#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o78 s LYS 2 N 0.00 3.91 1.08 3.17 2.47 -1.26 -5.07 119.74 124.04 1o78 s LYS 2 Ca 0.00 -0.34 -0.16 0.00 -1.56 0.00 0.00 55.97 53.91 1o78 s LYS 2 Cb 0.00 -3.60 0.13 0.00 -1.46 0.00 0.00 37.83 32.90 1o78 s LYS 2 CO 0.00 -0.17 0.36 1.28 0.16 0.00 0.00 175.35 176.99 1o78 n LEU 3 N 4.99 -1.34 -0.90 5.43 4.32 -1.26 -4.96 117.00 123.28 1o78 n LEU 3 Ca -0.14 0.00 0.01 0.00 -0.02 0.00 0.00 56.01 55.85 1o78 n LEU 3 Cb 0.52 -1.10 -0.00 0.00 -1.62 0.00 0.00 43.42 41.21 1o78 n LEU 3 CO 0.33 -3.20 0.20 2.29 -1.22 0.00 0.00 177.39 175.79 1o78 n LYS 4 N -2.69 0.00 -3.76 3.23 0.00 -1.26 -5.07 118.16 108.62 1o78 n LYS 4 Ca 0.03 -1.21 -0.37 0.00 -0.00 0.00 0.00 58.31 56.77 1o78 n LYS 4 Cb 0.58 -0.15 -0.13 0.00 -0.00 0.00 0.00 35.03 35.33 1o78 n LYS 4 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1o78 s VAL 5 N 0.00 4.28 -0.47 0.58 1.01 -1.26 -5.04 120.40 119.49 1o78 s VAL 5 Ca 0.12 -0.21 -0.27 0.00 0.00 0.00 0.00 61.98 61.61 1o78 s VAL 5 Cb 0.13 -3.01 -0.02 0.00 0.00 0.00 0.00 36.38 33.48 1o78 s VAL 5 CO -0.06 0.32 1.80 0.42 0.00 0.00 0.00 175.10 177.58 1o78 s THR 6 N 1.61 3.45 -0.41 3.92 -4.23 -1.26 -4.75 115.64 113.97 1o78 s THR 6 Ca 0.06 0.39 0.06 0.00 -1.18 0.00 0.00 61.69 61.02 1o78 s THR 6 Cb -0.15 -3.83 0.32 0.00 1.34 0.00 0.00 72.50 70.18 1o78 s THR 6 CO 0.03 -0.67 1.22 0.55 -0.54 0.00 0.00 174.62 175.21 1o78 n VAL 7 N 7.30 0.00 -3.96 2.29 3.14 -1.26 -5.15 118.33 120.68 1o78 n VAL 7 Ca 0.21 -1.24 -0.00 0.00 -2.96 0.00 0.00 64.34 60.35 1o78 n VAL 7 Cb 0.49 1.28 -0.00 0.00 -1.06 0.00 0.00 33.84 34.56 1o78 n VAL 7 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1o78 n ASN 8 N 0.23 -0.01 -0.13 6.55 3.02 -1.26 -5.04 115.26 118.61 1o78 n ASN 8 Ca 0.00 -1.03 -0.07 0.00 -0.03 0.00 0.00 54.58 53.45 1o78 n ASN 8 Cb 0.73 0.03 0.02 0.00 -0.61 0.00 0.00 39.78 39.95 1o78 n ASN 8 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1o78 h GLY 9 N 0.03 0.59 -1.27 7.41 0.00 -2.03 -3.48 103.07 104.32 1o78 h GLY 9 Ca -0.00 -0.18 0.16 0.00 0.00 0.00 0.00 47.33 47.31 1o78 h GLY 9 CO 0.01 0.15 -0.21 0.00 0.00 0.00 0.00 176.54 176.49 1o78 n ALA 10 N -2.26 -1.68 0.33 3.60 0.00 -1.26 -4.30 120.51 114.94 1o78 n ALA 10 Ca 0.02 0.18 -0.13 0.00 0.00 0.00 0.00 53.44 53.50 1o78 n ALA 10 Cb 0.07 -0.56 -0.06 0.00 0.00 0.00 0.00 19.45 18.90 1o78 n ALA 10 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1o78 h GLY 11 N -0.53 -0.92 -5.62 0.00 0.00 -1.98 -3.48 103.07 90.55 1o78 h GLY 11 Ca 0.01 0.34 -0.09 0.00 0.00 0.00 0.00 47.33 47.59 1o78 h GLY 11 CO 0.00 -0.33 -0.24 0.28 0.00 0.00 0.00 176.54 176.25 1o78 n LYS 12 N -4.98 -1.45 0.00 4.80 5.02 -1.26 -4.70 118.16 115.59 1o78 n LYS 12 Ca -0.11 1.42 0.00 0.00 -2.02 0.00 0.00 58.31 57.60 1o78 n LYS 12 Cb 0.35 -5.11 0.00 0.00 -0.02 0.00 0.00 35.03 30.24 1o78 n LYS 12 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1o78 n ALA 13 N -1.78 0.00 -2.00 7.82 0.00 -1.26 -4.75 120.51 118.54 1o78 n ALA 13 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1o78 n ALA 13 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1o78 n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o78 n GLY 14 N 0.00 2.16 3.27 0.00 0.00 -1.26 -4.95 105.19 104.42 1o78 n GLY 14 Ca 0.00 -0.23 -0.16 0.00 0.00 0.00 0.00 46.02 45.63 1o78 n GLY 14 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1o78 s GLU 15 N 1.67 1.12 -1.42 1.61 2.12 -1.26 -4.78 118.70 117.77 1o78 s GLU 15 Ca 0.00 -1.44 -0.10 0.00 0.36 0.00 0.00 54.97 53.78 1o78 s GLU 15 Cb 0.00 -0.81 0.03 0.00 0.26 0.00 0.00 34.13 33.61 1o78 s GLU 15 CO 0.00 0.12 1.11 0.41 -0.54 0.00 0.00 175.26 176.36 1o78 n GLY 16 N -0.09 -0.53 3.20 -1.50 0.00 -1.26 -4.97 105.19 100.03 1o78 n GLY 16 Ca -0.11 0.24 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 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 -6.38 0.94 -0.34 1.61 4.04 -1.26 -3.38 118.70 113.93 1o78 s GLU 17 Ca 0.60 -1.41 0.02 0.00 0.04 0.00 0.00 54.97 54.22 1o78 s GLU 17 Cb -0.28 -0.26 0.09 0.00 0.02 0.00 0.00 34.13 33.70 1o78 s GLU 17 CO 0.74 -0.04 0.05 0.42 -1.84 0.00 0.00 175.26 174.59 1o78 s ILE 18 N -3.61 2.53 0.66 1.83 1.09 -1.25 -4.99 121.20 117.46 1o78 s ILE 18 Ca 0.16 -2.08 -0.14 0.00 -1.10 0.00 0.00 60.65 57.50 1o78 s ILE 18 Cb 0.05 -2.73 -0.00 0.00 -1.06 0.00 0.00 42.46 38.72 1o78 s ILE 18 CO -0.02 -0.47 1.08 -2.16 -0.10 0.00 0.00 174.94 173.27 1o78 s PRO 19 N 1.02 2.90 0.10 2.79 0.04 -1.26 -2.91 135.00 137.67 1o78 s PRO 19 Ca 0.05 1.22 -0.23 0.00 0.04 0.00 0.00 61.00 62.08 1o78 s PRO 19 Cb -0.20 -1.97 -0.07 0.00 0.04 0.00 0.00 34.50 32.30 1o78 s PRO 19 CO -0.06 -1.15 0.69 0.00 0.04 0.00 0.00 177.00 176.52 1o78 s ALA 20 N -2.59 3.48 0.15 8.56 0.00 -1.03 -4.88 121.76 125.45 1o78 s ALA 20 Ca 0.63 0.22 0.15 0.00 0.00 0.00 0.00 51.96 52.96 1o78 s ALA 20 Cb -0.17 -2.84 0.44 0.00 0.00 0.00 0.00 23.12 20.54 1o78 s ALA 20 CO 0.45 0.28 1.62 -1.00 0.00 0.00 0.00 175.76 177.11 1o78 h PRO 21 N 4.73 0.00 -5.04 0.00 0.13 -1.94 0.84 132.00 130.72 1o78 h PRO 21 Ca -0.47 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.29 1o78 h PRO 21 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.19 1o78 h PRO 21 CO 0.66 0.51 -0.66 -1.17 -0.23 0.00 0.00 178.00 177.12 1o78 s LEU 22 N -7.11 2.15 0.79 1.56 2.96 -1.26 -4.71 118.68 113.07 1o78 s LEU 22 Ca 0.00 -1.22 -0.13 0.00 -0.22 0.00 0.00 54.13 52.56 1o78 s LEU 22 Cb 0.11 -0.23 0.08 0.00 0.50 0.00 0.00 46.19 46.65 1o78 s LEU 22 CO 0.73 -0.53 1.18 0.00 -1.32 0.00 0.00 176.35 176.41 1o78 s ALA 23 N -3.47 1.92 0.29 5.97 0.00 -1.26 -3.76 121.76 121.45 1o78 s ALA 23 Ca 0.28 0.76 0.04 0.00 0.00 0.00 0.00 51.96 53.05 1o78 s ALA 23 Cb 0.06 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.71 1o78 s ALA 23 CO 0.08 -2.17 0.15 0.41 0.00 0.00 0.00 175.76 174.24 1o78 n GLY 24 N 0.25 3.33 0.00 0.00 0.00 -0.48 -4.79 105.19 103.50 1o78 n GLY 24 Ca 0.13 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1o78 n GLY 24 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1o78 n THR 25 N -0.62 0.00 -0.29 2.61 -1.04 -1.26 -1.67 114.28 112.01 1o78 n THR 25 Ca -0.00 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.14 1o78 n THR 25 Cb 0.47 0.00 0.26 0.00 -1.82 0.00 0.00 70.33 69.24 1o78 n THR 25 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1o78 n VAL 26 N 0.00 -0.35 -3.80 12.58 0.24 -1.25 -3.28 118.33 122.47 1o78 n VAL 26 Ca 0.00 1.84 -0.27 0.00 -2.04 0.00 0.00 64.34 63.87 1o78 n VAL 26 Cb 0.00 -2.70 0.04 0.00 -1.47 0.00 0.00 33.84 29.71 1o78 n VAL 26 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1o78 n SER 27 N -5.20 -4.30 -4.53 -1.34 2.88 0.67 -0.07 113.62 101.73 1o78 n SER 27 Ca 0.20 -0.74 -0.27 0.00 -1.33 0.00 0.00 58.87 56.74 1o78 n SER 27 Cb 0.66 -4.19 -0.11 0.00 -0.75 0.00 0.00 64.21 59.83 1o78 n SER 27 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1o78 n LYS 28 N -4.65 0.47 -1.97 -1.46 5.02 0.04 -4.07 118.16 111.54 1o78 n LYS 28 Ca -0.04 -0.27 -0.25 0.00 -2.02 0.00 0.00 58.31 55.72 1o78 n LYS 28 Cb 0.57 -2.64 -0.06 0.00 -0.02 0.00 0.00 35.03 32.88 1o78 n LYS 28 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1o78 s ILE 29 N 9.88 3.40 0.26 -0.18 2.07 -1.26 -1.70 121.20 133.67 1o78 s ILE 29 Ca 1.11 -0.46 -0.02 0.00 -1.41 0.00 0.00 60.65 59.87 1o78 s ILE 29 Cb -0.51 -4.05 0.24 0.00 0.13 0.00 0.00 42.46 38.27 1o78 s ILE 29 CO 0.31 -0.80 1.80 -0.07 -1.91 0.00 0.00 174.94 174.28 1o78 h LEU 30 N 18.67 0.69-10.23 8.50 -0.00 0.33 -3.42 115.31 129.85 1o78 h LEU 30 Ca 0.11 0.06 -0.48 0.00 -0.00 0.00 0.00 57.88 57.58 1o78 h LEU 30 Cb 0.99 -0.07 0.20 0.00 -0.00 0.00 0.00 40.66 41.78 1o78 h LEU 30 CO 1.18 0.35 0.14 0.54 -0.00 0.00 0.00 178.44 180.65 1o78 s VAL 31 N -5.99 2.15 0.36 1.22 0.11 -0.62 -5.04 120.40 112.59 1o78 s VAL 31 Ca -0.12 0.05 0.06 0.00 -2.93 0.00 0.00 61.98 59.04 1o78 s VAL 31 Cb 0.21 -2.15 -0.07 0.00 -1.53 0.00 0.00 36.38 32.84 1o78 s VAL 31 CO 0.79 -0.06 0.02 -0.75 -3.33 0.00 0.00 175.10 171.76 1o78 s LYS 32 N -4.61 1.80 0.06 1.54 2.20 -1.26 -5.05 119.74 114.41 1o78 s LYS 32 Ca 0.67 -2.00 -0.26 0.00 -0.36 0.00 0.00 55.97 54.02 1o78 s LYS 32 Cb -0.23 -1.31 -0.05 0.00 -1.51 0.00 0.00 37.83 34.73 1o78 s LYS 32 CO 0.61 -0.09 0.81 -2.00 -0.36 0.00 0.00 175.35 174.32 1o78 s GLU 33 N -3.78 4.54 0.00 4.03 -6.30 -1.26 -3.56 118.70 112.37 1o78 s GLU 33 Ca 0.35 1.15 0.00 0.00 -2.50 0.00 0.00 54.97 53.97 1o78 s GLU 33 Cb 0.09 -3.37 0.00 0.00 0.00 0.00 0.00 34.13 30.85 1o78 s GLU 33 CO 0.16 0.26 0.00 0.41 0.02 0.00 0.00 175.26 176.11 1o78 n GLY 34 N 2.39 0.59 3.82 -1.50 0.00 -1.19 -5.04 105.19 104.26 1o78 n GLY 34 Ca -0.01 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.62 4.31 -0.01 1.61 1.01 -1.23 -4.93 116.67 114.81 1o78 s ASP 35 Ca 0.00 -1.56 0.07 0.00 0.71 0.00 0.00 52.55 51.78 1o78 s ASP 35 Cb 0.00 0.60 -0.02 0.00 1.01 0.00 0.00 42.92 44.51 1o78 s ASP 35 CO 0.00 -0.99 -0.23 -0.89 0.21 0.00 0.00 175.17 173.27 1o78 s THR 36 N -2.86 1.84 0.37 -1.27 2.01 -1.26 -2.03 115.64 112.44 1o78 s THR 36 Ca 0.12 -1.01 0.04 0.00 0.31 0.00 0.00 61.69 61.15 1o78 s THR 36 Cb -0.00 -1.53 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 1o78 s THR 36 CO 0.08 0.51 0.11 0.68 -0.69 0.00 0.00 174.62 175.30 1o78 s VAL 37 N -0.56 0.76 0.23 3.82 -7.23 -0.43 -5.00 120.40 112.00 1o78 s VAL 37 Ca 0.09 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.34 1o78 s VAL 37 Cb -0.09 -2.49 -0.05 0.00 0.56 0.00 0.00 36.38 34.31 1o78 s VAL 37 CO -0.01 0.00 -0.13 -0.54 -0.31 0.00 0.00 175.10 174.11 1o78 s LYS 38 N -3.79 1.43 0.14 4.82 1.02 -1.26 -2.08 119.74 120.02 1o78 s LYS 38 Ca 0.28 -1.66 -0.31 0.00 0.02 0.00 0.00 55.97 54.30 1o78 s LYS 38 Cb 0.05 -1.22 -0.10 0.00 -0.52 0.00 0.00 37.83 36.04 1o78 s LYS 38 CO 0.15 0.17 1.65 0.00 -0.92 0.00 0.00 175.35 176.39 1o78 s ALA 39 N -2.92 3.77 0.00 5.17 0.00 -1.26 -2.10 121.76 124.42 1o78 s ALA 39 Ca 0.25 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.58 1o78 s ALA 39 Cb -0.00 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1o78 s ALA 39 CO 0.09 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.31 1o78 n GLY 40 N 3.92 0.71 3.29 0.00 0.00 -0.75 -4.89 105.19 107.47 1o78 n GLY 40 Ca 0.15 -0.47 -0.37 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.91 2.77 -0.26 1.61 0.74 -0.89 -4.77 119.66 117.96 1o78 s GLN 41 Ca 0.00 -1.07 -0.37 0.00 0.05 0.00 0.00 55.36 53.97 1o78 s GLN 41 Cb 0.00 -3.42 -0.13 0.00 1.10 0.00 0.00 33.01 30.56 1o78 s GLN 41 CO 0.00 -0.59 1.96 2.41 -0.55 0.00 0.00 175.29 178.52 1o78 n THR 42 N 4.82 0.34 -0.01 -0.34 -1.04 -1.26 -0.38 114.28 116.41 1o78 n THR 42 Ca -0.13 -0.15 0.01 0.00 -2.04 0.00 0.00 64.05 61.74 1o78 n THR 42 Cb 0.46 -1.57 -0.04 0.00 -1.82 0.00 0.00 70.33 67.36 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 5.78 0.08 -4.21 12.58 0.24 0.90 -4.71 118.33 129.00 1o78 n VAL 43 Ca 0.31 -0.14 -0.16 0.00 -2.04 0.00 0.00 64.34 62.31 1o78 n VAL 43 Cb 0.21 0.06 -0.11 0.00 -1.47 0.00 0.00 33.84 32.53 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 -3.60 2.40 -0.23 1.34 1.43 -1.14 0.99 118.68 119.88 1o78 s LEU 44 Ca -0.02 -0.80 -0.00 0.00 -1.03 0.00 0.00 54.13 52.28 1o78 s LEU 44 Cb 0.03 -0.43 0.06 0.00 0.03 0.00 0.00 46.19 45.88 1o78 s LEU 44 CO 0.20 -0.20 -0.03 -0.69 0.23 0.00 0.00 176.35 175.87 1o78 s VAL 45 N -2.24 1.25 0.04 -1.59 1.01 -0.69 -0.71 120.40 117.47 1o78 s VAL 45 Ca 0.07 -1.05 -0.04 0.00 0.00 0.00 0.00 61.98 60.96 1o78 s VAL 45 Cb -0.04 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.70 1o78 s VAL 45 CO 0.02 -0.14 0.25 -0.76 0.00 0.00 0.00 175.10 174.47 1o78 s LEU 46 N 1.52 4.35 -0.50 3.92 1.43 -1.10 -0.24 118.68 128.06 1o78 s LEU 46 Ca -0.04 0.44 0.08 0.00 -1.03 0.00 0.00 54.13 53.58 1o78 s LEU 46 Cb -0.18 -2.85 0.35 0.00 0.03 0.00 0.00 46.19 43.53 1o78 s LEU 46 CO -0.07 0.20 0.87 1.21 0.23 0.00 0.00 176.35 178.79 1o78 n GLU 47 N 0.67 2.38 -2.14 1.70 2.13 -1.26 -2.08 120.64 122.05 1o78 n GLU 47 Ca -0.08 -4.29 -0.43 0.00 0.66 0.00 0.00 57.16 53.02 1o78 n GLU 47 Cb 0.52 -2.03 -0.02 0.00 0.27 0.00 0.00 31.44 30.18 1o78 n GLU 47 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1o78 s ALA 48 N -3.09 2.99 -1.39 4.31 0.00 -1.26 -3.13 121.76 120.20 1o78 s ALA 48 Ca 0.45 0.15 -0.07 0.00 0.00 0.00 0.00 51.96 52.49 1o78 s ALA 48 Cb 0.31 -3.96 0.03 0.00 0.00 0.00 0.00 23.12 19.50 1o78 s ALA 48 CO -0.12 -2.44 0.99 -1.33 0.00 0.00 0.00 175.76 172.86 1o78 n MET 49 N 8.19 -6.27 -3.79 0.00 0.00 -1.26 -1.89 117.12 112.10 1o78 n MET 49 Ca 0.20 0.71 -0.24 0.00 0.00 0.00 0.00 57.70 58.37 1o78 n MET 49 Cb 0.47 -5.59 0.02 0.00 0.00 0.00 0.00 33.22 28.12 1o78 n MET 49 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1o78 n LYS 50 N -4.61 -4.80 0.05 0.03 4.76 -1.18 -4.87 118.16 107.53 1o78 n LYS 50 Ca -0.09 0.58 0.11 0.00 -2.87 0.00 0.00 58.31 56.05 1o78 n LYS 50 Cb 0.59 -5.15 -0.06 0.00 -1.84 0.00 0.00 35.03 28.57 1o78 n LYS 50 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1o78 n MET 51 N -4.38 0.55 -2.91 1.97 2.81 -0.79 -5.04 117.12 109.34 1o78 n MET 51 Ca -0.23 -0.02 -0.03 0.00 -1.81 0.00 0.00 57.70 55.62 1o78 n MET 51 Cb 0.65 -1.67 0.00 0.00 -0.71 0.00 0.00 33.22 31.49 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 -2.38 -2.39 -4.09 0.03 2.13 -1.25 -4.98 120.64 107.72 1o78 n GLU 52 Ca -0.01 2.08 -0.32 0.00 0.66 0.00 0.00 57.16 59.57 1o78 n GLU 52 Cb 0.53 -3.97 -0.16 0.00 0.27 0.00 0.00 31.44 28.11 1o78 n GLU 52 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1o78 s THR 53 N -1.53 2.08 -0.24 6.31 2.01 -0.88 -5.02 115.64 118.37 1o78 s THR 53 Ca 0.04 -1.29 -0.29 0.00 0.31 0.00 0.00 61.69 60.46 1o78 s THR 53 Cb -0.01 -2.05 0.00 0.00 0.01 0.00 0.00 72.50 70.45 1o78 s THR 53 CO 0.56 0.23 1.16 -1.61 -0.69 0.00 0.00 174.62 174.27 1o78 s GLU 54 N 1.21 4.16 -0.93 4.92 8.01 -1.26 -2.73 118.70 132.07 1o78 s GLU 54 Ca -0.02 1.39 -0.19 0.00 0.01 0.00 0.00 54.97 56.15 1o78 s GLU 54 Cb -0.17 -3.73 0.12 0.00 -4.31 0.00 0.00 34.13 26.04 1o78 s GLU 54 CO -0.09 -0.78 1.15 0.42 0.01 0.00 0.00 175.26 175.97 1o78 s ILE 55 N 3.56 4.66 0.12 -1.63 -1.09 0.11 -4.94 121.20 121.99 1o78 s ILE 55 Ca 0.50 -1.51 -0.30 0.00 -2.23 0.00 0.00 60.65 57.11 1o78 s ILE 55 Cb -0.17 -4.80 -0.07 0.00 -1.58 0.00 0.00 42.46 35.84 1o78 s ILE 55 CO 0.13 -1.54 1.20 0.54 -1.23 0.00 0.00 174.94 174.04 1o78 s ASN 56 N 3.74 7.08 0.51 3.58 4.22 -1.26 -0.07 114.94 132.74 1o78 s ASN 56 Ca 0.34 2.12 -0.20 0.00 -2.14 0.00 0.00 52.86 52.98 1o78 s ASN 56 Cb -0.04 -2.59 -0.11 0.00 1.28 0.00 0.00 41.25 39.78 1o78 s ASN 56 CO -0.09 -0.42 0.45 0.00 -2.04 0.00 0.00 177.10 175.00 1o78 n ALA 57 N 3.27 -1.49 -0.04 3.54 0.00 0.48 -4.62 120.51 121.65 1o78 n ALA 57 Ca 0.07 0.04 -0.17 0.00 0.00 0.00 0.00 53.44 53.39 1o78 n ALA 57 Cb 0.45 -1.76 -0.06 0.00 0.00 0.00 0.00 19.45 18.08 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 0.43 0.81 -2.68 0.00 0.13 -1.92 -2.00 132.00 126.77 1o78 h PRO 58 Ca -0.43 -0.62 -0.07 0.00 -0.87 0.00 0.00 66.00 64.01 1o78 h PRO 58 Cb 1.40 0.12 -0.17 0.00 0.13 0.00 0.00 31.00 32.48 1o78 h PRO 58 CO 0.48 1.23 0.02 0.99 -0.23 0.00 0.00 178.00 180.50 1o78 s THR 59 N -3.85 0.03 0.37 1.56 2.01 -1.26 -4.65 115.64 109.84 1o78 s THR 59 Ca -0.11 -0.24 -0.27 0.00 0.31 0.00 0.00 61.69 61.39 1o78 s THR 59 Cb 0.09 -0.94 -0.11 0.00 0.01 0.00 0.00 72.50 71.54 1o78 s THR 59 CO 0.90 -0.13 1.27 -0.67 -0.69 0.00 0.00 174.62 175.29 1o78 n ASP 60 N 0.59 2.60 0.00 3.53 2.03 -1.26 -4.28 116.55 119.77 1o78 n ASP 60 Ca -0.19 1.17 0.00 0.00 0.52 0.00 0.00 54.79 56.29 1o78 n ASP 60 Cb 0.59 -1.48 0.00 0.00 -0.72 0.00 0.00 41.12 39.51 1o78 n ASP 60 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1o78 n GLY 61 N 0.81 -0.50 3.60 0.27 0.00 -0.89 -4.88 105.19 103.61 1o78 n GLY 61 Ca 0.05 -1.15 -0.33 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 -2.00 2.68 0.08 1.61 2.20 -1.26 -1.31 119.74 121.74 1o78 s LYS 62 Ca 0.00 -0.62 -0.31 0.00 -0.36 0.00 0.00 55.97 54.68 1o78 s LYS 62 Cb 0.00 -2.57 -0.07 0.00 -1.51 0.00 0.00 37.83 33.68 1o78 s LYS 62 CO 0.00 0.64 1.29 0.08 -0.36 0.00 0.00 175.35 177.00 1o78 s VAL 63 N -0.92 3.70 -1.62 4.02 1.01 -0.86 -0.03 120.40 125.70 1o78 s VAL 63 Ca 0.15 1.21 0.23 0.00 0.00 0.00 0.00 61.98 63.58 1o78 s VAL 63 Cb -0.11 -3.78 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 1o78 s VAL 63 CO 0.05 0.09 1.17 -0.62 0.00 0.00 0.00 175.10 175.79 1o78 n GLU 64 N 4.02 0.71 -3.62 2.72 -0.58 -0.38 -3.15 120.64 120.35 1o78 n GLU 64 Ca 0.10 -0.55 -0.05 0.00 -0.42 0.00 0.00 57.16 56.24 1o78 n GLU 64 Cb 0.44 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.78 1o78 n GLU 64 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1o78 s LYS 65 N -2.67 0.26 -0.02 3.49 2.20 -1.25 -4.94 119.74 116.83 1o78 s LYS 65 Ca 0.16 0.10 -0.00 0.00 -0.36 0.00 0.00 55.97 55.87 1o78 s LYS 65 Cb 0.18 0.12 -0.04 0.00 -1.51 0.00 0.00 37.83 36.58 1o78 s LYS 65 CO 0.65 -0.07 0.06 0.54 -0.36 0.00 0.00 175.35 176.16 1o78 s VAL 66 N -0.84 4.61 0.07 4.02 0.11 -1.26 -2.36 120.40 124.75 1o78 s VAL 66 Ca 0.05 -0.40 0.00 0.00 -2.93 0.00 0.00 61.98 58.69 1o78 s VAL 66 Cb -0.02 -3.07 0.00 0.00 -1.53 0.00 0.00 36.38 31.76 1o78 s VAL 66 CO -0.06 0.39 0.00 0.18 -3.33 0.00 0.00 175.10 172.29 1o78 n LEU 67 N 1.36 0.13 -4.66 2.54 4.77 -1.24 -4.97 117.00 114.94 1o78 n LEU 67 Ca -0.14 0.11 -0.48 0.00 -0.03 0.00 0.00 56.01 55.47 1o78 n LEU 67 Cb 0.53 0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.60 1o78 n LEU 67 CO 0.36 -0.44 1.18 0.52 -1.33 0.00 0.00 177.39 177.67 1o78 n VAL 68 N -2.98 0.09 1.99 4.08 0.31 -1.07 -4.83 118.33 115.92 1o78 n VAL 68 Ca 0.00 -0.02 0.13 0.00 -0.01 0.00 0.00 64.34 64.45 1o78 n VAL 68 Cb 0.15 -1.42 0.78 0.00 -0.91 0.00 0.00 33.84 32.44 1o78 n VAL 68 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1o78 n LYS 69 N 3.75 1.01 -1.72 5.55 5.02 -1.26 -4.84 118.16 125.68 1o78 n LYS 69 Ca 0.18 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 1o78 n LYS 69 Cb 0.26 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 1o78 n LYS 69 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1o78 n GLU 70 N -0.89 -4.83 -2.10 1.97 2.13 -1.26 -4.56 120.64 111.10 1o78 n GLU 70 Ca 0.20 3.51 -0.19 0.00 0.66 0.00 0.00 57.16 61.35 1o78 n GLU 70 Cb 0.09 -3.89 -0.03 0.00 0.27 0.00 0.00 31.44 27.88 1o78 n GLU 70 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1o78 n ARG 71 N 0.13 -1.68 -4.03 5.31 0.63 0.91 -4.85 116.66 113.08 1o78 n ARG 71 Ca 0.00 0.97 -0.29 0.00 -0.92 0.00 0.00 57.85 57.61 1o78 n ARG 71 Cb 0.00 -5.51 -0.17 0.00 0.45 0.00 0.00 32.46 27.23 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 -2.23 2.47 0.41 6.15 -1.08 0.22 -4.74 116.67 117.87 1o78 s ASP 72 Ca 0.00 -0.41 -0.25 0.00 -0.52 0.00 0.00 52.55 51.37 1o78 s ASP 72 Cb 0.00 -1.05 -0.10 0.00 -1.46 0.00 0.00 42.92 40.31 1o78 s ASP 72 CO 0.00 -0.07 1.12 0.00 0.52 0.00 0.00 175.17 176.74 1o78 n ALA 73 N 4.77 0.61 -2.28 3.66 0.00 -1.22 -3.87 120.51 122.17 1o78 n ALA 73 Ca -0.16 0.26 -0.16 0.00 0.00 0.00 0.00 53.44 53.38 1o78 n ALA 73 Cb 0.50 -2.15 -0.10 0.00 0.00 0.00 0.00 19.45 17.70 1o78 n ALA 73 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1o78 s VAL 74 N -1.23 0.31 0.51 0.00 -7.23 -0.67 -4.90 120.40 107.19 1o78 s VAL 74 Ca 0.62 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 1o78 s VAL 74 Cb -0.55 -2.56 0.03 0.00 0.56 0.00 0.00 36.38 33.86 1o78 s VAL 74 CO 0.58 0.00 0.25 0.00 -0.31 0.00 0.00 175.10 175.62 1o78 n GLN 75 N -0.44 0.75 -3.53 4.82 1.13 -1.26 -1.38 117.38 117.47 1o78 n GLN 75 Ca 0.01 -3.37 -0.37 0.00 -1.94 0.00 0.00 57.00 51.33 1o78 n GLN 75 Cb 0.66 0.56 -0.06 0.00 0.11 0.00 0.00 30.24 31.51 1o78 n GLN 75 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1o78 s GLY 76 N -3.96 2.44 0.00 1.08 0.00 -1.25 -4.25 107.32 101.38 1o78 s GLY 76 Ca 0.19 -0.26 0.00 0.00 0.00 0.00 0.00 44.72 44.65 1o78 s GLY 76 CO 0.12 0.07 0.00 0.61 0.00 0.00 0.00 173.10 173.90 1o78 n GLY 77 N 1.69 1.21 3.21 0.20 0.00 0.29 -4.86 105.19 106.93 1o78 n GLY 77 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.05 1.32 0.48 1.61 -1.52 -1.26 -4.53 119.66 115.71 1o78 s GLN 78 Ca 0.00 -0.84 -0.24 0.00 -1.95 0.00 0.00 55.36 52.34 1o78 s GLN 78 Cb 0.00 -1.38 -0.07 0.00 -0.22 0.00 0.00 33.01 31.34 1o78 s GLN 78 CO 0.00 0.36 1.36 0.20 -0.25 0.00 0.00 175.29 176.96 1o78 s GLY 79 N -0.99 2.90 -0.20 3.09 0.00 -1.26 -2.47 107.32 108.39 1o78 s GLY 79 Ca 0.06 1.34 -0.02 0.00 0.00 0.00 0.00 44.72 46.11 1o78 s GLY 79 CO 0.01 1.90 -0.20 1.04 0.00 0.00 0.00 173.10 175.85 1o78 n LEU 80 N -0.50 2.57 -3.61 0.66 4.77 -1.15 -4.66 117.00 115.08 1o78 n LEU 80 Ca 0.07 -0.01 -0.10 0.00 -0.03 0.00 0.00 56.01 55.94 1o78 n LEU 80 Cb 0.44 -0.67 -0.06 0.00 -2.33 0.00 0.00 43.42 40.79 1o78 n LEU 80 CO 0.55 0.73 0.73 -0.51 -1.33 0.00 0.00 177.39 177.56 1o78 s ILE 81 N -2.39 0.00 0.16 -0.08 1.10 -1.26 -2.61 121.20 116.12 1o78 s ILE 81 Ca -0.27 0.00 -0.10 0.00 -0.51 0.00 0.00 60.65 59.77 1o78 s ILE 81 Cb 0.08 -1.00 -0.06 0.00 0.15 0.00 0.00 42.46 41.63 1o78 s ILE 81 CO 0.43 0.00 0.48 -0.75 -2.11 0.00 0.00 174.94 172.99 1o78 s LYS 82 N -0.24 3.79 0.11 3.50 2.20 -0.99 -3.91 119.74 124.19 1o78 s LYS 82 Ca 0.01 0.22 0.03 0.00 -0.36 0.00 0.00 55.97 55.87 1o78 s LYS 82 Cb -0.03 -2.82 -0.04 0.00 -1.51 0.00 0.00 37.83 33.43 1o78 s LYS 82 CO -0.03 0.43 -0.09 0.96 -0.36 0.00 0.00 175.35 176.27 1o78 s ILE 83 N -1.62 0.91 -2.30 5.43 -4.36 -1.22 -1.25 121.20 116.78 1o78 s ILE 83 Ca 0.41 -1.89 0.30 0.00 -0.26 0.00 0.00 60.65 59.20 1o78 s ILE 83 Cb -0.13 -1.64 0.69 0.00 1.25 0.00 0.00 42.46 42.64 1o78 s ILE 83 CO 0.21 -0.75 1.94 0.61 0.24 0.00 0.00 174.94 177.19