#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o78 n LYS 2 N 0.00 -3.42 0.07 2.12 4.81 -1.26 -4.90 118.16 115.58 1o78 n LYS 2 Ca 0.00 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 1o78 n LYS 2 Cb 0.00 -4.90 0.00 0.00 0.02 0.00 0.00 35.03 30.15 1o78 n LYS 2 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1o78 n LEU 3 N -4.14 0.78 -3.64 3.14 7.94 -1.26 -5.11 117.00 114.72 1o78 n LEU 3 Ca -0.22 0.23 -0.08 0.00 -1.11 0.00 0.00 56.01 54.84 1o78 n LEU 3 Cb 0.65 -0.14 -0.07 0.00 0.53 0.00 0.00 43.42 44.39 1o78 n LEU 3 CO 0.68 -0.77 0.35 -1.59 -1.11 0.00 0.00 177.39 174.95 1o78 s LYS 4 N -1.99 0.71 -0.21 1.96 0.00 -1.26 -5.14 119.74 113.81 1o78 s LYS 4 Ca 0.00 1.21 -0.14 0.00 0.00 0.00 0.00 55.97 57.04 1o78 s LYS 4 Cb 0.00 0.16 -0.04 0.00 0.00 0.00 0.00 37.83 37.94 1o78 s LYS 4 CO 0.00 -0.15 0.31 0.08 0.00 0.00 0.00 175.35 175.60 1o78 s VAL 5 N 1.55 5.26 0.38 1.79 1.01 -1.26 -5.06 120.40 124.07 1o78 s VAL 5 Ca -0.09 0.53 0.06 0.00 0.00 0.00 0.00 61.98 62.47 1o78 s VAL 5 Cb -0.05 -3.65 -0.07 0.00 0.00 0.00 0.00 36.38 32.61 1o78 s VAL 5 CO -0.18 0.29 0.03 0.42 0.00 0.00 0.00 175.10 175.66 1o78 s THR 6 N 1.15 1.68 0.61 3.92 -4.23 -1.26 -5.06 115.64 112.45 1o78 s THR 6 Ca 0.15 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 1o78 s THR 6 Cb -0.14 -2.92 0.00 0.00 1.34 0.00 0.00 72.50 70.78 1o78 s THR 6 CO 0.06 -0.00 0.00 0.52 -0.54 0.00 0.00 174.62 174.66 1o78 n VAL 7 N -0.86 -2.77 -3.17 2.29 0.31 -1.26 -4.88 118.33 107.99 1o78 n VAL 7 Ca -0.04 1.44 -0.14 0.00 -0.01 0.00 0.00 64.34 65.59 1o78 n VAL 7 Cb 0.67 -2.38 0.01 0.00 -0.91 0.00 0.00 33.84 31.23 1o78 n VAL 7 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1o78 n ASN 8 N -2.84 -6.99 0.00 4.52 2.85 -1.26 -4.99 115.26 106.54 1o78 n ASN 8 Ca -0.01 0.02 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1o78 n ASN 8 Cb 0.52 -4.11 0.00 0.00 1.24 0.00 0.00 39.78 37.43 1o78 n ASN 8 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1o78 n GLY 9 N -0.88 -0.19 3.95 8.20 0.00 -1.26 -4.99 105.19 110.01 1o78 n GLY 9 Ca -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.01 4.31 0.00 4.61 0.00 -1.26 -5.13 121.76 121.29 1o78 s ALA 10 Ca 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.17 1o78 s ALA 10 Cb 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 23.12 21.81 1o78 s ALA 10 CO 0.00 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 175.89 1o78 n GLY 11 N -1.72 4.58 1.86 0.00 0.00 -1.26 -5.05 105.19 103.59 1o78 n GLY 11 Ca 0.06 -1.03 -0.21 0.00 0.00 0.00 0.00 46.02 44.83 1o78 n GLY 11 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1o78 n LYS 12 N 0.00 3.04 -3.09 1.61 4.81 -1.26 -4.99 118.16 118.28 1o78 n LYS 12 Ca 0.00 -3.80 -0.42 0.00 -0.87 0.00 0.00 58.31 53.22 1o78 n LYS 12 Cb 0.00 -2.17 -0.06 0.00 0.02 0.00 0.00 35.03 32.82 1o78 n LYS 12 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1o78 s ALA 13 N -3.57 3.42 0.00 3.14 0.00 -1.26 -4.60 121.76 118.89 1o78 s ALA 13 Ca 0.52 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1o78 s ALA 13 Cb 0.43 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 20.31 1o78 s ALA 13 CO 0.02 -1.47 0.00 0.41 0.00 0.00 0.00 175.76 174.71 1o78 n GLY 14 N 4.74 -2.30 0.00 0.00 0.00 -1.26 -4.96 105.19 101.41 1o78 n GLY 14 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 2.34 -3.18 1.61 1.02 -1.26 -4.84 120.64 116.33 1o78 n GLU 15 Ca 0.00 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.90 1o78 n GLU 15 Cb 0.00 -0.98 -0.06 0.00 -0.02 0.00 0.00 31.44 30.38 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 2.72 4.36 3.38 0.62 0.00 -1.26 -5.08 105.19 109.92 1o78 n GLY 16 Ca 0.00 -2.28 -0.19 0.00 0.00 0.00 0.00 46.02 43.55 1o78 n GLY 16 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1o78 s GLU 17 N -2.47 1.47 -0.32 1.61 1.03 -1.26 0.15 118.70 118.90 1o78 s GLU 17 Ca 0.41 -1.77 0.02 0.00 0.03 0.00 0.00 54.97 53.67 1o78 s GLU 17 Cb 0.24 -0.75 0.08 0.00 -0.80 0.00 0.00 34.13 32.89 1o78 s GLU 17 CO -0.08 -0.11 0.01 0.42 -1.33 0.00 0.00 175.26 174.16 1o78 s ILE 18 N -3.34 2.46 0.26 1.83 1.09 -1.23 -4.95 121.20 117.33 1o78 s ILE 18 Ca 0.31 -1.96 -0.29 0.00 -1.10 0.00 0.00 60.65 57.61 1o78 s ILE 18 Cb 0.06 -2.63 -0.09 0.00 -1.06 0.00 0.00 42.46 38.74 1o78 s ILE 18 CO 0.11 -0.36 1.19 -2.16 -0.10 0.00 0.00 174.94 173.62 1o78 s PRO 19 N 1.04 4.52 0.04 2.79 0.04 -1.26 -0.62 135.00 141.55 1o78 s PRO 19 Ca 0.02 1.93 -0.00 0.00 0.04 0.00 0.00 61.00 62.99 1o78 s PRO 19 Cb -0.20 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.12 1o78 s PRO 19 CO -0.06 0.01 0.17 0.00 0.04 0.00 0.00 177.00 177.17 1o78 s ALA 20 N -0.76 3.90 0.10 8.56 0.00 -1.06 -4.90 121.76 127.59 1o78 s ALA 20 Ca 0.49 -0.85 0.23 0.00 0.00 0.00 0.00 51.96 51.82 1o78 s ALA 20 Cb -0.34 -1.76 0.82 0.00 0.00 0.00 0.00 23.12 21.83 1o78 s ALA 20 CO 0.42 0.79 1.78 -1.00 0.00 0.00 0.00 175.76 177.75 1o78 h PRO 21 N 3.37 0.00 -1.45 0.00 0.13 -1.94 0.67 132.00 132.79 1o78 h PRO 21 Ca -0.47 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.52 1o78 h PRO 21 Cb 1.17 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.05 1o78 h PRO 21 CO 0.72 0.25 -0.51 -0.51 -0.23 0.00 0.00 178.00 177.72 1o78 s LEU 22 N -6.77 -1.01 0.08 1.56 1.43 -1.26 -4.55 118.68 108.16 1o78 s LEU 22 Ca 0.01 -0.51 -0.26 0.00 -1.03 0.00 0.00 54.13 52.33 1o78 s LEU 22 Cb 0.10 1.40 -0.11 0.00 0.03 0.00 0.00 46.19 47.61 1o78 s LEU 22 CO 0.65 -0.29 1.42 0.00 0.23 0.00 0.00 176.35 178.36 1o78 h ALA 23 N 7.74 -0.85 0.00 4.21 0.00 -1.81 -3.44 119.26 125.11 1o78 h ALA 23 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1o78 h ALA 23 Cb 1.14 0.85 0.00 0.00 0.00 0.00 0.00 17.79 19.77 1o78 h ALA 23 CO 0.20 -0.97 0.00 0.41 0.00 0.00 0.00 179.25 178.89 1o78 n GLY 24 N -1.35 -1.87 3.50 0.00 0.00 -1.26 -4.60 105.19 99.61 1o78 n GLY 24 Ca -0.06 -1.77 -0.44 0.00 0.00 0.00 0.00 46.02 43.75 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 -0.00 4.70 -0.20 2.61 2.01 -1.26 -0.64 115.64 122.87 1o78 s THR 25 Ca 0.00 -2.36 -0.33 0.00 0.31 0.00 0.00 61.69 59.31 1o78 s THR 25 Cb 0.00 -5.01 -0.10 0.00 0.01 0.00 0.00 72.50 67.40 1o78 s THR 25 CO 0.00 -1.76 2.07 0.52 -0.69 0.00 0.00 174.62 174.75 1o78 n VAL 26 N 5.26 0.41 -0.05 3.82 0.31 -1.14 -2.90 118.33 124.05 1o78 n VAL 26 Ca 0.41 -0.25 -0.06 0.00 -0.01 0.00 0.00 64.34 64.43 1o78 n VAL 26 Cb 0.44 -2.01 -0.06 0.00 -0.91 0.00 0.00 33.84 31.31 1o78 n VAL 26 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1o78 n SER 27 N 8.97 3.06 -3.84 4.52 7.64 -0.51 -2.64 113.62 130.82 1o78 n SER 27 Ca 0.30 -0.04 -0.12 0.00 1.01 0.00 0.00 58.87 60.02 1o78 n SER 27 Cb 0.32 0.14 -0.12 0.00 -1.01 0.00 0.00 64.21 63.54 1o78 n SER 27 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1o78 s LYS 28 N -2.21 0.25 -0.32 1.43 3.01 -1.23 -4.84 119.74 115.83 1o78 s LYS 28 Ca -0.11 0.01 -0.08 0.00 -1.01 0.00 0.00 55.97 54.79 1o78 s LYS 28 Cb 0.03 0.11 0.01 0.00 -1.01 0.00 0.00 37.83 36.98 1o78 s LYS 28 CO 0.29 -0.04 0.12 -1.50 0.51 0.00 0.00 175.35 174.72 1o78 s ILE 29 N -0.35 4.14 -0.11 2.17 2.07 -1.26 -1.71 121.20 126.15 1o78 s ILE 29 Ca -0.04 -0.75 0.15 0.00 -1.41 0.00 0.00 60.65 58.59 1o78 s ILE 29 Cb -0.03 -3.19 0.05 0.00 0.13 0.00 0.00 42.46 39.42 1o78 s ILE 29 CO 0.00 -0.02 1.46 -0.07 -1.91 0.00 0.00 174.94 174.40 1o78 h LEU 30 N 8.28 0.00-10.31 8.50 -0.00 0.67 -3.46 115.31 119.00 1o78 h LEU 30 Ca -0.29 0.00 -0.48 0.00 -0.00 0.00 0.00 57.88 57.11 1o78 h LEU 30 Cb 1.12 0.00 0.03 0.00 -0.00 0.00 0.00 40.66 41.81 1o78 h LEU 30 CO 0.62 0.53 -0.01 0.54 -0.00 0.00 0.00 178.44 180.12 1o78 s VAL 31 N -2.99 4.62 0.00 1.22 0.11 -0.36 -4.95 120.40 118.05 1o78 s VAL 31 Ca 0.03 -0.15 0.00 0.00 -2.93 0.00 0.00 61.98 58.94 1o78 s VAL 31 Cb 0.08 -3.73 0.00 0.00 -1.53 0.00 0.00 36.38 31.20 1o78 s VAL 31 CO 0.75 -0.62 0.00 1.17 -3.33 0.00 0.00 175.10 173.07 1o78 n LYS 32 N -2.14 0.63 -3.50 1.54 4.81 -1.26 -5.06 118.16 113.18 1o78 n LYS 32 Ca -0.00 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.07 1o78 n LYS 32 Cb 0.56 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.55 1o78 n LYS 32 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1o78 s GLU 33 N -1.37 4.11 0.00 1.64 2.12 -1.26 -3.95 118.70 120.00 1o78 s GLU 33 Ca 0.00 0.25 0.00 0.00 0.36 0.00 0.00 54.97 55.58 1o78 s GLU 33 Cb 0.00 -3.35 0.00 0.00 0.26 0.00 0.00 34.13 31.04 1o78 s GLU 33 CO 0.00 0.39 0.00 0.41 -0.54 0.00 0.00 175.26 175.52 1o78 n GLY 34 N 2.79 1.12 3.80 -1.50 0.00 -1.09 -5.00 105.19 105.31 1o78 n GLY 34 Ca -0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 1o78 n GLY 34 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1o78 s ASP 35 N -3.09 6.87 -0.16 1.61 1.11 -1.25 -4.76 116.67 116.99 1o78 s ASP 35 Ca 0.00 1.03 -0.24 0.00 0.18 0.00 0.00 52.55 53.52 1o78 s ASP 35 Cb 0.00 -2.30 -0.02 0.00 1.07 0.00 0.00 42.92 41.67 1o78 s ASP 35 CO 0.00 0.22 0.76 -0.89 1.18 0.00 0.00 175.17 176.44 1o78 s THR 36 N -0.64 4.94 0.34 -1.27 2.01 -1.26 -2.49 115.64 117.26 1o78 s THR 36 Ca 0.26 1.49 0.05 0.00 0.31 0.00 0.00 61.69 63.80 1o78 s THR 36 Cb -0.17 -4.07 0.05 0.00 0.01 0.00 0.00 72.50 68.31 1o78 s THR 36 CO 0.15 0.08 0.41 1.33 -0.69 0.00 0.00 174.62 175.90 1o78 n VAL 37 N 4.59 0.00 -4.15 3.82 0.24 -0.43 -4.92 118.33 117.48 1o78 n VAL 37 Ca 0.02 -1.18 -0.10 0.00 -2.04 0.00 0.00 64.34 61.05 1o78 n VAL 37 Cb 0.49 -0.59 -0.10 0.00 -1.47 0.00 0.00 33.84 32.18 1o78 n VAL 37 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1o78 s LYS 38 N -3.49 0.91 -0.68 7.34 -0.14 -1.26 -2.40 119.74 120.02 1o78 s LYS 38 Ca 0.31 -1.43 -0.26 0.00 -1.36 0.00 0.00 55.97 53.23 1o78 s LYS 38 Cb -0.02 0.18 -0.01 0.00 -1.68 0.00 0.00 37.83 36.30 1o78 s LYS 38 CO 0.20 -0.23 1.70 0.00 -0.76 0.00 0.00 175.35 176.26 1o78 s ALA 39 N -3.99 2.30 0.00 5.17 0.00 -1.26 -2.50 121.76 121.47 1o78 s ALA 39 Ca 0.22 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.21 1o78 s ALA 39 Cb 0.07 -4.32 0.00 0.00 0.00 0.00 0.00 23.12 18.87 1o78 s ALA 39 CO 0.01 -3.81 0.00 0.41 0.00 0.00 0.00 175.76 172.37 1o78 n GLY 40 N 5.76 1.62 3.43 0.00 0.00 -1.10 -4.91 105.19 109.99 1o78 n GLY 40 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.02 3.56 0.03 1.61 0.74 -1.04 -4.73 119.66 119.79 1o78 s GLN 41 Ca 0.00 -0.55 -0.37 0.00 0.05 0.00 0.00 55.36 54.49 1o78 s GLN 41 Cb 0.00 -3.36 -0.16 0.00 1.10 0.00 0.00 33.01 30.59 1o78 s GLN 41 CO 0.00 -0.24 1.45 2.41 -0.55 0.00 0.00 175.29 178.35 1o78 n THR 42 N 4.93 0.07 0.00 -0.34 -1.04 -1.26 0.05 114.28 116.68 1o78 n THR 42 Ca -0.16 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 1o78 n THR 42 Cb 0.51 -0.99 0.00 0.00 -1.82 0.00 0.00 70.33 68.03 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 3.02 0.00 -4.38 12.58 0.24 0.10 -4.73 118.33 125.16 1o78 n VAL 43 Ca 0.20 0.00 -0.20 0.00 -2.04 0.00 0.00 64.34 62.30 1o78 n VAL 43 Cb 0.19 -0.52 -0.10 0.00 -1.47 0.00 0.00 33.84 31.95 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 -2.92 2.54 -0.07 1.34 1.02 -1.15 0.13 118.68 119.57 1o78 s LEU 44 Ca 0.00 -1.07 0.01 0.00 0.02 0.00 0.00 54.13 53.09 1o78 s LEU 44 Cb 0.00 -0.71 0.02 0.00 0.02 0.00 0.00 46.19 45.52 1o78 s LEU 44 CO 0.00 -0.19 -0.06 -0.69 0.02 0.00 0.00 176.35 175.42 1o78 s VAL 45 N -2.93 0.77 0.22 -1.59 1.01 -0.69 0.42 120.40 117.62 1o78 s VAL 45 Ca 0.25 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 62.04 1o78 s VAL 45 Cb 0.00 -0.78 -0.05 0.00 0.00 0.00 0.00 36.38 35.55 1o78 s VAL 45 CO 0.09 0.29 0.05 -1.48 0.00 0.00 0.00 175.10 174.05 1o78 s LEU 46 N 1.16 1.89 -0.45 3.92 0.05 -1.06 -1.43 118.68 122.76 1o78 s LEU 46 Ca -0.06 -1.28 0.02 0.00 0.05 0.00 0.00 54.13 52.85 1o78 s LEU 46 Cb -0.14 -0.05 0.14 0.00 -2.05 0.00 0.00 46.19 44.09 1o78 s LEU 46 CO -0.01 -0.64 0.27 -1.61 -0.55 0.00 0.00 176.35 173.80 1o78 s GLU 47 N -3.97 1.31 -0.30 1.48 0.41 -1.14 -1.51 118.70 114.98 1o78 s GLU 47 Ca 0.31 -2.09 -0.34 0.00 -0.41 0.00 0.00 54.97 52.45 1o78 s GLU 47 Cb 0.07 -2.29 0.18 0.00 -1.78 0.00 0.00 34.13 30.31 1o78 s GLU 47 CO 0.09 -1.19 1.40 0.00 -0.49 0.00 0.00 175.26 175.07 1o78 s ALA 48 N 0.22 -2.18 -0.18 5.21 0.00 -1.14 -4.13 121.76 119.56 1o78 s ALA 48 Ca 0.20 1.93 -0.00 0.00 0.00 0.00 0.00 51.96 54.09 1o78 s ALA 48 Cb -0.20 -1.00 0.00 0.00 0.00 0.00 0.00 23.12 21.92 1o78 s ALA 48 CO -0.03 -0.39 0.01 -1.33 0.00 0.00 0.00 175.76 174.02 1o78 n MET 49 N 0.24 -2.21 -2.07 0.00 2.81 -1.26 -2.89 117.12 111.74 1o78 n MET 49 Ca 0.03 1.98 -0.17 0.00 -1.81 0.00 0.00 57.70 57.73 1o78 n MET 49 Cb 0.57 -3.53 -0.03 0.00 -0.71 0.00 0.00 33.22 29.52 1o78 n MET 49 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1o78 n LYS 50 N 1.02 -1.71 0.00 0.03 5.02 -1.26 -3.76 118.16 117.50 1o78 n LYS 50 Ca -0.01 0.91 0.00 0.00 -2.02 0.00 0.00 58.31 57.19 1o78 n LYS 50 Cb 0.22 -5.43 0.00 0.00 -0.02 0.00 0.00 35.03 29.80 1o78 n LYS 50 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1o78 n MET 51 N -2.63 0.00 0.00 1.97 2.81 -1.14 -4.77 117.12 113.35 1o78 n MET 51 Ca -0.19 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.70 1o78 n MET 51 Cb 0.62 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.13 1o78 n MET 51 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1o78 n GLU 52 N 0.00 0.00 0.00 0.03 4.07 -1.25 -2.88 120.64 120.61 1o78 n GLU 52 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1o78 n GLU 52 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1o78 n GLU 52 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1o78 n THR 53 N 0.00 0.00 -1.55 6.31 -1.04 -0.57 -4.61 114.28 112.82 1o78 n THR 53 Ca 0.00 0.00 -0.52 0.00 -2.04 0.00 0.00 64.05 61.49 1o78 n THR 53 Cb 0.00 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.44 1o78 n THR 53 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1o78 n GLU 54 N 0.00 1.25 -3.55 -2.82 1.02 -1.26 -2.57 120.64 112.71 1o78 n GLU 54 Ca 0.00 0.40 -0.41 0.00 -0.02 0.00 0.00 57.16 57.13 1o78 n GLU 54 Cb 0.00 -2.37 -0.08 0.00 -0.02 0.00 0.00 31.44 28.97 1o78 n GLU 54 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1o78 s ILE 55 N 5.72 4.22 0.25 -3.67 -1.09 0.17 -4.95 121.20 121.85 1o78 s ILE 55 Ca 1.04 -1.80 -0.30 0.00 -2.23 0.00 0.00 60.65 57.36 1o78 s ILE 55 Cb -0.91 -3.78 -0.10 0.00 -1.58 0.00 0.00 42.46 36.09 1o78 s ILE 55 CO 0.55 -0.78 1.50 0.20 -1.23 0.00 0.00 174.94 175.18 1o78 s ASN 56 N 2.67 6.56 0.77 3.58 -0.87 -1.26 0.01 114.94 126.41 1o78 s ASN 56 Ca 0.06 2.75 -0.15 0.00 -1.57 0.00 0.00 52.86 53.94 1o78 s ASN 56 Cb -0.26 -2.62 -0.01 0.00 -0.02 0.00 0.00 41.25 38.34 1o78 s ASN 56 CO -0.01 -0.78 0.63 0.00 -2.57 0.00 0.00 177.10 174.37 1o78 n ALA 57 N 2.45 -1.40 0.07 0.60 0.00 0.11 -4.73 120.51 117.60 1o78 n ALA 57 Ca 0.08 -0.31 -0.20 0.00 0.00 0.00 0.00 53.44 53.01 1o78 n ALA 57 Cb 0.39 -1.91 -0.11 0.00 0.00 0.00 0.00 19.45 17.82 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 -0.62 0.59 -2.72 0.00 0.13 -1.91 -2.91 132.00 124.56 1o78 h PRO 58 Ca -0.45 -0.72 -0.10 0.00 -0.87 0.00 0.00 66.00 63.85 1o78 h PRO 58 Cb 1.33 0.23 -0.20 0.00 0.13 0.00 0.00 31.00 32.49 1o78 h PRO 58 CO 0.42 1.31 -0.13 0.99 -0.23 0.00 0.00 178.00 180.35 1o78 s THR 59 N -3.11 0.04 0.67 1.56 2.01 -1.26 -4.71 115.64 110.83 1o78 s THR 59 Ca -0.09 -0.32 -0.16 0.00 0.31 0.00 0.00 61.69 61.43 1o78 s THR 59 Cb 0.07 -0.73 0.00 0.00 0.01 0.00 0.00 72.50 71.85 1o78 s THR 59 CO 0.92 -0.18 1.18 1.51 -0.69 0.00 0.00 174.62 177.36 1o78 s ASP 60 N -1.24 4.77 0.00 3.53 1.47 -1.26 -4.41 116.67 119.53 1o78 s ASP 60 Ca -0.12 2.26 0.00 0.00 1.18 0.00 0.00 52.55 55.87 1o78 s ASP 60 Cb -0.04 -2.58 0.00 0.00 -0.34 0.00 0.00 42.92 39.96 1o78 s ASP 60 CO 0.06 -1.87 0.00 0.61 0.68 0.00 0.00 175.17 174.65 1o78 n GLY 61 N 0.17 3.51 3.79 2.12 0.00 -1.01 -4.87 105.19 108.90 1o78 n GLY 61 Ca 0.13 -1.17 -0.38 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.35 4.43 0.07 1.61 2.20 -1.26 -1.31 119.74 123.12 1o78 s LYS 62 Ca 0.00 1.05 -0.30 0.00 -0.36 0.00 0.00 55.97 56.36 1o78 s LYS 62 Cb 0.00 -3.04 -0.05 0.00 -1.51 0.00 0.00 37.83 33.23 1o78 s LYS 62 CO 0.00 0.46 1.05 0.08 -0.36 0.00 0.00 175.35 176.58 1o78 s VAL 63 N -1.37 4.40 -0.58 4.02 1.01 -1.04 -4.01 120.40 122.84 1o78 s VAL 63 Ca 0.41 1.83 0.23 0.00 0.00 0.00 0.00 61.98 64.45 1o78 s VAL 63 Cb -0.20 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 1o78 s VAL 63 CO 0.24 0.20 1.14 -0.62 0.00 0.00 0.00 175.10 176.06 1o78 n GLU 64 N 3.40 0.33 0.00 2.72 1.02 -0.95 -2.68 120.64 124.48 1o78 n GLU 64 Ca 0.05 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1o78 n GLU 64 Cb 0.49 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 1o78 n GLU 64 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1o78 n LYS 65 N -2.09 0.00 -3.79 3.49 5.02 -1.25 -4.90 118.16 114.63 1o78 n LYS 65 Ca 0.02 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.02 1o78 n LYS 65 Cb 0.45 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 35.30 1o78 n LYS 65 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1o78 s VAL 66 N -2.00 0.94 -0.13 -0.18 -7.23 -1.26 -1.10 120.40 109.44 1o78 s VAL 66 Ca 0.00 -1.08 0.17 0.00 -1.81 0.00 0.00 61.98 59.26 1o78 s VAL 66 Cb 0.00 -1.50 -0.24 0.00 0.56 0.00 0.00 36.38 35.20 1o78 s VAL 66 CO 0.00 -0.38 0.37 0.00 -0.31 0.00 0.00 175.10 174.78 1o78 n LEU 67 N 4.86 0.33 -4.72 1.32 -0.00 -1.25 -4.95 117.00 112.60 1o78 n LEU 67 Ca -0.07 0.15 -0.34 0.00 -0.00 0.00 0.00 56.01 55.76 1o78 n LEU 67 Cb 0.44 0.30 0.10 0.00 -0.00 0.00 0.00 43.42 44.27 1o78 n LEU 67 CO 0.14 0.36 0.78 0.54 -0.00 0.00 0.00 177.39 179.20 1o78 s VAL 68 N -2.71 2.33 0.10 1.47 0.11 -1.04 -5.04 120.40 115.64 1o78 s VAL 68 Ca -0.07 0.15 0.02 0.00 -2.93 0.00 0.00 61.98 59.15 1o78 s VAL 68 Cb 0.08 -2.64 -0.04 0.00 -1.53 0.00 0.00 36.38 32.25 1o78 s VAL 68 CO 0.84 -0.10 -0.07 -0.75 -3.33 0.00 0.00 175.10 171.69 1o78 s LYS 69 N -4.07 0.86 -1.38 1.54 2.20 -1.26 -5.05 119.74 112.58 1o78 s LYS 69 Ca 0.72 -1.33 -0.16 0.00 -0.36 0.00 0.00 55.97 54.84 1o78 s LYS 69 Cb -0.28 -0.27 0.05 0.00 -1.51 0.00 0.00 37.83 35.82 1o78 s LYS 69 CO 0.48 -0.00 2.02 0.39 -0.36 0.00 0.00 175.35 177.87 1o78 n GLU 70 N -0.01 2.96 0.00 4.03 4.71 -1.26 -3.51 120.64 127.56 1o78 n GLU 70 Ca -0.12 -2.87 0.00 0.00 -0.01 0.00 0.00 57.16 54.16 1o78 n GLU 70 Cb 0.61 -3.38 0.00 0.00 -1.01 0.00 0.00 31.44 27.66 1o78 n GLU 70 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 1o78 n ARG 71 N 7.11 0.00 -1.47 3.49 3.00 -1.08 -4.86 116.66 122.84 1o78 n ARG 71 Ca 0.51 0.00 -0.47 0.00 -0.00 0.00 0.00 57.85 57.88 1o78 n ARG 71 Cb 0.42 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.81 1o78 n ARG 71 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1o78 n ASP 72 N -0.47 2.09 -4.62 6.15 2.03 -1.23 -4.76 116.55 115.74 1o78 n ASP 72 Ca 0.00 0.25 -0.36 0.00 0.52 0.00 0.00 54.79 55.20 1o78 n ASP 72 Cb 0.00 -1.30 -0.10 0.00 -0.72 0.00 0.00 41.12 39.00 1o78 n ASP 72 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1o78 s ALA 73 N 8.19 3.52 0.07 -1.67 0.00 -1.26 -2.86 121.76 127.75 1o78 s ALA 73 Ca 1.10 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1o78 s ALA 73 Cb -0.76 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.11 1o78 s ALA 73 CO 0.45 -0.21 0.00 0.28 0.00 0.00 0.00 175.76 176.28 1o78 n VAL 74 N 4.33-12.07 0.00 0.00 0.31 0.19 -4.87 118.33 106.22 1o78 n VAL 74 Ca -0.15 2.92 0.00 0.00 -0.01 0.00 0.00 64.34 67.10 1o78 n VAL 74 Cb 0.52 -5.41 0.00 0.00 -0.91 0.00 0.00 33.84 28.04 1o78 n VAL 74 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1o78 n GLN 75 N 1.90 0.00 -1.49 5.55 7.27 -1.26 -4.79 117.38 124.56 1o78 n GLN 75 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1o78 n GLN 75 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1o78 n GLN 75 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1o78 n GLY 76 N -0.42 -4.66 0.00 1.69 0.00 -1.26 -4.61 105.19 95.94 1o78 n GLY 76 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1o78 n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o78 n GLY 77 N -0.01 0.76 3.20 -0.02 0.00 0.23 -4.86 105.19 104.48 1o78 n GLY 77 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1o78 n GLY 77 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1o78 s GLN 78 N -0.71 1.07 0.39 1.61 -0.21 -1.26 -4.73 119.66 115.83 1o78 s GLN 78 Ca 0.00 -0.89 -0.27 0.00 0.02 0.00 0.00 55.36 54.22 1o78 s GLN 78 Cb 0.00 -1.14 -0.10 0.00 1.00 0.00 0.00 33.01 32.77 1o78 s GLN 78 CO 0.00 0.28 1.38 0.20 -2.12 0.00 0.00 175.29 175.03 1o78 s GLY 79 N -1.32 2.94 -0.16 3.09 0.00 -1.26 -2.58 107.32 108.03 1o78 s GLY 79 Ca 0.03 1.38 -0.24 0.00 0.00 0.00 0.00 44.72 45.90 1o78 s GLY 79 CO 0.02 2.01 0.52 1.41 0.00 0.00 0.00 173.10 177.06 1o78 h LEU 80 N 2.82 0.07 -7.57 0.66 3.38 -1.22 -3.42 115.31 110.03 1o78 h LEU 80 Ca -0.50 -0.78 -0.11 0.00 0.09 0.00 0.00 57.88 56.58 1o78 h LEU 80 Cb 1.24 -0.02 -0.18 0.00 0.09 0.00 0.00 40.66 41.79 1o78 h LEU 80 CO 0.63 1.30 -0.29 0.27 0.09 0.00 0.00 178.44 180.45 1o78 s ILE 81 N -2.32 0.08 0.69 1.22 -4.36 -1.26 -2.48 121.20 112.76 1o78 s ILE 81 Ca -0.23 -0.63 -0.13 0.00 -0.26 0.00 0.00 60.65 59.41 1o78 s ILE 81 Cb 0.02 -0.78 0.01 0.00 1.25 0.00 0.00 42.46 42.96 1o78 s ILE 81 CO 0.67 -0.35 1.08 -0.75 0.24 0.00 0.00 174.94 175.83 1o78 s LYS 82 N -2.02 2.79 -0.09 0.37 2.47 -0.26 -3.52 119.74 119.49 1o78 s LYS 82 Ca -0.09 1.16 -0.31 0.00 -1.56 0.00 0.00 55.97 55.17 1o78 s LYS 82 Cb -0.03 -1.96 0.09 0.00 -1.46 0.00 0.00 37.83 34.47 1o78 s LYS 82 CO -0.00 -1.23 0.78 -1.50 0.16 0.00 0.00 175.35 173.56 1o78 s ILE 83 N -2.74 0.00 0.00 5.43 2.07 0.12 -2.23 121.20 123.85 1o78 s ILE 83 Ca 0.62 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.86 1o78 s ILE 83 Cb -0.17 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.42 1o78 s ILE 83 CO 0.49 0.00 0.07 0.61 -1.91 0.00 0.00 174.94 174.20