#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f09 s GLN 2 N 0.00 1.23 -0.15 3.17 -0.21 -1.26 -4.98 119.66 117.46 2f09 s GLN 2 Ca 0.00 -0.36 -0.29 0.00 0.02 0.00 0.00 55.36 54.73 2f09 s GLN 2 Cb 0.00 -1.96 -0.01 0.00 1.00 0.00 0.00 33.01 32.04 2f09 s GLN 2 CO 0.00 -1.99 1.10 0.99 -2.12 0.00 0.00 175.29 173.28 2f09 s THR 3 N -3.66 4.55 0.70 -0.19 2.01 -1.26 -4.88 115.64 112.91 2f09 s THR 3 Ca 0.69 1.86 -0.15 0.00 0.31 0.00 0.00 61.69 64.39 2f09 s THR 3 Cb -0.06 -4.20 0.02 0.00 0.01 0.00 0.00 72.50 68.27 2f09 s THR 3 CO 0.50 -0.09 1.17 -0.62 -0.69 0.00 0.00 174.62 174.89 2f09 s ASP 4 N 1.38 4.56 -0.08 3.53 2.15 -0.47 -4.68 116.67 123.05 2f09 s ASP 4 Ca 0.49 2.23 -0.16 0.00 0.43 0.00 0.00 52.55 55.55 2f09 s ASP 4 Cb -0.19 -2.58 0.03 0.00 -0.30 0.00 0.00 42.92 39.89 2f09 s ASP 4 CO 0.14 -2.01 0.39 -0.89 -0.17 0.00 0.00 175.17 172.62 2f09 s THR 5 N -2.09 0.03 0.00 1.71 2.01 -0.86 0.48 115.64 116.92 2f09 s THR 5 Ca 0.72 -0.22 0.00 0.00 0.31 0.00 0.00 61.69 62.50 2f09 s THR 5 Cb -0.26 -0.63 0.00 0.00 0.01 0.00 0.00 72.50 71.62 2f09 s THR 5 CO 0.43 -0.12 0.00 0.18 -0.69 0.00 0.00 174.62 174.42 2f09 n LEU 6 N 1.97 0.00 0.17 4.42 4.32 -1.24 -4.10 117.00 122.52 2f09 n LEU 6 Ca -0.17 0.00 0.13 0.00 -0.02 0.00 0.00 56.01 55.95 2f09 n LEU 6 Cb 0.57 0.00 0.43 0.00 -1.62 0.00 0.00 43.42 42.80 2f09 n LEU 6 CO 0.18 -0.33 0.88 -0.08 -1.22 0.00 0.00 177.39 176.83 2f09 h GLU 7 N 0.00 0.00 -1.98 3.23 4.81 -1.84 -3.45 114.58 115.35 2f09 h GLU 7 Ca 0.00 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.01 2f09 h GLU 7 Cb 0.00 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.31 2f09 h GLU 7 CO 0.00 0.00 -0.22 2.48 -0.73 0.00 0.00 179.01 180.54 2f09 n TYR 8 N -2.57 -0.68 -3.63 0.92 0.18 -1.04 -4.88 117.16 105.45 2f09 n TYR 8 Ca 0.03 0.00 -0.29 0.00 1.88 0.00 0.00 57.90 59.52 2f09 n TYR 8 Cb 0.37 -2.35 -0.14 0.00 -0.38 0.00 0.00 39.34 36.84 2f09 n TYR 8 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 2f09 s GLN 9 N -3.35 0.62 -0.00 -3.48 -0.21 -1.26 -2.87 119.66 109.11 2f09 s GLN 9 Ca 0.00 -1.09 0.01 0.00 0.02 0.00 0.00 55.36 54.30 2f09 s GLN 9 Cb 0.00 -1.69 -0.00 0.00 1.00 0.00 0.00 33.01 32.32 2f09 s GLN 9 CO 0.00 -1.06 -0.03 0.00 -2.12 0.00 0.00 175.29 172.08 2f09 h ASP 11 N 6.06 0.00 0.05 0.00 3.58 -1.97 -2.75 116.42 121.38 2f09 h ASP 11 Ca -0.26 0.00 -0.24 0.00 0.42 0.00 0.00 57.03 56.95 2f09 h ASP 11 Cb 1.20 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.23 2f09 h ASP 11 CO 0.50 0.03 -1.26 -0.33 -2.88 0.00 0.00 179.24 175.31 2f09 h GLU 12 N 0.00 0.10 -3.44 0.28 4.39 -1.92 -3.48 114.58 110.52 2f09 h GLU 12 Ca -0.00 -0.18 -0.20 0.00 0.34 0.00 0.00 59.36 59.33 2f09 h GLU 12 Cb 0.07 0.07 -0.27 0.00 -0.10 0.00 0.00 28.75 28.52 2f09 h GLU 12 CO 0.00 1.09 -0.57 0.15 -1.16 0.00 0.00 179.01 178.52 2f09 s LYS 13 N -2.40 0.16 -0.11 2.33 -0.14 -1.04 -5.10 119.74 113.44 2f09 s LYS 13 Ca -0.24 0.15 -0.30 0.00 -1.36 0.00 0.00 55.97 54.22 2f09 s LYS 13 Cb 0.05 0.08 -0.03 0.00 -1.68 0.00 0.00 37.83 36.24 2f09 s LYS 13 CO 0.68 -0.02 1.34 -2.14 -0.76 0.00 0.00 175.35 174.44 2f09 s PRO 14 N 0.00 4.25 -0.90 -1.68 0.02 -1.26 -2.99 135.00 132.44 2f09 s PRO 14 Ca -0.01 1.79 -0.01 0.00 0.02 0.00 0.00 61.00 62.80 2f09 s PRO 14 Cb -0.01 -3.75 0.25 0.00 0.02 0.00 0.00 34.50 31.01 2f09 s PRO 14 CO 0.00 -0.68 0.96 -0.11 -0.33 0.00 0.00 177.00 176.85 2f09 n LEU 15 N 6.33 4.71 -4.45 -5.54 7.94 -1.14 -4.65 117.00 120.19 2f09 n LEU 15 Ca 0.14 -5.22 -0.43 0.00 -1.11 0.00 0.00 56.01 49.39 2f09 n LEU 15 Cb 0.45 -1.07 -0.04 0.00 0.53 0.00 0.00 43.42 43.29 2f09 n LEU 15 CO 0.57 1.69 0.77 -0.89 -1.11 0.00 0.00 177.39 178.42 2f09 s THR 16 N -1.96 4.36 -0.10 1.96 2.01 -1.26 -2.50 115.64 118.16 2f09 s THR 16 Ca 0.31 -0.47 -0.18 0.00 0.31 0.00 0.00 61.69 61.66 2f09 s THR 16 Cb 0.00 -4.69 -0.04 0.00 0.01 0.00 0.00 72.50 67.78 2f09 s THR 16 CO -0.04 -1.46 0.49 -0.69 -0.69 0.00 0.00 174.62 172.23 2f09 s VAL 17 N 3.94 5.14 -0.89 3.82 1.01 -1.26 -3.71 120.40 128.45 2f09 s VAL 17 Ca 0.23 1.00 -0.12 0.00 0.00 0.00 0.00 61.98 63.08 2f09 s VAL 17 Cb -0.16 -3.83 0.23 0.00 0.00 0.00 0.00 36.38 32.62 2f09 s VAL 17 CO 0.08 0.35 0.84 -0.54 0.00 0.00 0.00 175.10 175.83 2f09 s LYS 18 N 0.43 3.71 -0.85 2.72 3.01 0.87 -3.71 119.74 125.93 2f09 s LYS 18 Ca 0.27 -2.65 -0.25 0.00 -1.01 0.00 0.00 55.97 52.33 2f09 s LYS 18 Cb -0.16 -4.43 -0.04 0.00 -1.01 0.00 0.00 37.83 32.20 2f09 s LYS 18 CO 0.12 -1.28 1.89 -0.51 0.51 0.00 0.00 175.35 176.08 2f09 s LEU 19 N -0.19 3.21 -1.09 3.17 1.43 0.18 -1.75 118.68 123.64 2f09 s LEU 19 Ca 0.21 -0.51 -0.22 0.00 -1.03 0.00 0.00 54.13 52.58 2f09 s LEU 19 Cb -0.10 -2.55 0.04 0.00 0.03 0.00 0.00 46.19 43.61 2f09 s LEU 19 CO -0.09 -2.59 1.58 0.21 0.23 0.00 0.00 176.35 175.70 2f09 s ASN 20 N 7.81 6.44 0.19 2.29 3.84 0.50 -1.37 114.94 134.63 2f09 s ASN 20 Ca 0.68 -1.67 -0.24 0.00 0.21 0.00 0.00 52.86 51.84 2f09 s ASN 20 Cb -0.08 -2.57 0.08 0.00 -0.55 0.00 0.00 41.25 38.13 2f09 s ASN 20 CO 0.03 -1.57 1.56 -1.13 -2.79 0.00 0.00 177.10 173.20 2f09 h ASN 21 N 9.31 -1.61 1.01 -4.21 -0.73 -1.90 0.44 115.58 117.90 2f09 h ASN 21 Ca 0.26 0.28 0.00 0.00 1.87 0.00 0.00 56.30 58.71 2f09 h ASN 21 Cb 0.97 0.76 0.00 0.00 0.27 0.00 0.00 38.32 40.32 2f09 h ASN 21 CO 1.41 -0.30 0.00 -0.65 -0.37 0.00 0.00 177.43 177.52 2f09 h PRO 22 N -0.11 0.00 0.00 6.67 0.11 -1.96 -2.85 132.00 133.86 2f09 h PRO 22 Ca 0.23 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 66.14 2f09 h PRO 22 Cb 0.54 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.62 2f09 h PRO 22 CO -0.83 0.00 -1.77 0.54 -0.21 0.00 0.00 178.00 175.73 2f09 n ARG 23 N -2.98 0.65 -2.17 1.05 5.12 -0.32 -4.96 116.66 113.04 2f09 n ARG 23 Ca 0.01 0.09 -0.21 0.00 -1.93 0.00 0.00 57.85 55.81 2f09 n ARG 23 Cb 0.30 -1.68 -0.03 0.00 -1.16 0.00 0.00 32.46 29.89 2f09 n ARG 23 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2f09 n GLN 24 N -2.75 -1.62 -4.32 5.56 6.02 0.14 -4.86 117.38 115.55 2f09 n GLN 24 Ca -0.15 1.08 -0.24 0.00 -0.01 0.00 0.00 57.00 57.68 2f09 n GLN 24 Cb 0.88 -5.67 -0.08 0.00 1.02 0.00 0.00 30.24 26.40 2f09 n GLN 24 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 2f09 s GLU 25 N -4.68 2.17 -0.04 -1.09 -1.05 -1.20 -0.56 118.70 112.24 2f09 s GLU 25 Ca 0.00 -1.45 0.03 0.00 -0.15 0.00 0.00 54.97 53.40 2f09 s GLU 25 Cb 0.00 -2.10 0.00 0.00 -0.44 0.00 0.00 34.13 31.59 2f09 s GLU 25 CO 0.00 0.37 -0.13 0.14 0.95 0.00 0.00 175.26 176.59 2f09 s VAL 26 N -2.27 1.11 -0.31 1.83 -7.23 0.12 -0.37 120.40 113.28 2f09 s VAL 26 Ca 0.30 -0.52 -0.09 0.00 -1.81 0.00 0.00 61.98 59.87 2f09 s VAL 26 Cb -0.07 -0.98 -0.00 0.00 0.56 0.00 0.00 36.38 35.89 2f09 s VAL 26 CO 0.18 0.34 0.14 -0.44 -0.31 0.00 0.00 175.10 175.01 2f09 s SER 27 N 0.28 5.47 0.48 4.85 0.01 -0.72 -0.17 113.70 123.90 2f09 s SER 27 Ca -0.07 -0.56 0.05 0.00 1.31 0.00 0.00 55.95 56.69 2f09 s SER 27 Cb -0.12 -1.98 -0.01 0.00 0.21 0.00 0.00 66.02 64.13 2f09 s SER 27 CO 0.02 -0.19 0.24 0.72 0.41 0.00 0.00 173.24 174.44 2f09 s PHE 28 N 1.59 2.11 -0.35 2.43 -0.71 0.14 -0.09 117.98 123.10 2f09 s PHE 28 Ca 0.04 -0.75 -0.09 0.00 -1.04 0.00 0.00 56.93 55.10 2f09 s PHE 28 Cb -0.17 -1.89 0.03 0.00 -1.21 0.00 0.00 43.02 39.78 2f09 s PHE 28 CO 0.05 -0.07 0.15 0.08 -1.34 0.00 0.00 175.22 174.10 2f09 s VAL 29 N -2.71 4.21 0.16 -2.49 1.01 -1.24 -0.59 120.40 118.74 2f09 s VAL 29 Ca 0.32 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 2f09 s VAL 29 Cb 0.01 -3.35 0.03 0.00 0.00 0.00 0.00 36.38 33.07 2f09 s VAL 29 CO 0.19 -0.18 1.61 0.22 0.00 0.00 0.00 175.10 176.94 2f09 h TYR 30 N 8.33 1.01 0.00 5.22 3.20 -1.74 -3.46 116.97 129.53 2f09 h TYR 30 Ca -0.25 -0.17 0.00 0.00 3.14 0.00 0.00 58.73 61.45 2f09 h TYR 30 Cb 1.10 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.10 2f09 h TYR 30 CO 0.58 0.93 0.00 -3.47 -1.64 0.00 0.00 178.16 174.56 2f09 n ASP 31 N -4.29 -3.72 -2.77 -2.11 2.03 -1.26 -4.96 116.55 99.47 2f09 n ASP 31 Ca 0.01 0.87 -0.01 0.00 0.52 0.00 0.00 54.79 56.19 2f09 n ASP 31 Cb 0.32 3.51 0.08 0.00 -0.72 0.00 0.00 41.12 44.31 2f09 n ASP 31 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2f09 n ASN 32 N -3.40 0.48 -3.74 1.67 5.15 -1.26 -4.96 115.26 109.20 2f09 n ASN 32 Ca 0.00 -2.12 -0.13 0.00 -0.60 0.00 0.00 54.58 51.74 2f09 n ASN 32 Cb 0.00 -0.06 -0.08 0.00 -0.53 0.00 0.00 39.78 39.11 2f09 n ASN 32 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2f09 s GLN 33 N -2.39 0.76 -0.21 1.20 -2.07 -1.26 -5.13 119.66 110.56 2f09 s GLN 33 Ca 0.21 -0.34 -0.02 0.00 -1.82 0.00 0.00 55.36 53.39 2f09 s GLN 33 Cb 0.37 0.33 0.01 0.00 -1.09 0.00 0.00 33.01 32.63 2f09 s GLN 33 CO -0.07 -0.23 -0.10 -0.51 -1.32 0.00 0.00 175.29 173.06 2f09 s LEU 34 N -1.71 2.66 0.13 2.60 2.01 -1.25 -1.98 118.68 121.14 2f09 s LEU 34 Ca -0.09 -0.54 0.08 0.00 0.01 0.00 0.00 54.13 53.59 2f09 s LEU 34 Cb -0.03 -1.64 -0.04 0.00 0.01 0.00 0.00 46.19 44.49 2f09 s LEU 34 CO 0.00 -0.03 -0.19 -1.48 1.01 0.00 0.00 176.35 175.67 2f09 s LEU 35 N 1.40 2.37 0.21 1.79 2.34 0.24 -4.86 118.68 122.16 2f09 s LEU 35 Ca 0.05 -0.77 0.08 0.00 0.06 0.00 0.00 54.13 53.55 2f09 s LEU 35 Cb -0.14 -0.80 -0.04 0.00 -0.56 0.00 0.00 46.19 44.64 2f09 s LEU 35 CO -0.07 -0.01 0.04 -1.38 -1.06 0.00 0.00 176.35 173.87 2f09 s HIS 36 N -1.65 2.87 0.03 3.48 -3.43 -1.25 0.29 115.29 115.62 2f09 s HIS 36 Ca 0.10 -0.15 -0.08 0.00 -0.80 0.00 0.00 55.06 54.13 2f09 s HIS 36 Cb -0.08 -1.34 -0.00 0.00 -1.43 0.00 0.00 32.58 29.73 2f09 s HIS 36 CO 0.05 0.54 0.16 -0.51 -2.00 0.00 0.00 174.74 172.98 2f09 s LEU 37 N -3.27 1.51 0.06 5.38 1.02 0.76 -4.52 118.68 119.62 2f09 s LEU 37 Ca 0.29 -0.37 0.06 0.00 0.02 0.00 0.00 54.13 54.14 2f09 s LEU 37 Cb -0.08 0.81 -0.04 0.00 0.02 0.00 0.00 46.19 46.90 2f09 s LEU 37 CO 0.20 -0.50 -0.10 -1.59 0.02 0.00 0.00 176.35 174.38 2f09 s LYS 38 N -2.30 2.26 -0.29 1.70 -2.85 -1.07 0.13 119.74 117.32 2f09 s LYS 38 Ca -0.07 -0.92 -0.15 0.00 -1.00 0.00 0.00 55.97 53.83 2f09 s LYS 38 Cb -0.03 -2.35 -0.03 0.00 -2.06 0.00 0.00 37.83 33.37 2f09 s LYS 38 CO -0.03 0.54 0.38 -1.14 0.10 0.00 0.00 175.35 175.21 2f09 s GLN 39 N -1.82 3.88 0.00 1.78 -0.44 0.27 0.19 119.66 123.53 2f09 s GLN 39 Ca 0.19 -0.07 0.00 0.00 -2.50 0.00 0.00 55.36 52.97 2f09 s GLN 39 Cb -0.11 -3.70 0.00 0.00 -1.64 0.00 0.00 33.01 27.56 2f09 s GLN 39 CO 0.10 -0.37 0.00 0.41 0.50 0.00 0.00 175.29 175.94 2f09 n GLY 40 N 4.75 0.00 1.87 2.59 0.00 -1.08 -4.91 105.19 108.41 2f09 n GLY 40 Ca -0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.76 2f09 n GLY 40 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2f09 n ILE 41 N -0.08 2.64 -2.47 -0.61 3.06 -1.25 -4.83 119.36 115.82 2f09 n ILE 41 Ca 0.00 -1.54 -0.41 0.00 -2.50 0.00 0.00 62.75 58.31 2f09 n ILE 41 Cb 0.00 -0.95 -0.01 0.00 0.54 0.00 0.00 39.64 39.22 2f09 n ILE 41 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 2f09 n SER 42 N -0.28 4.61 0.14 9.51 3.41 -1.26 -4.67 113.62 125.07 2f09 n SER 42 Ca 0.38 -2.88 -0.01 0.00 -0.26 0.00 0.00 58.87 56.10 2f09 n SER 42 Cb 0.95 -1.74 0.23 0.00 -0.26 0.00 0.00 64.21 63.38 2f09 n SER 42 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2f09 h ALA 43 N 7.87 1.10 -2.64 7.33 0.00 -1.97 -3.45 119.26 127.50 2f09 h ALA 43 Ca 0.42 -0.47 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 2f09 h ALA 43 Cb 0.87 -0.08 -0.19 0.00 0.00 0.00 0.00 17.79 18.38 2f09 h ALA 43 CO 1.44 0.65 -0.41 -1.12 0.00 0.00 0.00 179.25 179.80 2f09 s SER 44 N -6.88 -0.02 1.95 0.00 0.01 -1.26 -5.08 113.70 102.42 2f09 s SER 44 Ca -0.03 -0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.04 2f09 s SER 44 Cb 0.13 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.61 2f09 s SER 44 CO 0.76 -0.44 0.00 0.61 0.41 0.00 0.00 173.24 174.58 2f09 n GLY 45 N 1.18 3.75 3.19 3.44 0.00 -1.26 -4.47 105.19 111.02 2f09 n GLY 45 Ca -0.21 -0.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.66 2f09 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f09 s ALA 46 N -1.66 -0.89 -0.18 4.61 0.00 -0.45 -4.88 121.76 118.31 2f09 s ALA 46 Ca 0.00 1.34 0.01 0.00 0.00 0.00 0.00 51.96 53.31 2f09 s ALA 46 Cb 0.00 -0.90 0.03 0.00 0.00 0.00 0.00 23.12 22.26 2f09 s ALA 46 CO 0.00 -0.32 -0.12 1.03 0.00 0.00 0.00 175.76 176.35 2f09 s ARG 47 N 1.56 2.11 -0.38 0.00 0.52 -1.26 -0.37 118.95 121.12 2f09 s ARG 47 Ca -0.08 -0.71 -0.18 0.00 -0.52 0.00 0.00 55.73 54.24 2f09 s ARG 47 Cb -0.10 -2.27 0.00 0.00 0.52 0.00 0.00 34.95 33.11 2f09 s ARG 47 CO -0.11 -0.35 0.48 0.71 0.02 0.00 0.00 175.30 176.04 2f09 s TYR 48 N 1.45 3.17 -0.11 -0.53 2.02 -0.96 -2.63 117.35 119.75 2f09 s TYR 48 Ca 0.01 -0.05 -0.07 0.00 -0.37 0.00 0.00 57.07 56.59 2f09 s TYR 48 Cb -0.15 -2.91 0.04 0.00 -0.40 0.00 0.00 41.96 38.54 2f09 s TYR 48 CO -0.09 -0.60 0.27 0.99 -1.57 0.00 0.00 175.55 174.54 2f09 s THR 49 N 2.30 -0.02 -0.43 -0.71 2.01 0.13 -0.00 115.64 118.91 2f09 s THR 49 Ca 0.16 0.07 0.08 0.00 0.31 0.00 0.00 61.69 62.31 2f09 s THR 49 Cb -0.16 -0.40 0.29 0.00 0.01 0.00 0.00 72.50 72.24 2f09 s THR 49 CO 0.14 0.03 0.83 -0.67 -0.69 0.00 0.00 174.62 174.26 2f09 n ASP 50 N 3.63 -1.22 0.00 3.53 2.03 -1.22 -2.60 116.55 120.69 2f09 n ASP 50 Ca -0.19 -3.21 0.00 0.00 0.52 0.00 0.00 54.79 51.91 2f09 n ASP 50 Cb 0.56 0.75 0.00 0.00 -0.72 0.00 0.00 41.12 41.71 2f09 n ASP 50 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2f09 n GLY 51 N 0.95 1.07 0.13 0.27 0.00 -1.26 -4.52 105.19 101.83 2f09 n GLY 51 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 2f09 n GLY 51 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2f09 h ILE 52 N 0.00 0.95 -4.18 -0.61 2.04 -1.95 -3.48 117.51 110.28 2f09 h ILE 52 Ca 0.00 -2.41 -0.26 0.00 1.00 0.00 0.00 64.86 63.19 2f09 h ILE 52 Cb 0.00 2.68 -0.09 0.00 -0.74 0.00 0.00 36.82 38.67 2f09 h ILE 52 CO 0.00 0.75 -0.25 -0.31 0.00 0.00 0.00 178.15 178.34 2f09 s TYR 53 N -2.51 1.05 -0.14 1.37 2.02 -1.26 -4.80 117.35 113.08 2f09 s TYR 53 Ca -0.20 -1.26 -0.01 0.00 -0.37 0.00 0.00 57.07 55.23 2f09 s TYR 53 Cb 0.05 -0.15 0.04 0.00 -0.40 0.00 0.00 41.96 41.50 2f09 s TYR 53 CO 0.78 -1.05 -0.02 0.08 -1.57 0.00 0.00 175.55 173.78 2f09 s VAL 54 N -3.32 0.77 -0.14 0.71 1.01 -1.22 -3.44 120.40 114.76 2f09 s VAL 54 Ca 0.31 -0.39 -0.13 0.00 0.00 0.00 0.00 61.98 61.78 2f09 s VAL 54 Cb 0.01 -1.01 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 2f09 s VAL 54 CO 0.19 0.10 0.27 -0.36 0.00 0.00 0.00 175.10 175.29 2f09 s PHE 55 N 1.78 3.51 -0.22 5.22 0.40 0.99 -0.69 117.98 128.97 2f09 s PHE 55 Ca 0.02 0.60 0.02 0.00 -0.60 0.00 0.00 56.93 56.97 2f09 s PHE 55 Cb -0.15 -2.26 0.04 0.00 0.51 0.00 0.00 43.02 41.17 2f09 s PHE 55 CO -0.07 0.36 -0.13 -0.46 0.70 0.00 0.00 175.22 175.62 2f09 s TRP 56 N 0.05 2.88 -0.34 0.36 -0.00 0.94 -2.27 118.94 120.57 2f09 s TRP 56 Ca 0.16 -1.94 -0.13 0.00 -0.00 0.00 0.00 56.10 54.20 2f09 s TRP 56 Cb -0.13 -1.84 -0.02 0.00 -0.00 0.00 0.00 33.47 31.49 2f09 s TRP 56 CO 0.04 -0.82 0.23 0.45 -0.00 0.00 0.00 176.95 176.86 2f09 s SER 57 N 1.24 6.01 0.00 5.86 0.15 0.50 -0.87 113.70 126.59 2f09 s SER 57 Ca -0.03 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.17 2f09 s SER 57 Cb -0.17 -2.13 0.00 0.00 -1.71 0.00 0.00 66.02 62.01 2f09 s SER 57 CO -0.08 -0.24 0.00 0.29 1.20 0.00 0.00 173.24 174.41 2f09 n LYS 58 N 5.10 3.91 -1.97 5.44 5.02 -0.09 -1.34 118.16 134.23 2f09 n LYS 58 Ca -0.13 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.79 2f09 n LYS 58 Cb 0.50 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.47 2f09 n LYS 58 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f09 n GLY 59 N 5.00 2.15 2.08 0.72 0.00 -1.26 -3.78 105.19 110.11 2f09 n GLY 59 Ca 0.00 -1.12 -0.00 0.00 0.00 0.00 0.00 46.02 44.90 2f09 n GLY 59 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f09 n ASP 60 N 10.39 -3.25 -4.30 1.61 8.00 -1.26 -5.00 116.55 122.74 2f09 n ASP 60 Ca 0.48 0.01 -0.30 0.00 0.71 0.00 0.00 54.79 55.68 2f09 n ASP 60 Cb 0.44 -0.79 -0.16 0.00 -0.02 0.00 0.00 41.12 40.59 2f09 n ASP 60 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2f09 s GLU 61 N -0.60 2.01 -0.16 -1.24 -1.05 -1.25 -0.13 118.70 116.28 2f09 s GLU 61 Ca 0.00 -0.92 0.01 0.00 -0.15 0.00 0.00 54.97 53.91 2f09 s GLU 61 Cb 0.00 -1.97 0.02 0.00 -0.44 0.00 0.00 34.13 31.75 2f09 s GLU 61 CO 0.00 0.54 -0.15 0.00 0.95 0.00 0.00 175.26 176.59 2f09 s ALA 62 N -0.61 2.02 -0.09 -0.84 0.00 -0.06 -0.91 121.76 121.27 2f09 s ALA 62 Ca 0.10 -1.04 0.02 0.00 0.00 0.00 0.00 51.96 51.03 2f09 s ALA 62 Cb -0.10 -1.12 -0.02 0.00 0.00 0.00 0.00 23.12 21.88 2f09 s ALA 62 CO -0.01 -0.43 -0.14 0.99 0.00 0.00 0.00 175.76 176.17 2f09 s THR 63 N 1.41 3.02 -0.28 0.00 2.01 -0.05 -3.36 115.64 118.38 2f09 s THR 63 Ca 0.04 -0.70 0.02 0.00 0.31 0.00 0.00 61.69 61.35 2f09 s THR 63 Cb -0.13 -2.22 0.08 0.00 0.01 0.00 0.00 72.50 70.23 2f09 s THR 63 CO -0.11 0.56 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.68 2f09 s VAL 64 N -0.14 1.74 -0.23 3.82 1.01 -1.26 -0.04 120.40 125.30 2f09 s VAL 64 Ca -0.01 -1.65 -0.02 0.00 0.00 0.00 0.00 61.98 60.29 2f09 s VAL 64 Cb -0.14 -2.12 0.07 0.00 0.00 0.00 0.00 36.38 34.20 2f09 s VAL 64 CO 0.03 -0.34 0.05 -0.47 0.00 0.00 0.00 175.10 174.38 2f09 s TYR 65 N 1.24 1.23 0.43 5.22 6.14 0.13 -1.63 117.35 130.11 2f09 s TYR 65 Ca 0.01 -1.14 -0.01 0.00 0.64 0.00 0.00 57.07 56.58 2f09 s TYR 65 Cb -0.19 -1.22 -0.02 0.00 0.42 0.00 0.00 41.96 40.95 2f09 s TYR 65 CO -0.10 -0.70 0.66 0.21 0.64 0.00 0.00 175.55 176.26 2f09 s LYS 66 N 1.79 3.29 0.42 4.97 2.20 -0.10 -3.44 119.74 128.86 2f09 s LYS 66 Ca 0.02 -0.29 0.18 0.00 -0.36 0.00 0.00 55.97 55.52 2f09 s LYS 66 Cb -0.17 -2.55 1.09 0.00 -1.51 0.00 0.00 37.83 34.69 2f09 s LYS 66 CO -0.14 -0.13 1.87 0.00 -0.36 0.00 0.00 175.35 176.58 2f09 h ARG 67 N 0.46 0.38 0.06 4.03 3.08 -1.96 -2.19 114.38 118.25 2f09 h ARG 67 Ca -0.47 -0.02 -0.32 0.00 0.07 0.00 0.00 59.98 59.23 2f09 h ARG 67 Cb 1.23 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 31.16 2f09 h ARG 67 CO 0.60 0.25 -1.78 -0.44 -1.07 0.00 0.00 179.97 177.53 2f09 h ASP 68 N 0.40 0.19 -2.87 7.04 3.32 -1.94 -3.47 116.42 119.07 2f09 h ASP 68 Ca 0.45 -0.40 0.08 0.00 0.02 0.00 0.00 57.03 57.19 2f09 h ASP 68 Cb 1.14 -0.06 -0.26 0.00 0.22 0.00 0.00 39.33 40.37 2f09 h ASP 68 CO -0.16 1.35 0.39 -0.60 -1.72 0.00 0.00 179.24 178.50 2f09 s ARG 69 N -2.59 0.46 0.23 3.56 3.52 -0.82 -5.13 118.95 118.18 2f09 s ARG 69 Ca -0.11 0.67 -0.26 0.00 -0.13 0.00 0.00 55.73 55.90 2f09 s ARG 69 Cb 0.07 0.16 -0.09 0.00 -1.56 0.00 0.00 34.95 33.54 2f09 s ARG 69 CO 0.81 -0.08 0.85 0.42 -0.81 0.00 0.00 175.30 176.49 2f09 s ILE 70 N 0.85 4.29 -0.07 4.11 1.01 -1.26 -0.92 121.20 129.20 2f09 s ILE 70 Ca -0.03 1.77 0.04 0.00 0.00 0.00 0.00 60.65 62.43 2f09 s ILE 70 Cb -0.04 -4.12 -0.06 0.00 0.01 0.00 0.00 42.46 38.24 2f09 s ILE 70 CO -0.11 0.39 0.13 1.33 0.00 0.00 0.00 174.94 176.68 2f09 n VAL 71 N 1.22 0.00 0.00 2.92 0.24 -0.65 -4.96 118.33 117.11 2f09 n VAL 71 Ca -0.03 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.07 2f09 n VAL 71 Cb 0.49 0.60 0.00 0.00 -1.47 0.00 0.00 33.84 33.46 2f09 n VAL 71 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2f09 n LEU 72 N -1.46 0.00 -0.48 1.34 7.99 -1.23 -4.68 117.00 118.47 2f09 n LEU 72 Ca -0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 56.01 55.93 2f09 n LEU 72 Cb 0.10 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.38 2f09 n LEU 72 CO 0.09 0.00 -0.06 -3.20 -1.51 0.00 0.00 177.39 172.71 2f09 n ASN 73 N 0.00 -3.94 -2.82 -1.43 5.15 -1.26 -4.88 115.26 106.08 2f09 n ASN 73 Ca 0.00 0.16 -0.05 0.00 -0.60 0.00 0.00 54.58 54.09 2f09 n ASN 73 Cb 0.00 -2.00 0.00 0.00 -0.53 0.00 0.00 39.78 37.26 2f09 n ASN 73 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2f09 s ASN 74 N -2.77 -1.29 -0.03 1.20 2.47 -1.26 -4.95 114.94 108.31 2f09 s ASN 74 Ca 0.00 -1.76 -0.01 0.00 0.42 0.00 0.00 52.86 51.51 2f09 s ASN 74 Cb 0.00 1.77 0.02 0.00 -1.45 0.00 0.00 41.25 41.60 2f09 s ASN 74 CO 0.00 -0.06 0.07 0.00 -3.72 0.00 0.00 177.10 173.39 2f09 s GLN 76 N 0.78 0.50 0.27 0.00 -0.21 -1.26 -0.88 119.66 118.86 2f09 s GLN 76 Ca -0.06 -0.49 -0.29 0.00 0.02 0.00 0.00 55.36 54.53 2f09 s GLN 76 Cb -0.09 -1.90 -0.09 0.00 1.00 0.00 0.00 33.01 31.93 2f09 s GLN 76 CO -0.03 -0.76 1.15 -1.17 -2.12 0.00 0.00 175.29 172.36 2f09 s LEU 77 N 1.90 4.51 -0.07 2.90 2.96 0.81 -4.91 118.68 126.79 2f09 s LEU 77 Ca 0.03 2.32 -0.24 0.00 -0.22 0.00 0.00 54.13 56.02 2f09 s LEU 77 Cb -0.17 -3.63 -0.19 0.00 0.50 0.00 0.00 46.19 42.71 2f09 s LEU 77 CO -0.15 -0.24 0.92 0.06 -1.32 0.00 0.00 176.35 175.61 2f09 h GLN 78 N 4.04 -0.09 0.00 1.98 3.07 -1.93 -3.48 115.11 118.71 2f09 h GLN 78 Ca -0.47 0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.28 2f09 h GLN 78 Cb 1.21 0.02 0.00 0.00 0.08 0.00 0.00 27.48 28.79 2f09 h GLN 78 CO 0.68 0.49 0.00 -1.71 0.09 0.00 0.00 178.83 178.38 2f09 n ASN 79 N -4.82 0.00 0.00 0.06 2.85 -1.26 -5.04 115.26 107.05 2f09 n ASN 79 Ca -0.08 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.51 2f09 n ASN 79 Cb 0.31 0.00 0.73 0.00 1.24 0.00 0.00 39.78 42.06 2f09 n ASN 79 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2f09 n PRO 80 N -0.36 0.86 -2.19 1.20 -0.04 -1.26 -4.64 135.00 128.57 2f09 n PRO 80 Ca 0.00 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.15 2f09 n PRO 80 Cb 0.00 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 31.96 2f09 n PRO 80 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 2f09 s GLN 81 N -2.00 2.84 0.00 0.54 -2.07 -1.26 -2.02 119.66 115.69 2f09 s GLN 81 Ca 0.37 -1.23 0.09 0.00 -1.82 0.00 0.00 55.36 52.78 2f09 s GLN 81 Cb 0.17 -5.29 0.07 0.00 -1.09 0.00 0.00 33.01 26.88 2f09 s GLN 81 CO 0.29 -3.50 0.80 0.54 -1.32 0.00 0.00 175.29 172.09