#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 0.59 1.02 2.12 2.20 -1.26 -5.15 119.74 119.26 1o78 s LYS 2 Ca 0.00 -0.63 -0.14 0.00 -0.36 0.00 0.00 55.97 54.84 1o78 s LYS 2 Cb 0.00 -0.46 0.20 0.00 -1.51 0.00 0.00 37.83 36.06 1o78 s LYS 2 CO 0.00 0.10 1.12 -0.51 -0.36 0.00 0.00 175.35 175.70 1o78 s LEU 3 N -1.17 1.54 0.35 5.43 1.02 -1.26 -5.08 118.68 119.51 1o78 s LEU 3 Ca -0.05 0.96 0.03 0.00 0.02 0.00 0.00 54.13 55.09 1o78 s LEU 3 Cb -0.08 -3.07 -0.01 0.00 0.02 0.00 0.00 46.19 43.05 1o78 s LEU 3 CO 0.01 -3.19 0.39 -1.59 0.02 0.00 0.00 176.35 171.99 1o78 s LYS 4 N -5.18 1.88 0.01 1.70 0.00 -1.26 -5.16 119.74 111.74 1o78 s LYS 4 Ca 0.66 -1.92 -0.05 0.00 0.00 0.00 0.00 55.97 54.67 1o78 s LYS 4 Cb -0.15 0.39 -0.04 0.00 0.00 0.00 0.00 37.83 38.02 1o78 s LYS 4 CO 0.56 -0.74 0.24 0.14 0.00 0.00 0.00 175.35 175.54 1o78 s VAL 5 N -3.16 5.35 0.12 1.79 -7.23 -1.26 -5.04 120.40 110.97 1o78 s VAL 5 Ca 0.36 0.01 -0.31 0.00 -1.81 0.00 0.00 61.98 60.22 1o78 s VAL 5 Cb 0.01 -3.56 -0.09 0.00 0.56 0.00 0.00 36.38 33.29 1o78 s VAL 5 CO 0.25 0.32 1.62 -0.89 -0.31 0.00 0.00 175.10 176.09 1o78 s THR 6 N -1.34 2.80 0.00 5.32 2.01 -1.26 -4.91 115.64 118.26 1o78 s THR 6 Ca 0.29 0.44 0.00 0.00 0.31 0.00 0.00 61.69 62.73 1o78 s THR 6 Cb -0.13 -3.28 0.00 0.00 0.01 0.00 0.00 72.50 69.10 1o78 s THR 6 CO 0.18 0.02 0.00 0.52 -0.69 0.00 0.00 174.62 174.65 1o78 n VAL 7 N 4.35 0.00 -3.28 3.82 0.31 -1.26 -4.98 118.33 117.29 1o78 n VAL 7 Ca 0.15 0.02 -0.23 0.00 -0.01 0.00 0.00 64.34 64.27 1o78 n VAL 7 Cb 0.39 -0.72 0.00 0.00 -0.91 0.00 0.00 33.84 32.61 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 -1.49 -4.14 0.00 4.52 5.15 -1.26 -4.73 115.26 113.31 1o78 n ASN 8 Ca 0.00 -0.36 0.00 0.00 -0.60 0.00 0.00 54.58 53.62 1o78 n ASN 8 Cb 0.00 -3.41 0.00 0.00 -0.53 0.00 0.00 39.78 35.84 1o78 n ASN 8 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1o78 n GLY 9 N -1.23 3.45 3.89 8.20 0.00 -1.26 -5.02 105.19 113.22 1o78 n GLY 9 Ca -0.04 -1.76 -0.29 0.00 0.00 0.00 0.00 46.02 43.94 1o78 n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o78 n ALA 10 N -1.75 -1.42 0.00 4.61 0.00 -1.26 -4.87 120.51 115.82 1o78 n ALA 10 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1o78 n ALA 10 Cb 0.00 -3.99 0.00 0.00 0.00 0.00 0.00 19.45 15.46 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 -1.68 3.35 1.36 0.00 0.00 -1.26 -5.09 105.19 101.87 1o78 n GLY 11 Ca -0.02 -0.82 0.16 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.06 -2.90 0.00 1.61 5.02 -1.26 -4.87 118.16 114.70 1o78 n LYS 12 Ca 0.00 2.28 0.00 0.00 -2.02 0.00 0.00 58.31 58.57 1o78 n LYS 12 Cb 0.00 -3.49 0.00 0.00 -0.02 0.00 0.00 35.03 31.52 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 -3.72 0.00 -3.00 7.82 0.00 -1.26 -4.32 120.51 116.03 1o78 n ALA 13 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1o78 n ALA 13 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 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 5.00 4.96 3.70 0.00 0.00 -1.26 -4.94 105.19 112.65 1o78 n GLY 14 Ca 0.00 -1.19 -0.42 0.00 0.00 0.00 0.00 46.02 44.41 1o78 n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o78 s GLU 15 N 1.45 4.35 0.00 1.61 2.02 -1.26 -3.49 118.70 123.38 1o78 s GLU 15 Ca 0.00 1.89 0.00 0.00 0.02 0.00 0.00 54.97 56.88 1o78 s GLU 15 Cb 0.00 -3.42 0.00 0.00 0.10 0.00 0.00 34.13 30.81 1o78 s GLU 15 CO 0.00 -0.42 0.00 0.41 0.02 0.00 0.00 175.26 175.27 1o78 n GLY 16 N 3.43 2.64 3.70 -1.39 0.00 -1.26 -5.01 105.19 107.29 1o78 n GLY 16 Ca 0.11 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 1o78 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o78 s GLU 17 N 0.00 1.28 -0.02 1.61 2.02 -1.23 -3.95 118.70 118.40 1o78 s GLU 17 Ca 0.00 1.18 0.02 0.00 0.02 0.00 0.00 54.97 56.19 1o78 s GLU 17 Cb 0.00 -1.78 0.00 0.00 0.10 0.00 0.00 34.13 32.45 1o78 s GLU 17 CO 0.00 -2.33 -0.08 0.96 0.02 0.00 0.00 175.26 173.83 1o78 s ILE 18 N -2.78 0.68 0.64 -1.63 -4.36 -1.23 -4.52 121.20 108.00 1o78 s ILE 18 Ca 0.64 -0.30 -0.14 0.00 -0.26 0.00 0.00 60.65 60.59 1o78 s ILE 18 Cb -0.20 -0.62 -0.01 0.00 1.25 0.00 0.00 42.46 42.88 1o78 s ILE 18 CO 0.58 0.22 1.08 -2.16 0.24 0.00 0.00 174.94 174.90 1o78 s PRO 19 N 0.25 3.00 -0.01 0.37 0.04 -1.26 0.10 135.00 137.49 1o78 s PRO 19 Ca -0.04 1.23 -0.26 0.00 0.04 0.00 0.00 61.00 61.97 1o78 s PRO 19 Cb -0.08 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1o78 s PRO 19 CO 0.00 -1.07 0.82 0.00 0.04 0.00 0.00 177.00 176.79 1o78 s ALA 20 N -2.53 3.28 -0.18 8.56 0.00 -0.83 -4.81 121.76 125.25 1o78 s ALA 20 Ca 0.64 0.32 0.28 0.00 0.00 0.00 0.00 51.96 53.20 1o78 s ALA 20 Cb -0.17 -3.11 0.86 0.00 0.00 0.00 0.00 23.12 20.70 1o78 s ALA 20 CO 0.42 -0.10 1.80 -1.00 0.00 0.00 0.00 175.76 176.88 1o78 h PRO 21 N 6.47 0.00 -5.44 0.00 0.13 -1.94 -2.71 132.00 128.51 1o78 h PRO 21 Ca -0.42 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.27 1o78 h PRO 21 Cb 1.21 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.11 1o78 h PRO 21 CO 0.74 0.00 -0.79 -1.17 -0.23 0.00 0.00 178.00 176.55 1o78 s LEU 22 N -6.16 2.25 0.63 1.56 1.98 -1.26 -4.91 118.68 112.77 1o78 s LEU 22 Ca 0.04 -0.58 -0.07 0.00 -2.89 0.00 0.00 54.13 50.64 1o78 s LEU 22 Cb 0.07 -0.59 0.02 0.00 0.66 0.00 0.00 46.19 46.36 1o78 s LEU 22 CO 0.60 -0.03 0.95 0.00 -1.89 0.00 0.00 176.35 175.99 1o78 s ALA 23 N -1.14 3.23 0.00 5.97 0.00 -1.26 -3.59 121.76 124.96 1o78 s ALA 23 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.24 1o78 s ALA 23 Cb -0.09 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 20.38 1o78 s ALA 23 CO 0.02 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.23 1o78 n GLY 24 N -2.71 -2.36 3.35 0.00 0.00 -1.26 -4.80 105.19 97.41 1o78 n GLY 24 Ca 0.06 -1.23 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 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 -2.01 3.12 0.26 2.61 2.01 -1.25 0.11 115.64 120.49 1o78 s THR 25 Ca 0.00 -0.62 -0.30 0.00 0.31 0.00 0.00 61.69 61.08 1o78 s THR 25 Cb 0.00 -2.34 -0.09 0.00 0.01 0.00 0.00 72.50 70.08 1o78 s THR 25 CO 0.00 0.50 1.05 -0.69 -0.69 0.00 0.00 174.62 174.79 1o78 s VAL 26 N 0.64 3.70 0.00 3.82 1.01 -0.98 -0.53 120.40 128.06 1o78 s VAL 26 Ca -0.06 1.69 0.00 0.00 0.00 0.00 0.00 61.98 63.61 1o78 s VAL 26 Cb -0.15 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.15 1o78 s VAL 26 CO 0.03 0.39 0.00 -1.20 0.00 0.00 0.00 175.10 174.32 1o78 n SER 27 N 1.40 1.02 -4.01 3.32 7.64 -0.99 -3.99 113.62 118.01 1o78 n SER 27 Ca -0.01 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.75 1o78 n SER 27 Cb 0.46 0.01 -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 -1.25 0.41 0.15 1.43 1.02 -1.24 -4.78 119.74 115.47 1o78 s LYS 28 Ca 0.00 -0.60 0.11 0.00 0.02 0.00 0.00 55.97 55.49 1o78 s LYS 28 Cb 0.00 -0.14 -0.04 0.00 -0.52 0.00 0.00 37.83 37.13 1o78 s LYS 28 CO 0.00 0.02 -0.26 -1.50 -0.92 0.00 0.00 175.35 172.69 1o78 s ILE 29 N -1.21 2.25 0.00 2.17 2.07 -1.26 -0.98 121.20 124.24 1o78 s ILE 29 Ca -0.10 -1.82 0.00 0.00 -1.41 0.00 0.00 60.65 57.31 1o78 s ILE 29 Cb -0.09 -2.01 0.00 0.00 0.13 0.00 0.00 42.46 40.50 1o78 s ILE 29 CO -0.00 0.02 0.00 0.18 -1.91 0.00 0.00 174.94 173.23 1o78 n LEU 30 N 0.74 0.09 -4.58 8.50 4.32 -0.71 -4.96 117.00 120.39 1o78 n LEU 30 Ca -0.17 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.41 1o78 n LEU 30 Cb 0.54 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.35 1o78 n LEU 30 CO 0.25 -0.21 0.50 0.55 -1.22 0.00 0.00 177.39 177.26 1o78 n VAL 31 N -2.73 2.32 -4.05 4.08 3.14 -0.63 -4.98 118.33 115.49 1o78 n VAL 31 Ca 0.00 -0.50 -0.24 0.00 -2.96 0.00 0.00 64.34 60.64 1o78 n VAL 31 Cb 0.27 -1.04 -0.04 0.00 -1.06 0.00 0.00 33.84 31.97 1o78 n VAL 31 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1o78 s LYS 32 N -1.91 3.09 0.30 1.45 1.02 -1.26 -5.05 119.74 117.38 1o78 s LYS 32 Ca 0.63 -0.88 -0.20 0.00 0.02 0.00 0.00 55.97 55.54 1o78 s LYS 32 Cb -0.58 -2.71 -0.09 0.00 -0.52 0.00 0.00 37.83 33.93 1o78 s LYS 32 CO 0.57 0.45 0.81 -1.83 -0.92 0.00 0.00 175.35 174.42 1o78 s GLU 33 N -3.57 4.26 -0.69 1.68 -1.05 -1.26 -3.49 118.70 114.57 1o78 s GLU 33 Ca 0.33 0.96 0.00 0.00 -0.15 0.00 0.00 54.97 56.10 1o78 s GLU 33 Cb -0.09 -2.65 0.00 0.00 -0.44 0.00 0.00 34.13 30.95 1o78 s GLU 33 CO 0.26 0.25 0.00 0.41 0.95 0.00 0.00 175.26 177.13 1o78 n GLY 34 N 0.23 0.73 3.85 -3.83 0.00 -0.89 -4.96 105.19 100.32 1o78 n GLY 34 Ca 0.01 -0.11 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.34 4.69 -0.36 1.61 2.15 -1.23 -4.83 116.67 116.36 1o78 s ASP 35 Ca 0.00 -1.07 -0.09 0.00 0.43 0.00 0.00 52.55 51.82 1o78 s ASP 35 Cb 0.00 -0.08 0.03 0.00 -0.30 0.00 0.00 42.92 42.57 1o78 s ASP 35 CO 0.00 -0.83 0.17 -0.89 -0.17 0.00 0.00 175.17 173.44 1o78 s THR 36 N -2.65 4.26 0.20 1.71 2.01 -1.26 -1.09 115.64 118.83 1o78 s THR 36 Ca 0.39 -0.96 -0.17 0.00 0.31 0.00 0.00 61.69 61.26 1o78 s THR 36 Cb -0.01 -3.39 -0.08 0.00 0.01 0.00 0.00 72.50 69.04 1o78 s THR 36 CO 0.23 -0.21 0.66 0.54 -0.69 0.00 0.00 174.62 175.15 1o78 s VAL 37 N 1.49 4.69 0.11 3.82 0.11 0.18 -4.89 120.40 125.91 1o78 s VAL 37 Ca 0.01 1.09 0.02 0.00 -2.93 0.00 0.00 61.98 60.16 1o78 s VAL 37 Cb -0.19 -3.79 -0.04 0.00 -1.53 0.00 0.00 36.38 30.83 1o78 s VAL 37 CO 0.05 0.19 0.23 -0.75 -3.33 0.00 0.00 175.10 171.49 1o78 s LYS 38 N -2.04 3.35 0.17 1.54 2.20 -1.26 -0.49 119.74 123.21 1o78 s LYS 38 Ca 0.42 -0.57 -0.31 0.00 -0.36 0.00 0.00 55.97 55.15 1o78 s LYS 38 Cb -0.16 -2.95 -0.10 0.00 -1.51 0.00 0.00 37.83 33.12 1o78 s LYS 38 CO 0.20 0.56 1.54 0.00 -0.36 0.00 0.00 175.35 177.29 1o78 s ALA 39 N -1.63 3.75 0.00 3.13 0.00 -1.26 -2.65 121.76 123.10 1o78 s ALA 39 Ca 0.34 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.65 1o78 s ALA 39 Cb -0.12 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.39 1o78 s ALA 39 CO 0.27 -0.77 0.00 0.41 0.00 0.00 0.00 175.76 175.68 1o78 n GLY 40 N 3.52 0.90 3.22 0.00 0.00 -0.68 -4.88 105.19 107.27 1o78 n GLY 40 Ca 0.13 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.82 3.18 -0.62 1.61 0.74 -1.08 -4.82 119.66 117.84 1o78 s GLN 41 Ca 0.00 -0.74 -0.28 0.00 0.05 0.00 0.00 55.36 54.39 1o78 s GLN 41 Cb 0.00 -2.72 -0.12 0.00 1.10 0.00 0.00 33.01 31.28 1o78 s GLN 41 CO 0.00 -0.13 2.48 2.41 -0.55 0.00 0.00 175.29 179.50 1o78 n THR 42 N 4.49 -0.03 0.13 -0.34 -1.04 -1.26 -0.23 114.28 115.99 1o78 n THR 42 Ca -0.20 -0.53 0.08 0.00 -2.04 0.00 0.00 64.05 61.37 1o78 n THR 42 Cb 0.51 -2.06 0.03 0.00 -1.82 0.00 0.00 70.33 66.99 1o78 n THR 42 CO 0.00 0.00 0.00 -0.37 -0.64 0.00 0.00 175.07 174.06 1o78 h VAL 43 N 7.74 0.20 -3.84 12.58 -1.51 -0.50 -3.37 116.25 127.56 1o78 h VAL 43 Ca -0.19 -1.34 -0.11 0.00 -1.23 0.00 0.00 66.70 63.83 1o78 h VAL 43 Cb 1.28 1.85 -0.10 0.00 -2.13 0.00 0.00 31.29 32.20 1o78 h VAL 43 CO 1.21 0.12 -0.19 -0.76 -1.23 0.00 0.00 177.57 176.72 1o78 s LEU 44 N -5.81 0.52 -0.00 4.19 1.43 -1.11 -1.61 118.68 116.30 1o78 s LEU 44 Ca 0.02 -1.07 0.01 0.00 -1.03 0.00 0.00 54.13 52.06 1o78 s LEU 44 Cb 0.08 1.55 -0.00 0.00 0.03 0.00 0.00 46.19 47.84 1o78 s LEU 44 CO 0.76 -1.13 -0.04 -0.69 0.23 0.00 0.00 176.35 175.47 1o78 s VAL 45 N -3.88 0.34 0.42 -1.59 1.01 -0.15 -0.05 120.40 116.49 1o78 s VAL 45 Ca 0.26 -0.20 0.07 0.00 0.00 0.00 0.00 61.98 62.11 1o78 s VAL 45 Cb 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 36.06 1o78 s VAL 45 CO 0.11 0.08 0.27 -0.76 0.00 0.00 0.00 175.10 174.80 1o78 s LEU 46 N -0.13 3.21 -0.19 3.92 1.43 0.26 -2.34 118.68 124.84 1o78 s LEU 46 Ca 0.01 -0.96 -0.09 0.00 -1.03 0.00 0.00 54.13 52.07 1o78 s LEU 46 Cb -0.02 -1.67 0.07 0.00 0.03 0.00 0.00 46.19 44.60 1o78 s LEU 46 CO -0.00 -0.61 0.44 -0.70 0.23 0.00 0.00 176.35 175.71 1o78 s GLU 47 N -4.01 0.40 0.00 1.70 -6.30 0.31 -1.93 118.70 108.87 1o78 s GLU 47 Ca 0.44 0.91 0.00 0.00 -2.50 0.00 0.00 54.97 53.81 1o78 s GLU 47 Cb 0.01 0.10 0.00 0.00 0.00 0.00 0.00 34.13 34.24 1o78 s GLU 47 CO 0.25 -0.18 0.00 0.00 0.02 0.00 0.00 175.26 175.34 1o78 n ALA 48 N 4.60 0.00 -1.02 6.30 0.00 -1.05 -3.75 120.51 125.60 1o78 n ALA 48 Ca -0.19 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.03 1o78 n ALA 48 Cb 0.54 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.04 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 0.00 2.07 0.00 0.00 1.56 -1.26 -4.26 117.12 115.23 1o78 n MET 49 Ca 0.00 -2.09 0.00 0.00 -0.27 0.00 0.00 57.70 55.34 1o78 n MET 49 Cb 0.00 -1.82 0.00 0.00 2.15 0.00 0.00 33.22 33.55 1o78 n MET 49 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 175.97 176.41 1o78 n LYS 50 N -0.05 0.00 -2.46 2.12 4.81 -1.26 -5.17 118.16 116.15 1o78 n LYS 50 Ca 0.40 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.83 1o78 n LYS 50 Cb 0.61 -0.05 0.01 0.00 0.02 0.00 0.00 35.03 35.62 1o78 n LYS 50 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 1o78 n MET 51 N -2.20 0.22 -4.34 1.64 2.81 -1.26 -5.15 117.12 108.83 1o78 n MET 51 Ca 0.00 -0.53 -0.35 0.00 -1.81 0.00 0.00 57.70 55.01 1o78 n MET 51 Cb 0.00 0.74 -0.10 0.00 -0.71 0.00 0.00 33.22 33.15 1o78 n MET 51 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1o78 s GLU 52 N -2.02 3.13 0.10 0.03 2.02 -1.26 -2.52 118.70 118.17 1o78 s GLU 52 Ca 0.10 -0.40 0.05 0.00 0.02 0.00 0.00 54.97 54.73 1o78 s GLU 52 Cb -0.01 -2.84 -0.04 0.00 0.10 0.00 0.00 34.13 31.34 1o78 s GLU 52 CO 0.02 0.64 -0.01 0.99 0.02 0.00 0.00 175.26 176.91 1o78 s THR 53 N -0.69 3.96 -0.16 3.63 2.01 -0.81 -4.93 115.64 118.64 1o78 s THR 53 Ca 0.11 -1.03 -0.07 0.00 0.31 0.00 0.00 61.69 61.01 1o78 s THR 53 Cb -0.12 -2.89 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 1o78 s THR 53 CO 0.02 0.11 0.07 -1.61 -0.69 0.00 0.00 174.62 172.51 1o78 s GLU 54 N -2.34 3.80 -0.93 4.92 8.01 -1.26 -0.57 118.70 130.33 1o78 s GLU 54 Ca 0.26 -0.32 -0.13 0.00 0.01 0.00 0.00 54.97 54.79 1o78 s GLU 54 Cb -0.12 -3.17 0.23 0.00 -4.31 0.00 0.00 34.13 26.76 1o78 s GLU 54 CO 0.18 0.39 0.91 0.42 0.01 0.00 0.00 175.26 177.17 1o78 s ILE 55 N 0.04 5.64 0.05 -1.63 1.01 0.93 -4.96 121.20 122.28 1o78 s ILE 55 Ca 0.06 -2.67 -0.31 0.00 0.00 0.00 0.00 60.65 57.73 1o78 s ILE 55 Cb -0.12 -4.54 -0.05 0.00 0.01 0.00 0.00 42.46 37.75 1o78 s ILE 55 CO 0.01 -1.13 1.21 0.20 0.00 0.00 0.00 174.94 175.23 1o78 s ASN 56 N 2.06 7.06 0.26 3.58 -0.87 -1.26 0.27 114.94 126.04 1o78 s ASN 56 Ca 0.23 2.00 -0.29 0.00 -1.57 0.00 0.00 52.86 53.24 1o78 s ASN 56 Cb -0.09 -2.58 -0.15 0.00 -0.02 0.00 0.00 41.25 38.41 1o78 s ASN 56 CO -0.08 -0.49 0.98 0.00 -2.57 0.00 0.00 177.10 174.93 1o78 n ALA 57 N 4.10 -0.63 0.00 0.60 0.00 0.68 -4.71 120.51 120.55 1o78 n ALA 57 Ca 0.09 0.41 -0.13 0.00 0.00 0.00 0.00 53.44 53.81 1o78 n ALA 57 Cb 0.46 -1.97 -0.01 0.00 0.00 0.00 0.00 19.45 17.92 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 2.12 0.63 -3.51 0.00 0.13 -1.91 -1.82 132.00 127.65 1o78 h PRO 58 Ca -0.39 -0.48 -0.15 0.00 -0.87 0.00 0.00 66.00 64.11 1o78 h PRO 58 Cb 1.35 0.09 -0.21 0.00 0.13 0.00 0.00 31.00 32.36 1o78 h PRO 58 CO 0.62 1.10 -0.49 0.99 -0.23 0.00 0.00 178.00 179.99 1o78 s THR 59 N -3.77 0.08 0.70 1.56 2.01 -1.26 -4.67 115.64 110.29 1o78 s THR 59 Ca -0.08 -0.65 -0.16 0.00 0.31 0.00 0.00 61.69 61.11 1o78 s THR 59 Cb 0.10 -0.42 0.02 0.00 0.01 0.00 0.00 72.50 72.21 1o78 s THR 59 CO 0.87 -0.36 1.22 1.51 -0.69 0.00 0.00 174.62 177.18 1o78 s ASP 60 N -1.30 4.34 0.00 3.53 1.47 -1.26 -4.36 116.67 119.08 1o78 s ASP 60 Ca -0.14 2.41 0.00 0.00 1.18 0.00 0.00 52.55 56.01 1o78 s ASP 60 Cb -0.07 -2.60 0.00 0.00 -0.34 0.00 0.00 42.92 39.91 1o78 s ASP 60 CO 0.01 -2.17 0.00 0.61 0.68 0.00 0.00 175.17 174.31 1o78 n GLY 61 N 0.51 -1.04 3.17 2.12 0.00 0.36 -4.86 105.19 105.45 1o78 n GLY 61 Ca 0.14 -0.95 -0.23 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.98 1.21 0.20 1.61 2.20 -1.26 0.49 119.74 123.21 1o78 s LYS 62 Ca 0.00 -0.73 -0.24 0.00 -0.36 0.00 0.00 55.97 54.65 1o78 s LYS 62 Cb 0.00 -1.22 -0.08 0.00 -1.51 0.00 0.00 37.83 35.01 1o78 s LYS 62 CO 0.00 0.32 0.78 0.08 -0.36 0.00 0.00 175.35 176.17 1o78 s VAL 63 N -0.63 4.41 0.00 4.02 1.01 -0.25 -0.94 120.40 128.02 1o78 s VAL 63 Ca 0.05 1.59 0.00 0.00 0.00 0.00 0.00 61.98 63.62 1o78 s VAL 63 Cb -0.07 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.27 1o78 s VAL 63 CO 0.01 0.38 0.00 -0.62 0.00 0.00 0.00 175.10 174.87 1o78 n GLU 64 N 1.20 5.45 0.00 2.72 1.02 -0.49 -2.09 120.64 128.45 1o78 n GLU 64 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 1o78 n GLU 64 Cb 0.50 -0.51 0.00 0.00 -0.02 0.00 0.00 31.44 31.41 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 -0.94 0.00 -3.76 3.49 5.02 -1.25 -4.86 118.16 115.86 1o78 n LYS 65 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.94 1o78 n LYS 65 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 34.96 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 0.00 5.31 -0.01 -0.18 -7.23 -1.26 -1.21 120.40 115.82 1o78 s VAL 66 Ca 0.00 0.20 0.01 0.00 -1.81 0.00 0.00 61.98 60.38 1o78 s VAL 66 Cb 0.00 -3.56 -0.02 0.00 0.56 0.00 0.00 36.38 33.36 1o78 s VAL 66 CO 0.00 0.40 0.02 0.00 -0.31 0.00 0.00 175.10 175.21 1o78 n LEU 67 N 1.24 0.00 -4.63 1.32 -0.00 -1.19 -4.97 117.00 108.77 1o78 n LEU 67 Ca -0.12 0.00 -0.30 0.00 -0.00 0.00 0.00 56.01 55.59 1o78 n LEU 67 Cb 0.53 0.01 0.19 0.00 -0.00 0.00 0.00 43.42 44.15 1o78 n LEU 67 CO 0.40 0.01 0.63 0.68 -0.00 0.00 0.00 177.39 179.11 1o78 s VAL 68 N -2.08 2.18 0.12 1.47 -7.23 -1.09 -5.05 120.40 108.73 1o78 s VAL 68 Ca -0.01 0.06 -0.21 0.00 -1.81 0.00 0.00 61.98 60.01 1o78 s VAL 68 Cb 0.01 -2.16 0.06 0.00 0.56 0.00 0.00 36.38 34.85 1o78 s VAL 68 CO 0.06 -0.08 0.53 -0.54 -0.31 0.00 0.00 175.10 174.77 1o78 s LYS 69 N -4.63 1.17 -0.67 4.82 1.02 -1.26 -5.04 119.74 115.15 1o78 s LYS 69 Ca 0.67 -0.47 -0.20 0.00 0.02 0.00 0.00 55.97 55.99 1o78 s LYS 69 Cb -0.23 0.53 -0.16 0.00 -0.52 0.00 0.00 37.83 37.45 1o78 s LYS 69 CO 0.60 -0.48 1.88 0.39 -0.92 0.00 0.00 175.35 176.82 1o78 n GLU 70 N -0.15 1.35 0.00 1.68 1.02 -1.26 -2.95 120.64 120.33 1o78 n GLU 70 Ca -0.17 -1.63 0.00 0.00 -0.02 0.00 0.00 57.16 55.34 1o78 n GLU 70 Cb 0.64 -2.76 0.00 0.00 -0.02 0.00 0.00 31.44 29.29 1o78 n GLU 70 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1o78 n ARG 71 N 6.62 0.00 -1.71 3.49 0.63 -1.26 -4.91 116.66 119.53 1o78 n ARG 71 Ca 0.47 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 57.02 1o78 n ARG 71 Cb 0.35 0.00 0.06 0.00 0.45 0.00 0.00 32.46 33.32 1o78 n ARG 71 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1o78 n ASP 72 N -1.19 1.91 -4.23 6.15 -0.08 -1.15 -4.82 116.55 113.14 1o78 n ASP 72 Ca 0.00 0.85 -0.29 0.00 -1.51 0.00 0.00 54.79 53.85 1o78 n ASP 72 Cb 0.00 -1.52 -0.07 0.00 2.34 0.00 0.00 41.12 41.86 1o78 n ASP 72 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1o78 s ALA 73 N -1.39 3.39 -0.71 -1.67 0.00 -1.26 -2.33 121.76 117.79 1o78 s ALA 73 Ca 0.79 -0.82 -0.03 0.00 0.00 0.00 0.00 51.96 51.90 1o78 s ALA 73 Cb -0.40 0.57 0.00 0.00 0.00 0.00 0.00 23.12 23.29 1o78 s ALA 73 CO 0.43 -0.25 0.49 1.33 0.00 0.00 0.00 175.76 177.76 1o78 n VAL 74 N -1.06 -2.55 1.48 0.00 0.24 0.29 -4.78 118.33 111.95 1o78 n VAL 74 Ca -0.11 -0.06 0.12 0.00 -2.04 0.00 0.00 64.34 62.25 1o78 n VAL 74 Cb 0.65 -2.26 0.71 0.00 -1.47 0.00 0.00 33.84 31.48 1o78 n VAL 74 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1o78 n GLN 75 N -2.49 0.71 -1.53 7.34 1.13 -1.13 -4.75 117.38 116.66 1o78 n GLN 75 Ca -0.25 0.01 -0.42 0.00 -1.94 0.00 0.00 57.00 54.40 1o78 n GLN 75 Cb 0.55 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 29.35 1o78 n GLN 75 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1o78 n GLY 76 N 0.57 0.34 0.83 1.08 0.00 -1.24 -2.12 105.19 104.64 1o78 n GLY 76 Ca 0.17 0.82 0.00 0.00 0.00 0.00 0.00 46.02 47.01 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 6.17 0.80 3.63 -0.02 0.00 -1.02 -4.91 105.19 109.84 1o78 n GLY 77 Ca 0.41 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.45 0.69 0.24 1.61 0.74 -0.90 -4.19 119.66 115.40 1o78 s GLN 78 Ca 0.00 0.87 -0.31 0.00 0.05 0.00 0.00 55.36 55.97 1o78 s GLN 78 Cb 0.00 0.31 -0.14 0.00 1.10 0.00 0.00 33.01 34.28 1o78 s GLN 78 CO 0.00 -0.09 1.24 0.41 -0.55 0.00 0.00 175.29 176.30 1o78 n GLY 79 N 2.77 0.33 0.09 2.59 0.00 -1.26 -1.97 105.19 107.74 1o78 n GLY 79 Ca -0.14 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 1.74 0.00 -3.79 0.99 4.77 0.12 -4.63 117.00 116.21 1o78 n LEU 80 Ca 0.11 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.97 1o78 n LEU 80 Cb 0.30 -0.38 -0.08 0.00 -2.33 0.00 0.00 43.42 40.93 1o78 n LEU 80 CO 0.62 -0.42 -0.02 0.27 -1.33 0.00 0.00 177.39 176.50 1o78 s ILE 81 N -0.85 0.08 -0.20 -0.08 -4.36 -1.26 -2.67 121.20 111.85 1o78 s ILE 81 Ca 0.00 -0.64 -0.19 0.00 -0.26 0.00 0.00 60.65 59.56 1o78 s ILE 81 Cb 0.00 -0.75 -0.03 0.00 1.25 0.00 0.00 42.46 42.93 1o78 s ILE 81 CO 0.00 -0.35 0.56 -0.75 0.24 0.00 0.00 174.94 174.64 1o78 s LYS 82 N -1.95 4.19 0.01 0.37 2.36 -0.35 -3.55 119.74 120.81 1o78 s LYS 82 Ca -0.09 0.48 0.04 0.00 -2.55 0.00 0.00 55.97 53.85 1o78 s LYS 82 Cb -0.03 -3.57 -0.01 0.00 -1.05 0.00 0.00 37.83 33.16 1o78 s LYS 82 CO 0.00 -0.20 -0.14 -1.50 1.55 0.00 0.00 175.35 175.07 1o78 s ILE 83 N 1.78 1.09 0.00 5.43 2.07 -1.25 -1.40 121.20 128.92 1o78 s ILE 83 Ca 0.26 -0.74 0.00 0.00 -1.41 0.00 0.00 60.65 58.75 1o78 s ILE 83 Cb -0.16 -0.94 0.00 0.00 0.13 0.00 0.00 42.46 41.50 1o78 s ILE 83 CO 0.10 0.19 0.00 0.61 -1.91 0.00 0.00 174.94 173.93