#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o78 h LYS 2 N 0.00 -0.11 0.00 0.03 1.79 -2.12 -3.19 116.57 112.96 1o78 h LYS 2 Ca 0.00 0.01 -0.15 0.00 -2.18 0.00 0.00 60.65 58.33 1o78 h LYS 2 Cb 0.00 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.65 1o78 h LYS 2 CO 0.00 0.01 -1.39 1.28 -1.08 0.00 0.00 179.45 178.26 1o78 n LEU 3 N -5.10 0.83 -1.55 2.94 7.99 -1.26 -5.07 117.00 115.77 1o78 n LEU 3 Ca -0.08 0.36 0.09 0.00 -0.01 0.00 0.00 56.01 56.37 1o78 n LEU 3 Cb 0.11 0.06 -0.05 0.00 -0.11 0.00 0.00 43.42 43.43 1o78 n LEU 3 CO 0.33 0.11 -0.59 1.17 -1.51 0.00 0.00 177.39 176.91 1o78 n LYS 4 N -2.85 -3.83 -1.71 3.23 4.81 -1.21 -4.63 118.16 111.96 1o78 n LYS 4 Ca -0.09 3.06 -0.42 0.00 -0.87 0.00 0.00 58.31 59.99 1o78 n LYS 4 Cb 0.80 -4.07 -0.03 0.00 0.02 0.00 0.00 35.03 31.75 1o78 n LYS 4 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1o78 s VAL 5 N -4.91 2.69 0.26 3.15 0.11 -1.26 -4.95 120.40 115.50 1o78 s VAL 5 Ca 0.00 0.07 -0.22 0.00 -2.93 0.00 0.00 61.98 58.90 1o78 s VAL 5 Cb 0.00 -3.04 -0.09 0.00 -1.53 0.00 0.00 36.38 31.72 1o78 s VAL 5 CO 0.00 -0.00 0.80 0.42 -3.33 0.00 0.00 175.10 172.99 1o78 s THR 6 N 3.22 4.45 0.30 5.04 -4.23 -1.26 -5.00 115.64 118.16 1o78 s THR 6 Ca 0.83 1.45 -0.30 0.00 -1.18 0.00 0.00 61.69 62.49 1o78 s THR 6 Cb -0.45 -3.90 -0.12 0.00 1.34 0.00 0.00 72.50 69.37 1o78 s THR 6 CO 0.37 0.17 1.45 0.55 -0.54 0.00 0.00 174.62 176.62 1o78 n VAL 7 N 0.62 1.34 -2.44 2.29 3.14 -1.26 -4.88 118.33 117.14 1o78 n VAL 7 Ca -0.01 -0.33 -0.03 0.00 -2.96 0.00 0.00 64.34 61.01 1o78 n VAL 7 Cb 0.51 -1.72 0.06 0.00 -1.06 0.00 0.00 33.84 31.63 1o78 n VAL 7 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 1o78 n ASN 8 N 1.64 -1.07 0.00 6.55 6.94 -1.26 -5.15 115.26 122.91 1o78 n ASN 8 Ca 0.08 -1.87 0.00 0.00 -0.02 0.00 0.00 54.58 52.76 1o78 n ASN 8 Cb 0.35 0.47 0.00 0.00 -2.36 0.00 0.00 39.78 38.24 1o78 n ASN 8 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1o78 n GLY 9 N -0.92 -0.94 3.85 4.83 0.00 -1.26 -5.14 105.19 105.61 1o78 n GLY 9 Ca -0.16 -1.28 -0.32 0.00 0.00 0.00 0.00 46.02 44.25 1o78 n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o78 s ALA 10 N -2.00 3.28 0.00 4.61 0.00 -1.26 -4.89 121.76 121.50 1o78 s ALA 10 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1o78 s ALA 10 Cb 0.00 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 20.30 1o78 s ALA 10 CO 0.00 0.25 0.00 0.41 0.00 0.00 0.00 175.76 176.42 1o78 n GLY 11 N -0.55 -2.15 0.47 0.00 0.00 -1.26 -5.00 105.19 96.71 1o78 n GLY 11 Ca 0.04 0.67 -0.19 0.00 0.00 0.00 0.00 46.02 46.55 1o78 n GLY 11 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1o78 h LYS 12 N 0.00 -1.03 -1.51 1.61 3.64 -1.91 -3.03 116.57 114.34 1o78 h LYS 12 Ca 0.00 0.07 0.09 0.00 -1.27 0.00 0.00 60.65 59.54 1o78 h LYS 12 Cb 0.00 0.23 -0.27 0.00 -0.41 0.00 0.00 32.23 31.78 1o78 h LYS 12 CO 0.00 -0.69 0.51 0.00 -2.27 0.00 0.00 179.45 177.01 1o78 s ALA 13 N -5.96 -2.05 0.00 5.00 0.00 -1.26 -0.76 121.76 116.73 1o78 s ALA 13 Ca -0.18 1.88 0.00 0.00 0.00 0.00 0.00 51.96 53.66 1o78 s ALA 13 Cb 0.04 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.63 1o78 s ALA 13 CO 0.61 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.55 1o78 n GLY 14 N 2.28 0.32 0.00 0.00 0.00 -1.26 -5.00 105.19 101.53 1o78 n GLY 14 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1o78 n GLY 14 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1o78 n GLU 15 N 0.00 1.93 -0.08 1.61 1.02 -1.26 -4.75 120.64 119.11 1o78 n GLU 15 Ca 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.20 1o78 n GLU 15 Cb 0.00 -0.98 0.10 0.00 -0.02 0.00 0.00 31.44 30.53 1o78 n GLU 15 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1o78 n GLY 16 N 3.18 3.94 3.65 0.62 0.00 -1.26 -4.99 105.19 110.33 1o78 n GLY 16 Ca 0.00 -0.64 -0.38 0.00 0.00 0.00 0.00 46.02 45.01 1o78 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o78 s GLU 17 N -2.02 4.10 -0.30 1.61 2.02 -1.26 -3.17 118.70 119.68 1o78 s GLU 17 Ca 0.20 -0.04 -0.27 0.00 0.02 0.00 0.00 54.97 54.88 1o78 s GLU 17 Cb 0.17 -3.56 0.01 0.00 0.10 0.00 0.00 34.13 30.85 1o78 s GLU 17 CO 0.03 -0.04 0.98 0.42 0.02 0.00 0.00 175.26 176.67 1o78 s ILE 18 N 1.33 4.63 0.16 -1.63 1.01 -1.23 -4.55 121.20 120.92 1o78 s ILE 18 Ca 0.13 1.60 -0.30 0.00 0.00 0.00 0.00 60.65 62.08 1o78 s ILE 18 Cb -0.14 -4.31 -0.07 0.00 0.01 0.00 0.00 42.46 37.94 1o78 s ILE 18 CO 0.07 -0.36 1.17 -2.16 0.00 0.00 0.00 174.94 173.66 1o78 s PRO 19 N 3.36 4.51 -0.10 2.79 0.04 -1.26 0.10 135.00 144.44 1o78 s PRO 19 Ca 0.41 1.81 -0.29 0.00 0.04 0.00 0.00 61.00 62.96 1o78 s PRO 19 Cb -0.13 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 31.12 1o78 s PRO 19 CO 0.13 -0.07 1.00 0.00 0.04 0.00 0.00 177.00 178.10 1o78 s ALA 20 N 0.10 3.38 0.31 8.56 0.00 -0.96 -4.80 121.76 128.34 1o78 s ALA 20 Ca 0.53 0.38 -0.28 0.00 0.00 0.00 0.00 51.96 52.58 1o78 s ALA 20 Cb -0.31 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.30 1o78 s ALA 20 CO 0.35 -0.56 1.10 -1.25 0.00 0.00 0.00 175.76 175.39 1o78 s PRO 21 N 1.90 4.53 0.34 0.00 0.04 -1.26 -2.23 135.00 138.33 1o78 s PRO 21 Ca 0.48 1.77 0.00 0.00 0.04 0.00 0.00 61.00 63.29 1o78 s PRO 21 Cb -0.18 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1o78 s PRO 21 CO 0.19 0.13 0.00 -0.11 0.04 0.00 0.00 177.00 177.24 1o78 n LEU 22 N 0.93 -6.23 -4.37 -3.56 0.00 -1.26 -4.90 117.00 97.61 1o78 n LEU 22 Ca 0.00 3.16 -0.29 0.00 0.00 0.00 0.00 56.01 58.87 1o78 n LEU 22 Cb 0.46 -3.02 0.23 0.00 0.00 0.00 0.00 43.42 41.09 1o78 n LEU 22 CO 0.53 -0.84 0.10 0.00 0.00 0.00 0.00 177.39 177.17 1o78 n ALA 23 N 0.76 -3.58 0.00 1.96 0.00 -1.26 -4.35 120.51 114.05 1o78 n ALA 23 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 53.44 52.13 1o78 n ALA 23 Cb 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 17.68 1o78 n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o78 n GLY 24 N 1.50 -1.46 3.07 0.00 0.00 0.83 -4.79 105.19 104.34 1o78 n GLY 24 Ca 0.02 -1.04 -0.16 0.00 0.00 0.00 0.00 46.02 44.84 1o78 n GLY 24 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1o78 s THR 25 N -2.22 0.72 0.03 2.61 2.01 -1.26 -1.08 115.64 116.45 1o78 s THR 25 Ca 0.00 -0.93 -0.24 0.00 0.31 0.00 0.00 61.69 60.83 1o78 s THR 25 Cb 0.00 -0.71 -0.05 0.00 0.01 0.00 0.00 72.50 71.75 1o78 s THR 25 CO 0.00 -0.18 0.72 -0.69 -0.69 0.00 0.00 174.62 173.78 1o78 s VAL 26 N -1.01 4.79 -0.02 3.82 1.01 -1.26 -2.11 120.40 125.62 1o78 s VAL 26 Ca -0.04 1.53 0.11 0.00 0.00 0.00 0.00 61.98 63.57 1o78 s VAL 26 Cb -0.08 -4.07 -0.16 0.00 0.00 0.00 0.00 36.38 32.07 1o78 s VAL 26 CO 0.01 0.37 0.22 -1.54 0.00 0.00 0.00 175.10 174.16 1o78 n SER 27 N 2.82 2.54 -3.43 3.32 3.41 -0.38 -3.65 113.62 118.24 1o78 n SER 27 Ca -0.04 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.59 1o78 n SER 27 Cb 0.50 1.44 -0.05 0.00 -0.26 0.00 0.00 64.21 65.85 1o78 n SER 27 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1o78 s LYS 28 N -2.71 0.25 0.27 4.33 2.20 -1.23 -4.87 119.74 117.97 1o78 s LYS 28 Ca -0.04 0.56 -0.22 0.00 -0.36 0.00 0.00 55.97 55.92 1o78 s LYS 28 Cb 0.07 0.27 -0.09 0.00 -1.51 0.00 0.00 37.83 36.57 1o78 s LYS 28 CO 0.45 -0.08 0.81 -1.50 -0.36 0.00 0.00 175.35 174.67 1o78 s ILE 29 N 2.05 4.44 -0.00 5.43 2.07 -1.26 -1.65 121.20 132.27 1o78 s ILE 29 Ca -0.04 1.47 0.01 0.00 -1.41 0.00 0.00 60.65 60.68 1o78 s ILE 29 Cb -0.04 -3.89 -0.01 0.00 0.13 0.00 0.00 42.46 38.65 1o78 s ILE 29 CO -0.16 0.14 0.01 0.18 -1.91 0.00 0.00 174.94 173.20 1o78 n LEU 30 N 0.55 0.00 -4.81 8.50 7.99 -0.54 -4.93 117.00 123.76 1o78 n LEU 30 Ca -0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 56.01 55.78 1o78 n LEU 30 Cb 0.51 0.01 -0.05 0.00 -0.11 0.00 0.00 43.42 43.78 1o78 n LEU 30 CO 0.43 0.01 -0.12 0.54 -1.51 0.00 0.00 177.39 176.74 1o78 s VAL 31 N -2.04 3.36 0.23 4.08 0.11 -0.26 -4.96 120.40 120.92 1o78 s VAL 31 Ca -0.00 -1.49 0.01 0.00 -2.93 0.00 0.00 61.98 57.57 1o78 s VAL 31 Cb 0.00 -3.11 -0.05 0.00 -1.53 0.00 0.00 36.38 31.69 1o78 s VAL 31 CO 0.03 -0.18 0.09 -1.59 -3.33 0.00 0.00 175.10 170.12 1o78 s LYS 32 N -3.94 1.30 0.66 1.54 -2.85 -1.26 -5.05 119.74 110.13 1o78 s LYS 32 Ca 0.40 -1.69 -0.13 0.00 -1.00 0.00 0.00 55.97 53.55 1o78 s LYS 32 Cb -0.05 -0.11 -0.00 0.00 -2.06 0.00 0.00 37.83 35.61 1o78 s LYS 32 CO 0.25 -0.30 1.07 -1.83 0.10 0.00 0.00 175.35 174.65 1o78 s GLU 33 N -4.05 2.98 -1.48 1.78 -1.05 -1.26 -3.31 118.70 112.31 1o78 s GLU 33 Ca 0.36 1.16 0.00 0.00 -0.15 0.00 0.00 54.97 56.34 1o78 s GLU 33 Cb 0.07 -1.99 0.00 0.00 -0.44 0.00 0.00 34.13 31.78 1o78 s GLU 33 CO 0.11 -1.08 0.00 0.41 0.95 0.00 0.00 175.26 175.65 1o78 n GLY 34 N -1.22 0.94 3.60 -3.83 0.00 -1.24 -4.99 105.19 98.45 1o78 n GLY 34 Ca 0.09 -0.30 -0.26 0.00 0.00 0.00 0.00 46.02 45.55 1o78 n GLY 34 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1o78 s ASP 35 N -2.67 3.97 -0.17 1.61 2.15 -1.21 -4.94 116.67 115.41 1o78 s ASP 35 Ca 0.00 -1.14 -0.04 0.00 0.43 0.00 0.00 52.55 51.80 1o78 s ASP 35 Cb 0.00 -0.43 -0.03 0.00 -0.30 0.00 0.00 42.92 42.16 1o78 s ASP 35 CO 0.00 -0.28 -0.03 -0.89 -0.17 0.00 0.00 175.17 173.80 1o78 s THR 36 N -2.59 3.87 0.24 1.71 2.01 -1.26 -1.67 115.64 117.95 1o78 s THR 36 Ca 0.34 -0.36 0.08 0.00 0.31 0.00 0.00 61.69 62.07 1o78 s THR 36 Cb 0.03 -2.71 -0.04 0.00 0.01 0.00 0.00 72.50 69.79 1o78 s THR 36 CO 0.18 0.47 0.09 0.54 -0.69 0.00 0.00 174.62 175.22 1o78 s VAL 37 N 0.58 3.98 0.56 3.82 0.11 0.11 -4.97 120.40 124.58 1o78 s VAL 37 Ca -0.02 -1.58 0.05 0.00 -2.93 0.00 0.00 61.98 57.49 1o78 s VAL 37 Cb -0.14 -3.12 0.04 0.00 -1.53 0.00 0.00 36.38 31.63 1o78 s VAL 37 CO 0.02 -0.31 0.37 -0.75 -3.33 0.00 0.00 175.10 171.10 1o78 s LYS 38 N -3.61 2.23 -0.19 1.54 2.20 -1.26 -0.97 119.74 119.69 1o78 s LYS 38 Ca 0.31 -2.11 -0.20 0.00 -0.36 0.00 0.00 55.97 53.62 1o78 s LYS 38 Cb -0.08 -2.02 -0.03 0.00 -1.51 0.00 0.00 37.83 34.19 1o78 s LYS 38 CO 0.22 -0.65 0.58 0.00 -0.36 0.00 0.00 175.35 175.14 1o78 s ALA 39 N -2.82 3.53 0.00 3.13 0.00 -1.26 -3.88 121.76 120.46 1o78 s ALA 39 Ca 0.29 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.96 1o78 s ALA 39 Cb -0.02 -2.89 0.00 0.00 0.00 0.00 0.00 23.12 20.21 1o78 s ALA 39 CO 0.18 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 175.90 1o78 n GLY 40 N 3.75 0.87 3.29 0.00 0.00 -1.25 -4.89 105.19 106.97 1o78 n GLY 40 Ca -0.03 -0.59 -0.34 0.00 0.00 0.00 0.00 46.02 45.06 1o78 n GLY 40 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1o78 s GLN 41 N -2.23 3.31 -0.27 1.61 0.74 -1.25 -4.84 119.66 116.73 1o78 s GLN 41 Ca 0.00 -0.67 -0.31 0.00 0.05 0.00 0.00 55.36 54.43 1o78 s GLN 41 Cb 0.00 -2.85 -0.07 0.00 1.10 0.00 0.00 33.01 31.19 1o78 s GLN 41 CO 0.00 -0.10 2.22 2.41 -0.55 0.00 0.00 175.29 179.26 1o78 n THR 42 N 4.47 0.28 0.03 -0.34 -1.04 -1.26 -0.16 114.28 116.25 1o78 n THR 42 Ca -0.19 -0.39 0.09 0.00 -2.04 0.00 0.00 64.05 61.52 1o78 n THR 42 Cb 0.51 -2.23 -0.10 0.00 -1.82 0.00 0.00 70.33 66.69 1o78 n THR 42 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1o78 n VAL 43 N 7.57 0.40 -4.08 12.58 0.24 0.16 -4.81 118.33 130.40 1o78 n VAL 43 Ca 0.34 -0.56 -0.12 0.00 -2.04 0.00 0.00 64.34 61.96 1o78 n VAL 43 Cb 0.37 -0.21 -0.06 0.00 -1.47 0.00 0.00 33.84 32.48 1o78 n VAL 43 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1o78 s LEU 44 N -4.97 0.79 -0.20 1.34 1.43 -1.15 -1.10 118.68 114.82 1o78 s LEU 44 Ca -0.05 -1.27 0.00 0.00 -1.03 0.00 0.00 54.13 51.78 1o78 s LEU 44 Cb 0.12 1.38 0.05 0.00 0.03 0.00 0.00 46.19 47.76 1o78 s LEU 44 CO 0.86 -1.16 -0.07 -0.69 0.23 0.00 0.00 176.35 175.51 1o78 s VAL 45 N -3.60 1.44 0.35 -1.59 1.01 -0.66 -1.95 120.40 115.40 1o78 s VAL 45 Ca 0.29 -0.96 0.08 0.00 0.00 0.00 0.00 61.98 61.39 1o78 s VAL 45 Cb 0.01 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1o78 s VAL 45 CO 0.15 0.07 0.16 -0.22 0.00 0.00 0.00 175.10 175.26 1o78 s LEU 46 N 1.47 3.27 -0.44 3.92 2.96 -0.86 -1.24 118.68 127.77 1o78 s LEU 46 Ca -0.02 -0.77 0.05 0.00 -0.22 0.00 0.00 54.13 53.16 1o78 s LEU 46 Cb -0.17 -1.75 0.17 0.00 0.50 0.00 0.00 46.19 44.94 1o78 s LEU 46 CO -0.07 -0.32 0.43 -1.61 -1.32 0.00 0.00 176.35 173.45 1o78 s GLU 47 N -3.86 0.94 0.00 1.98 0.41 -0.90 0.73 118.70 118.00 1o78 s GLU 47 Ca 0.38 -1.86 0.00 0.00 -0.41 0.00 0.00 54.97 53.08 1o78 s GLU 47 Cb -0.02 -1.09 0.00 0.00 -1.78 0.00 0.00 34.13 31.23 1o78 s GLU 47 CO 0.23 -1.38 0.00 0.00 -0.49 0.00 0.00 175.26 173.62 1o78 n ALA 48 N 2.87 0.00 -1.33 5.21 0.00 -1.26 -4.13 120.51 121.87 1o78 n ALA 48 Ca 0.27 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.47 1o78 n ALA 48 Cb 0.50 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.86 1o78 n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o78 n MET 49 N -0.35 2.69 0.09 0.00 0.00 -1.26 -4.08 117.12 114.21 1o78 n MET 49 Ca 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 57.70 55.77 1o78 n MET 49 Cb 0.00 -2.24 0.00 0.00 0.00 0.00 0.00 33.22 30.98 1o78 n MET 49 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1o78 n LYS 50 N 1.99 0.00 0.00 3.17 4.81 -1.26 -5.10 118.16 121.77 1o78 n LYS 50 Ca 0.52 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.96 1o78 n LYS 50 Cb 0.62 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.67 1o78 n LYS 50 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 1o78 n MET 51 N -2.91 0.00 0.00 1.64 0.00 -1.26 -5.08 117.12 109.52 1o78 n MET 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1o78 n MET 51 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 1o78 n MET 51 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1o78 n GLU 52 N 0.00 0.00 0.00 2.12 -0.58 -1.26 -4.12 120.64 116.80 1o78 n GLU 52 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1o78 n GLU 52 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1o78 n GLU 52 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1o78 n THR 53 N 0.00 0.00 -1.61 2.62 -1.04 0.22 -4.53 114.28 109.95 1o78 n THR 53 Ca 0.00 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.63 1o78 n THR 53 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 1o78 n THR 53 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1o78 s GLU 54 N 0.00 2.35 -0.79 -2.82 2.12 -1.26 -2.02 118.70 116.27 1o78 s GLU 54 Ca 0.00 1.47 -0.10 0.00 0.36 0.00 0.00 54.97 56.70 1o78 s GLU 54 Cb 0.00 -4.53 0.21 0.00 0.26 0.00 0.00 34.13 30.07 1o78 s GLU 54 CO 0.00 -3.00 0.69 0.42 -0.54 0.00 0.00 175.26 172.83 1o78 s ILE 55 N 11.19 5.05 0.18 -3.70 -1.09 -0.82 -4.97 121.20 127.04 1o78 s ILE 55 Ca 0.96 -2.72 -0.30 0.00 -2.23 0.00 0.00 60.65 56.36 1o78 s ILE 55 Cb -0.20 -4.15 -0.08 0.00 -1.58 0.00 0.00 42.46 36.45 1o78 s ILE 55 CO 0.27 -1.00 1.16 0.20 -1.23 0.00 0.00 174.94 174.34 1o78 s ASN 56 N 1.60 7.16 1.11 3.58 -0.87 -1.26 0.40 114.94 126.66 1o78 s ASN 56 Ca 0.19 2.17 -0.15 0.00 -1.57 0.00 0.00 52.86 53.49 1o78 s ASN 56 Cb -0.13 -2.61 0.17 0.00 -0.02 0.00 0.00 41.25 38.66 1o78 s ASN 56 CO -0.07 -0.31 0.47 0.00 -2.57 0.00 0.00 177.10 174.61 1o78 n ALA 57 N 2.47 -3.37 0.00 0.60 0.00 0.77 -4.79 120.51 116.20 1o78 n ALA 57 Ca 0.04 -1.14 -0.12 0.00 0.00 0.00 0.00 53.44 52.22 1o78 n ALA 57 Cb 0.45 -1.76 -0.09 0.00 0.00 0.00 0.00 19.45 18.05 1o78 n ALA 57 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1o78 h PRO 58 N -2.23 -0.10 -2.97 0.00 0.13 -1.91 -3.31 132.00 121.61 1o78 h PRO 58 Ca -0.55 0.01 0.07 0.00 -0.87 0.00 0.00 66.00 64.66 1o78 h PRO 58 Cb 1.34 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.44 1o78 h PRO 58 CO 0.42 0.47 0.24 0.99 -0.23 0.00 0.00 178.00 179.89 1o78 s THR 59 N -3.26 0.00 0.34 1.56 2.01 -1.26 -4.55 115.64 110.48 1o78 s THR 59 Ca -0.14 -0.99 -0.28 0.00 0.31 0.00 0.00 61.69 60.59 1o78 s THR 59 Cb -0.00 -2.03 -0.12 0.00 0.01 0.00 0.00 72.50 70.36 1o78 s THR 59 CO 0.56 0.00 1.42 0.47 -0.69 0.00 0.00 174.62 176.38 1o78 n ASP 60 N -0.49 3.35 0.00 3.53 9.92 -1.25 -4.31 116.55 127.29 1o78 n ASP 60 Ca -0.04 1.20 0.00 0.00 -0.53 0.00 0.00 54.79 55.42 1o78 n ASP 60 Cb 0.59 -1.55 0.00 0.00 -0.64 0.00 0.00 41.12 39.52 1o78 n ASP 60 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1o78 n GLY 61 N 0.91 0.70 3.66 0.44 0.00 -0.14 -4.90 105.19 105.85 1o78 n GLY 61 Ca 0.04 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.74 1o78 n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1o78 s LYS 62 N -2.00 2.44 -0.10 1.61 2.20 -1.26 0.05 119.74 122.67 1o78 s LYS 62 Ca 0.00 -0.89 -0.30 0.00 -0.36 0.00 0.00 55.97 54.42 1o78 s LYS 62 Cb 0.00 -2.48 -0.02 0.00 -1.51 0.00 0.00 37.83 33.82 1o78 s LYS 62 CO 0.00 0.53 1.11 0.08 -0.36 0.00 0.00 175.35 176.71 1o78 s VAL 63 N -1.29 4.52 -1.52 4.02 1.01 -0.67 -3.17 120.40 123.29 1o78 s VAL 63 Ca 0.25 1.82 0.20 0.00 0.00 0.00 0.00 61.98 64.25 1o78 s VAL 63 Cb -0.11 -4.17 -0.09 0.00 0.00 0.00 0.00 36.38 32.00 1o78 s VAL 63 CO 0.17 -0.03 0.96 -0.62 0.00 0.00 0.00 175.10 175.58 1o78 n GLU 64 N 5.33 1.00 -3.64 2.72 1.02 -0.58 -3.64 120.64 122.86 1o78 n GLU 64 Ca 0.10 -0.58 -0.03 0.00 -0.02 0.00 0.00 57.16 56.63 1o78 n GLU 64 Cb 0.47 -1.43 -0.04 0.00 -0.02 0.00 0.00 31.44 30.42 1o78 n GLU 64 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1o78 s LYS 65 N -2.54 0.11 0.06 3.49 2.20 -1.24 -4.97 119.74 116.86 1o78 s LYS 65 Ca 0.13 0.02 0.08 0.00 -0.36 0.00 0.00 55.97 55.85 1o78 s LYS 65 Cb 0.16 0.05 -0.03 0.00 -1.51 0.00 0.00 37.83 36.50 1o78 s LYS 65 CO 0.64 -0.04 -0.21 0.54 -0.36 0.00 0.00 175.35 175.92 1o78 s VAL 66 N -1.08 2.57 0.01 4.02 0.11 -1.26 -0.41 120.40 124.36 1o78 s VAL 66 Ca 0.08 -1.36 -0.00 0.00 -2.93 0.00 0.00 61.98 57.77 1o78 s VAL 66 Cb -0.01 -2.09 -0.00 0.00 -1.53 0.00 0.00 36.38 32.76 1o78 s VAL 66 CO -0.07 0.28 -0.00 0.18 -3.33 0.00 0.00 175.10 172.16 1o78 n LEU 67 N 1.41 0.10 -4.82 2.54 4.77 -1.05 -4.93 117.00 115.02 1o78 n LEU 67 Ca -0.16 0.01 -0.31 0.00 -0.03 0.00 0.00 56.01 55.51 1o78 n LEU 67 Cb 0.52 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.62 1o78 n LEU 67 CO 0.26 -0.52 0.71 0.68 -1.33 0.00 0.00 177.39 177.18 1o78 s VAL 68 N -1.09 4.06 0.00 4.08 -7.23 -1.11 -5.07 120.40 114.05 1o78 s VAL 68 Ca -0.00 0.74 0.00 0.00 -1.81 0.00 0.00 61.98 60.91 1o78 s VAL 68 Cb 0.00 -3.45 0.00 0.00 0.56 0.00 0.00 36.38 33.49 1o78 s VAL 68 CO 0.00 -0.81 0.00 1.17 -0.31 0.00 0.00 175.10 175.15 1o78 n LYS 69 N -2.83 1.47 -2.85 4.82 3.00 -1.26 -5.01 118.16 115.50 1o78 n LYS 69 Ca 0.08 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 58.09 1o78 n LYS 69 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.54 1o78 n LYS 69 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1o78 s GLU 70 N -0.72 3.75 -1.54 1.64 -6.30 -1.26 -3.85 118.70 110.43 1o78 s GLU 70 Ca 0.00 0.42 0.00 0.00 -2.50 0.00 0.00 54.97 52.89 1o78 s GLU 70 Cb 0.00 -2.40 0.00 0.00 0.00 0.00 0.00 34.13 31.73 1o78 s GLU 70 CO 0.00 -0.04 0.00 -2.13 0.02 0.00 0.00 175.26 173.11 1o78 n ARG 71 N -1.37 -1.72 -3.99 4.30 0.63 -1.24 -4.92 116.66 108.34 1o78 n ARG 71 Ca 0.02 0.86 -0.33 0.00 -0.92 0.00 0.00 57.85 57.49 1o78 n ARG 71 Cb 0.54 -5.36 -0.14 0.00 0.45 0.00 0.00 32.46 27.95 1o78 n ARG 71 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1o78 s ASP 72 N -2.18 4.73 0.30 6.15 2.15 -1.25 -4.98 116.67 121.59 1o78 s ASP 72 Ca 0.00 -1.70 -0.29 0.00 0.43 0.00 0.00 52.55 50.99 1o78 s ASP 72 Cb 0.00 -1.64 -0.13 0.00 -0.30 0.00 0.00 42.92 40.86 1o78 s ASP 72 CO 0.00 -0.30 1.37 0.00 -0.17 0.00 0.00 175.17 176.07 1o78 n ALA 73 N 4.42 1.39 -3.29 3.66 0.00 -1.26 -4.10 120.51 121.33 1o78 n ALA 73 Ca -0.07 0.38 -0.23 0.00 0.00 0.00 0.00 53.44 53.53 1o78 n ALA 73 Cb 0.42 -2.29 -0.16 0.00 0.00 0.00 0.00 19.45 17.42 1o78 n ALA 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1o78 s VAL 74 N -0.60 0.98 0.64 0.00 0.11 -0.24 -4.99 120.40 116.31 1o78 s VAL 74 Ca 0.61 -0.42 -0.06 0.00 -2.93 0.00 0.00 61.98 59.18 1o78 s VAL 74 Cb -0.59 -0.89 0.14 0.00 -1.53 0.00 0.00 36.38 33.51 1o78 s VAL 74 CO 0.56 0.31 0.88 0.00 -3.33 0.00 0.00 175.10 173.52 1o78 n GLN 75 N 3.61 -0.42 -2.89 1.54 6.02 -1.26 -0.12 117.38 123.86 1o78 n GLN 75 Ca -0.21 -1.85 -0.41 0.00 -0.01 0.00 0.00 57.00 54.52 1o78 n GLN 75 Cb 0.52 -0.75 -0.04 0.00 1.02 0.00 0.00 30.24 30.99 1o78 n GLN 75 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1o78 s GLY 76 N -4.81 2.31 0.00 1.08 0.00 -1.26 -4.35 107.32 100.29 1o78 s GLY 76 Ca 0.54 0.13 0.00 0.00 0.00 0.00 0.00 44.72 45.39 1o78 s GLY 76 CO 0.37 1.59 0.00 0.61 0.00 0.00 0.00 173.10 175.67 1o78 n GLY 77 N 3.30 0.76 3.38 0.20 0.00 -0.94 -4.86 105.19 107.03 1o78 n GLY 77 Ca 0.04 -0.68 -0.09 0.00 0.00 0.00 0.00 46.02 45.28 1o78 n GLY 77 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1o78 s GLN 78 N -1.15 0.48 0.14 1.61 -0.44 -1.14 -4.36 119.66 114.80 1o78 s GLN 78 Ca 0.00 0.95 -0.35 0.00 -2.50 0.00 0.00 55.36 53.47 1o78 s GLN 78 Cb 0.00 0.08 -0.15 0.00 -1.64 0.00 0.00 33.01 31.30 1o78 s GLN 78 CO 0.00 -0.17 1.45 0.41 0.50 0.00 0.00 175.29 177.48 1o78 n GLY 79 N 4.43 0.78 0.00 2.59 0.00 0.07 -2.27 105.19 110.78 1o78 n GLY 79 Ca -0.21 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1o78 n GLY 79 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1o78 n LEU 80 N 2.89 0.01 -4.04 0.99 4.77 0.11 -4.22 117.00 117.51 1o78 n LEU 80 Ca 0.17 0.19 -0.16 0.00 -0.03 0.00 0.00 56.01 56.19 1o78 n LEU 80 Cb 0.25 -0.50 -0.13 0.00 -2.33 0.00 0.00 43.42 40.71 1o78 n LEU 80 CO 0.63 -0.50 -0.42 -0.63 -1.33 0.00 0.00 177.39 175.14 1o78 s ILE 81 N -1.00 0.62 0.05 -0.08 -1.09 -1.26 -2.53 121.20 115.91 1o78 s ILE 81 Ca 0.00 -0.72 -0.20 0.00 -2.23 0.00 0.00 60.65 57.50 1o78 s ILE 81 Cb 0.00 -0.60 -0.06 0.00 -1.58 0.00 0.00 42.46 40.22 1o78 s ILE 81 CO 0.00 -0.10 0.59 -0.75 -1.23 0.00 0.00 174.94 173.46 1o78 s LYS 82 N -0.90 4.27 0.03 2.79 2.20 0.45 -3.55 119.74 125.04 1o78 s LYS 82 Ca -0.03 0.77 0.03 0.00 -0.36 0.00 0.00 55.97 56.38 1o78 s LYS 82 Cb -0.06 -3.28 -0.02 0.00 -1.51 0.00 0.00 37.83 32.96 1o78 s LYS 82 CO 0.00 0.53 -0.09 -1.50 -0.36 0.00 0.00 175.35 173.92 1o78 s ILE 83 N -0.74 0.71 -2.63 5.43 2.07 -1.19 -1.53 121.20 123.31 1o78 s ILE 83 Ca 0.30 -0.85 0.21 0.00 -1.41 0.00 0.00 60.65 58.90 1o78 s ILE 83 Cb -0.19 -0.69 0.17 0.00 0.13 0.00 0.00 42.46 41.88 1o78 s ILE 83 CO 0.19 -0.13 1.17 0.61 -1.91 0.00 0.00 174.94 174.86