#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 0.00 -4.20 0.03 5.02 -1.26 -4.55 118.16 113.20 1o78 n LYS 2 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.96 1o78 n LYS 2 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 34.86 1o78 n LYS 2 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1o78 s LEU 3 N 0.00 2.40 0.72 -0.35 2.96 -1.26 -5.12 118.68 118.03 1o78 s LEU 3 Ca 0.00 -0.54 -0.02 0.00 -0.22 0.00 0.00 54.13 53.35 1o78 s LEU 3 Cb 0.00 -1.56 0.12 0.00 0.50 0.00 0.00 46.19 45.25 1o78 s LEU 3 CO 0.00 0.02 1.00 -0.54 -1.32 0.00 0.00 176.35 175.51 1o78 s LYS 4 N 1.19 1.71 0.44 1.98 1.02 -1.26 -4.96 119.74 119.86 1o78 s LYS 4 Ca 0.02 -0.96 0.10 0.00 0.02 0.00 0.00 55.97 55.15 1o78 s LYS 4 Cb -0.14 -2.29 0.98 0.00 -0.52 0.00 0.00 37.83 35.86 1o78 s LYS 4 CO -0.07 -1.44 2.08 0.28 -0.92 0.00 0.00 175.35 175.27 1o78 h VAL 5 N -0.57 1.08 -3.40 3.17 2.07 -1.99 -3.43 116.25 113.17 1o78 h VAL 5 Ca -0.38 -0.18 -0.45 0.00 0.82 0.00 0.00 66.70 66.50 1o78 h VAL 5 Cb 1.27 0.72 0.21 0.00 -1.52 0.00 0.00 31.29 31.98 1o78 h VAL 5 CO 0.43 0.08 0.03 0.28 0.02 0.00 0.00 177.57 178.41 1o78 s THR 6 N -5.29 2.00 -0.26 2.57 -1.32 -1.26 -5.00 115.64 107.08 1o78 s THR 6 Ca -0.07 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.44 1o78 s THR 6 Cb 0.17 -2.01 0.06 0.00 -1.51 0.00 0.00 72.50 69.21 1o78 s THR 6 CO 0.71 -0.00 -0.10 -0.69 -2.21 0.00 0.00 174.62 172.33 1o78 s VAL 7 N -2.45 2.24 0.00 5.08 1.01 -1.26 -5.11 120.40 119.91 1o78 s VAL 7 Ca 0.68 -1.62 0.00 0.00 0.00 0.00 0.00 61.98 61.05 1o78 s VAL 7 Cb -0.25 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.81 1o78 s VAL 7 CO 0.64 -0.04 0.00 0.59 0.00 0.00 0.00 175.10 176.29 1o78 n ASN 8 N 4.45 -1.21 0.00 3.32 3.02 -1.26 -4.93 115.26 118.65 1o78 n ASN 8 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.41 1o78 n ASN 8 Cb 0.42 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 1o78 n ASN 8 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1o78 n GLY 9 N 0.00 0.61 0.17 7.41 0.00 -1.26 -5.00 105.19 107.13 1o78 n GLY 9 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 1o78 n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o78 h ALA 10 N 0.00 0.51 0.00 4.61 0.00 -2.03 -3.46 119.26 118.88 1o78 h ALA 10 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1o78 h ALA 10 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1o78 h ALA 10 CO 0.00 -0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.48 1o78 n GLY 11 N -1.23 -1.89 1.06 0.00 0.00 -1.26 -5.07 105.19 96.81 1o78 n GLY 11 Ca 0.02 0.66 0.14 0.00 0.00 0.00 0.00 46.02 46.84 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 -2.14 -2.09 -4.03 1.61 4.81 -1.26 -4.86 118.16 110.20 1o78 n LYS 12 Ca 0.00 1.44 -0.22 0.00 -0.87 0.00 0.00 58.31 58.66 1o78 n LYS 12 Cb 0.00 -2.58 -0.05 0.00 0.02 0.00 0.00 35.03 32.43 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 -2.29 3.62 0.00 3.14 0.00 -1.26 -3.86 121.76 121.11 1o78 s ALA 13 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 51.96 50.39 1o78 s ALA 13 Cb 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 23.12 21.98 1o78 s ALA 13 CO 0.00 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.32 1o78 n GLY 14 N -1.21 2.08 3.07 0.00 0.00 -1.26 -5.05 105.19 102.81 1o78 n GLY 14 Ca -0.05 -0.15 -0.14 0.00 0.00 0.00 0.00 46.02 45.67 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 1.62 0.57 -1.44 1.61 2.12 -1.26 -4.79 118.70 117.13 1o78 s GLU 15 Ca 0.00 -0.71 -0.09 0.00 0.36 0.00 0.00 54.97 54.53 1o78 s GLU 15 Cb 0.00 -0.41 0.05 0.00 0.26 0.00 0.00 34.13 34.03 1o78 s GLU 15 CO 0.00 0.08 0.71 0.41 -0.54 0.00 0.00 175.26 175.92 1o78 n GLY 16 N 1.66 -0.50 3.74 -1.50 0.00 -1.26 -4.85 105.19 102.47 1o78 n GLY 16 Ca -0.21 0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 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 -6.12 2.36 -0.31 1.61 4.04 -1.26 -2.80 118.70 116.21 1o78 s GLU 17 Ca 0.46 -1.59 0.00 0.00 0.04 0.00 0.00 54.97 53.88 1o78 s GLU 17 Cb -0.23 -2.16 0.10 0.00 0.02 0.00 0.00 34.13 31.86 1o78 s GLU 17 CO 0.57 0.06 0.08 0.42 -1.84 0.00 0.00 175.26 174.55 1o78 s ILE 18 N -2.46 1.14 -0.08 1.83 1.09 -1.24 -4.96 121.20 116.52 1o78 s ILE 18 Ca 0.39 -1.55 -0.30 0.00 -1.10 0.00 0.00 60.65 58.09 1o78 s ILE 18 Cb -0.02 -1.85 -0.04 0.00 -1.06 0.00 0.00 42.46 39.50 1o78 s ILE 18 CO 0.23 -0.64 1.44 -2.16 -0.10 0.00 0.00 174.94 173.70 1o78 s PRO 19 N 1.49 4.23 0.42 2.79 0.04 -1.26 0.01 135.00 142.71 1o78 s PRO 19 Ca 0.09 1.92 -0.26 0.00 0.04 0.00 0.00 61.00 62.79 1o78 s PRO 19 Cb -0.18 -3.80 -0.09 0.00 0.04 0.00 0.00 34.50 30.47 1o78 s PRO 19 CO -0.21 -0.72 1.45 0.00 0.04 0.00 0.00 177.00 177.55 1o78 s ALA 20 N 3.41 3.38 -0.04 8.56 0.00 -1.03 -4.70 121.76 131.35 1o78 s ALA 20 Ca 0.64 1.50 0.30 0.00 0.00 0.00 0.00 51.96 54.39 1o78 s ALA 20 Cb -0.28 -3.59 1.03 0.00 0.00 0.00 0.00 23.12 20.28 1o78 s ALA 20 CO 0.23 -1.12 1.86 -1.00 0.00 0.00 0.00 175.76 175.73 1o78 h PRO 21 N 2.62 0.00 -2.72 0.00 0.13 -1.94 -0.21 132.00 129.88 1o78 h PRO 21 Ca -0.51 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.53 1o78 h PRO 21 Cb 1.25 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.20 1o78 h PRO 21 CO 0.62 0.04 -0.08 -0.51 -0.23 0.00 0.00 178.00 177.84 1o78 s LEU 22 N -6.26 0.25 1.16 1.56 1.43 -1.26 -4.76 118.68 110.80 1o78 s LEU 22 Ca 0.03 0.25 -0.17 0.00 -1.03 0.00 0.00 54.13 53.20 1o78 s LEU 22 Cb 0.08 1.80 0.21 0.00 0.03 0.00 0.00 46.19 48.31 1o78 s LEU 22 CO 0.59 -0.56 0.40 0.00 0.23 0.00 0.00 176.35 177.00 1o78 n ALA 23 N 0.93 -3.05 0.00 4.21 0.00 -1.26 -4.13 120.51 117.21 1o78 n ALA 23 Ca -0.20 -1.34 0.00 0.00 0.00 0.00 0.00 53.44 51.91 1o78 n ALA 23 Cb 0.57 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 2.05 1.09 3.63 0.00 0.00 -1.13 -4.79 105.19 106.04 1o78 n GLY 24 Ca 0.05 -0.43 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 1o78 n GLY 24 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o78 s THR 25 N -2.00 4.31 -0.10 2.61 -4.23 -1.25 -2.23 115.64 112.76 1o78 s THR 25 Ca 0.00 -0.23 -0.20 0.00 -1.18 0.00 0.00 61.69 60.08 1o78 s THR 25 Cb 0.00 -2.86 -0.04 0.00 1.34 0.00 0.00 72.50 70.94 1o78 s THR 25 CO 0.00 0.55 0.56 -0.69 -0.54 0.00 0.00 174.62 174.50 1o78 s VAL 26 N -0.31 5.13 -0.08 2.29 1.01 -1.26 -1.62 120.40 125.56 1o78 s VAL 26 Ca 0.07 1.13 0.19 0.00 0.00 0.00 0.00 61.98 63.37 1o78 s VAL 26 Cb -0.12 -3.90 -0.28 0.00 0.00 0.00 0.00 36.38 32.08 1o78 s VAL 26 CO 0.02 0.30 0.32 -1.20 0.00 0.00 0.00 175.10 174.54 1o78 n SER 27 N 3.67 0.45 -3.63 3.32 7.64 -1.03 -2.31 113.62 121.73 1o78 n SER 27 Ca -0.05 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.79 1o78 n SER 27 Cb 0.51 1.61 -0.01 0.00 -1.01 0.00 0.00 64.21 65.31 1o78 n SER 27 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1o78 s LYS 28 N -3.09 0.81 0.05 1.43 2.20 -1.26 -4.70 119.74 115.19 1o78 s LYS 28 Ca -0.08 -0.39 0.08 0.00 -0.36 0.00 0.00 55.97 55.23 1o78 s LYS 28 Cb 0.10 0.31 -0.03 0.00 -1.51 0.00 0.00 37.83 36.71 1o78 s LYS 28 CO 0.80 -0.36 -0.23 -1.50 -0.36 0.00 0.00 175.35 173.70 1o78 s ILE 29 N -2.96 1.90 -0.19 5.43 2.07 -1.26 -1.34 121.20 124.86 1o78 s ILE 29 Ca 0.10 -1.33 -0.13 0.00 -1.41 0.00 0.00 60.65 57.87 1o78 s ILE 29 Cb -0.00 -1.65 -0.08 0.00 0.13 0.00 0.00 42.46 40.86 1o78 s ILE 29 CO -0.03 0.25 -0.30 0.18 -1.91 0.00 0.00 174.94 173.13 1o78 n LEU 30 N 1.72 1.73 0.00 8.50 4.32 -0.86 -4.94 117.00 127.47 1o78 n LEU 30 Ca -0.17 0.29 -0.04 0.00 -0.02 0.00 0.00 56.01 56.07 1o78 n LEU 30 Cb 0.53 -0.69 0.03 0.00 -1.62 0.00 0.00 43.42 41.67 1o78 n LEU 30 CO 0.23 0.11 0.08 1.33 -1.22 0.00 0.00 177.39 177.92 1o78 n VAL 31 N -4.18 0.00 -2.65 4.08 0.24 -1.02 -5.03 118.33 109.77 1o78 n VAL 31 Ca -0.31 -0.07 -0.02 0.00 -2.04 0.00 0.00 64.34 61.90 1o78 n VAL 31 Cb 0.65 -1.17 0.10 0.00 -1.47 0.00 0.00 33.84 31.95 1o78 n VAL 31 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1o78 n LYS 32 N -1.83 1.32 -1.62 7.34 0.00 -1.26 -5.09 118.16 117.02 1o78 n LYS 32 Ca 0.02 -1.64 0.00 0.00 0.00 0.00 0.00 58.31 56.69 1o78 n LYS 32 Cb 0.07 0.05 0.00 0.00 0.00 0.00 0.00 35.03 35.15 1o78 n LYS 32 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1o78 n GLU 33 N -1.24 -4.55 -1.32 1.64 2.13 -1.26 -4.65 120.64 111.38 1o78 n GLU 33 Ca -0.14 3.42 -0.11 0.00 0.66 0.00 0.00 57.16 61.00 1o78 n GLU 33 Cb 0.86 -3.94 -0.05 0.00 0.27 0.00 0.00 31.44 28.58 1o78 n GLU 33 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1o78 n GLY 34 N -1.28 1.14 3.38 8.31 0.00 -0.91 -4.96 105.19 110.87 1o78 n GLY 34 Ca 0.00 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.56 4.34 1.35 1.61 2.15 -1.26 -4.87 116.67 117.42 1o78 s ASP 35 Ca 0.00 -0.30 -0.21 0.00 0.43 0.00 0.00 52.55 52.47 1o78 s ASP 35 Cb 0.00 -1.71 0.33 0.00 -0.30 0.00 0.00 42.92 41.24 1o78 s ASP 35 CO 0.00 0.09 0.76 0.41 -0.17 0.00 0.00 175.17 176.27 1o78 n THR 36 N 4.03 0.00 -3.60 1.71 -1.04 -1.26 -2.70 114.28 111.41 1o78 n THR 36 Ca -0.18 -0.08 -0.04 0.00 -2.04 0.00 0.00 64.05 61.71 1o78 n THR 36 Cb 0.52 -0.88 -0.02 0.00 -1.82 0.00 0.00 70.33 68.13 1o78 n THR 36 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1o78 s VAL 37 N -2.14 0.00 0.47 12.58 0.11 0.30 -4.77 120.40 126.95 1o78 s VAL 37 Ca 0.61 -0.17 0.02 0.00 -2.93 0.00 0.00 61.98 59.51 1o78 s VAL 37 Cb -0.13 -1.41 -0.02 0.00 -1.53 0.00 0.00 36.38 33.30 1o78 s VAL 37 CO 0.53 0.00 0.04 -0.54 -3.33 0.00 0.00 175.10 171.80 1o78 s LYS 38 N -2.75 2.10 -0.12 1.54 1.02 -1.26 -0.07 119.74 120.20 1o78 s LYS 38 Ca 0.10 -2.31 -0.26 0.00 0.02 0.00 0.00 55.97 53.51 1o78 s LYS 38 Cb 0.00 -1.29 -0.02 0.00 -0.52 0.00 0.00 37.83 36.00 1o78 s LYS 38 CO -0.04 -0.36 0.86 0.00 -0.92 0.00 0.00 175.35 174.89 1o78 s ALA 39 N -2.96 3.42 0.00 5.17 0.00 -1.26 -3.45 121.76 122.67 1o78 s ALA 39 Ca 0.13 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.28 1o78 s ALA 39 Cb 0.03 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.91 1o78 s ALA 39 CO 0.07 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 175.75 1o78 n GLY 40 N 3.25 3.37 3.70 0.00 0.00 -1.17 -4.90 105.19 109.45 1o78 n GLY 40 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.75 4.31 0.27 1.61 0.74 -1.22 -4.40 119.66 120.22 1o78 s GLN 41 Ca 0.00 2.01 -0.29 0.00 0.05 0.00 0.00 55.36 57.13 1o78 s GLN 41 Cb 0.00 -3.41 -0.14 0.00 1.10 0.00 0.00 33.01 30.56 1o78 s GLN 41 CO 0.00 -0.49 1.19 2.41 -0.55 0.00 0.00 175.29 177.84 1o78 n THR 42 N 4.28 1.59 0.00 -0.34 -1.04 -1.26 0.15 114.28 117.66 1o78 n THR 42 Ca 0.12 -0.40 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 1o78 n THR 42 Cb 0.43 -1.21 0.00 0.00 -1.82 0.00 0.00 70.33 67.73 1o78 n THR 42 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1o78 n VAL 43 N 0.82 0.00 -4.20 12.58 0.31 0.14 -4.70 118.33 123.28 1o78 n VAL 43 Ca 0.10 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.27 1o78 n VAL 43 Cb 0.32 -0.56 -0.07 0.00 -0.91 0.00 0.00 33.84 32.61 1o78 n VAL 43 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1o78 s LEU 44 N -4.23 1.33 0.05 7.52 1.43 -1.17 -2.03 118.68 121.58 1o78 s LEU 44 Ca 0.00 -1.55 0.07 0.00 -1.03 0.00 0.00 54.13 51.62 1o78 s LEU 44 Cb 0.00 0.83 -0.03 0.00 0.03 0.00 0.00 46.19 47.02 1o78 s LEU 44 CO 0.00 -1.08 -0.21 -0.69 0.23 0.00 0.00 176.35 174.60 1o78 s VAL 45 N -3.55 1.69 0.18 -1.59 1.01 -0.45 0.19 120.40 117.88 1o78 s VAL 45 Ca 0.37 -1.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 1o78 s VAL 45 Cb 0.03 -1.47 0.01 0.00 0.00 0.00 0.00 36.38 34.94 1o78 s VAL 45 CO 0.21 0.20 0.26 0.18 0.00 0.00 0.00 175.10 175.95 1o78 n LEU 46 N 1.81 0.00 -3.15 3.92 4.77 0.06 -2.48 117.00 121.93 1o78 n LEU 46 Ca -0.17 -1.42 0.05 0.00 -0.03 0.00 0.00 56.01 54.44 1o78 n LEU 46 Cb 0.53 1.34 -0.01 0.00 -2.33 0.00 0.00 43.42 42.95 1o78 n LEU 46 CO 0.23 -0.34 0.41 -0.70 -1.33 0.00 0.00 177.39 175.67 1o78 s GLU 47 N -2.37 0.34 0.00 3.23 2.56 -0.64 0.16 118.70 121.99 1o78 s GLU 47 Ca 0.14 0.58 0.00 0.00 0.00 0.00 0.00 54.97 55.69 1o78 s GLU 47 Cb -0.01 0.32 0.00 0.00 2.00 0.00 0.00 34.13 36.44 1o78 s GLU 47 CO 0.10 -0.38 0.00 0.00 -0.56 0.00 0.00 175.26 174.42 1o78 n ALA 48 N 5.45 0.00 -0.03 6.30 0.00 -1.12 -3.87 120.51 127.24 1o78 n ALA 48 Ca -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.37 1o78 n ALA 48 Cb 0.53 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.19 1o78 n ALA 48 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1o78 h MET 49 N 0.00 0.59 -0.07 0.00 4.05 -2.02 -3.15 114.93 114.33 1o78 h MET 49 Ca 0.00 -0.18 0.00 0.00 -0.28 0.00 0.00 59.70 59.24 1o78 h MET 49 Cb 0.00 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 30.74 1o78 h MET 49 CO 0.00 0.70 0.00 1.63 0.23 0.00 0.00 176.91 179.47 1o78 n LYS 50 N -4.19 2.58 -4.41 0.39 5.02 -1.26 -5.02 118.16 111.27 1o78 n LYS 50 Ca 0.01 -1.92 -0.27 0.00 -2.02 0.00 0.00 58.31 54.10 1o78 n LYS 50 Cb 0.34 -1.21 -0.12 0.00 -0.02 0.00 0.00 35.03 34.01 1o78 n LYS 50 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1o78 s MET 51 N -1.56 1.48 -0.35 1.97 -1.94 -1.19 -5.09 119.30 112.62 1o78 s MET 51 Ca 0.14 -1.48 0.03 0.00 -1.71 0.00 0.00 55.69 52.67 1o78 s MET 51 Cb 0.11 -1.85 0.16 0.00 2.01 0.00 0.00 34.83 35.25 1o78 s MET 51 CO 0.04 0.41 0.39 -1.83 -0.01 0.00 0.00 175.02 174.02 1o78 s GLU 52 N -2.53 0.59 0.00 2.03 4.04 -1.26 -2.77 118.70 118.80 1o78 s GLU 52 Ca 0.19 -0.60 0.00 0.00 0.04 0.00 0.00 54.97 54.60 1o78 s GLU 52 Cb -0.08 -0.59 0.00 0.00 0.02 0.00 0.00 34.13 33.47 1o78 s GLU 52 CO 0.09 -1.16 0.00 -2.37 -1.84 0.00 0.00 175.26 169.98 1o78 n THR 53 N 4.53 0.00 -1.29 1.83 5.66 0.43 -4.57 114.28 120.87 1o78 n THR 53 Ca 0.08 0.00 -0.48 0.00 -3.05 0.00 0.00 64.05 60.60 1o78 n THR 53 Cb 0.47 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.19 1o78 n THR 53 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1o78 n GLU 54 N 11.55 0.00 -3.92 1.09 1.02 -1.25 -0.76 120.64 128.37 1o78 n GLU 54 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.84 1o78 n GLU 54 Cb 0.00 -1.16 -0.15 0.00 -0.02 0.00 0.00 31.44 30.11 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 -0.34 1.56 0.47 -3.67 -1.09 0.50 -4.82 121.20 113.81 1o78 s ILE 55 Ca 0.71 -1.44 -0.24 0.00 -2.23 0.00 0.00 60.65 57.45 1o78 s ILE 55 Cb -1.01 -1.93 -0.08 0.00 -1.58 0.00 0.00 42.46 37.86 1o78 s ILE 55 CO 0.50 -0.28 1.25 0.59 -1.23 0.00 0.00 174.94 175.78 1o78 n ASN 56 N 4.63 2.38 -4.73 3.58 3.02 -1.26 0.25 115.26 123.12 1o78 n ASN 56 Ca -0.08 1.05 -0.35 0.00 -0.03 0.00 0.00 54.58 55.17 1o78 n ASN 56 Cb 0.43 -1.50 0.08 0.00 -0.61 0.00 0.00 39.78 38.18 1o78 n ASN 56 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1o78 s ALA 57 N -1.25 2.26 0.21 5.41 0.00 0.12 -4.69 121.76 123.82 1o78 s ALA 57 Ca 0.65 0.99 0.02 0.00 0.00 0.00 0.00 51.96 53.61 1o78 s ALA 57 Cb -0.48 -3.49 0.15 0.00 0.00 0.00 0.00 23.12 19.31 1o78 s ALA 57 CO 0.55 -1.68 1.50 -1.00 0.00 0.00 0.00 175.76 175.13 1o78 h PRO 58 N 0.12 0.31 -2.09 0.00 0.13 -1.91 -3.08 132.00 125.49 1o78 h PRO 58 Ca -0.49 -0.24 -0.03 0.00 -0.87 0.00 0.00 66.00 64.38 1o78 h PRO 58 Cb 1.31 0.04 -0.18 0.00 0.13 0.00 0.00 31.00 32.29 1o78 h PRO 58 CO 0.51 0.86 0.25 -0.08 -0.23 0.00 0.00 178.00 179.32 1o78 s THR 59 N -3.69 0.00 0.86 1.56 -1.32 -1.26 -4.82 115.64 106.96 1o78 s THR 59 Ca -0.05 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.32 1o78 s THR 59 Cb 0.11 -1.00 0.11 0.00 -1.51 0.00 0.00 72.50 70.22 1o78 s THR 59 CO 0.82 0.00 1.16 1.51 -2.21 0.00 0.00 174.62 175.90 1o78 s ASP 60 N -1.44 3.33 0.00 8.08 -4.77 -1.26 -4.43 116.67 116.19 1o78 s ASP 60 Ca -0.07 2.22 0.00 0.00 -3.30 0.00 0.00 52.55 51.39 1o78 s ASP 60 Cb -0.00 -2.57 0.00 0.00 -1.09 0.00 0.00 42.92 39.26 1o78 s ASP 60 CO 0.05 -2.83 0.00 0.61 0.70 0.00 0.00 175.17 173.70 1o78 n GLY 61 N 0.17 0.28 3.08 2.12 0.00 0.90 -4.86 105.19 106.88 1o78 n GLY 61 Ca 0.12 -1.19 -0.07 0.00 0.00 0.00 0.00 46.02 44.88 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 0.57 -0.24 1.61 2.20 -1.26 0.11 119.74 120.72 1o78 s LYS 62 Ca 0.00 -1.10 -0.24 0.00 -0.36 0.00 0.00 55.97 54.27 1o78 s LYS 62 Cb 0.00 0.20 -0.01 0.00 -1.51 0.00 0.00 37.83 36.51 1o78 s LYS 62 CO 0.00 -0.11 0.82 0.08 -0.36 0.00 0.00 175.35 175.78 1o78 s VAL 63 N -3.47 4.84 -0.96 4.02 1.01 -1.10 -3.16 120.40 121.59 1o78 s VAL 63 Ca 0.03 1.55 0.25 0.00 0.00 0.00 0.00 61.98 63.80 1o78 s VAL 63 Cb 0.05 -4.11 -0.00 0.00 0.00 0.00 0.00 36.38 32.32 1o78 s VAL 63 CO -0.08 -0.07 1.39 -0.62 0.00 0.00 0.00 175.10 175.71 1o78 n GLU 64 N 6.00 0.03 0.00 2.72 -0.58 0.23 -2.15 120.64 126.89 1o78 n GLU 64 Ca 0.05 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 1o78 n GLU 64 Cb 0.48 -1.52 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 1o78 n GLU 64 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1o78 n LYS 65 N -1.56 0.00 -3.90 3.49 5.02 -1.25 -4.90 118.16 115.07 1o78 n LYS 65 Ca 0.05 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.04 1o78 n LYS 65 Cb 0.35 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 35.21 1o78 n LYS 65 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1o78 s VAL 66 N -2.00 1.98 0.21 -0.18 1.01 -1.26 -2.15 120.40 118.01 1o78 s VAL 66 Ca 0.00 -2.53 -0.03 0.00 0.00 0.00 0.00 61.98 59.42 1o78 s VAL 66 Cb 0.00 -2.43 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 1o78 s VAL 66 CO 0.00 -0.73 1.56 -0.07 0.00 0.00 0.00 175.10 175.87 1o78 h LEU 67 N 7.19 0.66 -9.24 3.92 3.38 -1.78 -3.42 115.31 116.01 1o78 h LEU 67 Ca -0.06 -0.30 -0.59 0.00 0.09 0.00 0.00 57.88 57.01 1o78 h LEU 67 Cb 0.96 -0.18 -0.11 0.00 0.09 0.00 0.00 40.66 41.42 1o78 h LEU 67 CO 0.56 0.99 -0.32 -0.69 0.09 0.00 0.00 178.44 179.07 1o78 s VAL 68 N -4.23 5.29 0.06 1.22 1.01 -0.93 -5.03 120.40 117.79 1o78 s VAL 68 Ca -0.08 0.55 0.01 0.00 0.00 0.00 0.00 61.98 62.45 1o78 s VAL 68 Cb 0.12 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.87 1o78 s VAL 68 CO 0.83 0.35 0.08 0.29 0.00 0.00 0.00 175.10 176.66 1o78 n LYS 69 N 3.84 0.81 -3.00 2.72 4.01 -1.26 -5.05 118.16 120.24 1o78 n LYS 69 Ca -0.11 -0.28 -0.40 0.00 -0.51 0.00 0.00 58.31 57.01 1o78 n LYS 69 Cb 0.52 -0.04 -0.05 0.00 -0.51 0.00 0.00 35.03 34.95 1o78 n LYS 69 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 1o78 s GLU 70 N -2.38 4.48 -1.52 1.97 2.12 -1.26 -3.90 118.70 118.21 1o78 s GLU 70 Ca 0.06 1.04 -0.12 0.00 0.36 0.00 0.00 54.97 56.31 1o78 s GLU 70 Cb -0.00 -3.36 0.08 0.00 0.26 0.00 0.00 34.13 31.11 1o78 s GLU 70 CO 0.04 0.30 0.88 0.54 -0.54 0.00 0.00 175.26 176.48 1o78 n ARG 71 N 2.78 -4.98 -0.03 4.30 1.74 -0.98 -4.85 116.66 114.63 1o78 n ARG 71 Ca -0.03 0.56 0.02 0.00 -0.77 0.00 0.00 57.85 57.63 1o78 n ARG 71 Cb 0.50 -5.33 -0.13 0.00 -1.02 0.00 0.00 32.46 26.48 1o78 n ARG 71 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1o78 n ASP 72 N -2.85 1.06 -2.15 0.55 -0.08 -1.25 -4.95 116.55 106.88 1o78 n ASP 72 Ca -0.02 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.26 1o78 n ASP 72 Cb 0.55 1.45 0.00 0.00 2.34 0.00 0.00 41.12 45.46 1o78 n ASP 72 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1o78 n ALA 73 N -2.28 -2.04 -4.50 -1.67 0.00 -1.26 -4.97 120.51 103.79 1o78 n ALA 73 Ca -0.12 0.48 -0.25 0.00 0.00 0.00 0.00 53.44 53.55 1o78 n ALA 73 Cb 0.66 -1.46 -0.06 0.00 0.00 0.00 0.00 19.45 18.60 1o78 n ALA 73 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1o78 n VAL 74 N 1.89 0.00 -4.45 0.00 0.24 -0.95 -5.00 118.33 110.07 1o78 n VAL 74 Ca 0.00 -1.96 -0.23 0.00 -2.04 0.00 0.00 64.34 60.11 1o78 n VAL 74 Cb 0.00 0.51 -0.10 0.00 -1.47 0.00 0.00 33.84 32.78 1o78 n VAL 74 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1o78 s GLN 75 N -3.42 1.61 0.49 7.34 0.74 -1.26 -2.85 119.66 122.32 1o78 s GLN 75 Ca 0.06 -1.79 -0.22 0.00 0.05 0.00 0.00 55.36 53.47 1o78 s GLN 75 Cb 0.00 -1.43 -0.06 0.00 1.10 0.00 0.00 33.01 32.62 1o78 s GLN 75 CO 0.05 0.16 1.23 0.20 -0.55 0.00 0.00 175.29 176.38 1o78 s GLY 76 N -3.48 2.81 0.00 2.59 0.00 -1.26 -3.85 107.32 104.14 1o78 s GLY 76 Ca 0.29 1.07 0.00 0.00 0.00 0.00 0.00 44.72 46.08 1o78 s GLY 76 CO 0.13 1.55 0.00 0.61 0.00 0.00 0.00 173.10 175.38 1o78 n GLY 77 N 0.54 1.08 3.07 0.20 0.00 -0.09 -4.84 105.19 105.15 1o78 n GLY 77 Ca 0.08 -0.30 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.09 0.22 -0.22 1.61 0.74 -1.25 -4.86 119.66 113.81 1o78 s GLN 78 Ca 0.00 0.49 -0.34 0.00 0.05 0.00 0.00 55.36 55.56 1o78 s GLN 78 Cb 0.00 -0.07 -0.11 0.00 1.10 0.00 0.00 33.01 33.93 1o78 s GLN 78 CO 0.00 -0.14 2.04 0.41 -0.55 0.00 0.00 175.29 177.05 1o78 n GLY 79 N 3.97 0.98 0.24 2.59 0.00 -1.25 -2.47 105.19 109.25 1o78 n GLY 79 Ca -0.23 0.88 -0.11 0.00 0.00 0.00 0.00 46.02 46.57 1o78 n GLY 79 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1o78 h LEU 80 N 11.17 -0.45 -8.60 0.99 3.38 -0.77 -3.42 115.31 117.61 1o78 h LEU 80 Ca -0.39 -0.09 -0.24 0.00 0.09 0.00 0.00 57.88 57.24 1o78 h LEU 80 Cb 1.29 0.12 -0.15 0.00 0.09 0.00 0.00 40.66 42.01 1o78 h LEU 80 CO 0.98 -0.01 -0.63 0.27 0.09 0.00 0.00 178.44 179.14 1o78 s ILE 81 N -3.82 0.13 -0.01 1.22 -4.36 -1.26 -2.19 121.20 110.90 1o78 s ILE 81 Ca -0.11 -1.98 0.03 0.00 -0.26 0.00 0.00 60.65 58.33 1o78 s ILE 81 Cb 0.01 -2.41 -0.03 0.00 1.25 0.00 0.00 42.46 41.28 1o78 s ILE 81 CO 0.37 -0.12 -0.08 -0.75 0.24 0.00 0.00 174.94 174.61 1o78 s LYS 82 N -4.11 2.57 0.09 0.37 2.20 -0.91 -3.65 119.74 116.29 1o78 s LYS 82 Ca 0.35 -0.70 -0.01 0.00 -0.36 0.00 0.00 55.97 55.25 1o78 s LYS 82 Cb 0.07 -2.50 -0.04 0.00 -1.51 0.00 0.00 37.83 33.86 1o78 s LYS 82 CO 0.10 0.61 0.02 0.96 -0.36 0.00 0.00 175.35 176.68 1o78 s ILE 83 N -0.94 0.16 0.00 5.43 -4.36 -1.12 -0.60 121.20 119.77 1o78 s ILE 83 Ca 0.16 -1.83 0.00 0.00 -0.26 0.00 0.00 60.65 58.72 1o78 s ILE 83 Cb -0.11 -1.77 0.00 0.00 1.25 0.00 0.00 42.46 41.83 1o78 s ILE 83 CO 0.06 -0.73 0.00 0.61 0.24 0.00 0.00 174.94 175.12