#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 -4.91 -0.89 4.77 -1.26 -5.11 117.00 109.60 1z8m n LEU 2 Ca 0.00 -2.57 -0.32 0.00 -0.03 0.00 0.00 56.01 53.09 1z8m n LEU 2 Cb 0.00 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 1z8m n LEU 2 CO 0.00 -0.55 -0.08 -0.75 -1.33 0.00 0.00 177.39 174.68 1z8m s LYS 3 N -4.00 3.51 0.09 3.23 2.36 -1.26 -4.90 119.74 118.76 1z8m s LYS 3 Ca 0.27 -0.28 0.08 0.00 -2.55 0.00 0.00 55.97 53.48 1z8m s LYS 3 Cb -0.02 -2.99 -0.04 0.00 -1.05 0.00 0.00 37.83 33.73 1z8m s LYS 3 CO 0.17 0.57 -0.17 -1.17 1.55 0.00 0.00 175.35 176.31 1z8m s LEU 4 N -2.44 2.72 0.36 5.43 2.96 -1.18 0.34 118.68 126.88 1z8m s LEU 4 Ca 0.36 -0.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.83 1z8m s LEU 4 Cb -0.13 -1.58 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 1z8m s LEU 4 CO 0.25 0.21 0.16 0.21 -1.32 0.00 0.00 176.35 175.86 1z8m s ASN 5 N -1.89 2.18 -0.21 3.68 2.47 -0.75 -4.91 114.94 115.53 1z8m s ASN 5 Ca 0.17 -1.64 -0.04 0.00 0.42 0.00 0.00 52.86 51.77 1z8m s ASN 5 Cb -0.11 0.45 0.11 0.00 -1.45 0.00 0.00 41.25 40.25 1z8m s ASN 5 CO 0.09 -0.93 0.32 -0.76 -3.72 0.00 0.00 177.10 172.10 1z8m s LEU 6 N -3.49 -0.44 0.80 3.21 1.43 -1.26 -2.81 118.68 116.13 1z8m s LEU 6 Ca 0.31 0.25 -0.07 0.00 -1.03 0.00 0.00 54.13 53.59 1z8m s LEU 6 Cb 0.04 0.87 0.14 0.00 0.03 0.00 0.00 46.19 47.27 1z8m s LEU 6 CO 0.18 -0.29 1.11 -0.54 0.23 0.00 0.00 176.35 177.04 1z8m s LYS 7 N 2.47 1.37 0.22 1.70 -0.14 -1.03 -4.97 119.74 119.36 1z8m s LYS 7 Ca 0.08 -0.76 0.03 0.00 -1.36 0.00 0.00 55.97 53.95 1z8m s LYS 7 Cb -0.15 -2.14 0.20 0.00 -1.68 0.00 0.00 37.83 34.07 1z8m s LYS 7 CO -0.13 -1.76 1.53 0.87 -0.76 0.00 0.00 175.35 175.10 1z8m h LYS 8 N -0.93 0.31 -0.33 1.68 6.56 -1.91 -2.79 116.57 119.17 1z8m h LYS 8 Ca -0.40 -0.21 -0.10 0.00 -1.06 0.00 0.00 60.65 58.87 1z8m h LYS 8 Cb 1.26 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.94 1z8m h LYS 8 CO 0.42 0.82 -0.21 1.03 -2.06 0.00 0.00 179.45 179.45 1z8m h SER 9 N 0.23 0.62 0.51 0.86 0.87 -1.95 -2.52 113.55 112.16 1z8m h SER 9 Ca -0.01 -0.21 -0.14 0.00 -1.23 0.00 0.00 61.79 60.21 1z8m h SER 9 Cb 1.13 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.91 1z8m h SER 9 CO 0.10 0.83 -0.61 0.15 -0.53 0.00 0.00 176.83 176.77 1z8m h PHE 10 N 0.55 0.13 -0.42 2.24 3.04 -1.20 -1.16 116.94 120.12 1z8m h PHE 10 Ca 0.08 -0.05 -0.14 0.00 3.98 0.00 0.00 57.97 61.84 1z8m h PHE 10 Cb 0.67 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.15 1z8m h PHE 10 CO 0.03 0.68 -0.29 1.96 -2.02 0.00 0.00 178.31 178.67 1z8m h GLN 11 N 0.07 0.94 -0.00 1.11 1.08 -1.22 -2.04 115.11 115.05 1z8m h GLN 11 Ca -0.01 -0.45 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 1z8m h GLN 11 Cb 1.09 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.51 1z8m h GLN 11 CO 0.09 1.11 -0.27 0.36 -0.95 0.00 0.00 178.83 179.16 1z8m n LYS 12 N -4.12 0.07 0.01 1.46 -0.00 -0.97 -2.65 118.16 111.96 1z8m n LYS 12 Ca -0.01 -0.03 -0.03 0.00 -0.00 0.00 0.00 58.31 58.24 1z8m n LYS 12 Cb 0.49 -1.50 -0.10 0.00 -0.00 0.00 0.00 35.03 33.92 1z8m n LYS 12 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1z8m n ASP 13 N -1.44 0.85 -0.00 -5.58 8.00 -0.44 -3.47 116.55 114.46 1z8m n ASP 13 Ca 0.07 0.38 -0.00 0.00 0.71 0.00 0.00 54.79 55.95 1z8m n ASP 13 Cb 0.33 0.11 -0.00 0.00 -0.02 0.00 0.00 41.12 41.54 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 -2.93 0.04 -0.17 1.24 7.35 -0.78 -3.53 117.46 118.67 1z8m n PHE 14 Ca -0.12 0.02 -0.02 0.00 -0.76 0.00 0.00 57.45 56.56 1z8m n PHE 14 Cb 0.91 -0.24 0.04 0.00 0.35 0.00 0.00 39.48 40.54 1z8m n PHE 14 CO 0.00 0.00 0.00 0.22 -0.76 0.00 0.00 176.76 176.22 1z8m h ASP 15 N -0.05 -0.51 0.55 -2.13 1.82 -1.75 0.72 116.42 115.06 1z8m h ASP 15 Ca 0.00 0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.80 1z8m h ASP 15 Cb 0.03 0.34 0.00 0.00 0.68 0.00 0.00 39.33 40.38 1z8m h ASP 15 CO 0.00 -0.18 0.00 1.17 -1.61 0.00 0.00 179.24 178.62 1z8m n LYS 16 N -5.38 0.14 -0.09 0.28 3.00 -1.23 -2.24 118.16 112.64 1z8m n LYS 16 Ca 0.05 0.42 -0.13 0.00 -0.00 0.00 0.00 58.31 58.65 1z8m n LYS 16 Cb 0.28 -1.79 -0.06 0.00 0.00 0.00 0.00 35.03 33.46 1z8m n LYS 16 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1z8m n LEU 17 N -2.06 1.84 0.14 3.14 4.77 0.21 -2.52 117.00 122.51 1z8m n LEU 17 Ca 0.02 0.53 0.19 0.00 -0.03 0.00 0.00 56.01 56.72 1z8m n LEU 17 Cb 0.18 -0.92 0.78 0.00 -2.33 0.00 0.00 43.42 41.13 1z8m n LEU 17 CO 0.16 -0.10 1.17 -0.07 -1.33 0.00 0.00 177.39 177.22 1z8m h LEU 18 N -1.00 0.00 0.07 2.23 3.38 -0.31 -0.50 115.31 119.18 1z8m h LEU 18 Ca -0.18 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.46 1z8m h LEU 18 Cb 0.91 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 1z8m h LEU 18 CO -0.11 0.00 -1.85 0.18 0.09 0.00 0.00 178.44 176.75 1z8m n LEU 19 N -3.78 1.79 0.29 1.67 4.77 -0.95 -3.66 117.00 117.13 1z8m n LEU 19 Ca 0.05 0.32 0.16 0.00 -0.03 0.00 0.00 56.01 56.51 1z8m n LEU 19 Cb 0.50 -0.50 0.91 0.00 -2.33 0.00 0.00 43.42 42.00 1z8m n LEU 19 CO 0.28 0.63 1.08 -1.13 -1.33 0.00 0.00 177.39 176.91 1z8m h ASN 20 N 0.04 0.00 0.00 -1.43 -1.24 -0.81 -3.44 115.58 108.70 1z8m h ASN 20 Ca -0.35 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.66 1z8m h ASN 20 Cb 2.03 0.00 0.00 0.00 0.73 0.00 0.00 38.32 41.08 1z8m h ASN 20 CO 0.09 0.04 0.00 0.61 -1.29 0.00 0.00 177.43 176.88 1z8m n GLY 21 N -0.93 0.35 3.31 1.57 0.00 -0.85 -5.08 105.19 103.57 1z8m n GLY 21 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.52 2.89 -0.48 1.61 2.19 -0.93 -5.00 117.98 117.74 1z8m s PHE 22 Ca 0.00 -0.90 -0.28 0.00 0.33 0.00 0.00 56.93 56.08 1z8m s PHE 22 Cb 0.00 -2.00 -0.09 0.00 -1.31 0.00 0.00 43.02 39.62 1z8m s PHE 22 CO 0.00 -0.45 2.39 -3.47 1.83 0.00 0.00 175.22 175.51 1z8m n ASP 23 N 4.32 2.23 0.05 6.13 2.03 -1.26 -4.46 116.55 125.59 1z8m n ASP 23 Ca -0.18 -0.17 0.19 0.00 0.52 0.00 0.00 54.79 55.15 1z8m n ASP 23 Cb 0.51 -1.46 0.72 0.00 -0.72 0.00 0.00 41.12 40.17 1z8m n ASP 23 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 1z8m h ASP 24 N 16.92 0.00 -0.27 1.67 3.04 -1.97 0.23 116.42 136.04 1z8m h ASP 24 Ca -0.25 0.00 0.08 0.00 -3.24 0.00 0.00 57.03 53.61 1z8m h ASP 24 Cb 1.28 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.55 1z8m h ASP 24 CO 1.13 0.00 0.25 -1.28 -2.04 0.00 0.00 179.24 177.30 1z8m h SER 25 N 0.00 0.00 0.14 4.15 0.87 -2.02 -0.28 113.55 116.42 1z8m h SER 25 Ca 0.21 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.59 1z8m h SER 25 Cb 0.91 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.87 1z8m h SER 25 CO -0.00 0.00 -0.66 0.58 -0.53 0.00 0.00 176.83 176.22 1z8m h VAL 26 N 0.00 1.35 -0.72 2.23 2.07 -1.32 -3.16 116.25 116.70 1z8m h VAL 26 Ca 0.13 -1.98 0.04 0.00 0.82 0.00 0.00 66.70 65.71 1z8m h VAL 26 Cb 0.64 1.96 -0.04 0.00 -1.52 0.00 0.00 31.29 32.33 1z8m h VAL 26 CO -0.00 0.61 0.47 0.17 0.02 0.00 0.00 177.57 178.84 1z8m h LEU 27 N 0.35 0.73 -2.66 2.57 8.10 -1.16 -0.62 115.31 122.62 1z8m h LEU 27 Ca -0.02 -0.01 0.00 0.00 0.11 0.00 0.00 57.88 57.97 1z8m h LEU 27 Cb 1.22 -0.17 0.00 0.00 -0.44 0.00 0.00 40.66 41.27 1z8m h LEU 27 CO 0.12 0.50 0.08 0.78 -4.11 0.00 0.00 178.44 175.80 1z8m h ASN 28 N 0.85 0.00 0.21 0.17 4.21 -1.54 0.89 115.58 120.37 1z8m h ASN 28 Ca 0.29 0.00 -0.35 0.00 1.21 0.00 0.00 56.30 57.45 1z8m h ASN 28 Cb 0.10 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.28 1z8m h ASN 28 CO -0.09 0.00 -1.92 -0.62 -1.29 0.00 0.00 177.43 173.51 1z8m n GLU 29 N -2.98 0.73 -0.05 0.81 1.02 -0.25 -3.72 120.64 116.20 1z8m n GLU 29 Ca -0.03 0.27 -0.22 0.00 -0.02 0.00 0.00 57.16 57.17 1z8m n GLU 29 Cb 0.14 -1.73 -0.13 0.00 -0.02 0.00 0.00 31.44 29.70 1z8m n GLU 29 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 1z8m n VAL 30 N -3.39 1.66 0.11 2.62 3.14 -0.67 -3.86 118.33 117.95 1z8m n VAL 30 Ca -0.28 -0.35 -0.13 0.00 -2.96 0.00 0.00 64.34 60.61 1z8m n VAL 30 Cb 1.05 -1.88 -0.08 0.00 -1.06 0.00 0.00 33.84 31.87 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 -0.46 0.88 -0.90 1.55 5.03 0.54 -2.40 117.51 121.75 1z8m h ILE 31 Ca -0.40 -0.23 0.15 0.00 -0.12 0.00 0.00 64.86 64.26 1z8m h ILE 31 Cb 1.68 1.02 -0.07 0.00 -3.03 0.00 0.00 36.82 36.42 1z8m h ILE 31 CO -0.07 0.06 0.58 0.17 -0.68 0.00 0.00 178.15 178.21 1z8m h LEU 32 N -0.35 0.65 -0.82 1.44 -0.00 -1.66 0.70 115.31 115.28 1z8m h LEU 32 Ca -0.02 0.04 -0.09 0.00 -0.00 0.00 0.00 57.88 57.81 1z8m h LEU 32 Cb 0.27 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 40.82 1z8m h LEU 32 CO 0.04 0.33 -0.04 0.74 -0.00 0.00 0.00 178.44 179.50 1z8m h THR 33 N 0.69 1.25 -0.00 0.15 2.02 -1.61 0.42 112.91 115.84 1z8m h THR 33 Ca 0.45 -1.10 -0.13 0.00 0.77 0.00 0.00 66.41 66.40 1z8m h THR 33 Cb 0.74 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 68.05 1z8m h THR 33 CO -0.21 0.38 -0.64 -0.07 0.37 0.00 0.00 175.52 175.35 1z8m h LEU 34 N 0.77 0.00 -3.50 2.58 3.38 -0.44 -3.00 115.31 115.11 1z8m h LEU 34 Ca 0.14 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1z8m h LEU 34 Cb 0.53 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1z8m h LEU 34 CO 0.03 0.64 0.01 0.54 0.09 0.00 0.00 178.44 179.75 1z8m n ARG 35 N -3.78 4.38 -0.19 1.13 1.74 -0.13 -4.27 116.66 115.54 1z8m n ARG 35 Ca -0.01 -3.09 0.09 0.00 -0.77 0.00 0.00 57.85 54.07 1z8m n ARG 35 Cb 0.63 -2.16 0.17 0.00 -1.02 0.00 0.00 32.46 30.09 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 0.31 1.93 -4.13 5.56 4.76 0.11 -4.97 118.16 121.71 1z8m n LYS 36 Ca 0.27 -2.61 -0.35 0.00 -2.87 0.00 0.00 58.31 52.74 1z8m n LYS 36 Cb 1.13 -1.59 -0.03 0.00 -1.84 0.00 0.00 35.03 32.70 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 -1.06 -2.80 -3.72 1.97 2.85 -1.26 -4.92 118.16 109.22 1z8m n LYS 37 Ca 0.17 0.34 -0.38 0.00 -1.05 0.00 0.00 58.31 57.39 1z8m n LYS 37 Cb 0.70 -5.04 -0.12 0.00 -0.65 0.00 0.00 35.03 29.92 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 -6.82 2.84 0.27 -1.58 2.12 -1.24 -4.06 118.70 110.22 1z8m s GLU 38 Ca 0.71 -1.03 -0.30 0.00 0.36 0.00 0.00 54.97 54.71 1z8m s GLU 38 Cb -0.39 -3.48 -0.10 0.00 0.26 0.00 0.00 34.13 30.42 1z8m s GLU 38 CO 0.87 -0.58 1.35 -1.25 -0.54 0.00 0.00 175.26 175.10 1z8m s PRO 39 N 1.47 4.34 1.01 4.30 0.04 -1.26 -4.84 135.00 140.06 1z8m s PRO 39 Ca 0.01 2.19 -0.17 0.00 0.04 0.00 0.00 61.00 63.07 1z8m s PRO 39 Cb -0.19 -3.12 0.23 0.00 0.04 0.00 0.00 34.50 31.47 1z8m s PRO 39 CO 0.03 -0.27 1.34 -0.51 0.04 0.00 0.00 177.00 177.64 1z8m s LEU 40 N -0.87 2.64 0.20 -3.56 1.43 -1.26 -5.09 118.68 112.16 1z8m s LEU 40 Ca 0.54 0.17 0.08 0.00 -1.03 0.00 0.00 54.13 53.90 1z8m s LEU 40 Cb -0.39 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.69 1z8m s LEU 40 CO 0.45 -3.00 -0.03 -1.81 0.23 0.00 0.00 176.35 172.20 1z8m s ASP 41 N -4.91 4.59 0.05 2.29 1.11 -1.26 -5.01 116.67 113.53 1z8m s ASP 41 Ca 0.76 -0.50 0.13 0.00 0.18 0.00 0.00 52.55 53.13 1z8m s ASP 41 Cb -0.02 -0.90 0.56 0.00 1.07 0.00 0.00 42.92 43.62 1z8m s ASP 41 CO 0.54 0.07 1.40 -0.81 1.18 0.00 0.00 175.17 177.56 1z8m n PRO 42 N -0.24 0.04 -0.08 8.23 -0.04 -1.26 -2.09 135.00 139.55 1z8m n PRO 42 Ca -0.09 0.35 0.07 0.00 -0.04 0.00 0.00 63.50 63.79 1z8m n PRO 42 Cb 0.56 -1.58 0.26 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 -1.65 1.48 -0.43 0.54 10.64 -1.26 -3.69 117.38 123.01 1z8m n GLN 43 Ca 0.02 -0.74 0.06 0.00 -1.83 0.00 0.00 57.00 54.52 1z8m n GLN 43 Cb 0.13 -1.26 0.25 0.00 -0.86 0.00 0.00 30.24 28.50 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 0.03 1.04 -3.41 2.61 3.01 -0.89 -4.90 117.46 114.95 1z8m n PHE 44 Ca 0.11 -0.41 -0.24 0.00 1.01 0.00 0.00 57.45 57.92 1z8m n PHE 44 Cb 0.21 -0.19 0.06 0.00 -0.01 0.00 0.00 39.48 39.55 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 0.70 -6.64 -3.21 -1.08 6.02 -1.24 -1.78 117.38 110.15 1z8m n GLN 45 Ca 0.18 0.84 -0.42 0.00 -0.01 0.00 0.00 57.00 57.58 1z8m n GLN 45 Cb 0.66 -5.81 -0.08 0.00 1.02 0.00 0.00 30.24 26.03 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 -3.09 6.30 0.18 1.08 -4.77 -1.26 -4.28 116.67 110.84 1z8m s ASP 46 Ca 0.49 -0.22 -0.10 0.00 -3.30 0.00 0.00 52.55 49.42 1z8m s ASP 46 Cb -0.22 -2.28 0.04 0.00 -1.09 0.00 0.00 42.92 39.37 1z8m s ASP 46 CO 0.61 -0.59 0.52 0.00 0.70 0.00 0.00 175.17 176.41 1z8m n HIS 47 N 5.88 -1.50 -2.88 2.11 1.44 -0.91 -4.95 115.22 114.41 1z8m n HIS 47 Ca -0.04 -0.95 -0.41 0.00 -2.01 0.00 0.00 57.72 54.31 1z8m n HIS 47 Cb 0.48 0.47 -0.04 0.00 0.12 0.00 0.00 29.99 31.02 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 -1.62 3.27 1.02 1.59 0.00 -1.26 0.41 121.76 125.18 1z8m s ALA 48 Ca 0.11 0.32 -0.16 0.00 0.00 0.00 0.00 51.96 52.23 1z8m s ALA 48 Cb -0.02 -3.15 0.20 0.00 0.00 0.00 0.00 23.12 20.15 1z8m s ALA 48 CO 0.05 -0.20 1.18 -0.51 0.00 0.00 0.00 175.76 176.28 1z8m s LEU 49 N 0.99 1.75 0.31 0.00 1.02 -1.15 -4.93 118.68 116.66 1z8m s LEU 49 Ca 0.44 0.68 0.07 0.00 0.02 0.00 0.00 54.13 55.34 1z8m s LEU 49 Cb -0.19 -2.73 -0.02 0.00 0.02 0.00 0.00 46.19 43.27 1z8m s LEU 49 CO 0.22 -3.14 0.36 -1.59 0.02 0.00 0.00 176.35 172.23 1z8m s LYS 50 N -5.47 3.03 4.44 1.70 -2.85 -1.26 -3.88 119.74 115.46 1z8m s LYS 50 Ca 0.69 -1.06 0.00 0.00 -1.00 0.00 0.00 55.97 54.60 1z8m s LYS 50 Cb -0.10 -2.70 0.00 0.00 -2.06 0.00 0.00 37.83 32.97 1z8m s LYS 50 CO 0.54 0.18 0.00 0.41 0.10 0.00 0.00 175.35 176.58 1z8m n GLY 51 N -1.46 0.33 0.00 0.59 0.00 -1.26 -3.30 105.19 100.08 1z8m n GLY 51 Ca -0.03 -0.89 0.13 0.00 0.00 0.00 0.00 46.02 45.23 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 11.85 0.43 -1.10 1.61 3.00 -1.26 -3.38 118.16 129.32 1z8m n LYS 52 Ca 0.00 0.03 -0.23 0.00 -0.00 0.00 0.00 58.31 58.11 1z8m n LYS 52 Cb 0.00 -1.50 0.13 0.00 0.00 0.00 0.00 35.03 33.66 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 -1.25 2.67 -0.07 5.64 8.01 -1.21 -4.46 117.44 126.77 1z8m n TRP 53 Ca 0.14 -2.00 -0.14 0.00 -1.31 0.00 0.00 57.50 54.19 1z8m n TRP 53 Cb 0.20 -1.00 -0.11 0.00 -2.01 0.00 0.00 31.31 28.39 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 1.17 0.00 0.00 -0.99 3.64 -1.66 -3.05 116.57 115.67 1z8m h LYS 54 Ca 0.54 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.92 1z8m h LYS 54 Cb 2.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.86 1z8m h LYS 54 CO 1.08 0.90 0.21 -1.35 -2.27 0.00 0.00 179.45 178.01 1z8m h PRO 55 N -1.00 0.00 -6.48 1.90 0.11 -1.89 -3.42 132.00 121.21 1z8m h PRO 55 Ca -0.05 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.56 1z8m h PRO 55 Cb 0.94 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.06 1z8m h PRO 55 CO -0.03 0.00 -0.15 -0.06 -0.21 0.00 0.00 178.00 177.55 1z8m s PHE 56 N -3.86 1.56 -0.01 0.65 0.08 -1.25 -4.98 117.98 110.18 1z8m s PHE 56 Ca -0.03 -0.72 0.02 0.00 0.12 0.00 0.00 56.93 56.31 1z8m s PHE 56 Cb 0.08 -2.16 -0.00 0.00 -0.57 0.00 0.00 43.02 40.37 1z8m s PHE 56 CO 0.26 -0.95 -0.05 0.50 -0.10 0.00 0.00 175.22 174.87 1z8m s ARG 57 N -4.56 0.43 0.29 0.44 6.06 -1.16 -4.15 118.95 116.31 1z8m s ARG 57 Ca 0.56 -0.18 0.01 0.00 -2.50 0.00 0.00 55.73 53.61 1z8m s ARG 57 Cb -0.05 -0.42 -0.03 0.00 0.06 0.00 0.00 34.95 34.50 1z8m s ARG 57 CO 0.35 0.11 0.48 -2.00 -2.50 0.00 0.00 175.30 171.73 1z8m s GLU 58 N -0.08 3.49 -0.30 5.12 2.12 0.17 -1.78 118.70 127.43 1z8m s GLU 58 Ca 0.02 -0.41 -0.05 0.00 0.36 0.00 0.00 54.97 54.89 1z8m s GLU 58 Cb -0.02 -2.74 0.17 0.00 0.26 0.00 0.00 34.13 31.79 1z8m s GLU 58 CO -0.00 0.26 0.65 0.00 -0.54 0.00 0.00 175.26 175.63 1z8m s HIS 60 N 2.86 3.62 0.56 0.00 0.09 -0.74 -1.26 115.29 120.43 1z8m s HIS 60 Ca 0.11 -1.88 0.27 0.00 -0.00 0.00 0.00 55.06 53.56 1z8m s HIS 60 Cb -0.14 -3.94 1.50 0.00 -0.00 0.00 0.00 32.58 30.00 1z8m s HIS 60 CO -0.20 -1.12 2.02 0.82 -0.00 0.00 0.00 174.74 176.26 1z8m h ILE 61 N 4.99 0.57 -3.42 0.60 5.03 -1.79 -3.44 117.51 120.04 1z8m h ILE 61 Ca 0.13 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.84 1z8m h ILE 61 Cb 1.03 0.75 -0.07 0.00 -3.03 0.00 0.00 36.82 35.50 1z8m h ILE 61 CO 0.86 0.00 0.01 -1.59 -0.68 0.00 0.00 178.15 176.75 1z8m s LYS 62 N -4.79 1.69 0.00 2.37 -2.85 -1.24 -5.01 119.74 109.90 1z8m s LYS 62 Ca -0.05 -1.20 0.11 0.00 -1.00 0.00 0.00 55.97 53.83 1z8m s LYS 62 Cb 0.17 0.52 0.67 0.00 -2.06 0.00 0.00 37.83 37.13 1z8m s LYS 62 CO 0.62 -0.73 1.11 -2.30 0.10 0.00 0.00 175.35 174.15 1z8m n PRO 63 N -0.43 0.35 -0.85 1.78 -0.02 -1.26 -2.12 135.00 132.45 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 -1.50 0.05 0.00 -0.02 0.00 0.00 33.50 32.64 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 -1.00 0.91 -3.66 2.55 8.00 -1.26 -5.03 116.55 117.05 1z8m n ASP 64 Ca 0.08 -2.39 -0.14 0.00 0.71 0.00 0.00 54.79 53.05 1z8m n ASP 64 Cb 0.04 -0.31 -0.08 0.00 -0.02 0.00 0.00 41.12 40.75 1z8m n ASP 64 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1z8m s VAL 65 N -0.79 0.01 -0.29 2.53 1.01 -0.90 -4.86 120.40 117.10 1z8m s VAL 65 Ca 0.22 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.18 1z8m s VAL 65 Cb 0.23 -0.80 0.20 0.00 0.00 0.00 0.00 36.38 36.01 1z8m s VAL 65 CO -0.07 -0.04 0.57 -1.48 0.00 0.00 0.00 175.10 174.08 1z8m s LEU 66 N -0.26 -1.54 0.11 3.92 2.34 -0.44 -3.24 118.68 119.56 1z8m s LEU 66 Ca -0.04 0.16 0.04 0.00 0.06 0.00 0.00 54.13 54.34 1z8m s LEU 66 Cb -0.03 1.94 -0.04 0.00 -0.56 0.00 0.00 46.19 47.50 1z8m s LEU 66 CO 0.03 -0.30 0.09 -1.48 -1.06 0.00 0.00 176.35 173.63 1z8m s LEU 67 N 2.80 3.77 -0.12 1.48 0.05 -0.39 -2.55 118.68 123.73 1z8m s LEU 67 Ca 0.10 -0.06 -0.07 0.00 0.05 0.00 0.00 54.13 54.16 1z8m s LEU 67 Cb -0.10 -2.44 -0.04 0.00 -2.05 0.00 0.00 46.19 41.56 1z8m s LEU 67 CO -0.26 0.14 0.13 -0.69 -0.55 0.00 0.00 176.35 175.12 1z8m s VAL 68 N -1.49 5.42 0.07 1.48 1.01 0.31 -2.05 120.40 125.15 1z8m s VAL 68 Ca 0.29 0.17 -0.07 0.00 0.00 0.00 0.00 61.98 62.37 1z8m s VAL 68 Cb -0.11 -3.36 -0.01 0.00 0.00 0.00 0.00 36.38 32.90 1z8m s VAL 68 CO 0.22 0.62 0.15 -0.72 0.00 0.00 0.00 175.10 175.37 1z8m s TYR 69 N -1.01 0.19 0.23 5.22 -0.85 -0.73 0.12 117.35 120.51 1z8m s TYR 69 Ca 0.15 -0.58 0.09 0.00 -0.52 0.00 0.00 57.07 56.21 1z8m s TYR 69 Cb -0.12 -0.11 -0.04 0.00 0.38 0.00 0.00 41.96 42.07 1z8m s TYR 69 CO 0.04 -0.48 -0.06 -1.17 -1.52 0.00 0.00 175.55 172.36 1z8m s LEU 70 N -2.65 3.06 -0.35 -3.49 2.96 0.70 -2.97 118.68 115.95 1z8m s LEU 70 Ca 0.02 -0.65 -0.02 0.00 -0.22 0.00 0.00 54.13 53.26 1z8m s LEU 70 Cb 0.04 -1.65 0.08 0.00 0.50 0.00 0.00 46.19 45.16 1z8m s LEU 70 CO -0.09 0.05 0.10 -0.69 -1.32 0.00 0.00 176.35 174.39 1z8m s VAL 71 N -2.09 3.16 0.80 1.68 1.01 -1.26 -2.14 120.40 121.55 1z8m s VAL 71 Ca 0.29 -1.68 -0.12 0.00 0.00 0.00 0.00 61.98 60.47 1z8m s VAL 71 Cb -0.07 -2.99 0.07 0.00 0.00 0.00 0.00 36.38 33.39 1z8m s VAL 71 CO 0.18 -0.38 1.11 -0.75 0.00 0.00 0.00 175.10 175.25 1z8m s LYS 72 N 1.21 2.08 0.51 2.72 2.47 0.34 -4.89 119.74 124.18 1z8m s LYS 72 Ca 0.01 0.53 0.38 0.00 -1.56 0.00 0.00 55.97 55.34 1z8m s LYS 72 Cb -0.21 -1.93 1.54 0.00 -1.46 0.00 0.00 37.83 35.77 1z8m s LYS 72 CO -0.02 -1.60 1.69 -0.44 0.16 0.00 0.00 175.35 175.14 1z8m h ASP 73 N -1.07 0.10 0.00 1.43 5.19 -2.04 -3.06 116.42 116.97 1z8m h ASP 73 Ca -0.47 0.04 -0.11 0.00 -0.62 0.00 0.00 57.03 55.86 1z8m h ASP 73 Cb 1.28 0.03 -0.11 0.00 0.18 0.00 0.00 39.33 40.70 1z8m h ASP 73 CO 0.61 -0.03 -0.25 0.47 -3.12 0.00 0.00 179.24 176.92 1z8m n ASP 74 N -4.25 -0.86 -3.89 6.45 8.00 -1.26 -5.14 116.55 115.59 1z8m n ASP 74 Ca 0.34 -1.84 -0.09 0.00 0.71 0.00 0.00 54.79 53.90 1z8m n ASP 74 Cb 1.49 0.26 -0.07 0.00 -0.02 0.00 0.00 41.12 42.78 1z8m n ASP 74 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1z8m s GLU 75 N 0.00 1.09 -0.08 -1.24 2.02 -1.16 -4.49 118.70 114.84 1z8m s GLU 75 Ca 0.00 -1.06 0.04 0.00 0.02 0.00 0.00 54.97 53.97 1z8m s GLU 75 Cb 0.00 0.39 0.00 0.00 0.10 0.00 0.00 34.13 34.62 1z8m s GLU 75 CO 0.00 -0.40 -0.21 -1.17 0.02 0.00 0.00 175.26 173.50 1z8m s LEU 76 N -2.92 1.97 -0.06 1.80 2.96 0.15 0.13 118.68 122.71 1z8m s LEU 76 Ca 0.12 -0.48 0.05 0.00 -0.22 0.00 0.00 54.13 53.60 1z8m s LEU 76 Cb 0.03 -1.24 -0.00 0.00 0.50 0.00 0.00 46.19 45.48 1z8m s LEU 76 CO -0.04 0.14 -0.21 0.27 -1.32 0.00 0.00 176.35 175.19 1z8m s ILE 77 N 0.35 1.76 -0.09 6.68 -5.25 -0.91 -1.80 121.20 121.93 1z8m s ILE 77 Ca -0.15 -0.88 -0.27 0.00 -0.99 0.00 0.00 60.65 58.35 1z8m s ILE 77 Cb -0.17 -1.52 -0.02 0.00 2.95 0.00 0.00 42.46 43.71 1z8m s ILE 77 CO 0.07 0.50 0.90 -0.76 -1.79 0.00 0.00 174.94 173.86 1z8m s LEU 78 N 0.12 4.26 -0.05 0.37 1.43 -1.12 -0.22 118.68 123.48 1z8m s LEU 78 Ca -0.09 1.41 -0.02 0.00 -1.03 0.00 0.00 54.13 54.40 1z8m s LEU 78 Cb -0.14 -3.40 -0.01 0.00 0.03 0.00 0.00 46.19 42.67 1z8m s LEU 78 CO 0.05 -0.34 -0.04 0.25 0.23 0.00 0.00 176.35 176.50 1z8m h LEU 79 N 7.65 0.00 -7.51 1.79 5.85 0.56 -2.74 115.31 120.91 1z8m h LEU 79 Ca -0.34 0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.45 1z8m h LEU 79 Cb 1.17 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 42.11 1z8m h LEU 79 CO 0.81 0.24 0.30 0.00 -0.34 0.00 0.00 178.44 179.46 1z8m s ARG 80 N -1.35 1.40 -0.04 1.25 3.03 -0.56 -1.55 118.95 121.13 1z8m s ARG 80 Ca -0.03 -0.69 0.05 0.00 2.03 0.00 0.00 55.73 57.09 1z8m s ARG 80 Cb 0.00 0.54 -0.01 0.00 -1.03 0.00 0.00 34.95 34.46 1z8m s ARG 80 CO 0.04 -0.63 -0.19 -1.17 -1.13 0.00 0.00 175.30 172.22 1z8m s LEU 81 N -2.82 1.96 0.00 -1.89 1.98 -1.26 0.12 118.68 116.76 1z8m s LEU 81 Ca 0.07 -0.39 -0.04 0.00 -2.89 0.00 0.00 54.13 50.89 1z8m s LEU 81 Cb -0.03 -1.06 0.01 0.00 0.66 0.00 0.00 46.19 45.78 1z8m s LEU 81 CO -0.02 0.18 0.19 0.61 -1.89 0.00 0.00 176.35 175.42 1z8m n GLY 82 N 3.06 1.60 0.00 7.98 0.00 -1.06 -4.69 105.19 112.09 1z8m n GLY 82 Ca -0.18 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1z8m n GLY 82 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1z8m n SER 83 N -1.01 0.81 0.16 1.61 2.88 -1.26 -1.33 113.62 115.47 1z8m n SER 83 Ca -0.02 -0.80 0.02 0.00 -1.33 0.00 0.00 58.87 56.75 1z8m n SER 83 Cb 0.13 0.00 0.22 0.00 -0.75 0.00 0.00 64.21 63.81 1z8m n SER 83 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 1z8m h HIS 84 N 0.80 0.00 0.00 0.66 2.76 -1.91 -1.70 115.15 115.76 1z8m h HIS 84 Ca 0.00 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.10 1z8m h HIS 84 Cb 0.00 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 1z8m h HIS 84 CO 0.00 0.51 -0.87 1.03 -1.30 0.00 0.00 177.93 177.30 1z8m h SER 85 N 0.00 0.00 0.00 3.26 0.87 -1.97 -2.95 113.55 112.76 1z8m h SER 85 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1z8m h SER 85 Cb 1.07 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 1z8m h SER 85 CO 0.07 0.27 -0.03 -0.08 -0.53 0.00 0.00 176.83 176.52 1z8m h GLU 86 N 0.00 0.00 -0.94 2.24 4.22 -1.92 -3.39 114.58 114.78 1z8m h GLU 86 Ca -0.05 0.00 0.01 0.00 0.08 0.00 0.00 59.36 59.40 1z8m h GLU 86 Cb 1.25 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.45 1z8m h GLU 86 CO 0.03 0.00 0.62 -0.07 -2.18 0.00 0.00 179.01 177.41 1z8m h LEU 87 N -0.09 1.07 -1.62 1.64 3.38 -1.53 -3.47 115.31 114.69 1z8m h LEU 87 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1z8m h LEU 87 Cb 0.03 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.52 1z8m h LEU 87 CO 0.00 0.77 0.00 0.49 0.09 0.00 0.00 178.44 179.79