#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 0.02 -2.20 0.03 4.81 -1.26 -5.04 118.16 114.52 1o78 n LYS 2 Ca 0.00 0.01 -0.37 0.00 -0.87 0.00 0.00 58.31 57.08 1o78 n LYS 2 Cb 0.00 -0.53 0.00 0.00 0.02 0.00 0.00 35.03 34.53 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 -6.09 3.90 0.00 3.14 0.20 -1.26 -5.02 118.68 113.56 1o78 s LEU 3 Ca -0.01 2.32 0.00 0.00 0.69 0.00 0.00 54.13 57.13 1o78 s LEU 3 Cb 0.00 -4.36 0.00 0.00 -0.43 0.00 0.00 46.19 41.41 1o78 s LEU 3 CO 0.01 -1.11 0.00 1.17 -0.29 0.00 0.00 176.35 176.14 1o78 n LYS 4 N -0.83 0.00 -3.57 1.98 3.00 -1.26 -5.12 118.16 112.36 1o78 n LYS 4 Ca 0.09 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.12 1o78 n LYS 4 Cb 0.49 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 35.40 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 -0.51 0.90 0.00 3.15 1.01 -1.26 -4.87 120.40 118.83 1o78 s VAL 5 Ca 0.00 -2.51 0.00 0.00 0.00 0.00 0.00 61.98 59.47 1o78 s VAL 5 Cb 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 36.38 34.75 1o78 s VAL 5 CO 0.00 -1.02 0.00 1.07 0.00 0.00 0.00 175.10 175.15 1o78 n THR 6 N 3.35 0.00 -4.63 3.92 5.66 -1.26 -5.15 114.28 116.17 1o78 n THR 6 Ca 0.16 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.84 1o78 n THR 6 Cb 0.39 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.10 1o78 n THR 6 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1o78 s VAL 7 N -1.05 1.22 0.02 1.08 -7.23 -1.26 -5.06 120.40 108.11 1o78 s VAL 7 Ca 0.00 -1.92 0.00 0.00 -1.81 0.00 0.00 61.98 58.25 1o78 s VAL 7 Cb 0.00 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.80 1o78 s VAL 7 CO 0.00 0.00 0.00 -3.20 -0.31 0.00 0.00 175.10 171.59 1o78 n ASN 8 N -1.35 -0.14 0.00 4.85 4.05 -1.26 -5.04 115.26 116.37 1o78 n ASN 8 Ca -0.17 0.03 0.00 0.00 0.45 0.00 0.00 54.58 54.89 1o78 n ASN 8 Cb 0.67 0.60 0.00 0.00 1.23 0.00 0.00 39.78 42.28 1o78 n ASN 8 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1o78 n GLY 9 N -1.49 0.42 1.05 8.20 0.00 -1.26 -4.96 105.19 107.16 1o78 n GLY 9 Ca 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.81 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 -0.98 3.00 -0.25 4.61 0.00 -1.26 -5.15 120.51 120.48 1o78 n ALA 10 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1o78 n ALA 10 Cb 0.00 0.23 0.00 0.00 0.00 0.00 0.00 19.45 19.68 1o78 n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o78 n GLY 11 N 3.49 -3.48 0.00 0.00 0.00 -1.26 -5.03 105.19 98.91 1o78 n GLY 11 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1o78 n GLY 11 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1o78 n LYS 12 N -0.50 0.00 -3.06 1.61 5.02 -1.26 -5.05 118.16 114.92 1o78 n LYS 12 Ca 0.00 0.03 -0.18 0.00 -2.02 0.00 0.00 58.31 56.14 1o78 n LYS 12 Cb 0.00 -0.34 0.02 0.00 -0.02 0.00 0.00 35.03 34.69 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 -2.01 -2.79 -1.35 7.82 0.00 -1.26 -5.01 120.51 115.91 1o78 n ALA 13 Ca 0.00 0.92 0.00 0.00 0.00 0.00 0.00 53.44 54.36 1o78 n ALA 13 Cb 0.00 -3.32 0.00 0.00 0.00 0.00 0.00 19.45 16.13 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 -0.27 1.29 0.90 0.00 0.00 -1.26 -5.03 105.19 100.83 1o78 n GLY 14 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 1o78 n GLY 14 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1o78 n GLU 15 N 0.00 0.02 -3.17 1.61 2.13 -1.26 -4.88 120.64 115.10 1o78 n GLU 15 Ca 0.00 0.01 -0.45 0.00 0.66 0.00 0.00 57.16 57.38 1o78 n GLU 15 Cb 0.00 -0.57 -0.01 0.00 0.27 0.00 0.00 31.44 31.13 1o78 n GLU 15 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1o78 s GLY 16 N -4.96 2.61 -0.03 8.31 0.00 -1.26 -4.96 107.32 107.03 1o78 s GLY 16 Ca -0.02 -3.36 -0.27 0.00 0.00 0.00 0.00 44.72 41.07 1o78 s GLY 16 CO 0.02 1.61 0.60 -1.83 0.00 0.00 0.00 173.10 173.50 1o78 s GLU 17 N 0.61 1.00 -0.44 2.90 1.03 -1.26 -4.50 118.70 118.04 1o78 s GLU 17 Ca 0.30 0.12 -0.04 0.00 0.03 0.00 0.00 54.97 55.37 1o78 s GLU 17 Cb -0.07 0.47 0.12 0.00 -0.80 0.00 0.00 34.13 33.84 1o78 s GLU 17 CO -0.07 -0.32 0.25 0.42 -1.33 0.00 0.00 175.26 174.21 1o78 s ILE 18 N -1.42 3.50 0.06 1.83 1.01 0.10 -4.87 121.20 121.42 1o78 s ILE 18 Ca -0.10 -2.06 -0.31 0.00 0.00 0.00 0.00 60.65 58.17 1o78 s ILE 18 Cb -0.01 -3.37 -0.07 0.00 0.01 0.00 0.00 42.46 39.03 1o78 s ILE 18 CO 0.07 -0.72 1.35 -2.16 0.00 0.00 0.00 174.94 173.48 1o78 s PRO 19 N 1.10 4.33 0.27 2.79 0.04 -1.26 -0.50 135.00 141.78 1o78 s PRO 19 Ca 0.08 1.96 -0.29 0.00 0.04 0.00 0.00 61.00 62.79 1o78 s PRO 19 Cb -0.23 -3.38 -0.10 0.00 0.04 0.00 0.00 34.50 30.83 1o78 s PRO 19 CO -0.04 -0.44 1.25 0.00 0.04 0.00 0.00 177.00 177.82 1o78 s ALA 20 N 1.53 3.48 -0.69 8.56 0.00 -1.07 -4.73 121.76 128.84 1o78 s ALA 20 Ca 0.63 1.11 0.23 0.00 0.00 0.00 0.00 51.96 53.93 1o78 s ALA 20 Cb -0.33 -3.44 0.90 0.00 0.00 0.00 0.00 23.12 20.25 1o78 s ALA 20 CO 0.29 -0.48 1.70 -0.35 0.00 0.00 0.00 175.76 176.92 1o78 n PRO 21 N 1.53 0.15 -3.88 0.00 -0.04 -1.26 -0.73 135.00 130.77 1o78 n PRO 21 Ca 0.02 0.30 -0.10 0.00 -0.04 0.00 0.00 63.50 63.67 1o78 n PRO 21 Cb 0.43 -1.75 -0.09 0.00 -0.04 0.00 0.00 33.50 32.05 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 -4.05 1.58 0.95 1.53 2.96 -1.26 -4.82 118.68 115.56 1o78 s LEU 22 Ca 0.07 -0.37 -0.11 0.00 -0.22 0.00 0.00 54.13 53.51 1o78 s LEU 22 Cb 0.11 0.74 0.16 0.00 0.50 0.00 0.00 46.19 47.71 1o78 s LEU 22 CO 0.43 -0.48 1.11 0.00 -1.32 0.00 0.00 176.35 176.10 1o78 s ALA 23 N -2.18 1.17 0.00 5.97 0.00 -1.26 -4.15 121.76 121.31 1o78 s ALA 23 Ca -0.08 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.26 1o78 s ALA 23 Cb -0.03 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.71 1o78 s ALA 23 CO -0.02 -2.86 0.00 0.41 0.00 0.00 0.00 175.76 173.29 1o78 n GLY 24 N 0.10 -0.91 3.27 0.00 0.00 -0.80 -4.86 105.19 101.99 1o78 n GLY 24 Ca 0.10 -0.73 -0.14 0.00 0.00 0.00 0.00 46.02 45.24 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 -3.00 0.05 -0.04 2.61 2.01 -1.23 -1.64 115.64 114.40 1o78 s THR 25 Ca 0.00 -0.40 -0.21 0.00 0.31 0.00 0.00 61.69 61.39 1o78 s THR 25 Cb 0.00 -0.64 -0.05 0.00 0.01 0.00 0.00 72.50 71.82 1o78 s THR 25 CO 0.00 -0.22 0.61 -0.69 -0.69 0.00 0.00 174.62 173.63 1o78 s VAL 26 N -1.20 4.99 -0.15 3.82 1.01 -1.24 -0.45 120.40 127.18 1o78 s VAL 26 Ca -0.12 1.25 0.16 0.00 0.00 0.00 0.00 61.98 63.27 1o78 s VAL 26 Cb -0.05 -3.94 -0.23 0.00 0.00 0.00 0.00 36.38 32.16 1o78 s VAL 26 CO 0.04 0.36 0.11 -1.20 0.00 0.00 0.00 175.10 174.42 1o78 n SER 27 N 3.15 0.64 -3.58 3.32 7.64 0.30 -2.35 113.62 122.74 1o78 n SER 27 Ca -0.05 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.75 1o78 n SER 27 Cb 0.51 1.07 -0.04 0.00 -1.01 0.00 0.00 64.21 64.74 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 -2.55 0.49 0.10 1.43 1.02 -1.22 -4.71 119.74 114.29 1o78 s LYS 28 Ca -0.08 0.00 0.07 0.00 0.02 0.00 0.00 55.97 55.97 1o78 s LYS 28 Cb 0.06 0.23 -0.04 0.00 -0.52 0.00 0.00 37.83 37.56 1o78 s LYS 28 CO 0.73 -0.18 -0.09 -1.50 -0.92 0.00 0.00 175.35 173.40 1o78 s ILE 29 N -1.67 3.44 -0.07 2.17 2.07 -1.26 -0.92 121.20 124.96 1o78 s ILE 29 Ca 0.03 -1.22 0.02 0.00 -1.41 0.00 0.00 60.65 58.08 1o78 s ILE 29 Cb -0.01 -2.60 -0.06 0.00 0.13 0.00 0.00 42.46 39.92 1o78 s ILE 29 CO -0.03 0.13 -0.03 0.18 -1.91 0.00 0.00 174.94 173.28 1o78 n LEU 30 N 0.75 1.80 -4.70 8.50 4.32 -0.14 -4.95 117.00 122.57 1o78 n LEU 30 Ca -0.13 -0.02 -0.25 0.00 -0.02 0.00 0.00 56.01 55.59 1o78 n LEU 30 Cb 0.52 -0.10 -0.07 0.00 -1.62 0.00 0.00 43.42 42.16 1o78 n LEU 30 CO 0.34 0.43 -0.29 -0.69 -1.22 0.00 0.00 177.39 175.96 1o78 s VAL 31 N -2.14 3.85 0.52 4.08 1.01 -0.72 -5.01 120.40 121.98 1o78 s VAL 31 Ca -0.07 -1.53 0.01 0.00 0.00 0.00 0.00 61.98 60.39 1o78 s VAL 31 Cb 0.02 -3.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.39 1o78 s VAL 31 CO 0.19 -0.23 0.01 -0.54 0.00 0.00 0.00 175.10 174.53 1o78 s LYS 32 N -3.34 2.20 0.06 2.72 -0.14 -1.26 -4.99 119.74 114.99 1o78 s LYS 32 Ca 0.30 -2.41 -0.30 0.00 -1.36 0.00 0.00 55.97 52.20 1o78 s LYS 32 Cb -0.08 -1.54 -0.05 0.00 -1.68 0.00 0.00 37.83 34.48 1o78 s LYS 32 CO 0.21 -0.38 1.07 -2.00 -0.76 0.00 0.00 175.35 173.49 1o78 s GLU 33 N -3.89 4.54 0.00 1.68 -6.30 -1.26 -2.97 118.70 110.49 1o78 s GLU 33 Ca 0.05 1.59 0.00 0.00 -2.50 0.00 0.00 54.97 54.11 1o78 s GLU 33 Cb 0.01 -3.38 0.00 0.00 0.00 0.00 0.00 34.13 30.76 1o78 s GLU 33 CO 0.03 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 175.65 1o78 n GLY 34 N 2.79 1.39 3.90 -1.50 0.00 -1.23 -5.04 105.19 105.49 1o78 n GLY 34 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.33 6.39 0.75 1.61 1.01 -1.16 -4.84 116.67 118.11 1o78 s ASP 35 Ca 0.00 0.91 -0.05 0.00 0.71 0.00 0.00 52.55 54.12 1o78 s ASP 35 Cb 0.00 -2.23 0.11 0.00 1.01 0.00 0.00 42.92 41.81 1o78 s ASP 35 CO 0.00 -0.41 1.04 -0.89 0.21 0.00 0.00 175.17 175.13 1o78 s THR 36 N -2.44 2.20 0.22 -1.27 2.01 -1.26 -2.10 115.64 113.01 1o78 s THR 36 Ca 0.47 -0.38 -0.19 0.00 0.31 0.00 0.00 61.69 61.90 1o78 s THR 36 Cb -0.10 -2.82 0.03 0.00 0.01 0.00 0.00 72.50 69.62 1o78 s THR 36 CO 0.36 0.00 0.60 0.54 -0.69 0.00 0.00 174.62 175.44 1o78 s VAL 37 N -3.29 0.01 0.38 3.82 0.11 0.16 -4.84 120.40 116.75 1o78 s VAL 37 Ca 0.65 -0.78 0.06 0.00 -2.93 0.00 0.00 61.98 58.98 1o78 s VAL 37 Cb -0.07 -1.69 -0.07 0.00 -1.53 0.00 0.00 36.38 33.02 1o78 s VAL 37 CO 0.46 -0.04 0.01 -0.54 -3.33 0.00 0.00 175.10 171.65 1o78 s LYS 38 N -3.88 1.87 -0.36 1.54 1.02 -1.26 -1.45 119.74 117.22 1o78 s LYS 38 Ca 0.10 -2.05 -0.29 0.00 0.02 0.00 0.00 55.97 53.75 1o78 s LYS 38 Cb -0.03 -1.45 0.02 0.00 -0.52 0.00 0.00 37.83 35.85 1o78 s LYS 38 CO 0.00 -0.07 1.12 0.00 -0.92 0.00 0.00 175.35 175.48 1o78 s ALA 39 N -2.85 3.39 0.00 5.17 0.00 -1.26 -3.25 121.76 122.96 1o78 s ALA 39 Ca 0.35 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.17 1o78 s ALA 39 Cb 0.09 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1o78 s ALA 39 CO 0.17 -1.72 0.00 0.41 0.00 0.00 0.00 175.76 174.62 1o78 n GLY 40 N 4.18 1.30 3.36 0.00 0.00 -1.15 -4.90 105.19 107.99 1o78 n GLY 40 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.03 3.47 -0.78 1.61 0.74 -1.20 -4.77 119.66 118.69 1o78 s GLN 41 Ca 0.00 -0.58 -0.23 0.00 0.05 0.00 0.00 55.36 54.60 1o78 s GLN 41 Cb 0.00 -3.16 -0.17 0.00 1.10 0.00 0.00 33.01 30.78 1o78 s GLN 41 CO 0.00 -0.21 2.40 2.41 -0.55 0.00 0.00 175.29 179.34 1o78 n THR 42 N 4.85 -0.02 0.05 -0.34 -1.04 -1.26 0.07 114.28 116.59 1o78 n THR 42 Ca -0.17 -0.51 0.00 0.00 -2.04 0.00 0.00 64.05 61.33 1o78 n THR 42 Cb 0.51 -1.61 0.32 0.00 -1.82 0.00 0.00 70.33 67.73 1o78 n THR 42 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1o78 h VAL 43 N 7.60 1.20 -3.14 12.58 2.07 0.17 -3.41 116.25 133.32 1o78 h VAL 43 Ca -0.06 -0.88 -0.11 0.00 0.82 0.00 0.00 66.70 66.47 1o78 h VAL 43 Cb 1.14 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1o78 h VAL 43 CO 1.22 0.28 0.07 0.18 0.02 0.00 0.00 177.57 179.35 1o78 n LEU 44 N -4.25 0.00 -3.89 2.57 4.77 -1.15 -0.97 117.00 114.09 1o78 n LEU 44 Ca 0.00 -2.14 -0.23 0.00 -0.03 0.00 0.00 56.01 53.62 1o78 n LEU 44 Cb 0.28 2.59 -0.17 0.00 -2.33 0.00 0.00 43.42 43.79 1o78 n LEU 44 CO 0.39 -0.61 -0.42 -0.69 -1.33 0.00 0.00 177.39 174.73 1o78 s VAL 45 N -2.49 0.67 0.56 4.08 1.01 -0.09 -0.13 120.40 124.01 1o78 s VAL 45 Ca 0.17 -0.15 0.09 0.00 0.00 0.00 0.00 61.98 62.10 1o78 s VAL 45 Cb -0.03 -0.71 0.08 0.00 0.00 0.00 0.00 36.38 35.72 1o78 s VAL 45 CO 0.13 0.28 0.74 -0.22 0.00 0.00 0.00 175.10 176.02 1o78 s LEU 46 N 1.27 3.13 -0.32 3.92 2.96 -0.83 -0.54 118.68 128.28 1o78 s LEU 46 Ca -0.05 -0.83 0.06 0.00 -0.22 0.00 0.00 54.13 53.09 1o78 s LEU 46 Cb -0.14 -1.70 0.19 0.00 0.50 0.00 0.00 46.19 45.04 1o78 s LEU 46 CO -0.02 -1.26 0.58 -0.70 -1.32 0.00 0.00 176.35 173.63 1o78 s GLU 47 N -4.61 0.61 0.01 1.98 2.12 0.41 -2.59 118.70 116.63 1o78 s GLU 47 Ca 0.59 0.31 -0.00 0.00 0.36 0.00 0.00 54.97 56.22 1o78 s GLU 47 Cb -0.06 0.16 -0.00 0.00 0.26 0.00 0.00 34.13 34.49 1o78 s GLU 47 CO 0.37 -1.08 -0.01 0.00 -0.54 0.00 0.00 175.26 174.00 1o78 n ALA 48 N 5.16 2.95 -1.33 6.30 0.00 -1.26 -3.48 120.51 128.85 1o78 n ALA 48 Ca 0.06 -0.03 -0.31 0.00 0.00 0.00 0.00 53.44 53.17 1o78 n ALA 48 Cb 0.54 0.45 0.05 0.00 0.00 0.00 0.00 19.45 20.50 1o78 n ALA 48 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1o78 n MET 49 N -3.10 2.47 -3.65 0.00 2.81 -1.26 -4.82 117.12 109.56 1o78 n MET 49 Ca -0.01 -2.85 -0.27 0.00 -1.81 0.00 0.00 57.70 52.76 1o78 n MET 49 Cb 0.44 -2.12 0.02 0.00 -0.71 0.00 0.00 33.22 30.85 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 -0.42 -4.92 -3.68 0.03 5.02 -1.26 -4.95 118.16 107.99 1o78 n LYS 50 Ca 0.53 0.61 -0.22 0.00 -2.02 0.00 0.00 58.31 57.21 1o78 n LYS 50 Cb 0.56 -5.46 -0.18 0.00 -0.02 0.00 0.00 35.03 29.94 1o78 n LYS 50 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1o78 s MET 51 N -6.34 0.10 -0.50 1.97 1.75 -1.26 -5.08 119.30 109.93 1o78 s MET 51 Ca 0.55 0.22 -0.28 0.00 -1.25 0.00 0.00 55.69 54.93 1o78 s MET 51 Cb -0.28 -0.89 -0.09 0.00 2.84 0.00 0.00 34.83 36.42 1o78 s MET 51 CO 0.68 -0.40 2.41 0.39 -0.65 0.00 0.00 175.02 177.45 1o78 n GLU 52 N 5.26 1.05 -3.29 4.11 1.02 -1.26 -4.56 120.64 122.97 1o78 n GLU 52 Ca -0.05 0.09 -0.38 0.00 -0.02 0.00 0.00 57.16 56.81 1o78 n GLU 52 Cb 0.50 -3.12 -0.06 0.00 -0.02 0.00 0.00 31.44 28.74 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 10.96 5.18 -0.40 2.62 2.01 -1.07 -4.96 115.64 129.98 1o78 s THR 53 Ca 1.04 0.99 -0.23 0.00 0.31 0.00 0.00 61.69 63.79 1o78 s THR 53 Cb -0.38 -3.83 0.02 0.00 0.01 0.00 0.00 72.50 68.32 1o78 s THR 53 CO 0.32 0.32 0.78 -1.61 -0.69 0.00 0.00 174.62 173.74 1o78 s GLU 54 N 0.67 3.62 -1.01 4.92 8.01 -1.26 -1.96 118.70 131.70 1o78 s GLU 54 Ca 0.27 0.15 -0.22 0.00 0.01 0.00 0.00 54.97 55.18 1o78 s GLU 54 Cb -0.15 -3.86 0.07 0.00 -4.31 0.00 0.00 34.13 25.88 1o78 s GLU 54 CO 0.11 -0.96 1.37 0.42 0.01 0.00 0.00 175.26 176.21 1o78 s ILE 55 N 3.18 4.15 0.19 -1.63 1.01 0.82 -4.92 121.20 124.01 1o78 s ILE 55 Ca 0.31 -1.03 -0.30 0.00 0.00 0.00 0.00 60.65 59.63 1o78 s ILE 55 Cb -0.13 -4.99 -0.08 0.00 0.01 0.00 0.00 42.46 37.27 1o78 s ILE 55 CO 0.19 -1.83 1.20 0.20 0.00 0.00 0.00 174.94 174.71 1o78 s ASN 56 N 4.58 7.08 0.75 3.58 0.01 -1.26 0.18 114.94 129.86 1o78 s ASN 56 Ca 0.43 2.24 -0.15 0.00 -0.71 0.00 0.00 52.86 54.67 1o78 s ASN 56 Cb -0.01 -2.61 0.02 0.00 0.41 0.00 0.00 41.25 39.06 1o78 s ASN 56 CO -0.09 -0.38 0.94 0.00 -1.51 0.00 0.00 177.10 176.06 1o78 n ALA 57 N 2.48 -0.45 -0.04 0.60 0.00 0.11 -4.73 120.51 118.48 1o78 n ALA 57 Ca 0.04 -0.25 -0.15 0.00 0.00 0.00 0.00 53.44 53.09 1o78 n ALA 57 Cb 0.45 -2.10 -0.09 0.00 0.00 0.00 0.00 19.45 17.70 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 -0.47 0.32 -3.33 0.00 0.13 -1.91 -3.05 132.00 123.68 1o78 h PRO 58 Ca -0.47 -0.24 0.01 0.00 -0.87 0.00 0.00 66.00 64.43 1o78 h PRO 58 Cb 1.32 0.04 -0.07 0.00 0.13 0.00 0.00 31.00 32.43 1o78 h PRO 58 CO 0.46 0.86 0.05 0.99 -0.23 0.00 0.00 178.00 180.13 1o78 s THR 59 N -3.77 0.00 0.48 1.56 2.01 -1.26 -4.66 115.64 110.00 1o78 s THR 59 Ca -0.14 -1.21 -0.24 0.00 0.31 0.00 0.00 61.69 60.41 1o78 s THR 59 Cb 0.04 -2.10 -0.07 0.00 0.01 0.00 0.00 72.50 70.38 1o78 s THR 59 CO 0.76 -0.00 1.29 1.51 -0.69 0.00 0.00 174.62 177.50 1o78 s ASP 60 N -2.97 5.86 0.00 3.53 -4.77 -1.26 -4.07 116.67 112.99 1o78 s ASP 60 Ca 0.17 2.61 0.00 0.00 -3.30 0.00 0.00 52.55 52.03 1o78 s ASP 60 Cb -0.03 -2.63 0.00 0.00 -1.09 0.00 0.00 42.92 39.17 1o78 s ASP 60 CO 0.08 -1.15 0.00 0.61 0.70 0.00 0.00 175.17 175.41 1o78 n GLY 61 N 0.62 -0.51 3.15 2.12 0.00 -0.53 -4.89 105.19 105.15 1o78 n GLY 61 Ca 0.07 -0.93 -0.16 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.73 0.76 0.15 1.61 2.20 -1.26 0.36 119.74 121.82 1o78 s LYS 62 Ca 0.00 -0.95 -0.30 0.00 -0.36 0.00 0.00 55.97 54.36 1o78 s LYS 62 Cb 0.00 -0.66 -0.08 0.00 -1.51 0.00 0.00 37.83 35.58 1o78 s LYS 62 CO 0.00 0.14 1.25 0.08 -0.36 0.00 0.00 175.35 176.46 1o78 s VAL 63 N -1.50 3.57 -0.97 4.02 1.01 -0.89 -2.38 120.40 123.25 1o78 s VAL 63 Ca -0.02 1.23 0.18 0.00 0.00 0.00 0.00 61.98 63.37 1o78 s VAL 63 Cb -0.09 -3.78 -0.18 0.00 0.00 0.00 0.00 36.38 32.33 1o78 s VAL 63 CO 0.02 0.15 0.81 -0.62 0.00 0.00 0.00 175.10 175.45 1o78 n GLU 64 N 3.11 0.96 -3.65 2.72 -0.58 -1.10 -3.56 120.64 118.55 1o78 n GLU 64 Ca 0.07 -0.10 -0.03 0.00 -0.42 0.00 0.00 57.16 56.68 1o78 n GLU 64 Cb 0.44 -1.37 -0.07 0.00 -0.57 0.00 0.00 31.44 29.87 1o78 n GLU 64 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1o78 s LYS 65 N -2.68 0.07 -0.40 3.49 1.02 -1.26 -4.97 119.74 115.01 1o78 s LYS 65 Ca 0.08 0.08 0.03 0.00 0.02 0.00 0.00 55.97 56.18 1o78 s LYS 65 Cb 0.14 0.04 0.11 0.00 -0.52 0.00 0.00 37.83 37.60 1o78 s LYS 65 CO 0.73 -0.01 0.15 0.08 -0.92 0.00 0.00 175.35 175.37 1o78 s VAL 66 N -0.01 1.97 -0.38 3.17 1.01 -1.26 -1.97 120.40 122.93 1o78 s VAL 66 Ca 0.07 -2.48 0.26 0.00 0.00 0.00 0.00 61.98 59.84 1o78 s VAL 66 Cb -0.05 -2.43 0.33 0.00 0.00 0.00 0.00 36.38 34.24 1o78 s VAL 66 CO -0.15 -0.72 1.75 -0.07 0.00 0.00 0.00 175.10 175.92 1o78 h LEU 67 N 7.25 0.00 -9.94 3.92 3.38 -1.00 -3.45 115.31 115.48 1o78 h LEU 67 Ca -0.06 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.40 1o78 h LEU 67 Cb 0.97 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.78 1o78 h LEU 67 CO 0.55 0.00 0.53 -0.69 0.09 0.00 0.00 178.44 178.92 1o78 s VAL 68 N -3.31 3.06 -0.07 1.22 1.01 -0.77 -4.94 120.40 116.60 1o78 s VAL 68 Ca 0.06 0.91 0.10 0.00 0.00 0.00 0.00 61.98 63.05 1o78 s VAL 68 Cb 0.08 -3.52 0.15 0.00 0.00 0.00 0.00 36.38 33.10 1o78 s VAL 68 CO 0.58 0.10 1.06 0.29 0.00 0.00 0.00 175.10 177.13 1o78 n LYS 69 N 0.14 1.79 -1.65 2.72 4.76 -1.26 -5.10 118.16 119.56 1o78 n LYS 69 Ca 0.04 -2.00 0.00 0.00 -2.87 0.00 0.00 58.31 53.48 1o78 n LYS 69 Cb 0.46 -1.21 0.00 0.00 -1.84 0.00 0.00 35.03 32.43 1o78 n LYS 69 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1o78 n GLU 70 N -0.95 -4.69 -2.82 1.97 2.13 -1.26 -4.61 120.64 110.41 1o78 n GLU 70 Ca 0.08 3.45 -0.19 0.00 0.66 0.00 0.00 57.16 61.16 1o78 n GLU 70 Cb 0.49 -3.85 0.00 0.00 0.27 0.00 0.00 31.44 28.36 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 -0.34 -3.13 -3.93 5.31 0.63 -0.99 -4.95 116.66 109.25 1o78 n ARG 71 Ca 0.00 0.71 -0.29 0.00 -0.92 0.00 0.00 57.85 57.36 1o78 n ARG 71 Cb 0.00 -5.42 -0.16 0.00 0.45 0.00 0.00 32.46 27.32 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 -2.38 2.78 0.50 6.15 2.15 -1.26 -4.93 116.67 119.67 1o78 s ASP 72 Ca 0.18 -0.60 -0.22 0.00 0.43 0.00 0.00 52.55 52.34 1o78 s ASP 72 Cb -0.09 -1.00 -0.06 0.00 -0.30 0.00 0.00 42.92 41.47 1o78 s ASP 72 CO 0.22 -0.14 1.28 0.00 -0.17 0.00 0.00 175.17 176.36 1o78 s ALA 73 N 1.58 2.90 -0.06 3.66 0.00 -1.26 -3.64 121.76 124.94 1o78 s ALA 73 Ca 0.02 1.17 -0.01 0.00 0.00 0.00 0.00 51.96 53.14 1o78 s ALA 73 Cb -0.14 -3.49 0.03 0.00 0.00 0.00 0.00 23.12 19.51 1o78 s ALA 73 CO -0.08 -1.06 0.00 0.14 0.00 0.00 0.00 175.76 174.76 1o78 s VAL 74 N -1.40 0.32 0.70 0.00 -7.23 -0.65 -4.99 120.40 107.15 1o78 s VAL 74 Ca 0.68 0.12 -0.11 0.00 -1.81 0.00 0.00 61.98 60.86 1o78 s VAL 74 Cb -0.36 -0.46 0.01 0.00 0.56 0.00 0.00 36.38 36.14 1o78 s VAL 74 CO 0.43 0.23 1.06 -1.10 -0.31 0.00 0.00 175.10 175.41 1o78 s GLN 75 N 1.71 2.86 0.21 4.82 1.11 -1.26 -1.91 119.66 127.19 1o78 s GLN 75 Ca 0.01 0.93 -0.32 0.00 0.01 0.00 0.00 55.36 55.99 1o78 s GLN 75 Cb -0.13 -1.98 -0.12 0.00 -1.01 0.00 0.00 33.01 29.77 1o78 s GLN 75 CO -0.04 -1.15 1.67 0.41 0.01 0.00 0.00 175.29 176.19 1o78 n GLY 76 N -1.99 1.41 0.00 3.09 0.00 -1.26 -2.37 105.19 104.07 1o78 n GLY 76 Ca 0.07 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.70 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 3.61 0.74 3.65 -0.02 0.00 0.09 -4.91 105.19 108.34 1o78 n GLY 77 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.52 4.08 0.34 1.61 2.00 -1.00 -4.78 119.66 121.38 1o78 s GLN 78 Ca 0.00 -0.10 -0.29 0.00 -2.00 0.00 0.00 55.36 52.97 1o78 s GLN 78 Cb 0.00 -3.57 -0.11 0.00 0.80 0.00 0.00 33.01 30.13 1o78 s GLN 78 CO 0.00 -0.05 1.54 0.20 -0.50 0.00 0.00 175.29 176.48 1o78 s GLY 79 N 1.23 2.55 -0.10 2.59 0.00 -1.26 -2.60 107.32 109.72 1o78 s GLY 79 Ca 0.12 1.58 -0.11 0.00 0.00 0.00 0.00 44.72 46.30 1o78 s GLY 79 CO 0.07 2.40 -0.22 1.04 0.00 0.00 0.00 173.10 176.39 1o78 n LEU 80 N 1.27 1.55 -4.15 0.66 4.77 0.35 -4.58 117.00 116.87 1o78 n LEU 80 Ca 0.04 0.25 -0.11 0.00 -0.03 0.00 0.00 56.01 56.16 1o78 n LEU 80 Cb 0.38 -0.58 -0.09 0.00 -2.33 0.00 0.00 43.42 40.81 1o78 n LEU 80 CO 0.64 -0.28 -0.13 -0.51 -1.33 0.00 0.00 177.39 175.78 1o78 s ILE 81 N -2.52 0.00 0.24 -0.08 2.07 -1.26 -0.42 121.20 119.23 1o78 s ILE 81 Ca -0.20 -1.84 -0.02 0.00 -1.41 0.00 0.00 60.65 57.18 1o78 s ILE 81 Cb 0.04 -2.42 -0.03 0.00 0.13 0.00 0.00 42.46 40.18 1o78 s ILE 81 CO 0.28 0.00 0.25 -0.75 -1.91 0.00 0.00 174.94 172.81 1o78 s LYS 82 N -4.11 1.42 -0.19 3.50 2.47 -0.83 -0.72 119.74 121.28 1o78 s LYS 82 Ca 0.35 -1.63 -0.12 0.00 -1.56 0.00 0.00 55.97 53.01 1o78 s LYS 82 Cb 0.05 0.33 0.06 0.00 -1.46 0.00 0.00 37.83 36.81 1o78 s LYS 82 CO 0.11 -0.52 0.47 0.96 0.16 0.00 0.00 175.35 176.54 1o78 s ILE 83 N -3.91 -0.02 0.00 5.43 -4.36 -1.26 -2.72 121.20 114.36 1o78 s ILE 83 Ca 0.35 0.06 0.00 0.00 -0.26 0.00 0.00 60.65 60.80 1o78 s ILE 83 Cb 0.04 -0.69 0.00 0.00 1.25 0.00 0.00 42.46 43.06 1o78 s ILE 83 CO 0.15 0.02 0.00 0.61 0.24 0.00 0.00 174.94 175.96