#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 0.00 -4.82 -0.89 4.77 -1.26 -4.86 117.00 109.94 1z8m n LEU 2 Ca 0.00 1.39 -0.29 0.00 -0.03 0.00 0.00 56.01 57.08 1z8m n LEU 2 Cb 0.00 -3.91 -0.06 0.00 -2.33 0.00 0.00 43.42 37.12 1z8m n LEU 2 CO 0.00 -2.67 -0.22 -0.75 -1.33 0.00 0.00 177.39 172.41 1z8m s LYS 3 N -2.01 3.01 0.02 3.23 2.36 -1.26 -4.88 119.74 120.21 1z8m s LYS 3 Ca 0.00 -0.69 0.08 0.00 -2.55 0.00 0.00 55.97 52.81 1z8m s LYS 3 Cb 0.00 -2.77 -0.03 0.00 -1.05 0.00 0.00 37.83 33.98 1z8m s LYS 3 CO 0.00 0.55 -0.22 -1.17 1.55 0.00 0.00 175.35 176.06 1z8m s LEU 4 N -2.64 2.38 0.33 5.43 2.96 -1.18 0.49 118.68 126.44 1z8m s LEU 4 Ca 0.31 -0.46 0.03 0.00 -0.22 0.00 0.00 54.13 53.79 1z8m s LEU 4 Cb -0.12 -1.41 -0.05 0.00 0.50 0.00 0.00 46.19 45.11 1z8m s LEU 4 CO 0.24 0.28 0.08 0.21 -1.32 0.00 0.00 176.35 175.84 1z8m s ASN 5 N -1.14 2.17 -0.13 3.68 2.47 -0.94 -4.91 114.94 116.14 1z8m s ASN 5 Ca 0.12 -1.44 -0.02 0.00 0.42 0.00 0.00 52.86 51.94 1z8m s ASN 5 Cb -0.10 0.10 0.04 0.00 -1.45 0.00 0.00 41.25 39.84 1z8m s ASN 5 CO 0.02 -0.71 0.02 -0.76 -3.72 0.00 0.00 177.10 171.96 1z8m s LEU 6 N -3.47 0.80 0.75 3.21 1.02 -1.26 -1.75 118.68 117.97 1z8m s LEU 6 Ca 0.34 -0.41 -0.09 0.00 0.02 0.00 0.00 54.13 53.99 1z8m s LEU 6 Cb 0.07 -0.48 0.07 0.00 0.02 0.00 0.00 46.19 45.86 1z8m s LEU 6 CO 0.15 -0.25 1.09 -0.54 0.02 0.00 0.00 176.35 176.81 1z8m s LYS 7 N 1.94 2.15 0.49 1.70 -0.14 -1.02 -4.89 119.74 119.97 1z8m s LYS 7 Ca 0.02 -0.06 0.14 0.00 -1.36 0.00 0.00 55.97 54.71 1z8m s LYS 7 Cb -0.14 -2.07 1.16 0.00 -1.68 0.00 0.00 37.83 35.10 1z8m s LYS 7 CO -0.07 -1.37 2.13 -0.22 -0.76 0.00 0.00 175.35 175.06 1z8m h LYS 8 N -0.79 0.14 -0.06 1.68 3.64 -1.91 -1.83 116.57 117.44 1z8m h LYS 8 Ca -0.45 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 58.84 1z8m h LYS 8 Cb 1.32 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 1z8m h LYS 8 CO 0.63 0.09 -0.28 0.77 -2.27 0.00 0.00 179.45 178.39 1z8m h SER 9 N 0.14 0.35 0.05 4.20 0.02 -1.93 -3.18 113.55 113.20 1z8m h SER 9 Ca 0.04 -0.65 -0.01 0.00 -0.84 0.00 0.00 61.79 60.33 1z8m h SER 9 Cb -0.01 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 1z8m h SER 9 CO -0.01 0.94 -0.05 0.15 -1.14 0.00 0.00 176.83 176.72 1z8m h PHE 10 N -0.23 0.00 0.33 3.45 3.57 -0.18 -0.34 116.94 123.54 1z8m h PHE 10 Ca -0.02 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 1z8m h PHE 10 Cb 0.93 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.67 1z8m h PHE 10 CO 0.13 0.05 -0.19 1.96 -2.23 0.00 0.00 178.31 178.04 1z8m h GLN 11 N 0.00 -0.47 0.00 1.11 4.20 -1.33 0.77 115.11 119.39 1z8m h GLN 11 Ca -0.00 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1z8m h GLN 11 Cb 0.09 0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1z8m h GLN 11 CO 0.01 -0.31 0.00 1.57 -0.67 0.00 0.00 178.83 179.42 1z8m h LYS 12 N -0.49 0.00 0.00 1.46 2.10 -1.52 -2.83 116.57 115.29 1z8m h LYS 12 Ca -0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 1z8m h LYS 12 Cb 0.40 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.73 1z8m h LYS 12 CO 0.04 0.00 -0.93 -0.25 -2.00 0.00 0.00 179.45 176.31 1z8m n ASP 13 N -2.57 0.75 -0.01 7.07 9.92 -0.16 0.48 116.55 132.02 1z8m n ASP 13 Ca 0.04 0.17 -0.01 0.00 -0.53 0.00 0.00 54.79 54.47 1z8m n ASP 13 Cb 0.43 0.47 -0.00 0.00 -0.64 0.00 0.00 41.12 41.38 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 -2.39 0.14 -0.02 1.24 7.35 0.27 -4.25 117.46 119.79 1z8m n PHE 14 Ca 0.01 0.06 -0.21 0.00 -0.76 0.00 0.00 57.45 56.55 1z8m n PHE 14 Cb 0.50 -0.31 -0.13 0.00 0.35 0.00 0.00 39.48 39.88 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 -2.66 2.08 0.23 -2.13 8.00 -1.08 -3.83 116.55 117.16 1z8m n ASP 15 Ca -0.01 0.23 0.11 0.00 0.71 0.00 0.00 54.79 55.82 1z8m n ASP 15 Cb 0.05 -0.86 0.53 0.00 -0.02 0.00 0.00 41.12 40.82 1z8m n ASP 15 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1z8m h LYS 16 N -0.10 0.00 -0.10 -1.24 1.63 -1.55 -2.68 116.57 112.54 1z8m h LYS 16 Ca -0.43 0.00 -0.18 0.00 -0.85 0.00 0.00 60.65 59.19 1z8m h LYS 16 Cb 1.92 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 33.55 1z8m h LYS 16 CO 0.03 0.20 -0.70 1.25 -3.45 0.00 0.00 179.45 176.77 1z8m h LEU 17 N 0.00 0.54 -0.69 5.20 5.85 -0.14 -2.83 115.31 123.23 1z8m h LEU 17 Ca -0.00 -0.34 0.04 0.00 0.84 0.00 0.00 57.88 58.41 1z8m h LEU 17 Cb 0.65 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 1z8m h LEU 17 CO 0.03 1.08 0.42 -0.07 -0.34 0.00 0.00 178.44 179.56 1z8m h LEU 18 N 0.32 0.68 0.00 2.25 4.07 -1.58 -0.13 115.31 120.92 1z8m h LEU 18 Ca -0.03 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.94 1z8m h LEU 18 Cb 1.28 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.88 1z8m h LEU 18 CO 0.12 0.46 0.00 0.18 -1.08 0.00 0.00 178.44 178.12 1z8m n LEU 19 N -4.70 0.00 -1.78 1.67 4.77 -1.20 -2.14 117.00 113.63 1z8m n LEU 19 Ca 0.08 0.23 -0.02 0.00 -0.03 0.00 0.00 56.01 56.28 1z8m n LEU 19 Cb 0.11 -0.23 0.29 0.00 -2.33 0.00 0.00 43.42 41.26 1z8m n LEU 19 CO 0.32 -0.00 0.89 -3.20 -1.33 0.00 0.00 177.39 174.06 1z8m n ASN 20 N -1.23 4.61 0.00 -1.43 4.05 -0.08 -4.82 115.26 116.35 1z8m n ASN 20 Ca 0.16 -2.94 0.00 0.00 0.45 0.00 0.00 54.58 52.24 1z8m n ASN 20 Cb 0.22 -0.69 0.00 0.00 1.23 0.00 0.00 39.78 40.53 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 0.13 1.15 3.45 8.20 0.00 -1.20 -5.03 105.19 111.88 1z8m n GLY 21 Ca 0.31 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 2.73 -0.27 1.61 2.19 -0.91 -5.03 117.98 116.29 1z8m s PHE 22 Ca 0.00 -0.28 -0.18 0.00 0.33 0.00 0.00 56.93 56.80 1z8m s PHE 22 Cb 0.00 -1.68 -0.03 0.00 -1.31 0.00 0.00 43.02 40.00 1z8m s PHE 22 CO 0.00 0.08 0.50 0.34 1.83 0.00 0.00 175.22 177.98 1z8m s ASP 23 N -0.46 6.41 0.60 6.13 -1.08 -1.26 -4.35 116.67 122.66 1z8m s ASP 23 Ca 0.06 0.47 0.39 0.00 -0.52 0.00 0.00 52.55 52.94 1z8m s ASP 23 Cb -0.12 -2.27 2.12 0.00 -1.46 0.00 0.00 42.92 41.18 1z8m s ASP 23 CO 0.02 -0.29 2.19 -2.24 0.52 0.00 0.00 175.17 175.36 1z8m h ASP 24 N 8.06 0.00 -0.69 -0.34 2.03 -1.97 -2.90 116.42 120.61 1z8m h ASP 24 Ca -0.29 0.00 0.15 0.00 -0.73 0.00 0.00 57.03 56.16 1z8m h ASP 24 Cb 1.14 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 39.51 1z8m h ASP 24 CO 0.71 0.00 -0.10 0.77 -1.03 0.00 0.00 179.24 179.60 1z8m h SER 25 N 0.00 -0.50 0.35 4.15 4.64 -2.00 0.62 113.55 120.80 1z8m h SER 25 Ca 0.00 0.19 -0.19 0.00 -0.47 0.00 0.00 61.79 61.32 1z8m h SER 25 Cb 0.08 0.38 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1z8m h SER 25 CO 0.00 -0.20 -0.81 0.58 -0.87 0.00 0.00 176.83 175.54 1z8m h VAL 26 N 0.04 1.41 -0.64 0.95 2.07 -1.95 -3.21 116.25 114.92 1z8m h VAL 26 Ca 0.35 -2.31 -0.07 0.00 0.82 0.00 0.00 66.70 65.49 1z8m h VAL 26 Cb 0.57 2.26 -0.03 0.00 -1.52 0.00 0.00 31.29 32.57 1z8m h VAL 26 CO -0.67 0.69 0.12 0.25 0.02 0.00 0.00 177.57 177.98 1z8m h LEU 27 N 0.22 0.98 -0.86 2.57 5.85 -1.04 -2.84 115.31 120.19 1z8m h LEU 27 Ca -0.04 -0.22 0.10 0.00 0.84 0.00 0.00 57.88 58.56 1z8m h LEU 27 Cb 1.40 -0.26 -0.08 0.00 0.37 0.00 0.00 40.66 42.10 1z8m h LEU 27 CO 0.13 0.97 0.50 -1.13 -0.34 0.00 0.00 178.44 178.57 1z8m h ASN 28 N 0.97 0.71 0.60 1.25 -0.73 0.12 0.22 115.58 118.73 1z8m h ASN 28 Ca 0.20 0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.42 1z8m h ASN 28 Cb 0.40 -0.09 0.00 0.00 0.27 0.00 0.00 38.32 38.90 1z8m h ASN 28 CO 0.01 0.39 0.00 -0.62 -0.37 0.00 0.00 177.43 176.84 1z8m n GLU 29 N -4.73 0.09 0.00 6.67 1.02 -1.08 -2.64 120.64 119.97 1z8m n GLU 29 Ca 0.15 0.34 0.00 0.00 -0.02 0.00 0.00 57.16 57.63 1z8m n GLU 29 Cb 0.30 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 1z8m n GLU 29 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1z8m n VAL 30 N -1.85 0.00 -0.35 2.62 0.31 0.71 -4.21 118.33 115.56 1z8m n VAL 30 Ca 0.03 0.45 0.16 0.00 -0.01 0.00 0.00 64.34 64.97 1z8m n VAL 30 Cb 0.20 -1.41 0.36 0.00 -0.91 0.00 0.00 33.84 32.08 1z8m n VAL 30 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1z8m h ILE 31 N 0.00 0.60 0.00 2.52 5.03 -1.50 0.49 117.51 124.65 1z8m h ILE 31 Ca 0.00 -0.22 0.00 0.00 -0.12 0.00 0.00 64.86 64.52 1z8m h ILE 31 Cb 0.00 -0.11 0.00 0.00 -3.03 0.00 0.00 36.82 33.68 1z8m h ILE 31 CO 0.00 0.12 0.00 0.00 -0.68 0.00 0.00 178.15 177.59 1z8m n LEU 32 N -4.84 0.57 -0.02 1.44 -0.00 -1.08 -0.54 117.00 112.52 1z8m n LEU 32 Ca 0.26 0.73 -0.09 0.00 -0.00 0.00 0.00 56.01 56.91 1z8m n LEU 32 Cb 0.68 -0.76 -0.14 0.00 -0.00 0.00 0.00 43.42 43.20 1z8m n LEU 32 CO 0.18 -0.85 -0.52 0.41 -0.00 0.00 0.00 177.39 176.61 1z8m n THR 33 N -2.23 1.62 -0.00 1.47 -1.04 0.17 -3.63 114.28 110.63 1z8m n THR 33 Ca -0.01 -0.79 -0.11 0.00 -2.04 0.00 0.00 64.05 61.11 1z8m n THR 33 Cb 0.08 -1.05 -0.14 0.00 -1.82 0.00 0.00 70.33 67.40 1z8m n THR 33 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1z8m h LEU 34 N 0.00 0.08 -2.72 -4.42 3.38 -1.13 -3.31 115.31 107.19 1z8m h LEU 34 Ca -0.28 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 1z8m h LEU 34 Cb 2.01 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.73 1z8m h LEU 34 CO 0.08 1.14 0.01 0.54 0.09 0.00 0.00 178.44 180.30 1z8m n ARG 35 N -3.16 3.57 -0.42 1.13 1.74 0.29 -3.96 116.66 115.86 1z8m n ARG 35 Ca -0.17 -2.10 0.07 0.00 -0.77 0.00 0.00 57.85 54.89 1z8m n ARG 35 Cb 1.04 -2.01 0.14 0.00 -1.02 0.00 0.00 32.46 30.61 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 0.40 1.17 -4.08 5.56 4.76 -1.24 -4.99 118.16 119.74 1z8m n LYS 36 Ca 0.19 -2.65 -0.29 0.00 -2.87 0.00 0.00 58.31 52.69 1z8m n LYS 36 Cb 0.89 -1.33 -0.03 0.00 -1.84 0.00 0.00 35.03 32.72 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 -1.03 -2.94 -3.98 1.97 2.85 -1.25 -4.90 118.16 108.87 1z8m n LYS 37 Ca 0.15 0.35 -0.31 0.00 -1.05 0.00 0.00 58.31 57.45 1z8m n LYS 37 Cb 0.70 -4.56 -0.15 0.00 -0.65 0.00 0.00 35.03 30.37 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 -6.77 1.82 0.25 -1.58 2.12 -1.25 -4.35 118.70 108.94 1z8m s GLU 38 Ca 0.21 -1.11 -0.30 0.00 0.36 0.00 0.00 54.97 54.13 1z8m s GLU 38 Cb -0.12 -2.69 -0.10 0.00 0.26 0.00 0.00 34.13 31.49 1z8m s GLU 38 CO 0.91 -0.59 1.39 -1.25 -0.54 0.00 0.00 175.26 175.19 1z8m s PRO 39 N 1.30 4.30 1.26 4.30 0.04 -1.26 -4.68 135.00 140.25 1z8m s PRO 39 Ca -0.07 2.24 -0.21 0.00 0.04 0.00 0.00 61.00 63.01 1z8m s PRO 39 Cb -0.19 -3.12 0.32 0.00 0.04 0.00 0.00 34.50 31.55 1z8m s PRO 39 CO -0.06 -0.35 0.88 1.28 0.04 0.00 0.00 177.00 178.79 1z8m n LEU 40 N 2.13 0.00 -4.53 -3.56 4.77 -1.26 -5.06 117.00 109.48 1z8m n LEU 40 Ca 0.05 -0.91 -0.24 0.00 -0.03 0.00 0.00 56.01 54.89 1z8m n LEU 40 Cb 0.41 -0.91 -0.09 0.00 -2.33 0.00 0.00 43.42 40.49 1z8m n LEU 40 CO 0.60 -2.46 -0.43 -1.81 -1.33 0.00 0.00 177.39 171.96 1z8m s ASP 41 N -3.50 3.86 0.49 -1.43 1.11 -1.26 -5.03 116.67 110.92 1z8m s ASP 41 Ca 0.63 -0.94 0.32 0.00 0.18 0.00 0.00 52.55 52.74 1z8m s ASP 41 Cb -0.09 -0.45 1.46 0.00 1.07 0.00 0.00 42.92 44.91 1z8m s ASP 41 CO 0.51 0.00 1.97 1.55 1.18 0.00 0.00 175.17 180.38 1z8m h PRO 42 N 2.14 0.00 0.00 8.23 0.13 -1.99 -2.30 132.00 138.21 1z8m h PRO 42 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1z8m h PRO 42 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1z8m h PRO 42 CO 0.61 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.38 1z8m n GLN 43 N -2.82 0.82 0.00 0.86 10.64 -1.26 -3.28 117.38 122.33 1z8m n GLN 43 Ca 0.00 0.00 0.14 0.00 -1.83 0.00 0.00 57.00 55.31 1z8m n GLN 43 Cb 0.22 -1.50 0.78 0.00 -0.86 0.00 0.00 30.24 28.89 1z8m n GLN 43 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 1z8m n PHE 44 N -1.08 0.00 -3.39 2.61 3.01 -0.87 -4.90 117.46 112.84 1z8m n PHE 44 Ca 0.21 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.48 1z8m n PHE 44 Cb 0.14 -0.15 0.07 0.00 -0.01 0.00 0.00 39.48 39.54 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 -1.15 -6.61 -2.87 -1.08 6.02 -1.21 -0.74 117.38 109.73 1z8m n GLN 45 Ca 0.17 0.74 -0.43 0.00 -0.01 0.00 0.00 57.00 57.47 1z8m n GLN 45 Cb 0.16 -5.48 -0.04 0.00 1.02 0.00 0.00 30.24 25.91 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 -3.61 6.18 0.32 1.08 -4.77 -1.26 -4.30 116.67 110.31 1z8m s ASP 46 Ca 0.33 -0.97 0.03 0.00 -3.30 0.00 0.00 52.55 48.64 1z8m s ASP 46 Cb -0.15 -2.41 -0.04 0.00 -1.09 0.00 0.00 42.92 39.23 1z8m s ASP 46 CO 0.64 -1.40 0.12 -1.00 0.70 0.00 0.00 175.17 174.23 1z8m s HIS 47 N 3.96 1.68 0.03 2.11 3.76 -1.11 -4.87 115.29 120.85 1z8m s HIS 47 Ca 0.22 -1.25 -0.29 0.00 -0.15 0.00 0.00 55.06 53.59 1z8m s HIS 47 Cb -0.17 -0.99 -0.04 0.00 1.11 0.00 0.00 32.58 32.49 1z8m s HIS 47 CO 0.11 -0.36 0.93 0.00 -0.85 0.00 0.00 174.74 174.57 1z8m s ALA 48 N -3.52 3.22 0.97 -1.40 0.00 -1.26 0.57 121.76 120.34 1z8m s ALA 48 Ca 0.34 0.49 -0.13 0.00 0.00 0.00 0.00 51.96 52.65 1z8m s ALA 48 Cb 0.06 -3.25 0.20 0.00 0.00 0.00 0.00 23.12 20.12 1z8m s ALA 48 CO 0.16 -0.13 1.17 1.28 0.00 0.00 0.00 175.76 178.24 1z8m n LEU 49 N 3.44 0.00 -4.29 0.00 4.77 -1.19 -4.91 117.00 114.83 1z8m n LEU 49 Ca 0.03 -1.37 -0.18 0.00 -0.03 0.00 0.00 56.01 54.47 1z8m n LEU 49 Cb 0.50 -0.88 -0.11 0.00 -2.33 0.00 0.00 43.42 40.61 1z8m n LEU 49 CO 0.51 -1.31 -0.45 -0.54 -1.33 0.00 0.00 177.39 174.27 1z8m s LYS 50 N -5.53 1.16 0.02 3.23 3.01 -1.25 -3.76 119.74 116.61 1z8m s LYS 50 Ca 0.67 -1.40 -0.00 0.00 -1.01 0.00 0.00 55.97 54.23 1z8m s LYS 50 Cb -0.02 -0.99 0.00 0.00 -1.01 0.00 0.00 37.83 35.81 1z8m s LYS 50 CO 0.47 0.18 0.00 0.41 0.51 0.00 0.00 175.35 176.92 1z8m n GLY 51 N 0.12 -5.87 4.74 -3.33 0.00 -1.26 -3.96 105.19 95.63 1z8m n GLY 51 Ca -0.12 0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 1.83 0.00 -1.32 1.61 3.00 -1.26 -4.38 118.16 117.65 1z8m n LYS 52 Ca -0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 58.05 1z8m n LYS 52 Cb 0.00 -0.13 0.12 0.00 0.00 0.00 0.00 35.03 35.03 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 2.76 0.08 5.64 5.03 -1.25 -4.66 117.44 125.03 1z8m n TRP 53 Ca 0.00 -2.37 -0.13 0.00 3.03 0.00 0.00 57.50 58.03 1z8m n TRP 53 Cb 0.00 -1.00 -0.08 0.00 -1.03 0.00 0.00 31.31 29.19 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 1.60 -0.22 0.00 -0.99 3.64 -1.76 -3.06 116.57 115.78 1z8m h LYS 54 Ca 0.52 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.91 1z8m h LYS 54 Cb 1.60 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.47 1z8m h LYS 54 CO 1.15 0.15 0.00 -0.35 -2.27 0.00 0.00 179.45 178.12 1z8m n PRO 55 N -5.01 0.89 -3.35 1.90 -0.04 -1.26 -4.49 135.00 123.64 1z8m n PRO 55 Ca -0.09 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.17 1z8m n PRO 55 Cb 0.24 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 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 2.37 -0.02 0.54 0.40 -1.16 -4.91 117.98 113.20 1z8m s PHE 56 Ca 0.23 -0.55 0.02 0.00 -0.60 0.00 0.00 56.93 56.04 1z8m s PHE 56 Cb 0.11 -2.21 -0.00 0.00 0.51 0.00 0.00 43.02 41.43 1z8m s PHE 56 CO 0.18 -0.44 -0.08 0.50 0.70 0.00 0.00 175.22 176.08 1z8m s ARG 57 N -4.31 0.81 0.48 0.44 3.52 -1.07 -3.32 118.95 115.51 1z8m s ARG 57 Ca 0.51 -0.29 0.07 0.00 -0.13 0.00 0.00 55.73 55.89 1z8m s ARG 57 Cb -0.05 -0.77 0.04 0.00 -1.56 0.00 0.00 34.95 32.60 1z8m s ARG 57 CO 0.31 0.14 0.66 -2.00 -0.81 0.00 0.00 175.30 173.59 1z8m s GLU 58 N 0.04 2.63 -0.29 5.12 2.12 0.19 -1.64 118.70 126.87 1z8m s GLU 58 Ca -0.00 -1.28 -0.16 0.00 0.36 0.00 0.00 54.97 53.89 1z8m s GLU 58 Cb -0.06 -2.69 0.12 0.00 0.26 0.00 0.00 34.13 31.76 1z8m s GLU 58 CO 0.00 -0.50 0.88 0.00 -0.54 0.00 0.00 175.26 175.09 1z8m s HIS 60 N 1.51 4.03 0.55 0.00 0.09 0.08 0.75 115.29 122.30 1z8m s HIS 60 Ca -0.09 -2.37 0.23 0.00 -0.00 0.00 0.00 55.06 52.82 1z8m s HIS 60 Cb -0.04 -3.85 1.47 0.00 -0.00 0.00 0.00 32.58 30.15 1z8m s HIS 60 CO -0.17 -0.99 2.12 0.82 -0.00 0.00 0.00 174.74 176.53 1z8m h ILE 61 N 4.18 0.76 -4.16 0.60 5.03 -1.81 -3.43 117.51 118.68 1z8m h ILE 61 Ca 0.15 0.00 -0.27 0.00 -0.12 0.00 0.00 64.86 64.62 1z8m h ILE 61 Cb 0.94 0.91 -0.15 0.00 -3.03 0.00 0.00 36.82 35.49 1z8m h ILE 61 CO 0.91 0.00 -0.63 -0.54 -0.68 0.00 0.00 178.15 177.21 1z8m s LYS 62 N -4.90 1.21 0.00 2.37 1.02 -1.26 -5.00 119.74 113.18 1z8m s LYS 62 Ca -0.05 -1.62 0.12 0.00 0.02 0.00 0.00 55.97 54.43 1z8m s LYS 62 Cb 0.17 0.00 0.65 0.00 -0.52 0.00 0.00 37.83 38.13 1z8m s LYS 62 CO 0.64 -0.29 1.22 -0.35 -0.92 0.00 0.00 175.35 175.64 1z8m n PRO 63 N -0.30 0.26 -1.25 -1.68 -0.04 -1.26 -2.44 135.00 128.29 1z8m n PRO 63 Ca -0.01 0.10 0.01 0.00 -0.04 0.00 0.00 63.50 63.56 1z8m n PRO 63 Cb 0.65 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.61 1z8m n PRO 63 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1z8m n ASP 64 N -1.16 0.43 -3.98 3.54 2.03 -1.26 -5.01 116.55 111.13 1z8m n ASP 64 Ca 0.07 -1.96 -0.12 0.00 0.52 0.00 0.00 54.79 53.29 1z8m n ASP 64 Cb 0.07 -0.15 -0.12 0.00 -0.72 0.00 0.00 41.12 40.20 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 0.00 0.30 -0.05 5.18 1.01 -1.02 -4.68 120.40 121.15 1z8m s VAL 65 Ca 0.22 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.54 1z8m s VAL 65 Cb 0.25 -0.35 0.03 0.00 0.00 0.00 0.00 36.38 36.31 1z8m s VAL 65 CO -0.11 -0.22 0.07 -0.76 0.00 0.00 0.00 175.10 174.08 1z8m s LEU 66 N -0.91 0.12 -0.14 3.92 1.43 0.08 -3.62 118.68 119.56 1z8m s LEU 66 Ca -0.07 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 1z8m s LEU 66 Cb -0.06 -0.10 -0.01 0.00 0.03 0.00 0.00 46.19 46.05 1z8m s LEU 66 CO -0.00 -0.25 -0.16 -0.22 0.23 0.00 0.00 176.35 175.95 1z8m s LEU 67 N 2.18 2.50 -0.12 1.79 2.96 0.23 -0.32 118.68 127.90 1z8m s LEU 67 Ca 0.05 -0.43 -0.05 0.00 -0.22 0.00 0.00 54.13 53.48 1z8m s LEU 67 Cb -0.12 -1.55 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 1z8m s LEU 67 CO -0.03 0.13 0.06 -0.69 -1.32 0.00 0.00 176.35 174.49 1z8m s VAL 68 N 0.56 4.81 0.18 1.68 1.01 -0.21 -1.03 120.40 127.39 1z8m s VAL 68 Ca -0.10 -0.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.70 1z8m s VAL 68 Cb -0.16 -3.08 0.01 0.00 0.00 0.00 0.00 36.38 33.15 1z8m s VAL 68 CO 0.04 0.58 0.41 -0.72 0.00 0.00 0.00 175.10 175.41 1z8m s TYR 69 N -0.70 0.12 0.55 5.22 -0.85 -0.65 0.12 117.35 121.16 1z8m s TYR 69 Ca 0.12 -0.48 0.03 0.00 -0.52 0.00 0.00 57.07 56.22 1z8m s TYR 69 Cb -0.12 0.18 0.03 0.00 0.38 0.00 0.00 41.96 42.43 1z8m s TYR 69 CO 0.02 -0.82 0.23 -1.17 -1.52 0.00 0.00 175.55 172.30 1z8m s LEU 70 N -2.91 2.44 -0.24 -3.49 2.96 0.21 -2.59 118.68 115.05 1z8m s LEU 70 Ca 0.13 -1.48 0.02 0.00 -0.22 0.00 0.00 54.13 52.58 1z8m s LEU 70 Cb 0.01 -0.93 0.05 0.00 0.50 0.00 0.00 46.19 45.83 1z8m s LEU 70 CO -0.02 -1.06 -0.10 -0.69 -1.32 0.00 0.00 176.35 173.16 1z8m s VAL 71 N -2.85 1.92 0.39 1.68 1.01 -1.26 -3.04 120.40 118.25 1z8m s VAL 71 Ca 0.18 -1.39 0.08 0.00 0.00 0.00 0.00 61.98 60.85 1z8m s VAL 71 Cb -0.01 -2.04 -0.00 0.00 0.00 0.00 0.00 36.38 34.32 1z8m s VAL 71 CO 0.12 0.03 0.50 -0.75 0.00 0.00 0.00 175.10 174.99 1z8m s LYS 72 N 1.23 2.87 -0.34 2.72 2.20 0.29 -4.99 119.74 123.72 1z8m s LYS 72 Ca -0.06 -1.22 -0.27 0.00 -0.36 0.00 0.00 55.97 54.06 1z8m s LYS 72 Cb -0.19 -2.71 -0.05 0.00 -1.51 0.00 0.00 37.83 33.38 1z8m s LYS 72 CO -0.06 -0.14 2.18 0.16 -0.36 0.00 0.00 175.35 177.13 1z8m s ASP 73 N -4.25 5.21 -1.99 1.43 -4.77 -1.26 -1.96 116.67 109.09 1z8m s ASP 73 Ca 0.50 1.46 0.00 0.00 -3.30 0.00 0.00 52.55 51.21 1z8m s ASP 73 Cb -0.09 -2.51 0.00 0.00 -1.09 0.00 0.00 42.92 39.23 1z8m s ASP 73 CO 0.31 -2.22 0.00 -0.67 0.70 0.00 0.00 175.17 173.29 1z8m n ASP 74 N 12.77 -5.16 -3.61 2.11 2.03 -1.26 -4.92 116.55 118.50 1z8m n ASP 74 Ca 0.30 0.41 -0.16 0.00 0.52 0.00 0.00 54.79 55.86 1z8m n ASP 74 Cb 0.49 -4.55 -0.07 0.00 -0.72 0.00 0.00 41.12 36.27 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 -3.86 0.88 0.07 -0.67 8.01 -0.83 -4.33 118.70 117.97 1z8m s GLU 75 Ca 0.00 0.27 0.06 0.00 0.01 0.00 0.00 54.97 55.31 1z8m s GLU 75 Cb 0.00 0.41 -0.04 0.00 -4.31 0.00 0.00 34.13 30.20 1z8m s GLU 75 CO 0.00 -0.24 -0.08 -1.17 0.01 0.00 0.00 175.26 173.78 1z8m s LEU 76 N -0.89 3.11 -0.03 1.80 0.20 0.18 0.10 118.68 123.15 1z8m s LEU 76 Ca -0.09 -0.29 0.03 0.00 0.69 0.00 0.00 54.13 54.47 1z8m s LEU 76 Cb -0.02 -1.86 0.00 0.00 -0.43 0.00 0.00 46.19 43.88 1z8m s LEU 76 CO 0.07 0.21 -0.11 0.27 -0.29 0.00 0.00 176.35 176.50 1z8m s ILE 77 N -1.14 0.94 0.33 6.68 -5.25 -1.17 -2.20 121.20 119.38 1z8m s ILE 77 Ca 0.20 -0.44 -0.18 0.00 -0.99 0.00 0.00 60.65 59.24 1z8m s ILE 77 Cb -0.11 -0.82 -0.09 0.00 2.95 0.00 0.00 42.46 44.38 1z8m s ILE 77 CO 0.12 0.29 0.80 -0.76 -1.79 0.00 0.00 174.94 173.59 1z8m s LEU 78 N 0.16 4.10 -0.02 0.37 1.43 -0.72 0.66 118.68 124.66 1z8m s LEU 78 Ca -0.03 1.44 -0.02 0.00 -1.03 0.00 0.00 54.13 54.48 1z8m s LEU 78 Cb -0.09 -4.10 -0.01 0.00 0.03 0.00 0.00 46.19 42.02 1z8m s LEU 78 CO 0.01 -0.19 -0.05 0.18 0.23 0.00 0.00 176.35 176.53 1z8m n LEU 79 N -0.18 0.29 -3.85 1.79 7.99 0.33 -2.44 117.00 120.93 1z8m n LEU 79 Ca 0.03 0.05 -0.07 0.00 -0.01 0.00 0.00 56.01 56.01 1z8m n LEU 79 Cb 0.53 -0.46 -0.01 0.00 -0.11 0.00 0.00 43.42 43.37 1z8m n LEU 79 CO 0.41 -0.48 0.50 0.00 -1.51 0.00 0.00 177.39 176.31 1z8m s ARG 80 N -1.28 1.79 -0.07 3.23 1.04 -1.03 -0.27 118.95 122.35 1z8m s ARG 80 Ca -0.04 -1.01 0.04 0.00 -1.04 0.00 0.00 55.73 53.68 1z8m s ARG 80 Cb 0.01 0.59 0.00 0.00 -2.04 0.00 0.00 34.95 33.51 1z8m s ARG 80 CO 0.06 -0.82 -0.18 -1.17 -0.04 0.00 0.00 175.30 173.14 1z8m s LEU 81 N -2.94 1.89 0.00 -1.89 1.98 -1.26 -1.04 118.68 115.41 1z8m s LEU 81 Ca 0.12 -0.41 0.00 0.00 -2.89 0.00 0.00 54.13 50.95 1z8m s LEU 81 Cb -0.05 -1.09 0.00 0.00 0.66 0.00 0.00 46.19 45.70 1z8m s LEU 81 CO 0.07 0.12 0.00 0.61 -1.89 0.00 0.00 176.35 175.26 1z8m n GLY 82 N 3.46 3.83 3.20 7.98 0.00 0.57 -4.83 105.19 119.40 1z8m n GLY 82 Ca -0.20 -1.12 -0.12 0.00 0.00 0.00 0.00 46.02 44.58 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 1.05 0.30 0.55 1.61 1.04 -1.26 -0.74 113.70 116.25 1z8m s SER 83 Ca 0.00 -1.34 0.23 0.00 0.48 0.00 0.00 55.95 55.32 1z8m s SER 83 Cb 0.00 0.34 1.53 0.00 0.10 0.00 0.00 66.02 67.98 1z8m s SER 83 CO 0.00 -0.80 2.17 -0.74 0.98 0.00 0.00 173.24 174.85 1z8m h HIS 84 N 2.66 0.00 0.00 5.02 2.76 -1.91 -0.27 115.15 123.40 1z8m h HIS 84 Ca -0.36 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.81 1z8m h HIS 84 Cb 1.24 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 -0.93 0.77 -1.30 0.00 0.00 177.93 176.85 1z8m h SER 85 N 0.00 0.00 0.00 3.26 0.02 -1.96 -3.27 113.55 111.60 1z8m h SER 85 Ca 0.03 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1z8m h SER 85 Cb 0.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.67 1z8m h SER 85 CO -0.00 0.03 -0.06 -0.08 -1.14 0.00 0.00 176.83 175.59 1z8m h GLU 86 N 0.00 0.00 -0.80 3.45 4.22 -1.49 -3.36 114.58 116.60 1z8m h GLU 86 Ca 0.00 0.00 0.21 0.00 0.08 0.00 0.00 59.36 59.65 1z8m h GLU 86 Cb 0.93 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.14 1z8m h GLU 86 CO 0.00 0.00 0.56 -0.07 -2.18 0.00 0.00 179.01 177.32 1z8m h LEU 87 N -0.24 0.18 -1.57 1.64 4.07 -1.47 -3.47 115.31 114.45 1z8m h LEU 87 Ca 0.00 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.98 1z8m h LEU 87 Cb 0.06 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.78 1z8m h LEU 87 CO 0.00 0.08 0.00 0.49 -1.08 0.00 0.00 178.44 177.93