#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 1.82 -3.88 0.03 4.81 -1.26 -4.76 118.16 114.93 1o78 n LYS 2 Ca 0.00 -1.47 -0.08 0.00 -0.87 0.00 0.00 58.31 55.89 1o78 n LYS 2 Cb 0.00 -2.51 -0.02 0.00 0.02 0.00 0.00 35.03 32.52 1o78 n LYS 2 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 1o78 s LEU 3 N 0.30 -0.04 0.40 3.14 2.96 -1.26 -5.18 118.68 119.00 1o78 s LEU 3 Ca 0.41 -0.83 0.05 0.00 -0.22 0.00 0.00 54.13 53.53 1o78 s LEU 3 Cb 0.10 2.55 -0.06 0.00 0.50 0.00 0.00 46.19 49.28 1o78 s LEU 3 CO 0.00 -1.40 0.03 -0.54 -1.32 0.00 0.00 176.35 173.12 1o78 s LYS 4 N -3.50 1.91 -0.77 1.98 1.02 -1.26 -5.09 119.74 114.03 1o78 s LYS 4 Ca 0.15 -2.10 0.02 0.00 0.02 0.00 0.00 55.97 54.06 1o78 s LYS 4 Cb -0.05 -1.37 0.19 0.00 -0.52 0.00 0.00 37.83 36.08 1o78 s LYS 4 CO 0.09 -0.15 0.59 0.08 -0.92 0.00 0.00 175.35 175.05 1o78 s VAL 5 N -2.91 3.51 -0.09 3.17 1.01 -1.26 -4.83 120.40 119.00 1o78 s VAL 5 Ca 0.31 -4.00 -0.01 0.00 0.00 0.00 0.00 61.98 58.28 1o78 s VAL 5 Cb 0.08 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 33.23 1o78 s VAL 5 CO 0.15 -1.02 0.03 1.07 0.00 0.00 0.00 175.10 175.33 1o78 n THR 6 N 2.26 0.00 -3.68 3.92 5.66 -1.26 -1.25 114.28 119.93 1o78 n THR 6 Ca 0.19 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.88 1o78 n THR 6 Cb 0.36 -0.02 0.04 0.00 -1.55 0.00 0.00 70.33 69.15 1o78 n THR 6 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1o78 n VAL 7 N -2.33 -5.73 -1.99 1.08 0.31 -1.26 -4.98 118.33 103.43 1o78 n VAL 7 Ca 0.01 -0.84 -0.06 0.00 -0.01 0.00 0.00 64.34 63.43 1o78 n VAL 7 Cb 0.45 -4.27 0.04 0.00 -0.91 0.00 0.00 33.84 29.15 1o78 n VAL 7 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1o78 n ASN 8 N -2.58 0.24 0.00 4.52 5.03 -0.38 -4.92 115.26 117.17 1o78 n ASN 8 Ca -0.10 -1.24 0.00 0.00 0.87 0.00 0.00 54.58 54.11 1o78 n ASN 8 Cb 0.59 -0.19 0.00 0.00 -1.02 0.00 0.00 39.78 39.16 1o78 n ASN 8 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1o78 n GLY 9 N 2.96 0.81 3.63 7.41 0.00 -1.26 -5.06 105.19 113.68 1o78 n GLY 9 Ca 0.04 -1.33 0.08 0.00 0.00 0.00 0.00 46.02 44.81 1o78 n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o78 n ALA 10 N 3.84 -1.82 -2.24 4.61 0.00 -1.26 -4.95 120.51 118.69 1o78 n ALA 10 Ca 0.00 0.18 -0.14 0.00 0.00 0.00 0.00 53.44 53.48 1o78 n ALA 10 Cb 0.00 -0.60 -0.10 0.00 0.00 0.00 0.00 19.45 18.75 1o78 n ALA 10 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1o78 s GLY 11 N -4.80 1.52 -0.13 0.00 0.00 -1.26 -5.17 107.32 97.48 1o78 s GLY 11 Ca 0.00 -1.75 -0.15 0.00 0.00 0.00 0.00 44.72 42.82 1o78 s GLY 11 CO 0.00 -1.47 0.40 1.25 0.00 0.00 0.00 173.10 173.28 1o78 s LYS 12 N -4.10 0.52 0.41 2.90 2.20 -1.26 -5.04 119.74 115.36 1o78 s LYS 12 Ca 0.37 0.45 0.07 0.00 -0.36 0.00 0.00 55.97 56.51 1o78 s LYS 12 Cb 0.07 0.25 -0.06 0.00 -1.51 0.00 0.00 37.83 36.58 1o78 s LYS 12 CO 0.12 -0.08 0.14 0.00 -0.36 0.00 0.00 175.35 175.17 1o78 s ALA 13 N -0.03 3.48 0.00 3.13 0.00 -1.26 -4.32 121.76 122.77 1o78 s ALA 13 Ca -0.02 -2.15 0.00 0.00 0.00 0.00 0.00 51.96 49.79 1o78 s ALA 13 Cb -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.82 1o78 s ALA 13 CO 0.01 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.03 1o78 n GLY 14 N -1.17 2.01 2.77 0.00 0.00 -1.26 -5.02 105.19 102.52 1o78 n GLY 14 Ca -0.02 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 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 3.54 0.99 0.00 1.61 2.56 -1.26 -4.79 118.70 121.35 1o78 s GLU 15 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 54.97 53.51 1o78 s GLU 15 Cb 0.00 -2.28 0.00 0.00 2.00 0.00 0.00 34.13 33.85 1o78 s GLU 15 CO 0.00 -1.03 0.00 0.41 -0.56 0.00 0.00 175.26 174.08 1o78 n GLY 16 N 4.39 0.77 3.73 -1.50 0.00 -1.26 -4.78 105.19 106.54 1o78 n GLY 16 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 0.46 2.13 -0.46 1.61 4.04 -1.26 -1.14 118.70 124.09 1o78 s GLU 17 Ca 0.00 -2.21 -0.08 0.00 0.04 0.00 0.00 54.97 52.72 1o78 s GLU 17 Cb 0.00 -1.68 0.12 0.00 0.02 0.00 0.00 34.13 32.59 1o78 s GLU 17 CO 0.00 -0.26 0.32 0.42 -1.84 0.00 0.00 175.26 173.90 1o78 s ILE 18 N -2.78 4.04 0.48 1.83 -1.09 0.06 -4.82 121.20 118.93 1o78 s ILE 18 Ca 0.22 -1.83 -0.21 0.00 -2.23 0.00 0.00 60.65 56.60 1o78 s ILE 18 Cb 0.04 -3.68 -0.08 0.00 -1.58 0.00 0.00 42.46 37.17 1o78 s ILE 18 CO 0.12 -0.76 1.08 -2.16 -1.23 0.00 0.00 174.94 171.99 1o78 s PRO 19 N 1.32 3.73 -0.33 2.79 0.04 -1.26 0.15 135.00 141.44 1o78 s PRO 19 Ca 0.06 1.49 -0.27 0.00 0.04 0.00 0.00 61.00 62.33 1o78 s PRO 19 Cb -0.26 -2.17 0.01 0.00 0.04 0.00 0.00 34.50 32.13 1o78 s PRO 19 CO -0.01 -0.51 0.97 0.00 0.04 0.00 0.00 177.00 177.49 1o78 s ALA 20 N -1.83 3.48 -1.20 8.56 0.00 -0.99 -4.81 121.76 124.98 1o78 s ALA 20 Ca 0.67 -0.24 0.18 0.00 0.00 0.00 0.00 51.96 52.57 1o78 s ALA 20 Cb -0.20 -3.56 0.82 0.00 0.00 0.00 0.00 23.12 20.18 1o78 s ALA 20 CO 0.24 -1.45 1.55 -0.35 0.00 0.00 0.00 175.76 175.76 1o78 n PRO 21 N 6.69 0.12 -3.69 0.00 -0.04 -1.26 -0.12 135.00 136.70 1o78 n PRO 21 Ca 0.09 0.16 -0.11 0.00 -0.04 0.00 0.00 63.50 63.60 1o78 n PRO 21 Cb 0.48 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.32 1o78 n PRO 21 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1o78 s LEU 22 N -2.80 -0.16 1.40 1.53 2.96 -1.26 -4.92 118.68 115.42 1o78 s LEU 22 Ca 0.12 0.80 -0.22 0.00 -0.22 0.00 0.00 54.13 54.62 1o78 s LEU 22 Cb 0.12 1.14 0.35 0.00 0.50 0.00 0.00 46.19 48.29 1o78 s LEU 22 CO 0.30 -0.20 0.83 0.00 -1.32 0.00 0.00 176.35 175.95 1o78 n ALA 23 N 4.69 -4.48 0.00 5.97 0.00 -1.26 -4.55 120.51 120.88 1o78 n ALA 23 Ca -0.18 -1.77 0.00 0.00 0.00 0.00 0.00 53.44 51.49 1o78 n ALA 23 Cb 0.53 -1.57 0.00 0.00 0.00 0.00 0.00 19.45 18.41 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 1.85 0.04 2.60 0.00 0.00 -0.56 -4.84 105.19 104.28 1o78 n GLY 24 Ca 0.11 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 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 -4.00 0.23 -0.72 2.61 -4.23 -1.19 0.18 115.64 108.52 1o78 s THR 25 Ca 0.00 -0.96 -0.29 0.00 -1.18 0.00 0.00 61.69 59.26 1o78 s THR 25 Cb 0.00 -1.20 -0.14 0.00 1.34 0.00 0.00 72.50 72.50 1o78 s THR 25 CO 0.00 -0.71 2.53 0.52 -0.54 0.00 0.00 174.62 176.42 1o78 n VAL 26 N 5.12 -0.03 -0.34 2.29 0.31 -1.26 -2.82 118.33 121.60 1o78 n VAL 26 Ca -0.05 -0.41 0.01 0.00 -0.01 0.00 0.00 64.34 63.89 1o78 n VAL 26 Cb 0.42 -1.68 0.15 0.00 -0.91 0.00 0.00 33.84 31.81 1o78 n VAL 26 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 1o78 h SER 27 N 15.74 0.93 -4.12 4.52 0.87 -0.59 1.25 113.55 132.15 1o78 h SER 27 Ca -0.15 0.01 0.19 0.00 -1.23 0.00 0.00 61.79 60.61 1o78 h SER 27 Cb 1.29 -0.19 -0.20 0.00 -0.44 0.00 0.00 62.40 62.86 1o78 h SER 27 CO 1.26 0.60 0.73 -0.75 -0.53 0.00 0.00 176.83 178.14 1o78 s LYS 28 N -6.06 0.41 -0.10 2.24 2.20 -1.18 -4.63 119.74 112.63 1o78 s LYS 28 Ca -0.13 -0.08 -0.12 0.00 -0.36 0.00 0.00 55.97 55.29 1o78 s LYS 28 Cb 0.19 0.19 -0.05 0.00 -1.51 0.00 0.00 37.83 36.65 1o78 s LYS 28 CO 0.80 -0.17 0.28 -1.50 -0.36 0.00 0.00 175.35 174.41 1o78 s ILE 29 N -2.08 5.27 -0.11 5.43 2.07 -1.26 -2.23 121.20 128.30 1o78 s ILE 29 Ca 0.06 0.54 0.16 0.00 -1.41 0.00 0.00 60.65 60.01 1o78 s ILE 29 Cb -0.01 -3.59 -0.24 0.00 0.13 0.00 0.00 42.46 38.76 1o78 s ILE 29 CO -0.05 0.52 0.20 0.18 -1.91 0.00 0.00 174.94 173.88 1o78 n LEU 30 N 2.52 0.00 -4.88 8.50 7.99 -1.02 -4.97 117.00 125.15 1o78 n LEU 30 Ca -0.15 0.00 -0.30 0.00 -0.01 0.00 0.00 56.01 55.55 1o78 n LEU 30 Cb 0.53 0.24 -0.04 0.00 -0.11 0.00 0.00 43.42 44.04 1o78 n LEU 30 CO 0.36 0.24 0.40 0.54 -1.51 0.00 0.00 177.39 177.42 1o78 s VAL 31 N -2.76 4.81 0.10 4.08 0.11 -0.93 -4.97 120.40 120.83 1o78 s VAL 31 Ca -0.08 0.58 0.09 0.00 -2.93 0.00 0.00 61.98 59.64 1o78 s VAL 31 Cb 0.08 -3.71 -0.04 0.00 -1.53 0.00 0.00 36.38 31.18 1o78 s VAL 31 CO 0.72 -0.43 -0.23 -0.75 -3.33 0.00 0.00 175.10 171.07 1o78 s LYS 32 N -3.65 1.26 0.23 1.54 2.47 -1.26 -5.07 119.74 115.26 1o78 s LYS 32 Ca 0.50 -1.19 -0.30 0.00 -1.56 0.00 0.00 55.97 53.42 1o78 s LYS 32 Cb -0.10 -1.58 -0.09 0.00 -1.46 0.00 0.00 37.83 34.60 1o78 s LYS 32 CO 0.29 0.38 1.28 -2.00 0.16 0.00 0.00 175.35 175.45 1o78 s GLU 33 N -1.85 4.42 0.00 4.03 2.12 -1.26 -2.77 118.70 123.39 1o78 s GLU 33 Ca 0.09 2.04 0.00 0.00 0.36 0.00 0.00 54.97 57.46 1o78 s GLU 33 Cb -0.10 -3.17 0.00 0.00 0.26 0.00 0.00 34.13 31.12 1o78 s GLU 33 CO 0.04 -0.18 0.00 0.41 -0.54 0.00 0.00 175.26 175.00 1o78 n GLY 34 N 1.92 0.41 3.18 -1.50 0.00 -1.25 -5.04 105.19 102.91 1o78 n GLY 34 Ca 0.04 -0.98 -0.23 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.97 2.02 -0.31 1.61 1.01 -1.11 -4.95 116.67 111.96 1o78 s ASP 35 Ca 0.00 -0.42 -0.24 0.00 0.71 0.00 0.00 52.55 52.60 1o78 s ASP 35 Cb 0.00 -0.18 0.00 0.00 1.01 0.00 0.00 42.92 43.76 1o78 s ASP 35 CO 0.00 0.13 0.83 -0.89 0.21 0.00 0.00 175.17 175.46 1o78 s THR 36 N -0.67 4.74 0.15 -1.27 2.01 -1.26 -2.40 115.64 116.94 1o78 s THR 36 Ca 0.05 1.24 0.03 0.00 0.31 0.00 0.00 61.69 63.32 1o78 s THR 36 Cb -0.08 -4.19 -0.04 0.00 0.01 0.00 0.00 72.50 68.20 1o78 s THR 36 CO 0.01 -0.30 0.25 0.54 -0.69 0.00 0.00 174.62 174.43 1o78 s VAL 37 N 3.08 5.19 0.03 3.82 0.11 0.13 -4.91 120.40 127.84 1o78 s VAL 37 Ca 0.34 -0.74 0.04 0.00 -2.93 0.00 0.00 61.98 58.69 1o78 s VAL 37 Cb -0.14 -3.66 -0.04 0.00 -1.53 0.00 0.00 36.38 31.02 1o78 s VAL 37 CO 0.13 -0.08 -0.06 -0.54 -3.33 0.00 0.00 175.10 171.23 1o78 s LYS 38 N -3.17 2.52 0.40 1.54 -0.14 -1.26 -0.33 119.74 119.30 1o78 s LYS 38 Ca 0.34 -0.77 -0.26 0.00 -1.36 0.00 0.00 55.97 53.92 1o78 s LYS 38 Cb -0.11 -2.50 -0.11 0.00 -1.68 0.00 0.00 37.83 33.44 1o78 s LYS 38 CO 0.28 0.58 1.21 0.00 -0.76 0.00 0.00 175.35 176.66 1o78 n ALA 39 N 1.30 1.00 0.00 5.17 0.00 -1.25 -1.98 120.51 124.75 1o78 n ALA 39 Ca -0.14 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1o78 n ALA 39 Cb 0.52 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.76 1o78 n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o78 n GLY 40 N 0.89 2.92 3.68 0.00 0.00 -0.81 -4.86 105.19 107.02 1o78 n GLY 40 Ca 0.07 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 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 0.00 4.21 -0.52 1.61 0.74 -0.84 -4.33 119.66 120.53 1o78 s GLN 41 Ca 0.00 2.24 -0.27 0.00 0.05 0.00 0.00 55.36 57.38 1o78 s GLN 41 Cb 0.00 -3.72 -0.09 0.00 1.10 0.00 0.00 33.01 30.31 1o78 s GLN 41 CO 0.00 -0.74 2.43 -2.37 -0.55 0.00 0.00 175.29 174.05 1o78 n THR 42 N 4.94 -0.03 0.40 -0.34 5.66 -1.26 -0.27 114.28 123.39 1o78 n THR 42 Ca 0.16 -0.66 0.13 0.00 -3.05 0.00 0.00 64.05 60.63 1o78 n THR 42 Cb 0.42 -2.47 0.36 0.00 -1.55 0.00 0.00 70.33 67.09 1o78 n THR 42 CO 0.00 0.00 0.00 -0.37 -3.05 0.00 0.00 175.07 171.65 1o78 h VAL 43 N 7.67 0.00 -3.17 1.08 -1.51 0.13 -3.42 116.25 117.03 1o78 h VAL 43 Ca -0.23 -0.65 -0.08 0.00 -1.23 0.00 0.00 66.70 64.51 1o78 h VAL 43 Cb 1.27 1.62 -0.16 0.00 -2.13 0.00 0.00 31.29 31.89 1o78 h VAL 43 CO 1.16 0.00 -0.15 -0.76 -1.23 0.00 0.00 177.57 176.60 1o78 s LEU 44 N -5.37 0.56 -0.16 4.19 1.43 -1.13 -2.20 118.68 116.00 1o78 s LEU 44 Ca 0.07 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 1o78 s LEU 44 Cb 0.09 1.63 0.03 0.00 0.03 0.00 0.00 46.19 47.97 1o78 s LEU 44 CO 0.59 -0.68 -0.11 -0.69 0.23 0.00 0.00 176.35 175.70 1o78 s VAL 45 N -2.71 1.44 0.50 -1.59 1.01 -0.94 0.39 120.40 118.50 1o78 s VAL 45 Ca -0.04 -0.68 0.08 0.00 0.00 0.00 0.00 61.98 61.35 1o78 s VAL 45 Cb -0.00 -1.45 0.04 0.00 0.00 0.00 0.00 36.38 34.97 1o78 s VAL 45 CO -0.04 0.33 0.61 -0.76 0.00 0.00 0.00 175.10 175.23 1o78 s LEU 46 N 1.52 3.27 -0.29 3.92 2.01 -0.93 0.10 118.68 128.28 1o78 s LEU 46 Ca 0.03 -0.75 -0.08 0.00 0.01 0.00 0.00 54.13 53.34 1o78 s LEU 46 Cb -0.14 -1.96 0.14 0.00 0.01 0.00 0.00 46.19 44.24 1o78 s LEU 46 CO -0.09 -1.02 0.60 -0.70 1.01 0.00 0.00 176.35 176.15 1o78 s GLU 47 N -4.43 0.54 0.00 1.70 2.12 -1.13 -1.22 118.70 116.27 1o78 s GLU 47 Ca 0.54 1.28 0.00 0.00 0.36 0.00 0.00 54.97 57.15 1o78 s GLU 47 Cb -0.06 0.70 0.00 0.00 0.26 0.00 0.00 34.13 35.03 1o78 s GLU 47 CO 0.33 -0.31 0.00 0.00 -0.54 0.00 0.00 175.26 174.74 1o78 n ALA 48 N 5.44 1.97 -1.54 6.30 0.00 -1.26 -3.18 120.51 128.23 1o78 n ALA 48 Ca -0.09 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.02 1o78 n ALA 48 Cb 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.90 1o78 n ALA 48 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1o78 n MET 49 N -0.97 3.58 -3.66 0.00 0.00 -1.26 -4.64 117.12 110.17 1o78 n MET 49 Ca 0.00 -2.50 -0.27 0.00 -0.00 0.00 0.00 57.70 54.92 1o78 n MET 49 Cb 0.00 -2.52 0.02 0.00 0.00 0.00 0.00 33.22 30.73 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 2.32 -5.06 -3.59 2.12 4.76 -1.26 -4.95 118.16 112.50 1o78 n LYS 50 Ca 0.63 0.62 -0.27 0.00 -2.87 0.00 0.00 58.31 56.42 1o78 n LYS 50 Cb 0.39 -5.48 -0.16 0.00 -1.84 0.00 0.00 35.03 27.94 1o78 n LYS 50 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 1o78 s MET 51 N -6.36 0.18 -0.28 1.97 1.75 -1.26 -5.09 119.30 110.21 1o78 s MET 51 Ca 0.56 -0.32 -0.30 0.00 -1.25 0.00 0.00 55.69 54.38 1o78 s MET 51 Cb -0.28 -1.58 -0.07 0.00 2.84 0.00 0.00 34.83 35.74 1o78 s MET 51 CO 0.69 -0.82 2.24 0.39 -0.65 0.00 0.00 175.02 176.87 1o78 n GLU 52 N 5.24 1.65 -2.94 4.11 1.02 -1.26 -4.18 120.64 124.27 1o78 n GLU 52 Ca -0.07 0.42 -0.44 0.00 -0.02 0.00 0.00 57.16 57.06 1o78 n GLU 52 Cb 0.46 -3.06 -0.02 0.00 -0.02 0.00 0.00 31.44 28.80 1o78 n GLU 52 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1o78 s THR 53 N 8.44 4.83 0.24 2.62 2.01 -0.36 -4.90 115.64 128.52 1o78 s THR 53 Ca 1.03 -1.86 -0.31 0.00 0.31 0.00 0.00 61.69 60.86 1o78 s THR 53 Cb -0.46 -4.80 -0.11 0.00 0.01 0.00 0.00 72.50 67.14 1o78 s THR 53 CO 0.38 -1.52 1.63 -1.61 -0.69 0.00 0.00 174.62 172.81 1o78 s GLU 54 N 2.33 4.15 -0.48 4.92 0.41 -1.26 -2.20 118.70 126.57 1o78 s GLU 54 Ca 0.35 2.54 -0.09 0.00 -0.41 0.00 0.00 54.97 57.36 1o78 s GLU 54 Cb -0.04 -3.07 0.12 0.00 -1.78 0.00 0.00 34.13 29.36 1o78 s GLU 54 CO -0.07 -0.66 0.35 0.42 -0.49 0.00 0.00 175.26 174.81 1o78 s ILE 55 N 0.63 4.19 0.25 -1.63 1.01 0.16 -4.96 121.20 120.86 1o78 s ILE 55 Ca 0.69 -1.83 -0.30 0.00 0.00 0.00 0.00 60.65 59.21 1o78 s ILE 55 Cb -0.48 -3.76 -0.09 0.00 0.01 0.00 0.00 42.46 38.14 1o78 s ILE 55 CO 0.39 -0.78 1.23 0.54 0.00 0.00 0.00 174.94 176.32 1o78 s ASN 56 N 2.61 7.01 0.58 3.58 4.22 -1.26 0.16 114.94 131.83 1o78 s ASN 56 Ca 0.06 2.40 -0.20 0.00 -2.14 0.00 0.00 52.86 52.99 1o78 s ASN 56 Cb -0.26 -2.62 -0.05 0.00 1.28 0.00 0.00 41.25 39.60 1o78 s ASN 56 CO -0.01 -0.39 1.11 0.00 -2.04 0.00 0.00 177.10 175.77 1o78 n ALA 57 N 1.77 0.65 0.02 3.54 0.00 0.63 -4.66 120.51 122.45 1o78 n ALA 57 Ca 0.02 0.05 -0.11 0.00 0.00 0.00 0.00 53.44 53.41 1o78 n ALA 57 Cb 0.43 -2.20 0.03 0.00 0.00 0.00 0.00 19.45 17.72 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 0.81 0.52 -3.01 0.00 0.13 -1.91 -2.14 132.00 126.39 1o78 h PRO 58 Ca -0.49 -0.38 -0.04 0.00 -0.87 0.00 0.00 66.00 64.22 1o78 h PRO 58 Cb 1.34 0.06 -0.14 0.00 0.13 0.00 0.00 31.00 32.40 1o78 h PRO 58 CO 0.53 1.00 0.09 0.99 -0.23 0.00 0.00 178.00 180.38 1o78 s THR 59 N -3.80 0.03 0.27 1.56 2.01 -1.26 -4.79 115.64 109.66 1o78 s THR 59 Ca -0.07 -0.22 -0.29 0.00 0.31 0.00 0.00 61.69 61.41 1o78 s THR 59 Cb 0.11 -1.04 -0.09 0.00 0.01 0.00 0.00 72.50 71.48 1o78 s THR 59 CO 0.85 -0.12 1.15 1.51 -0.69 0.00 0.00 174.62 177.31 1o78 s ASP 60 N -2.51 7.17 0.00 3.53 -4.77 -1.26 -3.90 116.67 114.93 1o78 s ASP 60 Ca -0.01 2.33 0.00 0.00 -3.30 0.00 0.00 52.55 51.57 1o78 s ASP 60 Cb -0.00 -2.63 0.00 0.00 -1.09 0.00 0.00 42.92 39.20 1o78 s ASP 60 CO -0.09 -0.24 0.00 0.61 0.70 0.00 0.00 175.17 176.15 1o78 n GLY 61 N 1.28 -1.06 3.47 2.12 0.00 0.55 -4.86 105.19 106.70 1o78 n GLY 61 Ca -0.00 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.28 2.55 0.34 1.61 2.20 -1.26 0.19 119.74 125.09 1o78 s LYS 62 Ca 0.00 -0.69 -0.27 0.00 -0.36 0.00 0.00 55.97 54.65 1o78 s LYS 62 Cb 0.00 -2.39 -0.09 0.00 -1.51 0.00 0.00 37.83 33.84 1o78 s LYS 62 CO 0.00 0.60 1.14 0.08 -0.36 0.00 0.00 175.35 176.81 1o78 s VAL 63 N -0.67 3.33 -0.15 4.02 1.01 -1.01 -4.75 120.40 122.18 1o78 s VAL 63 Ca 0.10 1.21 0.15 0.00 0.00 0.00 0.00 61.98 63.45 1o78 s VAL 63 Cb -0.11 -3.72 -0.23 0.00 0.00 0.00 0.00 36.38 32.32 1o78 s VAL 63 CO 0.01 0.19 0.39 -0.62 0.00 0.00 0.00 175.10 175.08 1o78 n GLU 64 N 0.59 0.75 0.00 2.72 -0.58 -0.51 -3.84 120.64 119.77 1o78 n GLU 64 Ca 0.02 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.64 1o78 n GLU 64 Cb 0.46 -1.34 0.00 0.00 -0.57 0.00 0.00 31.44 29.99 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 -1.91 0.00 -3.67 3.49 5.02 -1.25 -4.90 118.16 114.93 1o78 n LYS 65 Ca -0.02 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.98 1o78 n LYS 65 Cb 0.37 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 35.23 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 0.56 -0.68 -0.18 -7.23 -1.26 -0.03 120.40 109.58 1o78 s VAL 66 Ca 0.00 -1.18 0.25 0.00 -1.81 0.00 0.00 61.98 59.24 1o78 s VAL 66 Cb 0.00 -1.44 0.17 0.00 0.56 0.00 0.00 36.38 35.68 1o78 s VAL 66 CO 0.00 -0.69 1.55 0.17 -0.31 0.00 0.00 175.10 175.82 1o78 h LEU 67 N 8.20 0.00 -9.39 1.32 8.10 -1.73 -3.47 115.31 118.33 1o78 h LEU 67 Ca -0.16 -0.10 -0.57 0.00 0.11 0.00 0.00 57.88 57.16 1o78 h LEU 67 Cb 1.01 0.00 0.19 0.00 -0.44 0.00 0.00 40.66 41.43 1o78 h LEU 67 CO 0.46 0.05 -0.81 1.33 -4.11 0.00 0.00 178.44 175.36 1o78 n VAL 68 N -2.21 1.04 -0.17 0.15 0.24 -1.07 -4.92 118.33 111.37 1o78 n VAL 68 Ca 0.04 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 1o78 n VAL 68 Cb 0.44 -0.44 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1o78 n VAL 68 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1o78 n LYS 69 N 0.31 1.70 -1.60 7.34 5.02 -1.26 -5.12 118.16 124.56 1o78 n LYS 69 Ca 0.08 -1.11 0.00 0.00 -2.02 0.00 0.00 58.31 55.25 1o78 n LYS 69 Cb 0.50 -0.91 0.00 0.00 -0.02 0.00 0.00 35.03 34.60 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 -0.32 -4.46 -3.81 1.97 2.13 -1.26 -4.68 120.64 110.21 1o78 n GLU 70 Ca 0.00 3.37 -0.29 0.00 0.66 0.00 0.00 57.16 60.89 1o78 n GLU 70 Cb 0.24 -3.92 0.02 0.00 0.27 0.00 0.00 31.44 28.04 1o78 n GLU 70 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1o78 n ARG 71 N -1.47 -4.98 -2.71 5.31 1.74 0.43 -4.84 116.66 110.14 1o78 n ARG 71 Ca 0.00 0.58 -0.03 0.00 -0.77 0.00 0.00 57.85 57.63 1o78 n ARG 71 Cb 0.16 -5.43 0.10 0.00 -1.02 0.00 0.00 32.46 26.27 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 -2.72 -0.73 -0.05 0.55 -0.08 -1.26 -4.74 116.55 107.52 1o78 n ASP 72 Ca 0.03 -2.26 0.15 0.00 -1.51 0.00 0.00 54.79 51.20 1o78 n ASP 72 Cb 0.53 0.43 0.70 0.00 2.34 0.00 0.00 41.12 45.12 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 -1.08 2.63 -1.48 -1.67 0.00 -1.02 -4.77 120.51 113.12 1o78 n ALA 73 Ca -0.08 -0.20 -0.46 0.00 0.00 0.00 0.00 53.44 52.69 1o78 n ALA 73 Cb 0.85 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.86 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 -1.12 1.97 -2.74 0.00 0.24 0.47 -1.50 118.33 115.65 1o78 n VAL 74 Ca 0.15 -0.50 -0.04 0.00 -2.04 0.00 0.00 64.34 61.91 1o78 n VAL 74 Cb 0.25 -0.43 -0.04 0.00 -1.47 0.00 0.00 33.84 32.16 1o78 n VAL 74 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1o78 n GLN 75 N 0.87 -3.69 0.00 7.34 7.27 -1.26 -4.68 117.38 123.22 1o78 n GLN 75 Ca 0.14 2.85 0.00 0.00 0.07 0.00 0.00 57.00 60.06 1o78 n GLN 75 Cb 0.29 -3.86 0.00 0.00 2.41 0.00 0.00 30.24 29.07 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 1.97 -2.27 1.02 1.69 0.00 -1.26 -4.34 105.19 101.99 1o78 n GLY 76 Ca -0.31 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.25 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 2.72 3.14 3.71 -0.02 0.00 0.82 -4.87 105.19 110.69 1o78 n GLY 77 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.40 4.56 0.86 1.61 0.74 -1.26 -4.60 119.66 121.17 1o78 s GLN 78 Ca 0.00 1.48 -0.13 0.00 0.05 0.00 0.00 55.36 56.76 1o78 s GLN 78 Cb 0.00 -3.43 0.06 0.00 1.10 0.00 0.00 33.01 30.74 1o78 s GLN 78 CO 0.00 -0.04 0.82 0.41 -0.55 0.00 0.00 175.29 175.93 1o78 n GLY 79 N 2.84 -0.97 0.96 2.59 0.00 -1.26 -2.35 105.19 107.00 1o78 n GLY 79 Ca 0.06 -0.59 -0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.28 0.59 -4.31 0.99 4.77 0.38 -4.64 117.00 112.51 1o78 n LEU 80 Ca 0.11 0.08 -0.20 0.00 -0.03 0.00 0.00 56.01 55.96 1o78 n LEU 80 Cb 0.52 -0.20 -0.11 0.00 -2.33 0.00 0.00 43.42 41.30 1o78 n LEU 80 CO 0.49 -0.61 -0.46 -0.63 -1.33 0.00 0.00 177.39 174.85 1o78 s ILE 81 N -1.53 1.66 0.03 -0.08 1.01 -1.26 -1.95 121.20 119.09 1o78 s ILE 81 Ca -0.01 -1.94 -0.05 0.00 0.00 0.00 0.00 60.65 58.65 1o78 s ILE 81 Cb 0.00 -1.82 -0.05 0.00 0.01 0.00 0.00 42.46 40.61 1o78 s ILE 81 CO 0.01 -0.42 0.26 -0.75 0.00 0.00 0.00 174.94 174.04 1o78 s LYS 82 N -3.00 3.54 -0.03 2.79 2.47 0.96 -0.76 119.74 125.72 1o78 s LYS 82 Ca 0.16 -0.18 0.14 0.00 -1.56 0.00 0.00 55.97 54.53 1o78 s LYS 82 Cb -0.04 -3.04 0.25 0.00 -1.46 0.00 0.00 37.83 33.54 1o78 s LYS 82 CO 0.06 0.62 1.11 1.51 0.16 0.00 0.00 175.35 178.80 1o78 n ILE 83 N 0.80 0.35 -0.98 5.43 3.06 -0.29 -1.42 119.36 126.30 1o78 n ILE 83 Ca -0.09 -0.92 0.00 0.00 -2.50 0.00 0.00 62.75 59.24 1o78 n ILE 83 Cb 0.52 0.60 0.00 0.00 0.54 0.00 0.00 39.64 41.30 1o78 n ILE 83 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66