 -0.04 0.00 0.03 0.00 0.00 46.19 46.59 1z8m s LEU 66 CO -0.01 -0.29 0.76 -0.22 0.23 0.00 0.00 176.35 176.82 1z8m s LEU 67 N 1.58 4.37 -0.27 1.79 1.98 -0.10 -2.29 118.68 125.74 1z8m s LEU 67 Ca 0.16 1.34 -0.06 0.00 -2.89 0.00 0.00 54.13 52.68 1z8m s LEU 67 Cb -0.16 -3.19 0.01 0.00 0.66 0.00 0.00 46.19 43.51 1z8m s LEU 67 CO -0.09 -0.08 0.04 -0.69 -1.89 0.00 0.00 176.35 173.64 1z8m s VAL 68 N 0.49 3.72 0.09 1.68 1.01 0.17 -1.78 120.40 125.79 1z8m s VAL 68 Ca 0.40 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.73 1z8m s VAL 68 Cb -0.19 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 1z8m s VAL 68 CO 0.21 0.17 -0.09 -0.72 0.00 0.00 0.00 175.10 174.68 1z8m s TYR 69 N 1.48 0.96 0.55 5.22 1.13 -1.00 0.12 117.35 125.79 1z8m s TYR 69 Ca 0.03 -0.72 0.04 0.00 -1.41 0.00 0.00 57.07 55.01 1z8m s TYR 69 Cb -0.16 -0.53 0.04 0.00 -1.10 0.00 0.00 41.96 40.20 1z8m s TYR 69 CO 0.01 -0.06 0.34 -0.11 -2.51 0.00 0.00 175.55 173.21 1z8m n LEU 70 N 0.45 0.00 -3.82 -3.49 7.94 0.15 -3.70 117.00 114.53 1z8m n LEU 70 Ca -0.15 -2.95 -0.29 0.00 -1.11 0.00 0.00 56.01 51.50 1z8m n LEU 70 Cb 0.58 0.03 -0.16 0.00 0.53 0.00 0.00 43.42 44.41 1z8m n LEU 70 CO 0.27 -0.57 -0.38 -0.69 -1.11 0.00 0.00 177.39 174.92 1z8m s VAL 71 N -2.78 1.01 0.54 1.96 1.01 -1.26 -3.02 120.40 117.86 1z8m s VAL 71 Ca 0.25 -1.00 0.06 0.00 0.00 0.00 0.00 61.98 61.30 1z8m s VAL 71 Cb -0.02 -1.47 0.06 0.00 0.00 0.00 0.00 36.38 34.94 1z8m s VAL 71 CO 0.16 -0.25 0.74 -0.75 0.00 0.00 0.00 175.10 175.00 1z8m s LYS 72 N 1.62 2.44 -0.42 2.72 2.20 0.28 -4.99 119.74 123.59 1z8m s LYS 72 Ca -0.01 -1.27 -0.27 0.00 -0.36 0.00 0.00 55.97 54.06 1z8m s LYS 72 Cb -0.18 -2.62 -0.07 0.00 -1.51 0.00 0.00 37.83 33.46 1z8m s LYS 72 CO -0.10 -0.71 2.37 -0.25 -0.36 0.00 0.00 175.35 176.30 1z8m n ASP 73 N -2.20 2.54 -2.00 1.43 9.92 -1.26 -1.93 116.55 123.04 1z8m n ASP 73 Ca 0.11 -0.31 -0.17 0.00 -0.53 0.00 0.00 54.79 53.90 1z8m n ASP 73 Cb 0.60 -1.57 -0.04 0.00 -0.64 0.00 0.00 41.12 39.48 1z8m n ASP 73 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1z8m n ASP 74 N 14.73 -4.67 -3.68 -2.24 9.92 -1.26 -4.93 116.55 124.42 1z8m n ASP 74 Ca 0.36 0.23 -0.10 0.00 -0.53 0.00 0.00 54.79 54.75 1z8m n ASP 74 Cb 0.51 -4.05 -0.10 0.00 -0.64 0.00 0.00 41.12 36.84 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 -4.31 0.47 -0.02 -1.24 2.02 -0.81 -4.44 118.70 110.36 1z8m s GLU 75 Ca 0.00 0.88 -0.08 0.00 0.02 0.00 0.00 54.97 55.79 1z8m s GLU 75 Cb 0.00 0.02 -0.05 0.00 0.10 0.00 0.00 34.13 34.20 1z8m s GLU 75 CO 0.00 -0.15 0.26 -1.17 0.02 0.00 0.00 175.26 174.22 1z8m s LEU 76 N 1.41 4.39 -0.03 1.80 0.20 0.62 0.10 118.68 127.18 1z8m s LEU 76 Ca -0.09 0.61 0.04 0.00 0.69 0.00 0.00 54.13 55.38 1z8m s LEU 76 Cb -0.07 -2.51 -0.00 0.00 -0.43 0.00 0.00 46.19 43.17 1z8m s LEU 76 CO -0.14 0.30 -0.13 0.27 -0.29 0.00 0.00 176.35 176.36 1z8m s ILE 77 N -1.20 1.09 -0.04 6.68 -5.25 -1.17 -2.12 121.20 119.20 1z8m s ILE 77 Ca 0.24 -0.54 -0.22 0.00 -0.99 0.00 0.00 60.65 59.14 1z8m s ILE 77 Cb -0.14 -0.95 -0.05 0.00 2.95 0.00 0.00 42.46 44.28 1z8m s ILE 77 CO 0.13 0.32 0.65 -0.76 -1.79 0.00 0.00 174.94 173.49 1z8m s LEU 78 N 0.05 4.36 -0.11 0.37 1.43 -1.00 0.33 118.68 124.10 1z8m s LEU 78 Ca -0.02 1.17 -0.06 0.00 -1.03 0.00 0.00 54.13 54.19 1z8m s LEU 78 Cb -0.09 -3.00 -0.02 0.00 0.03 0.00 0.00 46.19 43.11 1z8m s LEU 78 CO 0.01 -0.01 -0.12 0.25 0.23 0.00 0.00 176.35 176.71 1z8m h LEU 79 N 6.24 0.00 -7.10 1.79 7.12 0.53 -3.04 115.31 120.84 1z8m h LEU 79 Ca -0.43 0.00 0.23 0.00 0.13 0.00 0.00 57.88 57.82 1z8m h LEU 79 Cb 1.20 0.00 -0.16 0.00 -0.53 0.00 0.00 40.66 41.17 1z8m h LEU 79 CO 0.73 0.60 0.72 0.00 -0.13 0.00 0.00 178.44 180.37 1z8m s ARG 80 N -1.94 0.50 -0.11 1.25 1.04 -0.56 -1.31 118.95 117.81 1z8m s ARG 80 Ca -0.10 -0.22 0.01 0.00 -1.04 0.00 0.00 55.73 54.39 1z8m s ARG 80 Cb 0.01 0.21 -0.01 0.00 -2.04 0.00 0.00 34.95 33.12 1z8m s ARG 80 CO 0.14 -0.22 -0.16 -1.17 -0.04 0.00 0.00 175.30 173.86 1z8m s LEU 81 N -2.47 2.58 0.00 -1.89 1.98 -1.26 -0.65 118.68 116.97 1z8m s LEU 81 Ca 0.10 -0.36 0.00 0.00 -2.89 0.00 0.00 54.13 50.98 1z8m s LEU 81 Cb 0.00 -1.56 0.00 0.00 0.66 0.00 0.00 46.19 45.29 1z8m s LEU 81 CO -0.05 0.19 0.00 0.61 -1.89 0.00 0.00 176.35 175.21 1z8m n GLY 82 N 3.37 5.03 3.45 7.98 0.00 -0.97 -4.85 105.19 119.21 1z8m n GLY 82 Ca -0.18 -1.50 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.01 0.54 1.61 1.04 -1.26 -2.28 113.70 113.93 1z8m s SER 83 Ca 0.00 -1.07 0.20 0.00 0.48 0.00 0.00 55.95 55.56 1z8m s SER 83 Cb 0.00 0.51 1.40 0.00 0.10 0.00 0.00 66.02 68.03 1z8m s SER 83 CO 0.00 -1.03 2.15 -0.74 0.98 0.00 0.00 173.24 174.61 1z8m h HIS 84 N 2.39 0.00 0.00 5.02 2.76 -1.88 0.29 115.15 123.72 1z8m h HIS 84 Ca -0.30 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 57.85 1z8m h HIS 84 Cb 1.25 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.20 1z8m h HIS 84 CO 0.38 0.00 -1.08 0.43 -1.30 0.00 0.00 177.93 176.36 1z8m n SER 85 N -4.37 0.85 0.00 3.26 7.64 -1.26 -3.31 113.62 116.43 1z8m n SER 85 Ca -0.02 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.20 1z8m n SER 85 Cb 0.14 0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 1z8m n SER 85 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1z8m n GLU 86 N -2.71 0.00 -0.30 1.43 1.02 -0.38 -4.55 120.64 115.14 1z8m n GLU 86 Ca -0.02 0.14 0.01 0.00 -0.02 0.00 0.00 57.16 57.27 1z8m n GLU 86 Cb 0.60 -0.54 0.14 0.00 -0.02 0.00 0.00 31.44 31.62 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 0.80 -1.81 -4.62 3.38 -1.26 -3.47 115.31 108.33 1z8m h LEU 87 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1z8m h LEU 87 Cb 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1z8m h LEU 87 CO 0.00 0.51 0.00 0.49 0.09 0.00 0.00 178.44 179.53