#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 -1.06 -4.68 3.17 4.77 -1.26 -4.81 117.00 113.13 1z8m n LEU 2 Ca 0.00 2.46 -0.36 0.00 -0.03 0.00 0.00 56.01 58.08 1z8m n LEU 2 Cb 0.00 -3.29 0.08 0.00 -2.33 0.00 0.00 43.42 37.88 1z8m n LEU 2 CO 0.00 -2.27 0.75 1.17 -1.33 0.00 0.00 177.39 175.71 1z8m n LYS 3 N -4.40 0.82 -4.40 3.23 0.00 -1.26 -4.67 118.16 107.47 1z8m n LYS 3 Ca -0.09 0.34 -0.30 0.00 0.00 0.00 0.00 58.31 58.26 1z8m n LYS 3 Cb 0.70 -2.40 -0.12 0.00 0.00 0.00 0.00 35.03 33.22 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 -3.93 2.65 0.00 3.14 2.96 -1.22 0.12 118.68 122.40 1z8m s LEU 4 Ca 0.79 -0.54 0.07 0.00 -0.22 0.00 0.00 54.13 54.22 1z8m s LEU 4 Cb -0.37 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 1z8m s LEU 4 CO 0.45 0.20 0.28 -3.20 -1.32 0.00 0.00 176.35 172.76 1z8m n ASN 5 N 1.00 -0.72 -3.84 3.68 5.15 -0.33 -4.90 115.26 115.30 1z8m n ASN 5 Ca -0.16 -3.03 -0.12 0.00 -0.60 0.00 0.00 54.58 50.67 1z8m n ASN 5 Cb 0.53 1.64 -0.11 0.00 -0.53 0.00 0.00 39.78 41.30 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 1.44 0.00 1.20 1.02 -1.26 -1.57 118.68 119.51 1z8m s LEU 6 Ca 0.37 0.13 0.02 0.00 0.02 0.00 0.00 54.13 54.67 1z8m s LEU 6 Cb 0.02 0.61 0.02 0.00 0.02 0.00 0.00 46.19 46.85 1z8m s LEU 6 CO 0.26 -0.17 0.17 0.29 0.02 0.00 0.00 176.35 176.91 1z8m n LYS 7 N 2.42 0.91 0.11 1.70 4.76 -0.94 -4.89 118.16 122.23 1z8m n LYS 7 Ca -0.16 -2.93 -0.03 0.00 -2.87 0.00 0.00 58.31 52.32 1z8m n LYS 7 Cb 0.58 0.56 0.17 0.00 -1.84 0.00 0.00 35.03 34.49 1z8m n LYS 7 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1z8m h LYS 8 N 0.00 0.13 -0.09 1.97 3.64 -1.90 -1.49 116.57 118.83 1z8m h LYS 8 Ca -0.32 -0.08 -0.15 0.00 -1.27 0.00 0.00 60.65 58.83 1z8m h LYS 8 Cb 1.05 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.87 1z8m h LYS 8 CO 0.51 0.67 -0.60 1.03 -2.27 0.00 0.00 179.45 178.79 1z8m h SER 9 N 0.10 0.35 0.84 4.20 0.87 -1.93 -3.09 113.55 114.89 1z8m h SER 9 Ca -0.00 -0.20 -0.24 0.00 -1.23 0.00 0.00 61.79 60.12 1z8m h SER 9 Cb 1.04 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.88 1z8m h SER 9 CO 0.08 0.87 -1.11 0.15 -0.53 0.00 0.00 176.83 176.29 1z8m h PHE 10 N 0.23 0.21 -0.87 2.24 3.57 -0.53 -2.61 116.94 119.19 1z8m h PHE 10 Ca -0.00 -0.15 0.01 0.00 3.53 0.00 0.00 57.97 61.35 1z8m h PHE 10 Cb 1.11 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.80 1z8m h PHE 10 CO 0.03 1.12 0.57 1.96 -2.23 0.00 0.00 178.31 179.76 1z8m h GLN 11 N 0.03 1.13 0.00 1.11 4.20 -1.22 0.67 115.11 121.03 1z8m h GLN 11 Ca -0.06 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.51 1z8m h GLN 11 Cb 1.86 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 29.37 1z8m h GLN 11 CO 0.16 0.75 -0.84 1.57 -0.67 0.00 0.00 178.83 179.80 1z8m h LYS 12 N 1.17 0.00 0.00 1.46 2.10 -1.60 -3.22 116.57 116.48 1z8m h LYS 12 Ca 0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.97 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 -0.07 0.18 -0.56 -0.25 -2.00 0.00 0.00 179.45 176.76 1z8m n ASP 13 N -2.92 0.55 -0.02 7.07 8.00 -0.83 -1.12 116.55 127.28 1z8m n ASP 13 Ca -0.02 -0.28 -0.01 0.00 0.71 0.00 0.00 54.79 55.19 1z8m n ASP 13 Cb 0.67 0.31 -0.00 0.00 -0.02 0.00 0.00 41.12 42.08 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 -1.55 0.23 -0.02 1.24 7.35 0.23 -4.11 117.46 120.83 1z8m n PHE 14 Ca 0.05 0.10 -0.10 0.00 -0.76 0.00 0.00 57.45 56.74 1z8m n PHE 14 Cb 0.34 -0.37 -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 -3.47 -0.76 0.00 0.00 176.76 172.53 1z8m n ASP 15 N -2.86 0.99 0.13 -2.13 2.03 -1.22 -3.76 116.55 109.74 1z8m n ASP 15 Ca -0.02 0.35 0.01 0.00 0.52 0.00 0.00 54.79 55.65 1z8m n ASP 15 Cb 0.07 -0.10 0.07 0.00 -0.72 0.00 0.00 41.12 40.44 1z8m n ASP 15 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1z8m h LYS 16 N 0.01 0.00 -0.00 -0.67 1.57 -1.62 -3.18 116.57 112.67 1z8m h LYS 16 Ca -0.33 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.28 1z8m h LYS 16 Cb 2.03 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.33 1z8m h LYS 16 CO 0.08 0.58 -0.81 1.25 -0.57 0.00 0.00 179.45 179.98 1z8m h LEU 17 N 0.00 0.12 -0.75 2.94 6.46 -1.27 -3.20 115.31 119.62 1z8m h LEU 17 Ca -0.01 -0.10 0.08 0.00 -0.12 0.00 0.00 57.88 57.74 1z8m h LEU 17 Cb 1.35 -0.04 -0.07 0.00 -0.73 0.00 0.00 40.66 41.17 1z8m h LEU 17 CO 0.08 0.88 0.41 -0.07 -0.62 0.00 0.00 178.44 179.12 1z8m h LEU 18 N 0.06 0.59 -1.85 2.25 4.07 -1.64 0.19 115.31 118.98 1z8m h LEU 18 Ca -0.02 0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.98 1z8m h LEU 18 Cb 1.41 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 43.08 1z8m h LEU 18 CO 0.11 0.35 0.00 0.00 -1.08 0.00 0.00 178.44 177.83 1z8m n LEU 19 N -4.78 2.73 -1.43 1.67 -0.00 -1.22 -2.94 117.00 111.03 1z8m n LEU 19 Ca 0.11 -1.37 -0.11 0.00 -0.00 0.00 0.00 56.01 54.64 1z8m n LEU 19 Cb 0.24 -0.43 0.15 0.00 -0.00 0.00 0.00 43.42 43.38 1z8m n LEU 19 CO 0.27 0.47 0.63 -3.20 -0.00 0.00 0.00 177.39 175.57 1z8m n ASN 20 N 0.46 3.43 0.00 1.45 2.85 0.05 -4.87 115.26 118.64 1z8m n ASN 20 Ca 0.13 -3.80 0.00 0.00 -0.11 0.00 0.00 54.58 50.81 1z8m n ASN 20 Cb 0.53 -0.60 0.00 0.00 1.24 0.00 0.00 39.78 40.95 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 -1.02 1.01 3.52 8.20 0.00 -1.25 -5.02 105.19 110.62 1z8m n GLY 21 Ca 0.38 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 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 2.60 -0.65 1.61 2.19 -1.15 -5.07 117.98 115.51 1z8m s PHE 22 Ca 0.00 -0.23 -0.20 0.00 0.33 0.00 0.00 56.93 56.83 1z8m s PHE 22 Cb 0.00 -1.38 0.10 0.00 -1.31 0.00 0.00 43.02 40.43 1z8m s PHE 22 CO 0.00 0.39 0.82 0.34 1.83 0.00 0.00 175.22 178.60 1z8m s ASP 23 N -2.12 6.24 0.53 6.13 -1.08 -1.26 -4.64 116.67 120.46 1z8m s ASP 23 Ca 0.19 -1.41 0.26 0.00 -0.52 0.00 0.00 52.55 51.07 1z8m s ASP 23 Cb -0.11 -2.34 1.40 0.00 -1.46 0.00 0.00 42.92 40.41 1z8m s ASP 23 CO 0.11 -1.19 1.97 -2.24 0.52 0.00 0.00 175.17 174.35 1z8m h ASP 24 N 9.22 0.02 -0.07 -0.34 3.04 -1.96 0.11 116.42 126.44 1z8m h ASP 24 Ca -0.24 0.00 0.02 0.00 -3.24 0.00 0.00 57.03 53.57 1z8m h ASP 24 Cb 1.07 -0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.36 1z8m h ASP 24 CO 1.11 0.01 0.07 0.28 -2.04 0.00 0.00 179.24 178.68 1z8m h SER 25 N 0.02 0.00 0.40 4.15 0.02 -2.00 -1.83 113.55 114.31 1z8m h SER 25 Ca 0.29 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.92 1z8m h SER 25 Cb 1.12 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.66 1z8m h SER 25 CO -0.01 0.00 -1.58 0.58 -1.14 0.00 0.00 176.83 174.68 1z8m h VAL 26 N 0.00 1.10 -0.77 2.27 2.07 -1.19 -3.33 116.25 116.40 1z8m h VAL 26 Ca 0.03 -2.74 0.11 0.00 0.82 0.00 0.00 66.70 64.93 1z8m h VAL 26 Cb 0.18 2.75 -0.05 0.00 -1.52 0.00 0.00 31.29 32.65 1z8m h VAL 26 CO -0.00 0.82 0.51 0.17 0.02 0.00 0.00 177.57 179.09 1z8m h LEU 27 N 0.07 0.56 0.14 2.57 8.10 -1.28 -2.92 115.31 122.55 1z8m h LEU 27 Ca -0.26 0.02 -0.00 0.00 0.11 0.00 0.00 57.88 57.75 1z8m h LEU 27 Cb 2.03 -0.10 -0.01 0.00 -0.44 0.00 0.00 40.66 42.14 1z8m h LEU 27 CO 0.16 0.32 -0.20 -1.13 -4.11 0.00 0.00 178.44 173.48 1z8m h ASN 28 N 0.62 -0.58 -1.12 0.17 -0.73 -1.63 -0.05 115.58 112.25 1z8m h ASN 28 Ca 0.37 0.05 0.33 0.00 1.87 0.00 0.00 56.30 58.91 1z8m h ASN 28 Cb 0.58 0.20 -0.04 0.00 0.27 0.00 0.00 38.32 39.33 1z8m h ASN 28 CO -0.14 -0.25 0.90 -0.33 -0.37 0.00 0.00 177.43 177.25 1z8m h GLU 29 N -0.36 0.00 0.01 6.67 5.08 -1.69 0.38 114.58 124.66 1z8m h GLU 29 Ca -0.02 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1z8m h GLU 29 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1z8m h GLU 29 CO -0.06 0.00 -0.00 0.28 -1.00 0.00 0.00 179.01 178.22 1z8m h VAL 30 N 0.00 0.00 -0.18 3.13 2.07 -1.21 -3.18 116.25 116.88 1z8m h VAL 30 Ca 0.53 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 68.07 1z8m h VAL 30 Cb 2.33 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 1z8m h VAL 30 CO -0.01 0.00 0.24 0.40 0.02 0.00 0.00 177.57 178.22 1z8m h ILE 31 N -0.04 0.35 0.00 4.57 5.03 -0.57 0.25 117.51 127.09 1z8m h ILE 31 Ca -0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.72 1z8m h ILE 31 Cb 0.01 0.80 -0.00 0.00 -3.03 0.00 0.00 36.82 34.60 1z8m h ILE 31 CO 0.00 0.00 -0.07 0.25 -0.68 0.00 0.00 178.15 177.66 1z8m h LEU 32 N 0.00 0.00 0.05 1.44 6.46 -0.36 0.23 115.31 123.13 1z8m h LEU 32 Ca 0.08 0.00 -0.32 0.00 -0.12 0.00 0.00 57.88 57.53 1z8m h LEU 32 Cb 0.56 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.46 1z8m h LEU 32 CO -0.00 0.07 -1.80 0.74 -0.62 0.00 0.00 178.44 176.83 1z8m h THR 33 N 0.00 0.78 0.00 1.05 2.02 -0.49 -3.30 112.91 112.98 1z8m h THR 33 Ca -0.00 -2.59 -0.18 0.00 0.77 0.00 0.00 66.41 64.41 1z8m h THR 33 Cb 0.61 2.46 -0.03 0.00 -1.74 0.00 0.00 68.15 69.45 1z8m h THR 33 CO 0.01 0.64 -1.45 0.18 0.37 0.00 0.00 175.52 175.26 1z8m n LEU 34 N -3.21 0.86 -1.85 2.58 4.77 -1.09 -3.37 117.00 115.70 1z8m n LEU 34 Ca -0.22 0.38 0.06 0.00 -0.03 0.00 0.00 56.01 56.20 1z8m n LEU 34 Cb 1.05 0.09 0.38 0.00 -2.33 0.00 0.00 43.42 42.61 1z8m n LEU 34 CO 0.44 0.18 0.86 0.54 -1.33 0.00 0.00 177.39 178.08 1z8m n ARG 35 N -2.91 4.68 0.00 3.23 1.74 0.81 -4.43 116.66 119.79 1z8m n ARG 35 Ca -0.11 -3.02 -0.03 0.00 -0.77 0.00 0.00 57.85 53.92 1z8m n ARG 35 Cb 0.87 -2.24 -0.01 0.00 -1.02 0.00 0.00 32.46 30.06 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 0.55 0.10 0.00 5.56 5.02 -1.24 -4.96 118.16 123.18 1z8m n LYS 36 Ca 0.28 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.61 1z8m n LYS 36 Cb 1.18 -0.67 0.00 0.00 -0.02 0.00 0.00 35.03 35.52 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 -3.47 0.00 -1.80 1.97 -0.00 -1.26 -4.95 118.16 108.66 1z8m n LYS 37 Ca -0.06 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.82 1z8m n LYS 37 Cb 0.30 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.30 1z8m n LYS 37 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1z8m s GLU 38 N 0.00 3.29 0.95 -1.58 2.56 -1.22 -3.77 118.70 118.93 1z8m s GLU 38 Ca 0.00 1.79 -0.12 0.00 0.00 0.00 0.00 54.97 56.64 1z8m s GLU 38 Cb 0.00 -4.28 0.16 0.00 2.00 0.00 0.00 34.13 32.01 1z8m s GLU 38 CO 0.00 -1.92 1.09 -1.25 -0.56 0.00 0.00 175.26 172.62 1z8m s PRO 39 N 5.91 0.85 -0.23 4.30 0.04 -1.26 -4.51 135.00 140.10 1z8m s PRO 39 Ca 0.90 0.71 -0.16 0.00 0.04 0.00 0.00 61.00 62.49 1z8m s PRO 39 Cb -0.29 -1.77 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 1z8m s PRO 39 CO 0.34 -2.49 0.40 -0.51 0.04 0.00 0.00 177.00 174.78 1z8m s LEU 40 N -6.35 4.11 0.72 -3.56 1.43 -1.26 -5.05 118.68 108.72 1z8m s LEU 40 Ca 0.64 0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 54.05 1z8m s LEU 40 Cb -0.18 -2.49 0.03 0.00 0.03 0.00 0.00 46.19 43.58 1z8m s LEU 40 CO 0.57 -0.12 1.12 -1.81 0.23 0.00 0.00 176.35 176.34 1z8m s ASP 41 N 1.26 4.64 0.00 2.29 1.01 -1.26 -4.91 116.67 119.70 1z8m s ASP 41 Ca 0.18 2.00 0.15 0.00 0.71 0.00 0.00 52.55 55.59 1z8m s ASP 41 Cb -0.15 -2.55 0.68 0.00 1.01 0.00 0.00 42.92 41.91 1z8m s ASP 41 CO 0.08 -1.95 1.47 -0.81 0.21 0.00 0.00 175.17 174.18 1z8m n PRO 42 N -2.94 0.06 -0.23 8.23 -0.04 -1.26 -2.47 135.00 136.36 1z8m n PRO 42 Ca 0.10 0.21 0.05 0.00 -0.04 0.00 0.00 63.50 63.83 1z8m n PRO 42 Cb 0.52 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.64 1z8m n PRO 42 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1z8m n GLN 43 N -1.44 2.03 -0.57 0.54 1.13 -1.26 -3.83 117.38 113.98 1z8m n GLN 43 Ca 0.05 -1.32 0.09 0.00 -1.94 0.00 0.00 57.00 53.88 1z8m n GLN 43 Cb 0.16 -1.39 0.34 0.00 0.11 0.00 0.00 30.24 29.46 1z8m n GLN 43 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1z8m n PHE 44 N 0.49 1.39 -3.25 1.08 3.01 -1.03 -4.93 117.46 114.22 1z8m n PHE 44 Ca 0.12 -0.56 -0.23 0.00 1.01 0.00 0.00 57.45 57.78 1z8m n PHE 44 Cb 0.38 -0.21 0.03 0.00 -0.01 0.00 0.00 39.48 39.67 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 1.16 -4.75 -2.66 -1.08 1.13 -1.25 -2.53 117.38 107.40 1z8m n GLN 45 Ca 0.25 0.74 -0.42 0.00 -1.94 0.00 0.00 57.00 55.63 1z8m n GLN 45 Cb 0.83 -5.58 -0.03 0.00 0.11 0.00 0.00 30.24 25.58 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 -2.81 6.52 0.30 1.08 -4.77 -1.26 -4.61 116.67 111.11 1z8m s ASP 46 Ca 0.39 -1.57 0.06 0.00 -3.30 0.00 0.00 52.55 48.14 1z8m s ASP 46 Cb -0.19 -2.52 -0.02 0.00 -1.09 0.00 0.00 42.92 39.10 1z8m s ASP 46 CO 0.48 -1.40 0.23 1.41 0.70 0.00 0.00 175.17 176.58 1z8m n HIS 47 N 8.29 -0.57 -2.90 2.11 8.25 -1.11 -4.91 115.22 124.38 1z8m n HIS 47 Ca 0.29 -2.40 -0.38 0.00 -0.26 0.00 0.00 57.72 54.97 1z8m n HIS 47 Cb 0.50 0.21 -0.06 0.00 1.12 0.00 0.00 29.99 31.77 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 -3.14 3.35 0.84 -1.41 0.00 -1.26 -0.42 121.76 119.73 1z8m s ALA 48 Ca 0.32 0.43 -0.03 0.00 0.00 0.00 0.00 51.96 52.68 1z8m s ALA 48 Cb 0.02 -3.05 0.05 0.00 0.00 0.00 0.00 23.12 20.13 1z8m s ALA 48 CO 0.23 0.25 0.28 1.28 0.00 0.00 0.00 175.76 177.80 1z8m n LEU 49 N 1.13 0.00 -4.60 0.00 4.77 -1.12 -4.90 117.00 112.27 1z8m n LEU 49 Ca -0.02 -0.38 -0.24 0.00 -0.03 0.00 0.00 56.01 55.34 1z8m n LEU 49 Cb 0.49 -0.21 -0.09 0.00 -2.33 0.00 0.00 43.42 41.28 1z8m n LEU 49 CO 0.46 -0.69 -0.35 -0.54 -1.33 0.00 0.00 177.39 174.95 1z8m s LYS 50 N -3.48 2.02 5.10 3.23 -0.14 -1.26 -4.04 119.74 121.19 1z8m s LYS 50 Ca 0.17 -1.71 0.00 0.00 -1.36 0.00 0.00 55.97 53.07 1z8m s LYS 50 Cb -0.01 -1.92 0.00 0.00 -1.68 0.00 0.00 37.83 34.22 1z8m s LYS 50 CO 0.12 0.21 0.00 0.41 -0.76 0.00 0.00 175.35 175.33 1z8m n GLY 51 N -0.87 0.78 0.24 -3.33 0.00 -1.26 -3.12 105.19 97.64 1z8m n GLY 51 Ca -0.05 -0.75 0.17 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.03 1.61 1.79 -2.04 -2.63 116.57 114.27 1z8m h LYS 52 Ca 0.00 0.00 -0.45 0.00 -2.18 0.00 0.00 60.65 58.02 1z8m h LYS 52 Cb 0.00 0.00 -0.25 0.00 -1.58 0.00 0.00 32.23 30.40 1z8m h LYS 52 CO 0.00 0.00 0.58 0.91 -1.08 0.00 0.00 179.45 179.86 1z8m n TRP 53 N -2.81 2.56 -0.06 -1.35 8.01 -1.18 -4.45 117.44 118.15 1z8m n TRP 53 Ca 0.00 -1.82 -0.12 0.00 -1.31 0.00 0.00 57.50 54.25 1z8m n TRP 53 Cb 0.22 -0.92 -0.11 0.00 -2.01 0.00 0.00 31.31 28.49 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 1.02 -0.00 0.00 -0.99 1.57 -1.60 -2.97 116.57 113.59 1z8m h LYS 54 Ca 0.52 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.30 1z8m h LYS 54 Cb 2.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.53 1z8m h LYS 54 CO 0.99 0.84 0.00 -2.30 -0.57 0.00 0.00 179.45 178.41 1z8m n PRO 55 N -4.64 0.06 -3.44 3.15 -0.02 -1.26 -4.55 135.00 124.29 1z8m n PRO 55 Ca -0.09 0.46 -0.21 0.00 -2.02 0.00 0.00 63.50 61.65 1z8m n PRO 55 Cb 0.41 -1.66 -0.01 0.00 -0.02 0.00 0.00 33.50 32.21 1z8m n PRO 55 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1z8m s PHE 56 N -3.18 2.47 0.15 6.00 0.08 -1.24 -4.97 117.98 117.30 1z8m s PHE 56 Ca 0.02 -0.54 0.08 0.00 0.12 0.00 0.00 56.93 56.61 1z8m s PHE 56 Cb 0.05 -2.19 -0.04 0.00 -0.57 0.00 0.00 43.02 40.27 1z8m s PHE 56 CO 0.16 -0.33 -0.18 0.50 -0.10 0.00 0.00 175.22 175.28 1z8m s ARG 57 N -4.25 1.21 0.31 0.44 3.52 -0.94 -3.76 118.95 115.48 1z8m s ARG 57 Ca 0.49 -1.34 0.10 0.00 -0.13 0.00 0.00 55.73 54.85 1z8m s ARG 57 Cb -0.05 -1.27 -0.05 0.00 -1.56 0.00 0.00 34.95 32.02 1z8m s ARG 57 CO 0.29 0.26 -0.09 -2.00 -0.81 0.00 0.00 175.30 172.95 1z8m s GLU 58 N -2.64 1.92 -0.08 5.12 2.12 0.44 -1.89 118.70 123.69 1z8m s GLU 58 Ca 0.13 -1.74 -0.15 0.00 0.36 0.00 0.00 54.97 53.57 1z8m s GLU 58 Cb -0.06 -1.87 0.03 0.00 0.26 0.00 0.00 34.13 32.50 1z8m s GLU 58 CO 0.06 0.25 0.36 0.00 -0.54 0.00 0.00 175.26 175.39 1z8m s HIS 60 N -0.61 3.40 0.55 0.00 3.76 -1.05 -0.60 115.29 120.74 1z8m s HIS 60 Ca -0.07 -3.05 0.21 0.00 -0.15 0.00 0.00 55.06 52.00 1z8m s HIS 60 Cb -0.04 -2.97 1.47 0.00 1.11 0.00 0.00 32.58 32.15 1z8m s HIS 60 CO 0.03 -0.74 2.19 0.82 -0.85 0.00 0.00 174.74 176.19 1z8m h ILE 61 N 5.05 0.83 -2.96 0.60 5.03 -1.86 -3.45 117.51 120.74 1z8m h ILE 61 Ca 0.01 -0.00 0.07 0.00 -0.12 0.00 0.00 64.86 64.82 1z8m h ILE 61 Cb 0.88 1.00 -0.05 0.00 -3.03 0.00 0.00 36.82 35.61 1z8m h ILE 61 CO 0.72 0.00 0.24 -1.59 -0.68 0.00 0.00 178.15 176.85 1z8m s LYS 62 N -4.91 1.74 0.00 2.37 -2.85 -1.26 -5.02 119.74 109.81 1z8m s LYS 62 Ca -0.05 -0.95 0.05 0.00 -1.00 0.00 0.00 55.97 54.02 1z8m s LYS 62 Cb 0.16 0.60 0.32 0.00 -2.06 0.00 0.00 37.83 36.85 1z8m s LYS 62 CO 0.63 -0.80 0.73 -2.30 0.10 0.00 0.00 175.35 173.71 1z8m n PRO 63 N -0.46 0.40 -1.11 1.78 -0.02 -1.26 -2.37 135.00 131.96 1z8m n PRO 63 Ca -0.05 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.46 1z8m n PRO 63 Cb 0.59 -1.21 0.01 0.00 -0.02 0.00 0.00 33.50 32.88 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 -0.71 0.62 -3.63 2.55 2.03 -1.26 -4.90 116.55 111.26 1z8m n ASP 64 Ca 0.04 -2.01 -0.16 0.00 0.52 0.00 0.00 54.79 53.18 1z8m n ASP 64 Cb 0.02 -0.26 -0.07 0.00 -0.72 0.00 0.00 41.12 40.08 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 -0.02 0.02 -0.15 5.18 1.01 -1.00 -4.69 120.40 120.75 1z8m s VAL 65 Ca 0.21 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.96 1z8m s VAL 65 Cb 0.24 -0.83 0.07 0.00 0.00 0.00 0.00 36.38 35.86 1z8m s VAL 65 CO -0.10 -0.10 0.26 -0.76 0.00 0.00 0.00 175.10 174.40 1z8m s LEU 66 N -1.14 -0.29 -0.15 3.92 1.43 0.23 -3.83 118.68 118.85 1z8m s LEU 66 Ca -0.11 0.41 -0.04 0.00 -1.03 0.00 0.00 54.13 53.35 1z8m s LEU 66 Cb -0.02 0.67 -0.03 0.00 0.03 0.00 0.00 46.19 46.83 1z8m s LEU 66 CO 0.07 -0.26 -0.00 -0.22 0.23 0.00 0.00 176.35 176.17 1z8m s LEU 67 N 2.41 3.46 -0.27 1.79 1.98 0.23 -0.54 118.68 127.75 1z8m s LEU 67 Ca 0.03 -0.02 -0.08 0.00 -2.89 0.00 0.00 54.13 51.17 1z8m s LEU 67 Cb -0.13 -1.84 -0.02 0.00 0.66 0.00 0.00 46.19 44.86 1z8m s LEU 67 CO -0.10 0.21 0.10 -0.69 -1.89 0.00 0.00 176.35 173.98 1z8m s VAL 68 N 0.13 4.40 0.37 1.68 1.01 -0.08 -0.52 120.40 127.38 1z8m s VAL 68 Ca 0.01 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 61.79 1z8m s VAL 68 Cb -0.13 -3.12 -0.02 0.00 0.00 0.00 0.00 36.38 33.11 1z8m s VAL 68 CO 0.02 0.25 0.18 0.00 0.00 0.00 0.00 175.10 175.56 1z8m n TYR 69 N 4.94 -0.16 -4.49 5.22 0.18 -0.79 0.11 117.16 122.17 1z8m n TYR 69 Ca -0.15 -2.58 -0.23 0.00 1.88 0.00 0.00 57.90 56.81 1z8m n TYR 69 Cb 0.51 0.09 -0.11 0.00 -0.38 0.00 0.00 39.34 39.45 1z8m n TYR 69 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 1z8m s LEU 70 N 0.00 2.40 -0.33 -3.48 2.96 0.82 -2.21 118.68 118.83 1z8m s LEU 70 Ca 0.26 -1.35 0.04 0.00 -0.22 0.00 0.00 54.13 52.85 1z8m s LEU 70 Cb 0.01 -0.55 0.10 0.00 0.50 0.00 0.00 46.19 46.25 1z8m s LEU 70 CO 0.18 -0.53 0.05 -0.69 -1.32 0.00 0.00 176.35 174.03 1z8m s VAL 71 N -3.11 2.16 0.76 1.68 1.01 -1.26 -3.02 120.40 118.61 1z8m s VAL 71 Ca 0.35 -2.23 -0.11 0.00 0.00 0.00 0.00 61.98 59.99 1z8m s VAL 71 Cb 0.08 -2.58 0.05 0.00 0.00 0.00 0.00 36.38 33.93 1z8m s VAL 71 CO 0.16 -0.58 1.09 -0.54 0.00 0.00 0.00 175.10 175.23 1z8m s LYS 72 N 0.97 2.41 0.41 2.72 3.01 0.30 -4.90 119.74 124.66 1z8m s LYS 72 Ca 0.10 0.68 0.26 0.00 -1.01 0.00 0.00 55.97 56.00 1z8m s LYS 72 Cb -0.19 -1.95 1.33 0.00 -1.01 0.00 0.00 37.83 36.01 1z8m s LYS 72 CO -0.09 -1.40 1.64 -0.44 0.51 0.00 0.00 175.35 175.57 1z8m h ASP 73 N -0.93 0.31 0.00 2.83 5.19 -2.03 -3.04 116.42 118.76 1z8m h ASP 73 Ca -0.46 0.15 -0.08 0.00 -0.62 0.00 0.00 57.03 56.02 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 0.59 -0.16 -0.35 -0.90 -3.12 0.00 0.00 179.24 175.30 1z8m n ASP 74 N -4.78 -0.23 -3.71 6.45 5.68 -1.26 -5.13 116.55 113.56 1z8m n ASP 74 Ca 0.35 -1.69 -0.11 0.00 -0.50 0.00 0.00 54.79 52.83 1z8m n ASP 74 Cb 1.29 0.05 -0.05 0.00 -1.14 0.00 0.00 41.12 41.26 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 1.67 0.03 0.11 2.02 -1.15 -4.39 118.70 116.99 1z8m s GLU 75 Ca 0.06 -1.49 0.05 0.00 0.02 0.00 0.00 54.97 53.61 1z8m s GLU 75 Cb 0.06 0.44 -0.02 0.00 0.10 0.00 0.00 34.13 34.72 1z8m s GLU 75 CO -0.03 -0.68 -0.16 -1.17 0.02 0.00 0.00 175.26 173.24 1z8m s LEU 76 N -3.12 2.15 -0.04 1.80 2.96 0.32 0.11 118.68 122.86 1z8m s LEU 76 Ca 0.27 -0.44 0.02 0.00 -0.22 0.00 0.00 54.13 53.76 1z8m s LEU 76 Cb 0.00 -0.72 0.01 0.00 0.50 0.00 0.00 46.19 45.99 1z8m s LEU 76 CO 0.14 0.09 -0.08 0.27 -1.32 0.00 0.00 176.35 175.44 1z8m s ILE 77 N -0.76 0.76 -0.10 6.68 -5.25 -1.17 -1.18 121.20 120.19 1z8m s ILE 77 Ca 0.04 -0.29 -0.29 0.00 -0.99 0.00 0.00 60.65 59.12 1z8m s ILE 77 Cb -0.08 -0.72 -0.01 0.00 2.95 0.00 0.00 42.46 44.60 1z8m s ILE 77 CO 0.01 0.26 0.98 -0.76 -1.79 0.00 0.00 174.94 173.64 1z8m s LEU 78 N 0.59 4.26 -0.08 0.37 1.43 -0.61 -0.13 118.68 124.51 1z8m s LEU 78 Ca -0.09 1.50 -0.04 0.00 -1.03 0.00 0.00 54.13 54.46 1z8m s LEU 78 Cb -0.13 -3.51 -0.01 0.00 0.03 0.00 0.00 46.19 42.57 1z8m s LEU 78 CO 0.01 -0.41 -0.08 0.25 0.23 0.00 0.00 176.35 176.35 1z8m h LEU 79 N 7.87 0.00 -7.95 1.79 5.85 0.50 -2.50 115.31 120.87 1z8m h LEU 79 Ca -0.32 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.46 1z8m h LEU 79 Cb 1.16 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.13 1z8m h LEU 79 CO 0.84 0.43 0.21 0.00 -0.34 0.00 0.00 178.44 179.58 1z8m s ARG 80 N -1.66 1.75 -0.01 1.25 3.03 -0.44 -0.29 118.95 122.57 1z8m s ARG 80 Ca -0.07 -0.97 0.08 0.00 2.03 0.00 0.00 55.73 56.80 1z8m s ARG 80 Cb 0.01 0.60 -0.02 0.00 -1.03 0.00 0.00 34.95 34.51 1z8m s ARG 80 CO 0.10 -0.80 -0.26 -1.17 -1.13 0.00 0.00 175.30 172.05 1z8m s LEU 81 N -2.91 2.10 0.00 -1.89 1.98 -1.26 -0.91 118.68 115.79 1z8m s LEU 81 Ca 0.11 -0.49 0.00 0.00 -2.89 0.00 0.00 54.13 50.86 1z8m s LEU 81 Cb -0.05 -1.34 0.00 0.00 0.66 0.00 0.00 46.19 45.46 1z8m s LEU 81 CO 0.06 0.31 0.00 0.61 -1.89 0.00 0.00 176.35 175.44 1z8m n GLY 82 N 2.27 2.74 1.94 7.98 0.00 0.30 -4.88 105.19 115.55 1z8m n GLY 82 Ca -0.16 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 44.78 1z8m n GLY 82 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1z8m n SER 83 N -0.74 -0.83 0.18 1.61 7.64 -1.26 -0.60 113.62 119.62 1z8m n SER 83 Ca 0.00 -2.06 0.03 0.00 1.01 0.00 0.00 58.87 57.85 1z8m n SER 83 Cb 0.00 1.53 0.34 0.00 -1.01 0.00 0.00 64.21 65.07 1z8m n SER 83 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 1z8m h HIS 84 N 1.58 0.00 0.00 1.43 2.76 -1.90 -1.36 115.15 117.66 1z8m h HIS 84 Ca -0.16 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 57.90 1z8m h HIS 84 Cb 0.68 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.62 1z8m h HIS 84 CO 0.00 0.40 -1.26 0.43 -1.30 0.00 0.00 177.93 176.21 1z8m n SER 85 N -3.98 0.87 0.00 3.26 7.64 -1.26 -2.94 113.62 117.20 1z8m n SER 85 Ca -0.02 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.23 1z8m n SER 85 Cb 0.44 0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.89 1z8m n SER 85 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1z8m n GLU 86 N -2.82 0.00 -0.14 1.43 0.00 -1.10 -4.57 120.64 113.45 1z8m n GLU 86 Ca -0.06 0.22 -0.12 0.00 0.00 0.00 0.00 57.16 57.21 1z8m n GLU 86 Cb 0.73 -0.68 -0.02 0.00 0.00 0.00 0.00 31.44 31.48 1z8m n GLU 86 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 1z8m h LEU 87 N 0.00 0.90 -1.74 4.31 3.38 -1.50 -3.47 115.31 117.19 1z8m h LEU 87 Ca 0.00 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1z8m h LEU 87 Cb 0.00 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.50 1z8m h LEU 87 CO 0.00 1.10 0.00 0.49 0.09 0.00 0.00 178.44 180.12