#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ae1 n TRP 17 N 0.00 2.87 -4.64 -0.14 7.02 -1.26 -1.45 117.44 119.84 1ae1 n TRP 17 Ca 0.00 -2.39 -0.23 0.00 -1.02 0.00 0.00 57.50 53.85 1ae1 n TRP 17 Cb 0.00 -0.47 -0.14 0.00 -2.42 0.00 0.00 31.31 28.28 1ae1 n TRP 17 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1ae1 s SER 18 N -3.35 2.01 -0.22 -0.99 0.15 -1.26 -5.01 113.70 105.03 1ae1 s SER 18 Ca 0.52 -0.39 0.13 0.00 0.70 0.00 0.00 55.95 56.91 1ae1 s SER 18 Cb 0.42 -0.19 0.46 0.00 -1.71 0.00 0.00 66.02 65.01 1ae1 s SER 18 CO 0.01 0.15 1.36 0.18 1.20 0.00 0.00 173.24 176.14 1ae1 n LEU 19 N 2.27 3.55 -4.71 3.45 4.77 -1.10 -4.60 117.00 120.63 1ae1 n LEU 19 Ca -0.16 -3.43 -0.42 0.00 -0.03 0.00 0.00 56.01 51.97 1ae1 n LEU 19 Cb 0.54 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 1ae1 n LEU 19 CO 0.24 0.99 1.07 -0.75 -1.33 0.00 0.00 177.39 177.60 1ae1 s LYS 20 N -3.05 4.32 -0.76 3.23 2.36 -1.21 -2.40 119.74 122.23 1ae1 s LYS 20 Ca 0.41 2.03 0.00 0.00 -2.55 0.00 0.00 55.97 55.85 1ae1 s LYS 20 Cb 0.36 -3.35 0.00 0.00 -1.05 0.00 0.00 37.83 33.79 1ae1 s LYS 20 CO 0.02 -0.46 0.00 0.41 1.55 0.00 0.00 175.35 176.87 1ae1 n GLY 21 N 3.52 0.73 3.95 5.54 0.00 -1.02 -4.93 105.19 112.98 1ae1 n GLY 21 Ca 0.12 -0.67 -0.23 0.00 0.00 0.00 0.00 46.02 45.23 1ae1 n GLY 21 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ae1 s THR 22 N -2.30 4.48 -0.03 2.61 -4.23 -1.01 -4.96 115.64 110.19 1ae1 s THR 22 Ca 0.00 -0.48 0.07 0.00 -1.18 0.00 0.00 61.69 60.09 1ae1 s THR 22 Cb 0.00 -3.64 -0.02 0.00 1.34 0.00 0.00 72.50 70.18 1ae1 s THR 22 CO 0.00 -0.43 -0.23 0.42 -0.54 0.00 0.00 174.62 173.84 1ae1 s THR 23 N -2.45 2.34 0.01 3.99 -4.23 -1.26 -0.03 115.64 114.00 1ae1 s THR 23 Ca 0.45 -1.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.97 1ae1 s THR 23 Cb -0.10 -1.85 -0.01 0.00 1.34 0.00 0.00 72.50 71.89 1ae1 s THR 23 CO 0.37 0.58 -0.03 0.00 -0.54 0.00 0.00 174.62 175.00 1ae1 s ALA 24 N -0.59 0.27 -0.23 3.99 0.00 0.69 -1.82 121.76 124.07 1ae1 s ALA 24 Ca 0.09 -0.25 0.01 0.00 0.00 0.00 0.00 51.96 51.81 1ae1 s ALA 24 Cb -0.11 -0.02 0.04 0.00 0.00 0.00 0.00 23.12 23.03 1ae1 s ALA 24 CO -0.00 0.02 -0.13 -1.17 0.00 0.00 0.00 175.76 174.49 1ae1 s LEU 25 N -0.41 2.98 -0.16 0.00 0.20 -0.16 -0.06 118.68 121.06 1ae1 s LEU 25 Ca -0.02 -1.05 0.01 0.00 0.69 0.00 0.00 54.13 53.75 1ae1 s LEU 25 Cb -0.03 -1.55 0.01 0.00 -0.43 0.00 0.00 46.19 44.19 1ae1 s LEU 25 CO -0.00 -0.12 -0.18 0.68 -0.29 0.00 0.00 176.35 176.44 1ae1 s VAL 26 N 1.21 2.28 0.36 1.68 -7.23 -0.44 -0.46 120.40 117.80 1ae1 s VAL 26 Ca -0.03 -0.88 -0.23 0.00 -1.81 0.00 0.00 61.98 59.03 1ae1 s VAL 26 Cb -0.17 -1.95 -0.10 0.00 0.56 0.00 0.00 36.38 34.72 1ae1 s VAL 26 CO -0.07 0.53 0.91 0.42 -0.31 0.00 0.00 175.10 176.58 1ae1 s THR 27 N 1.05 4.34 -1.05 5.32 -4.23 -0.97 -3.79 115.64 116.31 1ae1 s THR 27 Ca -0.01 1.59 -0.03 0.00 -1.18 0.00 0.00 61.69 62.07 1ae1 s THR 27 Cb -0.14 -3.81 -0.03 0.00 1.34 0.00 0.00 72.50 69.85 1ae1 s THR 27 CO -0.06 -0.05 0.90 0.61 -0.54 0.00 0.00 174.62 175.48 1ae1 n GLY 28 N 0.05 -0.65 0.90 3.99 0.00 -0.49 -3.03 105.19 105.97 1ae1 n GLY 28 Ca 0.04 0.29 0.10 0.00 0.00 0.00 0.00 46.02 46.44 1ae1 n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ae1 n GLY 29 N -1.18 1.22 0.05 -0.02 0.00 -1.10 -4.07 105.19 100.08 1ae1 n GLY 29 Ca -0.17 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.41 1ae1 n GLY 29 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ae1 n SER 30 N 0.95 0.60 -3.64 1.61 3.41 -1.26 -2.77 113.62 112.52 1ae1 n SER 30 Ca 0.17 0.13 -0.08 0.00 -0.26 0.00 0.00 58.87 58.84 1ae1 n SER 30 Cb 0.45 -0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.38 1ae1 n SER 30 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1ae1 s LYS 31 N -3.10 1.88 6.72 4.33 -2.85 -1.26 -4.84 119.74 120.61 1ae1 s LYS 31 Ca 0.09 -1.13 0.00 0.00 -1.00 0.00 0.00 55.97 53.93 1ae1 s LYS 31 Cb 0.15 0.60 0.00 0.00 -2.06 0.00 0.00 37.83 36.52 1ae1 s LYS 31 CO 0.68 -0.86 0.00 0.41 0.10 0.00 0.00 175.35 175.68 1ae1 n GLY 32 N -0.47 3.25 0.21 0.59 0.00 -1.26 -2.02 105.19 105.48 1ae1 n GLY 32 Ca -0.05 -0.24 -0.04 0.00 0.00 0.00 0.00 46.02 45.69 1ae1 n GLY 32 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ae1 h ILE 33 N 0.00 1.31 -0.61 -0.61 2.04 -1.91 -2.86 117.51 114.87 1ae1 h ILE 33 Ca 0.00 -1.58 -0.04 0.00 1.00 0.00 0.00 64.86 64.24 1ae1 h ILE 33 Cb 0.00 1.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 1ae1 h ILE 33 CO 0.00 0.48 0.23 1.23 0.00 0.00 0.00 178.15 180.09 1ae1 h GLY 34 N 1.18 0.99 0.12 5.37 0.00 -1.63 -0.24 103.07 108.86 1ae1 h GLY 34 Ca 0.02 -0.55 0.04 0.00 0.00 0.00 0.00 47.33 46.85 1ae1 h GLY 34 CO 0.07 0.52 -0.36 -1.82 0.00 0.00 0.00 176.54 174.95 1ae1 h TYR 35 N 0.85 -1.00 -0.95 5.60 5.03 -1.22 -1.87 116.97 123.41 1ae1 h TYR 35 Ca 0.20 0.04 0.07 0.00 2.58 0.00 0.00 58.73 61.62 1ae1 h TYR 35 Cb 0.23 0.46 -0.06 0.00 1.55 0.00 0.00 36.73 38.90 1ae1 h TYR 35 CO 0.01 -0.43 0.61 0.00 -1.32 0.00 0.00 178.16 177.04 1ae1 h ALA 36 N 0.28 1.47 -0.46 1.82 0.00 -1.21 -2.22 119.26 118.95 1ae1 h ALA 36 Ca 0.08 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1ae1 h ALA 36 Cb 0.58 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ae1 h ALA 36 CO -0.36 0.39 -0.14 0.82 0.00 0.00 0.00 179.25 179.96 1ae1 h ILE 37 N 1.09 1.26 -0.33 0.00 2.04 -0.77 -0.69 117.51 120.11 1ae1 h ILE 37 Ca 0.41 -1.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.01 1ae1 h ILE 37 Cb 0.19 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1ae1 h ILE 37 CO -0.16 0.43 0.16 0.58 0.00 0.00 0.00 178.15 179.15 1ae1 h VAL 38 N 0.76 1.16 -0.62 1.67 2.07 -0.77 -0.40 116.25 120.13 1ae1 h VAL 38 Ca 0.12 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 67.08 1ae1 h VAL 38 Cb 0.66 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1ae1 h VAL 38 CO 0.05 0.17 0.04 -0.33 0.02 0.00 0.00 177.57 177.52 1ae1 h GLU 39 N 0.40 1.06 0.16 1.57 5.08 -1.16 -0.30 114.58 121.38 1ae1 h GLU 39 Ca 0.11 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1ae1 h GLU 39 Cb 0.13 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1ae1 h GLU 39 CO -0.01 1.01 -0.08 1.49 -1.00 0.00 0.00 179.01 180.42 1ae1 h GLU 40 N 0.98 -0.20 -0.59 2.33 4.57 -0.90 0.49 114.58 121.25 1ae1 h GLU 40 Ca 0.18 0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.33 1ae1 h GLU 40 Cb 0.50 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 1ae1 h GLU 40 CO 0.02 0.16 0.20 -0.07 -1.18 0.00 0.00 179.01 178.14 1ae1 h LEU 41 N -0.61 0.81 0.02 1.64 4.07 -1.01 -2.26 115.31 117.97 1ae1 h LEU 41 Ca -0.02 -0.12 -0.25 0.00 0.08 0.00 0.00 57.88 57.57 1ae1 h LEU 41 Cb 0.46 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.99 1ae1 h LEU 41 CO 0.04 0.76 -1.11 0.00 -1.08 0.00 0.00 178.44 177.04 1ae1 h ALA 42 N 1.36 0.23 0.00 1.53 0.00 -0.98 -1.89 119.26 119.51 1ae1 h ALA 42 Ca 0.20 -0.85 -0.01 0.00 0.00 0.00 0.00 54.91 54.24 1ae1 h ALA 42 Cb 0.23 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ae1 h ALA 42 CO -0.01 1.01 -0.07 0.78 0.00 0.00 0.00 179.25 180.96 1ae1 h GLY 43 N 1.91 0.00 -2.26 0.00 0.00 0.22 -2.55 103.07 100.39 1ae1 h GLY 43 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.24 1ae1 h GLY 43 CO 0.17 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.75 1ae1 n LEU 44 N -3.28 3.36 0.00 3.11 4.77 -0.87 -4.96 117.00 119.13 1ae1 n LEU 44 Ca -0.01 -1.58 0.00 0.00 -0.03 0.00 0.00 56.01 54.39 1ae1 n LEU 44 Cb 0.27 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1ae1 n LEU 44 CO 0.28 0.79 0.00 0.61 -1.33 0.00 0.00 177.39 177.74 1ae1 n GLY 45 N 1.50 1.16 3.79 -0.72 0.00 -0.96 -2.71 105.19 107.26 1ae1 n GLY 45 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1ae1 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ae1 s ALA 46 N -2.00 2.76 -0.26 4.61 0.00 -0.72 -2.43 121.76 123.72 1ae1 s ALA 46 Ca 0.00 0.65 -0.20 0.00 0.00 0.00 0.00 51.96 52.41 1ae1 s ALA 46 Cb 0.00 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 19.81 1ae1 s ALA 46 CO 0.00 -0.62 0.61 1.03 0.00 0.00 0.00 175.76 176.78 1ae1 s ARG 47 N -3.44 4.08 -0.14 0.00 0.52 0.95 -4.45 118.95 116.48 1ae1 s ARG 47 Ca 0.69 0.48 -0.03 0.00 -0.52 0.00 0.00 55.73 56.35 1ae1 s ARG 47 Cb -0.19 -3.66 -0.03 0.00 0.52 0.00 0.00 34.95 31.59 1ae1 s ARG 47 CO 0.26 -0.42 -0.02 0.08 0.02 0.00 0.00 175.30 175.22 1ae1 s VAL 48 N 2.48 4.04 -0.11 3.52 1.01 -0.65 -0.22 120.40 130.47 1ae1 s VAL 48 Ca 0.25 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1ae1 s VAL 48 Cb -0.15 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 1ae1 s VAL 48 CO 0.09 0.52 -0.13 -0.47 0.00 0.00 0.00 175.10 175.11 1ae1 s TYR 49 N -0.00 2.78 0.19 5.22 6.14 0.91 -0.27 117.35 132.33 1ae1 s TYR 49 Ca 0.02 -0.52 -0.02 0.00 0.64 0.00 0.00 57.07 57.18 1ae1 s TYR 49 Cb -0.13 -1.79 -0.04 0.00 0.42 0.00 0.00 41.96 40.42 1ae1 s TYR 49 CO 0.02 -0.11 0.16 -0.08 0.64 0.00 0.00 175.55 176.18 1ae1 s THR 50 N 0.08 0.02 0.10 4.34 -1.32 -0.56 -1.33 115.64 116.96 1ae1 s THR 50 Ca -0.05 -1.91 -0.20 0.00 -1.21 0.00 0.00 61.69 58.31 1ae1 s THR 50 Cb -0.15 -2.38 0.05 0.00 -1.51 0.00 0.00 72.50 68.51 1ae1 s THR 50 CO 0.04 -0.08 0.49 0.00 -2.21 0.00 0.00 174.62 172.86 1ae1 n SER 52 N 0.03 0.00 -0.70 0.00 3.41 -1.24 -1.39 113.62 113.73 1ae1 n SER 52 Ca -0.17 -0.74 0.10 0.00 -0.26 0.00 0.00 58.87 57.80 1ae1 n SER 52 Cb 0.62 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.63 1ae1 n SER 52 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ae1 n ARG 53 N 0.00 1.74 -3.86 4.33 1.74 -1.25 -1.04 116.66 118.31 1ae1 n ARG 53 Ca 0.00 -1.46 -0.12 0.00 -0.77 0.00 0.00 57.85 55.50 1ae1 n ARG 53 Cb 0.00 -1.40 -0.14 0.00 -1.02 0.00 0.00 32.46 29.90 1ae1 n ARG 53 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1ae1 s ASN 54 N -1.92 -0.02 0.10 0.55 2.20 -1.26 -4.89 114.94 109.71 1ae1 s ASN 54 Ca 0.22 0.04 -0.22 0.00 -0.94 0.00 0.00 52.86 51.96 1ae1 s ASN 54 Cb 0.17 0.03 -0.12 0.00 -2.00 0.00 0.00 41.25 39.33 1ae1 s ASN 54 CO 0.35 -0.02 1.74 -0.08 -2.94 0.00 0.00 177.10 176.15 1ae1 h GLU 55 N 6.21 0.10 -0.02 3.55 4.81 -1.99 -2.23 114.58 125.02 1ae1 h GLU 55 Ca -0.26 -0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 58.81 1ae1 h GLU 55 Cb 1.20 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.54 1ae1 h GLU 55 CO 0.50 0.08 -0.69 0.87 -0.73 0.00 0.00 179.01 179.03 1ae1 h LYS 56 N 0.08 0.08 -0.14 1.92 1.79 -1.98 0.15 116.57 118.47 1ae1 h LYS 56 Ca 0.03 -0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.39 1ae1 h LYS 56 Cb 0.00 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.67 1ae1 h LYS 56 CO -0.01 0.74 -0.06 0.93 -1.08 0.00 0.00 179.45 179.98 1ae1 h GLU 57 N 0.05 0.29 0.00 3.15 5.08 -1.98 -2.37 114.58 118.80 1ae1 h GLU 57 Ca -0.01 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 1ae1 h GLU 57 Cb 1.22 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1ae1 h GLU 57 CO 0.10 0.60 -0.24 1.25 -1.00 0.00 0.00 179.01 179.72 1ae1 h LEU 58 N -0.04 0.00 -0.07 1.33 5.85 -1.14 -3.12 115.31 118.12 1ae1 h LEU 58 Ca 0.03 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.54 1ae1 h LEU 58 Cb 0.51 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 1ae1 h LEU 58 CO 0.02 0.24 -1.00 0.44 -0.34 0.00 0.00 178.44 177.80 1ae1 h ASP 59 N 0.00 0.11 0.22 1.25 5.19 -0.50 -2.57 116.42 120.12 1ae1 h ASP 59 Ca -0.00 -0.11 -0.18 0.00 -0.62 0.00 0.00 57.03 56.12 1ae1 h ASP 59 Cb 0.46 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 39.93 1ae1 h ASP 59 CO 0.03 1.04 -0.71 1.05 -3.12 0.00 0.00 179.24 177.52 1ae1 h GLU 60 N 0.03 0.43 -0.27 3.56 4.11 -1.40 -1.78 114.58 119.27 1ae1 h GLU 60 Ca -0.04 -0.35 0.00 0.00 0.07 0.00 0.00 59.36 59.05 1ae1 h GLU 60 Cb 1.72 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 31.03 1ae1 h GLU 60 CO 0.14 0.98 0.17 0.00 0.07 0.00 0.00 179.01 180.37 1ae1 h LEU 62 N 0.36 0.10 0.07 0.00 4.07 -1.29 0.93 115.31 119.54 1ae1 h LEU 62 Ca 0.10 -0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.86 1ae1 h LEU 62 Cb -0.03 -0.02 0.02 0.00 1.08 0.00 0.00 40.66 41.70 1ae1 h LEU 62 CO -0.02 0.08 -0.80 -0.08 -1.08 0.00 0.00 178.44 176.54 1ae1 h GLU 63 N 0.11 0.42 -0.45 1.13 4.57 -0.62 -2.56 114.58 117.18 1ae1 h GLU 63 Ca 0.03 -0.54 -0.01 0.00 -1.18 0.00 0.00 59.36 57.66 1ae1 h GLU 63 Cb 0.01 0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 1ae1 h GLU 63 CO -0.01 1.21 0.26 0.82 -1.18 0.00 0.00 179.01 180.12 1ae1 h ILE 64 N -0.12 1.15 -0.06 2.32 2.04 -0.26 -2.44 117.51 120.15 1ae1 h ILE 64 Ca -0.12 -0.36 -0.16 0.00 1.00 0.00 0.00 64.86 65.22 1ae1 h ILE 64 Cb 1.54 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 1ae1 h ILE 64 CO 0.15 0.16 -0.65 -0.50 0.00 0.00 0.00 178.15 177.31 1ae1 h TRP 65 N 0.60 0.32 -0.21 1.37 6.55 -0.90 -3.01 115.95 120.67 1ae1 h TRP 65 Ca 0.16 -0.13 -0.17 0.00 0.95 0.00 0.00 58.89 59.70 1ae1 h TRP 65 Cb 0.02 -0.05 -0.00 0.00 -0.86 0.00 0.00 29.16 28.26 1ae1 h TRP 65 CO -0.03 0.83 -0.56 -0.09 -1.05 0.00 0.00 178.44 177.54 1ae1 h ARG 66 N 0.18 0.66 -0.44 0.49 1.12 -1.38 0.30 114.38 115.31 1ae1 h ARG 66 Ca -0.01 -0.42 -0.02 0.00 -1.11 0.00 0.00 59.98 58.41 1ae1 h ARG 66 Cb 1.18 0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 31.17 1ae1 h ARG 66 CO 0.10 1.04 0.17 0.93 -3.11 0.00 0.00 179.97 179.11 1ae1 h GLU 67 N 0.50 0.62 -0.68 0.20 5.08 -1.38 -1.59 114.58 117.34 1ae1 h GLU 67 Ca 0.01 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1ae1 h GLU 67 Cb 1.13 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1ae1 h GLU 67 CO 0.11 0.52 0.00 0.36 -1.00 0.00 0.00 179.01 179.00 1ae1 n LYS 68 N -4.37 2.99 -1.08 2.33 2.85 -1.14 -4.91 118.16 114.84 1ae1 n LYS 68 Ca 0.03 -1.79 -0.02 0.00 -1.05 0.00 0.00 58.31 55.49 1ae1 n LYS 68 Cb 0.15 -1.80 -0.01 0.00 -0.65 0.00 0.00 35.03 32.72 1ae1 n LYS 68 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ae1 n GLY 69 N 0.58 0.49 3.82 2.58 0.00 -0.60 -5.01 105.19 107.05 1ae1 n GLY 69 Ca 0.16 -1.01 -0.38 0.00 0.00 0.00 0.00 46.02 44.79 1ae1 n GLY 69 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ae1 s LEU 70 N -0.36 4.47 -1.16 0.99 1.43 0.09 -5.01 118.68 119.13 1ae1 s LEU 70 Ca 0.00 1.23 -0.15 0.00 -1.03 0.00 0.00 54.13 54.18 1ae1 s LEU 70 Cb 0.00 -3.04 0.16 0.00 0.03 0.00 0.00 46.19 43.33 1ae1 s LEU 70 CO 0.00 0.21 1.40 0.21 0.23 0.00 0.00 176.35 178.40 1ae1 s ASN 71 N -1.30 6.97 -0.05 2.29 3.04 -1.26 -4.30 114.94 120.33 1ae1 s ASN 71 Ca 0.32 -2.77 0.01 0.00 0.04 0.00 0.00 52.86 50.46 1ae1 s ASN 71 Cb -0.18 -2.41 0.02 0.00 -1.54 0.00 0.00 41.25 37.13 1ae1 s ASN 71 CO 0.19 -0.84 -0.06 0.54 -3.04 0.00 0.00 177.10 173.90 1ae1 s VAL 72 N 1.98 0.65 0.35 -5.21 0.11 -1.26 -1.63 120.40 115.39 1ae1 s VAL 72 Ca 0.42 -0.17 0.08 0.00 -2.93 0.00 0.00 61.98 59.37 1ae1 s VAL 72 Cb -0.03 -0.67 -0.03 0.00 -1.53 0.00 0.00 36.38 34.12 1ae1 s VAL 72 CO -0.01 0.26 0.24 -1.61 -3.33 0.00 0.00 175.10 170.65 1ae1 s GLU 73 N 1.00 2.55 -0.15 1.54 0.41 0.63 -4.94 118.70 119.74 1ae1 s GLU 73 Ca -0.10 -1.44 -0.31 0.00 -0.41 0.00 0.00 54.97 52.71 1ae1 s GLU 73 Cb -0.14 -2.33 0.13 0.00 -1.78 0.00 0.00 34.13 30.01 1ae1 s GLU 73 CO -0.00 0.06 1.07 0.20 -0.49 0.00 0.00 175.26 176.10 1ae1 s GLY 74 N -3.95 -0.26 0.06 -1.39 0.00 -1.26 -1.49 107.32 99.02 1ae1 s GLY 74 Ca 0.41 1.85 -0.07 0.00 0.00 0.00 0.00 44.72 46.90 1ae1 s GLY 74 CO 0.25 0.80 0.15 -1.35 0.00 0.00 0.00 173.10 172.95 1ae1 s SER 75 N -1.59 0.14 0.14 1.64 1.04 -0.99 -4.97 113.70 109.11 1ae1 s SER 75 Ca 0.03 -0.57 -0.30 0.00 0.48 0.00 0.00 55.95 55.60 1ae1 s SER 75 Cb -0.01 0.28 -0.07 0.00 0.10 0.00 0.00 66.02 66.33 1ae1 s SER 75 CO -0.03 -0.61 1.06 -0.69 0.98 0.00 0.00 173.24 173.95 1ae1 s VAL 76 N -3.16 4.13 -0.09 5.02 1.01 -1.26 -3.65 120.40 122.39 1ae1 s VAL 76 Ca -0.00 1.77 -0.18 0.00 0.00 0.00 0.00 61.98 63.57 1ae1 s VAL 76 Cb 0.02 -4.13 0.04 0.00 0.00 0.00 0.00 36.38 32.31 1ae1 s VAL 76 CO -0.07 0.27 0.43 0.00 0.00 0.00 0.00 175.10 175.73 1ae1 s ASP 78 N -0.62 5.43 0.00 0.00 -1.08 -1.26 -3.97 116.67 115.17 1ae1 s ASP 78 Ca -0.07 -1.63 0.07 0.00 -0.52 0.00 0.00 52.55 50.40 1ae1 s ASP 78 Cb -0.03 -1.91 0.37 0.00 -1.46 0.00 0.00 42.92 39.89 1ae1 s ASP 78 CO 0.04 -0.51 1.06 0.18 0.52 0.00 0.00 175.17 176.46 1ae1 n LEU 79 N 4.79 0.00 0.18 -1.34 4.77 -1.26 -1.42 117.00 122.71 1ae1 n LEU 79 Ca -0.08 0.25 0.12 0.00 -0.03 0.00 0.00 56.01 56.27 1ae1 n LEU 79 Cb 0.42 -0.25 0.11 0.00 -2.33 0.00 0.00 43.42 41.37 1ae1 n LEU 79 CO 0.36 -0.19 0.51 -0.07 -1.33 0.00 0.00 177.39 176.67 1ae1 h LEU 80 N 0.00 0.00 -9.22 2.23 3.38 -1.93 -3.43 115.31 106.34 1ae1 h LEU 80 Ca 0.00 -0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 1ae1 h LEU 80 Cb 0.06 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.74 1ae1 h LEU 80 CO 0.00 0.00 0.20 -0.55 0.09 0.00 0.00 178.44 178.18 1ae1 s SER 81 N -5.87 6.88 0.40 -0.43 0.15 -0.51 -4.95 113.70 109.36 1ae1 s SER 81 Ca 0.04 1.06 0.17 0.00 0.70 0.00 0.00 55.95 57.93 1ae1 s SER 81 Cb 0.07 -2.40 0.83 0.00 -1.71 0.00 0.00 66.02 62.81 1ae1 s SER 81 CO 0.71 -0.26 1.84 -0.09 1.20 0.00 0.00 173.24 176.64 1ae1 h ARG 82 N 7.18 0.00 -0.33 5.44 2.43 -1.86 -2.36 114.38 124.88 1ae1 h ARG 82 Ca -0.34 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 58.67 1ae1 h ARG 82 Cb 1.16 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1ae1 h ARG 82 CO 0.79 0.33 -0.41 1.15 -1.51 0.00 0.00 179.97 180.32 1ae1 h THR 83 N 0.00 1.28 0.00 0.20 2.02 -1.94 -2.39 112.91 112.07 1ae1 h THR 83 Ca -0.00 -1.59 -0.08 0.00 0.77 0.00 0.00 66.41 65.51 1ae1 h THR 83 Cb 0.68 1.52 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 1ae1 h THR 83 CO 0.04 0.52 -0.39 -0.33 0.37 0.00 0.00 175.52 175.74 1ae1 h GLU 84 N 0.65 0.00 -0.21 6.66 5.08 -1.81 -0.71 114.58 124.24 1ae1 h GLU 84 Ca 0.04 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.29 1ae1 h GLU 84 Cb 1.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.25 1ae1 h GLU 84 CO 0.10 0.39 -0.32 0.00 -1.00 0.00 0.00 179.01 178.18 1ae1 h ARG 85 N 0.00 0.58 -0.46 2.33 3.08 -1.41 0.20 114.38 118.71 1ae1 h ARG 85 Ca -0.00 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.69 1ae1 h ARG 85 Cb 0.90 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.96 1ae1 h ARG 85 CO 0.05 0.95 0.24 -0.44 -1.07 0.00 0.00 179.97 179.70 1ae1 h ASP 86 N 0.27 0.58 -0.12 7.04 3.32 -1.26 -2.12 116.42 124.12 1ae1 h ASP 86 Ca 0.02 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 56.88 1ae1 h ASP 86 Cb 0.90 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.28 1ae1 h ASP 86 CO 0.07 0.52 -0.20 0.50 -1.72 0.00 0.00 179.24 178.41 1ae1 h LYS 87 N 0.60 0.54 -0.60 3.56 1.63 -1.05 -1.92 116.57 119.33 1ae1 h LYS 87 Ca 0.16 -0.19 -0.10 0.00 -0.85 0.00 0.00 60.65 59.67 1ae1 h LYS 87 Cb 0.07 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 1ae1 h LYS 87 CO -0.02 0.71 -0.02 1.25 -3.45 0.00 0.00 179.45 177.92 1ae1 h LEU 88 N 0.48 1.05 -0.97 5.20 5.85 -0.77 -1.75 115.31 124.40 1ae1 h LEU 88 Ca 0.08 -0.31 -0.08 0.00 0.84 0.00 0.00 57.88 58.40 1ae1 h LEU 88 Cb 0.62 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1ae1 h LEU 88 CO 0.04 1.11 -0.40 -0.03 -0.34 0.00 0.00 178.44 178.82 1ae1 h MET 89 N 0.97 0.00 -0.04 1.25 4.05 -1.10 -0.70 114.93 119.36 1ae1 h MET 89 Ca 0.17 0.00 -0.19 0.00 -0.28 0.00 0.00 59.70 59.40 1ae1 h MET 89 Cb 0.58 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.38 1ae1 h MET 89 CO 0.03 0.40 -0.79 1.96 0.23 0.00 0.00 176.91 178.75 1ae1 h GLN 90 N 0.00 0.34 -0.23 0.39 4.20 -1.00 -1.15 115.11 117.66 1ae1 h GLN 90 Ca -0.00 -0.31 -0.13 0.00 0.06 0.00 0.00 58.65 58.27 1ae1 h GLN 90 Cb 0.89 0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.74 1ae1 h GLN 90 CO 0.05 0.97 -0.35 1.15 -0.67 0.00 0.00 178.83 179.98 1ae1 h THR 91 N 0.22 1.32 -0.71 -0.54 2.02 -0.99 -1.39 112.91 112.84 1ae1 h THR 91 Ca -0.04 -1.55 -0.03 0.00 0.77 0.00 0.00 66.41 65.55 1ae1 h THR 91 Cb 1.38 1.77 -0.03 0.00 -1.74 0.00 0.00 68.15 69.52 1ae1 h THR 91 CO 0.13 0.49 0.31 0.58 0.37 0.00 0.00 175.52 177.40 1ae1 h VAL 92 N 0.34 1.23 -0.60 3.16 2.07 -1.17 -1.86 116.25 119.42 1ae1 h VAL 92 Ca 0.02 -0.70 -0.05 0.00 0.82 0.00 0.00 66.70 66.79 1ae1 h VAL 92 Cb 0.93 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1ae1 h VAL 92 CO 0.08 0.29 0.16 0.00 0.02 0.00 0.00 177.57 178.12 1ae1 h ALA 93 N 1.32 1.14 0.16 1.67 0.00 -0.98 -2.50 119.26 120.07 1ae1 h ALA 93 Ca 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ae1 h ALA 93 Cb 0.15 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1ae1 h ALA 93 CO -0.03 0.58 -0.08 1.25 0.00 0.00 0.00 179.25 180.98 1ae1 h HIS 94 N 0.90 -0.20 0.00 0.00 6.17 -0.77 -0.90 115.15 120.36 1ae1 h HIS 94 Ca 0.20 -0.00 -0.02 0.00 0.71 0.00 0.00 60.37 61.25 1ae1 h HIS 94 Cb 0.30 0.06 -0.00 0.00 2.52 0.00 0.00 27.41 30.30 1ae1 h HIS 94 CO 0.02 0.21 -0.09 -0.39 0.71 0.00 0.00 177.93 178.38 1ae1 h VAL 95 N -0.67 0.27 -0.02 5.26 -1.51 -1.34 -2.91 116.25 115.32 1ae1 h VAL 95 Ca -0.02 -0.70 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 1ae1 h VAL 95 Cb 0.49 1.55 0.00 0.00 -2.13 0.00 0.00 31.29 31.21 1ae1 h VAL 95 CO 0.04 0.09 -0.11 0.49 -1.23 0.00 0.00 177.57 176.85 1ae1 n PHE 96 N -3.27 0.00 -3.19 5.19 3.72 -0.94 -4.99 117.46 113.98 1ae1 n PHE 96 Ca -0.00 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.22 1ae1 n PHE 96 Cb 0.33 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.92 1ae1 n PHE 96 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1ae1 n ASP 97 N 0.70 -5.21 0.00 4.37 8.00 -0.94 -3.25 116.55 120.22 1ae1 n ASP 97 Ca 0.10 -0.35 0.00 0.00 0.71 0.00 0.00 54.79 55.24 1ae1 n ASP 97 Cb 0.44 -3.87 0.00 0.00 -0.02 0.00 0.00 41.12 37.67 1ae1 n ASP 97 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ae1 n GLY 98 N -1.55 0.42 2.68 0.44 0.00 -0.39 -5.03 105.19 101.76 1ae1 n GLY 98 Ca -0.02 -0.99 -0.25 0.00 0.00 0.00 0.00 46.02 44.76 1ae1 n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ae1 s LYS 99 N -2.37 0.29 -0.12 1.61 1.02 -1.20 -4.54 119.74 114.43 1ae1 s LYS 99 Ca 0.00 -0.08 0.01 0.00 0.02 0.00 0.00 55.97 55.93 1ae1 s LYS 99 Cb 0.00 -1.57 0.02 0.00 -0.52 0.00 0.00 37.83 35.76 1ae1 s LYS 99 CO 0.00 -0.55 -0.15 -1.17 -0.92 0.00 0.00 175.35 172.56 1ae1 s LEU 100 N 2.04 1.69 -0.14 3.17 2.96 -0.80 -4.81 118.68 122.79 1ae1 s LEU 100 Ca 0.02 -0.44 -0.16 0.00 -0.22 0.00 0.00 54.13 53.33 1ae1 s LEU 100 Cb -0.15 -1.11 -0.24 0.00 0.50 0.00 0.00 46.19 45.19 1ae1 s LEU 100 CO -0.07 -0.01 0.41 0.78 -1.32 0.00 0.00 176.35 176.14 1ae1 h ASN 101 N 7.61 0.25 -3.48 3.68 2.35 -1.69 -3.18 115.58 121.12 1ae1 h ASN 101 Ca -0.33 -0.77 -0.50 0.00 -0.55 0.00 0.00 56.30 54.15 1ae1 h ASN 101 Cb 1.16 -0.08 -0.33 0.00 0.05 0.00 0.00 38.32 39.12 1ae1 h ASN 101 CO 0.50 1.61 -0.81 -0.63 -1.65 0.00 0.00 177.43 176.45 1ae1 s ILE 102 N -2.45 1.09 -0.14 2.81 1.01 -0.75 0.41 121.20 123.17 1ae1 s ILE 102 Ca -0.23 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 59.96 1ae1 s ILE 102 Cb 0.05 -0.99 0.02 0.00 0.01 0.00 0.00 42.46 41.55 1ae1 s ILE 102 CO 0.71 0.34 -0.13 -0.22 0.00 0.00 0.00 174.94 175.64 1ae1 s LEU 103 N 0.61 1.56 -0.39 2.97 2.96 0.98 -0.99 118.68 126.38 1ae1 s LEU 103 Ca -0.13 -0.44 -0.05 0.00 -0.22 0.00 0.00 54.13 53.29 1ae1 s LEU 103 Cb -0.15 -1.09 0.08 0.00 0.50 0.00 0.00 46.19 45.54 1ae1 s LEU 103 CO 0.03 -0.07 0.18 -0.69 -1.32 0.00 0.00 176.35 174.49 1ae1 s VAL 104 N 1.50 3.58 -1.31 1.68 1.01 0.40 -0.72 120.40 126.54 1ae1 s VAL 104 Ca 0.04 -1.65 -0.18 0.00 0.00 0.00 0.00 61.98 60.19 1ae1 s VAL 104 Cb -0.13 -3.26 0.05 0.00 0.00 0.00 0.00 36.38 33.04 1ae1 s VAL 104 CO -0.09 -0.49 1.82 0.59 0.00 0.00 0.00 175.10 176.92 1ae1 n ASN 105 N 4.72 4.66 0.00 3.32 3.02 0.49 -2.28 115.26 129.19 1ae1 n ASN 105 Ca -0.08 -2.89 -0.18 0.00 -0.03 0.00 0.00 54.58 51.40 1ae1 n ASN 105 Cb 0.42 -1.73 -0.14 0.00 -0.61 0.00 0.00 39.78 37.72 1ae1 n ASN 105 CO 0.00 0.00 0.00 -1.13 -2.62 0.00 0.00 177.26 173.51 1ae1 h ASN 106 N 7.52 0.32 -3.03 6.41 -0.73 -1.83 -2.96 115.58 121.27 1ae1 h ASN 106 Ca 0.45 -0.71 -0.58 0.00 1.87 0.00 0.00 56.30 57.34 1ae1 h ASN 106 Cb 0.84 -0.10 0.11 0.00 0.27 0.00 0.00 38.32 39.43 1ae1 h ASN 106 CO 1.50 1.63 0.45 0.00 -0.37 0.00 0.00 177.43 180.64 1ae1 n ALA 107 N -2.87 0.95 -3.61 1.57 0.00 -1.17 -4.86 120.51 110.51 1ae1 n ALA 107 Ca -0.27 0.38 -0.06 0.00 0.00 0.00 0.00 53.44 53.48 1ae1 n ALA 107 Cb 1.05 -2.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.27 1ae1 n ALA 107 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ae1 s GLY 108 N -0.26 -0.37 0.04 0.00 0.00 -1.26 -4.71 107.32 100.77 1ae1 s GLY 108 Ca 0.58 0.60 -0.01 0.00 0.00 0.00 0.00 44.72 45.90 1ae1 s GLY 108 CO 0.60 0.18 -0.03 -1.34 0.00 0.00 0.00 173.10 172.51 1ae1 s VAL 109 N -3.21 0.18 -0.04 1.40 -7.23 -1.26 -5.04 120.40 105.19 1ae1 s VAL 109 Ca 0.08 -1.45 0.04 0.00 -1.81 0.00 0.00 61.98 58.84 1ae1 s VAL 109 Cb -0.01 -1.03 -0.00 0.00 0.56 0.00 0.00 36.38 35.89 1ae1 s VAL 109 CO -0.04 -0.80 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.09 1ae1 s VAL 110 N -2.96 1.37 -0.06 1.32 1.01 -1.26 -4.93 120.40 114.88 1ae1 s VAL 110 Ca -0.02 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.31 1ae1 s VAL 110 Cb 0.01 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1ae1 s VAL 110 CO -0.06 0.39 -0.17 -0.63 0.00 0.00 0.00 175.10 174.63 1ae1 s ILE 111 N -0.02 2.83 -0.51 2.22 1.01 -1.26 -5.10 121.20 120.37 1ae1 s ILE 111 Ca -0.02 -0.79 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 1ae1 s ILE 111 Cb -0.10 -2.10 0.13 0.00 0.01 0.00 0.00 42.46 40.39 1ae1 s ILE 111 CO 0.02 0.57 0.40 -1.00 0.00 0.00 0.00 174.94 174.93 1ae1 s HIS 112 N -0.43 3.41 0.18 3.97 3.76 -1.26 -4.63 115.29 120.29 1ae1 s HIS 112 Ca 0.05 -1.79 -0.02 0.00 -0.15 0.00 0.00 55.06 53.14 1ae1 s HIS 112 Cb -0.12 -3.57 -0.04 0.00 1.11 0.00 0.00 32.58 29.97 1ae1 s HIS 112 CO 0.02 -1.00 0.15 0.15 -0.85 0.00 0.00 174.74 173.21 1ae1 s LYS 113 N 1.31 1.16 0.50 1.40 1.02 -0.13 -5.02 119.74 119.98 1ae1 s LYS 113 Ca 0.06 -1.53 -0.19 0.00 0.02 0.00 0.00 55.97 54.33 1ae1 s LYS 113 Cb -0.26 0.28 -0.08 0.00 -0.52 0.00 0.00 37.83 37.26 1ae1 s LYS 113 CO -0.00 -0.38 1.03 -1.21 -0.92 0.00 0.00 175.35 173.86 1ae1 s GLU 114 N -4.11 3.76 0.45 1.68 2.02 -1.26 -4.08 118.70 117.16 1ae1 s GLU 114 Ca 0.33 1.26 0.16 0.00 0.02 0.00 0.00 54.97 56.73 1ae1 s GLU 114 Cb 0.06 -2.10 1.09 0.00 0.10 0.00 0.00 34.13 33.28 1ae1 s GLU 114 CO 0.09 -0.45 1.97 0.00 0.02 0.00 0.00 175.26 176.88 1ae1 h ALA 115 N 1.30 2.10 0.00 5.21 0.00 -1.99 0.14 119.26 126.02 1ae1 h ALA 115 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1ae1 h ALA 115 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1ae1 h ALA 115 CO 0.59 -0.26 0.00 0.36 0.00 0.00 0.00 179.25 179.94 1ae1 n LYS 116 N -4.46 0.14 -0.01 0.00 2.85 -1.26 -3.76 118.16 111.65 1ae1 n LYS 116 Ca 0.11 0.01 0.10 0.00 -1.05 0.00 0.00 58.31 57.48 1ae1 n LYS 116 Cb 0.44 -1.50 -0.17 0.00 -0.65 0.00 0.00 35.03 33.15 1ae1 n LYS 116 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1ae1 n ASP 117 N -1.43 0.01 -4.72 -5.58 8.00 0.03 -4.95 116.55 107.90 1ae1 n ASP 117 Ca 0.09 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.18 1ae1 n ASP 117 Cb 0.30 1.95 -0.03 0.00 -0.02 0.00 0.00 41.12 43.32 1ae1 n ASP 117 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1ae1 s PHE 118 N -3.48 2.94 0.62 1.24 0.08 -1.21 -4.99 117.98 113.19 1ae1 s PHE 118 Ca -0.08 0.46 -0.04 0.00 0.12 0.00 0.00 56.93 57.39 1ae1 s PHE 118 Cb 0.14 -4.07 0.13 0.00 -0.57 0.00 0.00 43.02 38.65 1ae1 s PHE 118 CO 0.91 -3.99 0.84 0.25 -0.10 0.00 0.00 175.22 173.12 1ae1 n THR 119 N 3.85 0.00 0.06 0.64 -2.24 -1.26 -4.94 114.28 110.38 1ae1 n THR 119 Ca 0.15 -1.04 -0.07 0.00 -2.27 0.00 0.00 64.05 60.81 1ae1 n THR 119 Cb 0.36 -1.22 0.08 0.00 -2.10 0.00 0.00 70.33 67.46 1ae1 n THR 119 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1ae1 h GLU 120 N 0.00 0.35 -0.30 -0.78 4.81 -1.99 -2.11 114.58 114.56 1ae1 h GLU 120 Ca -0.28 -0.25 -0.05 0.00 -0.13 0.00 0.00 59.36 58.66 1ae1 h GLU 120 Cb 0.92 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 1ae1 h GLU 120 CO 0.26 0.87 0.00 -0.22 -0.73 0.00 0.00 179.01 179.19 1ae1 h LYS 121 N 0.25 0.53 -0.08 1.92 1.63 -1.99 -1.08 116.57 117.76 1ae1 h LYS 121 Ca -0.01 -0.17 0.04 0.00 -0.85 0.00 0.00 60.65 59.66 1ae1 h LYS 121 Cb 1.17 -0.05 -0.06 0.00 -0.60 0.00 0.00 32.23 32.69 1ae1 h LYS 121 CO 0.11 0.67 -0.29 -0.44 -3.45 0.00 0.00 179.45 176.05 1ae1 h ASP 122 N 0.33 -0.87 -0.77 4.20 3.32 -1.93 -0.70 116.42 120.00 1ae1 h ASP 122 Ca 0.09 0.13 0.15 0.00 0.02 0.00 0.00 57.03 57.41 1ae1 h ASP 122 Cb 0.43 0.37 -0.10 0.00 0.22 0.00 0.00 39.33 40.25 1ae1 h ASP 122 CO 0.01 -0.34 0.31 0.22 -1.72 0.00 0.00 179.24 177.73 1ae1 h TYR 123 N -0.39 0.53 -0.25 4.55 3.20 -1.15 -0.43 116.97 123.03 1ae1 h TYR 123 Ca 0.08 0.04 -0.17 0.00 3.14 0.00 0.00 58.73 61.82 1ae1 h TYR 123 Cb 0.51 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 1ae1 h TYR 123 CO -0.35 0.06 -0.54 -0.91 -1.64 0.00 0.00 178.16 174.77 1ae1 h ASN 124 N 0.45 0.82 -0.07 -2.11 -0.26 -0.13 0.94 115.58 115.22 1ae1 h ASN 124 Ca 0.42 -0.44 -0.02 0.00 -0.56 0.00 0.00 56.30 55.71 1ae1 h ASN 124 Cb 0.65 -0.24 -0.00 0.00 -1.06 0.00 0.00 38.32 37.68 1ae1 h ASN 124 CO -0.41 1.20 -0.02 0.40 -1.06 0.00 0.00 177.43 177.54 1ae1 h ILE 125 N 0.57 1.29 -0.06 2.81 2.04 -0.75 0.05 117.51 123.47 1ae1 h ILE 125 Ca 0.01 -0.93 -0.05 0.00 1.00 0.00 0.00 64.86 64.89 1ae1 h ILE 125 Cb 1.12 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.99 1ae1 h ILE 125 CO 0.11 0.26 -0.18 0.40 0.00 0.00 0.00 178.15 178.74 1ae1 h ILE 126 N -0.21 1.44 -0.17 -0.67 2.04 -0.99 0.31 117.51 119.26 1ae1 h ILE 126 Ca 0.02 -1.57 -0.11 0.00 1.00 0.00 0.00 64.86 64.19 1ae1 h ILE 126 Cb 0.42 2.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.82 1ae1 h ILE 126 CO 0.01 0.44 -0.34 0.24 0.00 0.00 0.00 178.15 178.50 1ae1 h MET 127 N -0.31 0.53 -0.28 2.37 2.86 -0.96 -1.74 114.93 117.41 1ae1 h MET 127 Ca -0.01 -0.34 0.06 0.00 -2.06 0.00 0.00 59.70 57.35 1ae1 h MET 127 Cb 0.80 0.04 -0.06 0.00 0.06 0.00 0.00 31.60 32.45 1ae1 h MET 127 CO 0.04 0.95 -0.08 0.78 1.06 0.00 0.00 176.91 179.66 1ae1 h GLY 128 N 0.18 0.18 0.33 8.32 0.00 -1.01 -1.46 103.07 109.62 1ae1 h GLY 128 Ca 0.01 0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.44 1ae1 h GLY 128 CO 0.08 -0.12 -0.02 -0.84 0.00 0.00 0.00 176.54 175.63 1ae1 h THR 129 N -0.02 1.30 -0.06 4.70 2.02 -0.98 -1.05 112.91 118.82 1ae1 h THR 129 Ca 0.14 -1.44 -0.24 0.00 0.77 0.00 0.00 66.41 65.64 1ae1 h THR 129 Cb 0.23 2.22 0.01 0.00 -1.74 0.00 0.00 68.15 68.86 1ae1 h THR 129 CO -0.30 0.35 -0.90 0.78 0.37 0.00 0.00 175.52 175.82 1ae1 h ASN 130 N -0.74 0.80 0.00 4.18 2.35 -1.39 -3.36 115.58 117.42 1ae1 h ASN 130 Ca -0.01 -0.59 -0.08 0.00 -0.55 0.00 0.00 56.30 55.08 1ae1 h ASN 130 Cb 0.62 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 1ae1 h ASN 130 CO 0.01 1.38 -0.90 0.33 -1.65 0.00 0.00 177.43 176.61 1ae1 n PHE 131 N -3.86 0.00 0.01 1.19 7.35 -0.83 -4.45 117.46 116.88 1ae1 n PHE 131 Ca -0.08 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.49 1ae1 n PHE 131 Cb 0.81 -0.29 -0.06 0.00 0.35 0.00 0.00 39.48 40.28 1ae1 n PHE 131 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 1ae1 h GLU 132 N -0.43 0.07 -0.71 -4.13 4.81 -1.29 0.19 114.58 113.10 1ae1 h GLU 132 Ca -0.11 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 1ae1 h GLU 132 Cb 0.74 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.08 1ae1 h GLU 132 CO -0.07 0.12 0.35 0.00 -0.73 0.00 0.00 179.01 178.68 1ae1 h ALA 133 N 0.95 0.91 -0.35 2.92 0.00 -1.35 0.22 119.26 122.57 1ae1 h ALA 133 Ca 0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1ae1 h ALA 133 Cb 0.07 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1ae1 h ALA 133 CO -0.00 0.47 0.08 0.00 0.00 0.00 0.00 179.25 179.80 1ae1 h ALA 134 N 1.17 1.50 0.03 0.00 0.00 -1.61 -1.34 119.26 119.01 1ae1 h ALA 134 Ca 0.24 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1ae1 h ALA 134 Cb 0.11 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1ae1 h ALA 134 CO -0.03 0.37 -0.22 -0.92 0.00 0.00 0.00 179.25 178.45 1ae1 h TYR 135 N 0.50 0.16 -0.54 0.00 3.20 -0.05 -2.98 116.97 117.26 1ae1 h TYR 135 Ca 0.12 -0.11 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1ae1 h TYR 135 Cb 0.19 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.43 1ae1 h TYR 135 CO 0.01 1.04 0.32 1.25 -1.64 0.00 0.00 178.16 179.14 1ae1 h HIS 136 N -0.76 0.72 -0.96 -3.82 2.76 -0.55 -0.92 115.15 111.63 1ae1 h HIS 136 Ca -0.04 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.17 1ae1 h HIS 136 Cb 1.13 -0.24 -0.06 0.00 1.55 0.00 0.00 27.41 29.79 1ae1 h HIS 136 CO 0.24 0.51 0.62 -0.07 -1.30 0.00 0.00 177.93 177.92 1ae1 h LEU 137 N 0.73 1.01 -0.93 0.26 3.38 -1.36 -1.56 115.31 116.84 1ae1 h LEU 137 Ca 0.19 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 1ae1 h LEU 137 Cb 0.00 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1ae1 h LEU 137 CO -0.04 0.68 0.27 0.28 0.09 0.00 0.00 178.44 179.72 1ae1 h SER 138 N 1.17 0.96 -0.58 -0.43 0.02 -1.19 0.51 113.55 114.01 1ae1 h SER 138 Ca 0.39 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1ae1 h SER 138 Cb 0.07 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 1ae1 h SER 138 CO -0.14 0.86 0.36 1.56 -1.14 0.00 0.00 176.83 178.33 1ae1 h GLN 139 N 1.02 0.79 0.00 3.45 4.20 -0.23 -2.65 115.11 121.68 1ae1 h GLN 139 Ca 0.24 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1ae1 h GLN 139 Cb 0.21 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1ae1 h GLN 139 CO -0.02 0.56 -0.89 0.44 -0.67 0.00 0.00 178.83 178.25 1ae1 n ILE 140 N -4.64 0.25 0.15 2.54 -5.35 -0.82 -3.58 119.36 107.91 1ae1 n ILE 140 Ca 0.04 -0.27 0.03 0.00 -0.27 0.00 0.00 62.75 62.28 1ae1 n ILE 140 Cb 0.05 0.06 0.12 0.00 -1.74 0.00 0.00 39.64 38.12 1ae1 n ILE 140 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ae1 h ALA 141 N 2.50 0.75 -0.99 -1.28 0.00 -0.91 -3.38 119.26 115.95 1ae1 h ALA 141 Ca 0.00 -0.43 0.35 0.00 0.00 0.00 0.00 54.91 54.83 1ae1 h ALA 141 Cb 0.75 -0.08 -0.17 0.00 0.00 0.00 0.00 17.79 18.29 1ae1 h ALA 141 CO 0.00 0.59 0.38 -0.92 0.00 0.00 0.00 179.25 179.30 1ae1 h TYR 142 N 0.00 0.56 0.00 0.00 3.20 -1.52 0.36 116.97 119.57 1ae1 h TYR 142 Ca -0.00 0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.80 1ae1 h TYR 142 Cb 1.25 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.43 1ae1 h TYR 142 CO 0.00 -0.40 -0.53 -1.35 -1.64 0.00 0.00 178.16 174.24 1ae1 h PRO 143 N 0.07 0.00 -0.20 1.82 0.11 -1.83 -0.78 132.00 131.19 1ae1 h PRO 143 Ca 0.74 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.66 1ae1 h PRO 143 Cb 1.78 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.89 1ae1 h PRO 143 CO -0.78 0.53 -0.61 -0.07 -0.21 0.00 0.00 178.00 176.86 1ae1 h LEU 144 N 0.00 0.79 -0.06 2.35 3.38 -0.54 -1.18 115.31 120.05 1ae1 h LEU 144 Ca -0.01 -0.45 -0.03 0.00 0.09 0.00 0.00 57.88 57.48 1ae1 h LEU 144 Cb 1.18 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 1ae1 h LEU 144 CO 0.07 1.22 -0.08 -0.07 0.09 0.00 0.00 178.44 179.67 1ae1 h LEU 145 N 0.52 0.17 -0.91 1.67 3.38 -1.36 -1.31 115.31 117.47 1ae1 h LEU 145 Ca -0.01 -0.52 0.16 0.00 0.09 0.00 0.00 57.88 57.61 1ae1 h LEU 145 Cb 1.20 -0.05 -0.10 0.00 0.09 0.00 0.00 40.66 41.80 1ae1 h LEU 145 CO 0.12 0.66 0.51 0.50 0.09 0.00 0.00 178.44 180.32 1ae1 h LYS 146 N -0.30 0.67 -0.27 1.13 3.64 -1.19 -2.28 116.57 117.96 1ae1 h LYS 146 Ca 0.01 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.25 1ae1 h LYS 146 Cb 0.62 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1ae1 h LYS 146 CO 0.02 0.44 -0.25 0.00 -2.27 0.00 0.00 179.45 177.39 1ae1 h ALA 147 N 1.59 1.06 0.00 5.00 0.00 -1.03 -2.76 119.26 123.12 1ae1 h ALA 147 Ca 0.51 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1ae1 h ALA 147 Cb 0.74 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1ae1 h ALA 147 CO -0.37 0.57 -0.11 0.66 0.00 0.00 0.00 179.25 180.00 1ae1 h SER 148 N 0.46 0.00 -0.64 0.00 4.64 -0.68 -3.46 113.55 113.87 1ae1 h SER 148 Ca 0.07 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.11 1ae1 h SER 148 Cb 0.68 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.66 1ae1 h SER 148 CO 0.05 0.11 -0.25 0.00 -0.87 0.00 0.00 176.83 175.87 1ae1 n GLN 149 N -3.39 -1.63 -2.83 4.77 6.02 -1.04 -4.82 117.38 114.46 1ae1 n GLN 149 Ca -0.01 0.97 -0.08 0.00 -0.01 0.00 0.00 57.00 57.87 1ae1 n GLN 149 Cb 0.29 -5.39 0.01 0.00 1.02 0.00 0.00 30.24 26.18 1ae1 n GLN 149 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1ae1 n ASN 150 N -1.23 -2.89 -4.94 1.08 4.05 -1.26 -4.92 115.26 105.16 1ae1 n ASN 150 Ca -0.13 -2.99 -0.24 0.00 0.45 0.00 0.00 54.58 51.66 1ae1 n ASN 150 Cb 0.62 1.50 -0.01 0.00 1.23 0.00 0.00 39.78 43.11 1ae1 n ASN 150 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 1ae1 s GLY 151 N -0.13 1.40 -0.23 8.20 0.00 -0.51 -4.57 107.32 111.48 1ae1 s GLY 151 Ca 0.31 -0.89 -0.08 0.00 0.00 0.00 0.00 44.72 44.06 1ae1 s GLY 151 CO -0.13 -0.83 0.50 -1.31 0.00 0.00 0.00 173.10 171.34 1ae1 s ASN 152 N -3.91 -0.57 -0.04 1.64 0.01 0.16 -2.13 114.94 110.10 1ae1 s ASN 152 Ca 0.40 1.19 0.07 0.00 -0.71 0.00 0.00 52.86 53.81 1ae1 s ASN 152 Cb -0.10 1.64 -0.01 0.00 0.41 0.00 0.00 41.25 43.19 1ae1 s ASN 152 CO 0.35 -0.23 -0.24 0.54 -1.51 0.00 0.00 177.10 176.01 1ae1 s VAL 153 N 2.64 1.93 -0.09 1.60 0.11 -0.27 -0.01 120.40 126.31 1ae1 s VAL 153 Ca -0.04 -1.02 -0.00 0.00 -2.93 0.00 0.00 61.98 57.99 1ae1 s VAL 153 Cb -0.12 -1.62 0.02 0.00 -1.53 0.00 0.00 36.38 33.14 1ae1 s VAL 153 CO -0.15 0.54 -0.06 -0.63 -3.33 0.00 0.00 175.10 171.47 1ae1 s ILE 154 N -0.37 0.85 0.10 7.04 -1.09 0.10 -2.21 121.20 125.62 1ae1 s ILE 154 Ca 0.03 -0.19 -0.04 0.00 -2.23 0.00 0.00 60.65 58.22 1ae1 s ILE 154 Cb -0.11 -0.89 -0.05 0.00 -1.58 0.00 0.00 42.46 39.83 1ae1 s ILE 154 CO 0.01 0.33 0.31 -0.36 -1.23 0.00 0.00 174.94 174.00 1ae1 s PHE 155 N 1.62 3.51 -0.32 3.97 0.08 -0.64 -0.38 117.98 125.82 1ae1 s PHE 155 Ca 0.02 0.48 -0.18 0.00 0.12 0.00 0.00 56.93 57.37 1ae1 s PHE 155 Cb -0.13 -1.94 -0.01 0.00 -0.57 0.00 0.00 43.02 40.37 1ae1 s PHE 155 CO -0.06 0.51 0.52 -0.51 -0.10 0.00 0.00 175.22 175.58 1ae1 s LEU 156 N -2.45 4.25 0.00 -0.37 2.01 -1.12 -1.53 118.68 119.46 1ae1 s LEU 156 Ca 0.37 0.15 0.00 0.00 0.01 0.00 0.00 54.13 54.66 1ae1 s LEU 156 Cb -0.13 -2.62 0.00 0.00 0.01 0.00 0.00 46.19 43.46 1ae1 s LEU 156 CO 0.24 -0.43 0.00 -0.24 1.01 0.00 0.00 176.35 176.93 1ae1 n SER 157 N 5.70 0.00 -3.54 2.29 2.88 0.07 -4.96 113.62 116.06 1ae1 n SER 157 Ca -0.04 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.39 1ae1 n SER 157 Cb 0.49 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.91 1ae1 n SER 157 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1ae1 s SER 158 N -0.65 -0.39 0.56 -3.46 0.15 -1.26 -4.23 113.70 104.41 1ae1 s SER 158 Ca 0.00 0.24 0.26 0.00 0.70 0.00 0.00 55.95 57.16 1ae1 s SER 158 Cb 0.00 0.36 1.48 0.00 -1.71 0.00 0.00 66.02 66.14 1ae1 s SER 158 CO 0.00 -0.49 2.02 0.16 1.20 0.00 0.00 173.24 176.13 1ae1 h ILE 159 N 2.34 0.61 0.00 6.45 3.07 -1.69 -0.57 117.51 127.73 1ae1 h ILE 159 Ca -0.21 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.20 1ae1 h ILE 159 Cb 1.20 0.76 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 1ae1 h ILE 159 CO 0.32 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.42 1ae1 n ALA 160 N -2.50 1.75 -0.68 0.16 0.00 -1.26 -1.25 120.51 116.73 1ae1 n ALA 160 Ca 0.07 -0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.54 1ae1 n ALA 160 Cb 0.51 -1.29 0.36 0.00 0.00 0.00 0.00 19.45 19.03 1ae1 n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ae1 n GLY 161 N 0.19 2.82 0.77 0.00 0.00 -0.22 -4.39 105.19 104.35 1ae1 n GLY 161 Ca 0.04 -0.82 -0.03 0.00 0.00 0.00 0.00 46.02 45.21 1ae1 n GLY 161 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1ae1 n PHE 162 N 0.56 0.00 -3.94 1.61 7.35 -0.38 -4.73 117.46 117.94 1ae1 n PHE 162 Ca 0.25 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.85 1ae1 n PHE 162 Cb 1.09 -0.11 -0.05 0.00 0.35 0.00 0.00 39.48 40.76 1ae1 n PHE 162 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 1ae1 s SER 163 N -5.12 -0.11 0.13 -2.13 1.04 -1.11 -5.15 113.70 101.25 1ae1 s SER 163 Ca -0.04 -0.82 -0.30 0.00 0.48 0.00 0.00 55.95 55.27 1ae1 s SER 163 Cb 0.02 0.57 -0.07 0.00 0.10 0.00 0.00 66.02 66.63 1ae1 s SER 163 CO 0.05 -1.10 1.22 0.00 0.98 0.00 0.00 173.24 174.39 1ae1 s ALA 164 N -3.98 3.44 0.06 5.32 0.00 -1.26 -4.42 121.76 120.91 1ae1 s ALA 164 Ca 0.19 0.93 0.08 0.00 0.00 0.00 0.00 51.96 53.16 1ae1 s ALA 164 Cb -0.00 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 1ae1 s ALA 164 CO 0.05 -0.41 -0.22 -0.51 0.00 0.00 0.00 175.76 174.67 1ae1 s LEU 165 N 0.35 2.19 0.39 0.00 1.43 -1.26 -5.08 118.68 116.69 1ae1 s LEU 165 Ca 0.56 -0.57 -0.27 0.00 -1.03 0.00 0.00 54.13 52.82 1ae1 s LEU 165 Cb -0.32 -1.03 -0.11 0.00 0.03 0.00 0.00 46.19 44.76 1ae1 s LEU 165 CO 0.33 0.17 1.47 -0.81 0.23 0.00 0.00 176.35 177.74 1ae1 n PRO 166 N 1.69 2.58 -0.66 1.29 -0.04 -1.26 -3.49 135.00 135.10 1ae1 n PRO 166 Ca -0.17 0.91 0.00 0.00 -0.04 0.00 0.00 63.50 64.19 1ae1 n PRO 166 Cb 0.53 -2.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.34 1ae1 n PRO 166 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1ae1 n SER 167 N 0.34 0.00 -1.89 3.54 7.64 -1.26 -4.83 113.62 117.17 1ae1 n SER 167 Ca 0.02 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.86 1ae1 n SER 167 Cb 0.39 -0.04 0.07 0.00 -1.01 0.00 0.00 64.21 63.61 1ae1 n SER 167 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1ae1 n VAL 168 N -2.00 1.49 -0.03 0.44 0.24 -1.23 -0.96 118.33 116.29 1ae1 n VAL 168 Ca 0.00 -2.89 -0.09 0.00 -2.04 0.00 0.00 64.34 59.33 1ae1 n VAL 168 Cb 0.00 0.29 -0.03 0.00 -1.47 0.00 0.00 33.84 32.63 1ae1 n VAL 168 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1ae1 h SER 169 N 1.82 -0.13 -0.14 -1.34 4.64 -1.80 -0.24 113.55 116.35 1ae1 h SER 169 Ca 0.00 0.05 -0.06 0.00 -0.47 0.00 0.00 61.79 61.31 1ae1 h SER 169 Cb 1.43 0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.60 1ae1 h SER 169 CO 0.28 -0.04 -0.10 0.25 -0.87 0.00 0.00 176.83 176.35 1ae1 h LEU 170 N 0.02 0.45 -0.47 5.97 5.85 -1.92 -2.28 115.31 122.93 1ae1 h LEU 170 Ca 0.08 -0.11 -0.14 0.00 0.84 0.00 0.00 57.88 58.56 1ae1 h LEU 170 Cb 0.12 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1ae1 h LEU 170 CO -0.17 0.59 -0.26 0.22 -0.34 0.00 0.00 178.44 178.48 1ae1 h TYR 171 N 0.44 1.14 -0.81 1.25 3.20 -1.73 -2.74 116.97 117.72 1ae1 h TYR 171 Ca 0.09 -0.29 0.05 0.00 3.14 0.00 0.00 58.73 61.72 1ae1 h TYR 171 Cb 0.44 -0.26 -0.06 0.00 1.54 0.00 0.00 36.73 38.39 1ae1 h TYR 171 CO 0.01 1.12 0.50 0.77 -1.64 0.00 0.00 178.16 178.93 1ae1 h SER 172 N 0.84 0.79 -0.84 -2.11 0.02 -0.66 -1.37 113.55 110.21 1ae1 h SER 172 Ca 0.10 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1ae1 h SER 172 Cb 0.84 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 63.20 1ae1 h SER 172 CO 0.07 0.51 0.38 0.00 -1.14 0.00 0.00 176.83 176.66 1ae1 h ALA 173 N 1.38 1.09 0.00 3.77 0.00 -1.15 0.90 119.26 125.25 1ae1 h ALA 173 Ca 0.35 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1ae1 h ALA 173 Cb 0.14 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1ae1 h ALA 173 CO -0.16 0.67 -0.32 0.66 0.00 0.00 0.00 179.25 180.10 1ae1 h SER 174 N 1.20 0.00 0.89 0.00 4.64 -0.99 -1.20 113.55 118.09 1ae1 h SER 174 Ca 0.29 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.38 1ae1 h SER 174 Cb 0.15 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.22 1ae1 h SER 174 CO -0.03 0.32 -1.08 0.11 -0.87 0.00 0.00 176.83 175.28 1ae1 h LYS 175 N 0.00 0.07 -0.64 4.77 1.79 -0.70 -2.61 116.57 119.25 1ae1 h LYS 175 Ca -0.00 -0.13 -0.04 0.00 -2.18 0.00 0.00 60.65 58.30 1ae1 h LYS 175 Cb 0.61 0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.28 1ae1 h LYS 175 CO 0.04 1.05 0.24 0.78 -1.08 0.00 0.00 179.45 180.48 1ae1 h GLY 176 N 2.62 1.02 1.03 3.86 0.00 -0.17 -0.19 103.07 111.23 1ae1 h GLY 176 Ca -0.05 -0.54 -0.07 0.00 0.00 0.00 0.00 47.33 46.67 1ae1 h GLY 176 CO 0.15 0.51 0.10 0.00 0.00 0.00 0.00 176.54 177.30 1ae1 h ALA 177 N 1.34 0.79 0.05 3.60 0.00 -1.21 -2.57 119.26 121.26 1ae1 h ALA 177 Ca 0.22 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ae1 h ALA 177 Cb 0.20 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1ae1 h ALA 177 CO -0.02 0.53 -0.03 0.82 0.00 0.00 0.00 179.25 180.56 1ae1 h ILE 178 N 0.88 1.03 -0.72 0.00 1.08 -1.13 -0.82 117.51 117.83 1ae1 h ILE 178 Ca 0.18 -0.27 0.16 0.00 -0.39 0.00 0.00 64.86 64.54 1ae1 h ILE 178 Cb 0.41 1.21 -0.13 0.00 -3.07 0.00 0.00 36.82 35.24 1ae1 h ILE 178 CO 0.01 0.07 -0.04 0.78 -0.69 0.00 0.00 178.15 178.27 1ae1 h ASN 179 N -0.19 -0.42 -0.29 1.72 -0.26 -1.00 -0.64 115.58 114.51 1ae1 h ASN 179 Ca -0.01 0.19 -0.10 0.00 -0.56 0.00 0.00 56.30 55.83 1ae1 h ASN 179 Cb 0.17 0.36 -0.01 0.00 -1.06 0.00 0.00 38.32 37.78 1ae1 h ASN 179 CO 0.01 -0.19 -0.22 1.56 -1.06 0.00 0.00 177.43 177.54 1ae1 h GLN 180 N 0.07 0.65 -0.28 0.81 1.08 -1.12 -3.01 115.11 113.32 1ae1 h GLN 180 Ca 0.38 -0.32 -0.02 0.00 -1.45 0.00 0.00 58.65 57.24 1ae1 h GLN 180 Cb 0.64 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.06 1ae1 h GLN 180 CO -0.66 0.92 0.08 1.98 -0.95 0.00 0.00 178.83 180.19 1ae1 h MET 181 N 0.39 0.39 0.00 1.46 4.05 -0.59 -2.21 114.93 118.43 1ae1 h MET 181 Ca 0.05 -0.05 -0.05 0.00 -0.28 0.00 0.00 59.70 59.37 1ae1 h MET 181 Cb 0.77 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.48 1ae1 h MET 181 CO 0.06 0.36 -0.24 0.00 0.23 0.00 0.00 176.91 177.32 1ae1 h THR 182 N 0.39 0.80 -0.08 -0.77 1.03 -1.00 -0.70 112.91 112.58 1ae1 h THR 182 Ca 0.10 -0.95 -0.22 0.00 -0.01 0.00 0.00 66.41 65.32 1ae1 h THR 182 Cb 0.14 1.58 0.01 0.00 -1.07 0.00 0.00 68.15 68.81 1ae1 h THR 182 CO -0.01 0.23 -0.84 0.11 -0.01 0.00 0.00 175.52 175.01 1ae1 h LYS 183 N 0.00 0.62 0.04 0.00 1.57 -1.39 -2.43 116.57 114.98 1ae1 h LYS 183 Ca -0.00 -0.55 -0.00 0.00 -1.87 0.00 0.00 60.65 58.22 1ae1 h LYS 183 Cb 0.56 0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1ae1 h LYS 183 CO 0.03 1.17 -0.02 0.77 -0.57 0.00 0.00 179.45 180.83 1ae1 h SER 184 N 0.40 -0.05 -0.87 0.86 0.02 -1.12 -2.40 113.55 110.39 1ae1 h SER 184 Ca -0.06 -0.44 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1ae1 h SER 184 Cb 1.46 0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.97 1ae1 h SER 184 CO 0.16 0.43 0.55 -0.07 -1.14 0.00 0.00 176.83 176.76 1ae1 h LEU 185 N -0.54 1.03 -0.89 5.07 4.07 -1.27 -0.81 115.31 121.96 1ae1 h LEU 185 Ca -0.01 -0.05 0.01 0.00 0.08 0.00 0.00 57.88 57.92 1ae1 h LEU 185 Cb 0.49 -0.26 -0.05 0.00 1.08 0.00 0.00 40.66 41.93 1ae1 h LEU 185 CO 0.01 0.77 0.59 0.00 -1.08 0.00 0.00 178.44 178.73 1ae1 h ALA 186 N 1.30 1.14 0.00 1.53 0.00 -1.45 -0.28 119.26 121.51 1ae1 h ALA 186 Ca 0.32 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.98 1ae1 h ALA 186 Cb -0.09 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.34 1ae1 h ALA 186 CO -0.06 0.52 -0.86 0.00 0.00 0.00 0.00 179.25 178.84 1ae1 h GLU 188 N 0.09 0.39 -0.17 0.00 5.08 -0.82 -3.37 114.58 115.79 1ae1 h GLU 188 Ca -0.04 -0.67 0.00 0.00 -1.00 0.00 0.00 59.36 57.65 1ae1 h GLU 188 Cb 1.49 0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.99 1ae1 h GLU 188 CO 0.13 1.31 0.00 0.91 -1.00 0.00 0.00 179.01 180.36 1ae1 n TRP 189 N -3.60 0.20 0.15 4.33 8.01 -0.15 -4.32 117.44 122.06 1ae1 n TRP 189 Ca -0.14 -0.10 0.04 0.00 -1.31 0.00 0.00 57.50 55.99 1ae1 n TRP 189 Cb 1.07 0.00 0.44 0.00 -2.01 0.00 0.00 31.31 30.81 1ae1 n TRP 189 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1ae1 h ALA 190 N 4.63 1.62 0.00 6.99 0.00 -1.60 -0.53 119.26 130.36 1ae1 h ALA 190 Ca 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1ae1 h ALA 190 Cb 0.99 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1ae1 h ALA 190 CO 0.00 0.28 -0.11 1.57 0.00 0.00 0.00 179.25 180.99 1ae1 h LYS 191 N 0.17 0.00 -0.64 0.00 2.10 -1.86 -2.88 116.57 113.47 1ae1 h LYS 191 Ca 0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.69 1ae1 h LYS 191 Cb 0.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.62 1ae1 h LYS 191 CO 0.02 0.11 0.00 -0.25 -2.00 0.00 0.00 179.45 177.32 1ae1 n ASP 192 N -3.21 4.13 -3.85 7.07 8.00 -0.25 -4.93 116.55 123.51 1ae1 n ASP 192 Ca 0.01 -2.46 -0.30 0.00 0.71 0.00 0.00 54.79 52.75 1ae1 n ASP 192 Cb 0.41 -0.55 0.01 0.00 -0.02 0.00 0.00 41.12 40.96 1ae1 n ASP 192 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1ae1 n ASN 193 N 0.75 -2.66 -4.11 -2.24 4.13 -1.09 -4.67 115.26 105.38 1ae1 n ASN 193 Ca 0.21 -1.04 -0.28 0.00 1.68 0.00 0.00 54.58 55.15 1ae1 n ASN 193 Cb 0.81 -3.06 -0.17 0.00 -1.54 0.00 0.00 39.78 35.82 1ae1 n ASN 193 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1ae1 s ILE 194 N -3.72 1.58 -0.10 2.41 1.01 -0.97 -1.43 121.20 119.98 1ae1 s ILE 194 Ca 0.24 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 1ae1 s ILE 194 Cb -0.09 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 40.95 1ae1 s ILE 194 CO 0.89 0.45 -0.06 -0.13 0.00 0.00 0.00 174.94 176.09 1ae1 s ARG 195 N 0.59 3.10 -0.06 2.79 0.52 -0.91 -3.83 118.95 121.16 1ae1 s ARG 195 Ca -0.15 -0.54 0.01 0.00 -0.52 0.00 0.00 55.73 54.53 1ae1 s ARG 195 Cb -0.17 -2.70 0.02 0.00 0.52 0.00 0.00 34.95 32.62 1ae1 s ARG 195 CO 0.05 0.50 -0.06 0.54 0.02 0.00 0.00 175.30 176.35 1ae1 s VAL 196 N -0.35 0.69 0.04 3.52 0.11 -1.26 -1.11 120.40 122.04 1ae1 s VAL 196 Ca 0.05 -0.17 -0.01 0.00 -2.93 0.00 0.00 61.98 58.91 1ae1 s VAL 196 Cb -0.12 -0.71 -0.03 0.00 -1.53 0.00 0.00 36.38 33.99 1ae1 s VAL 196 CO 0.02 0.27 -0.01 0.20 -3.33 0.00 0.00 175.10 172.26 1ae1 s ASN 197 N 1.14 0.34 -0.03 3.54 0.01 -0.94 -0.01 114.94 118.99 1ae1 s ASN 197 Ca -0.07 -0.73 0.03 0.00 -0.71 0.00 0.00 52.86 51.38 1ae1 s ASN 197 Cb -0.14 0.17 -0.03 0.00 0.41 0.00 0.00 41.25 41.66 1ae1 s ASN 197 CO -0.01 -0.47 -0.10 -0.44 -1.51 0.00 0.00 177.10 174.56 1ae1 s SER 198 N -2.24 4.35 -0.19 -1.22 0.01 -0.20 -1.61 113.70 112.60 1ae1 s SER 198 Ca -0.04 -0.16 -0.04 0.00 1.31 0.00 0.00 55.95 57.03 1ae1 s SER 198 Cb -0.00 -0.98 -0.02 0.00 0.21 0.00 0.00 66.02 65.23 1ae1 s SER 198 CO -0.06 0.32 -0.03 -0.69 0.41 0.00 0.00 173.24 173.20 1ae1 s VAL 199 N -0.85 3.72 -0.56 3.43 1.01 -0.58 -1.31 120.40 125.25 1ae1 s VAL 199 Ca 0.14 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1ae1 s VAL 199 Cb -0.11 -2.67 0.14 0.00 0.00 0.00 0.00 36.38 33.75 1ae1 s VAL 199 CO 0.03 0.45 0.33 0.00 0.00 0.00 0.00 175.10 175.91 1ae1 s ALA 200 N 0.95 3.42 0.77 5.51 0.00 0.72 -0.75 121.76 132.37 1ae1 s ALA 200 Ca 0.00 -3.25 -0.11 0.00 0.00 0.00 0.00 51.96 48.61 1ae1 s ALA 200 Cb -0.14 -2.38 0.05 0.00 0.00 0.00 0.00 23.12 20.65 1ae1 s ALA 200 CO 0.01 -2.05 1.09 -2.14 0.00 0.00 0.00 175.76 172.67 1ae1 s PRO 201 N -0.16 2.31 0.00 0.00 0.02 -1.26 -1.54 135.00 134.37 1ae1 s PRO 201 Ca 0.17 1.09 0.00 0.00 0.02 0.00 0.00 61.00 62.28 1ae1 s PRO 201 Cb -0.23 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.38 1ae1 s PRO 201 CO -0.02 -1.58 0.00 0.41 -0.33 0.00 0.00 177.00 175.48 1ae1 n GLY 202 N -1.37 1.13 3.64 0.52 0.00 -0.65 -2.37 105.19 106.09 1ae1 n GLY 202 Ca 0.09 -1.73 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 1ae1 n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ae1 s VAL 203 N 1.29 3.31 -0.08 1.61 1.01 -1.26 -4.91 120.40 121.36 1ae1 s VAL 203 Ca 0.00 0.35 0.04 0.00 0.00 0.00 0.00 61.98 62.38 1ae1 s VAL 203 Cb 0.00 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 1ae1 s VAL 203 CO 0.00 -0.10 -0.22 -0.63 0.00 0.00 0.00 175.10 174.16 1ae1 s ILE 204 N 5.44 2.34 -0.30 2.22 -1.09 -1.26 -0.49 121.20 128.06 1ae1 s ILE 204 Ca 0.84 -0.95 -0.29 0.00 -2.23 0.00 0.00 60.65 58.02 1ae1 s ILE 204 Cb -0.34 -1.89 -0.02 0.00 -1.58 0.00 0.00 42.46 38.63 1ae1 s ILE 204 CO 0.35 0.56 1.70 -0.76 -1.23 0.00 0.00 174.94 175.56 1ae1 s LEU 205 N -0.01 3.63 0.00 2.97 1.43 -0.86 -4.93 118.68 120.91 1ae1 s LEU 205 Ca -0.07 1.35 0.00 0.00 -1.03 0.00 0.00 54.13 54.38 1ae1 s LEU 205 Cb -0.15 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.54 1ae1 s LEU 205 CO 0.05 -1.54 0.00 0.00 0.23 0.00 0.00 176.35 175.09 1ae1 n GLN 219 N 8.17 0.00 0.10 1.70 3.00 -1.26 -4.58 117.38 124.50 1ae1 n GLN 219 Ca 0.21 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 57.07 1ae1 n GLN 219 Cb 0.46 -1.62 -0.06 0.00 0.00 0.00 0.00 30.24 29.02 1ae1 n GLN 219 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 1ae1 h LYS 220 N 0.00 -0.51 -0.75 -1.09 3.11 -2.05 0.83 116.57 116.11 1ae1 h LYS 220 Ca 0.00 0.04 0.17 0.00 -2.81 0.00 0.00 60.65 58.05 1ae1 h LYS 220 Cb 0.00 0.12 -0.12 0.00 -1.00 0.00 0.00 32.23 31.22 1ae1 h LYS 220 CO 0.00 -0.34 0.10 1.49 -2.81 0.00 0.00 179.45 177.88 1ae1 h GLU 221 N -0.53 0.17 -0.15 1.90 4.81 -2.06 0.32 114.58 119.03 1ae1 h GLU 221 Ca 0.04 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1ae1 h GLU 221 Cb 0.58 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1ae1 h GLU 221 CO -0.22 0.11 -0.01 0.93 -0.73 0.00 0.00 179.01 179.09 1ae1 h GLU 222 N 0.17 0.28 -0.28 1.92 5.08 -1.92 -2.20 114.58 117.64 1ae1 h GLU 222 Ca 0.42 -0.09 -0.08 0.00 -1.00 0.00 0.00 59.36 58.61 1ae1 h GLU 222 Cb 0.76 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1ae1 h GLU 222 CO -0.60 0.52 -0.18 0.82 -1.00 0.00 0.00 179.01 178.57 1ae1 h ILE 223 N 0.01 1.24 -0.90 3.13 5.03 0.07 -1.94 117.51 124.15 1ae1 h ILE 223 Ca 0.04 -1.12 0.02 0.00 -0.12 0.00 0.00 64.86 63.68 1ae1 h ILE 223 Cb 0.40 1.23 -0.05 0.00 -3.03 0.00 0.00 36.82 35.37 1ae1 h ILE 223 CO 0.01 0.36 0.59 0.44 -0.68 0.00 0.00 178.15 178.87 1ae1 h ASP 224 N 0.45 1.00 -0.19 1.72 3.32 -0.20 -2.21 116.42 120.30 1ae1 h ASP 224 Ca 0.08 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.95 1ae1 h ASP 224 Cb 0.57 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 1ae1 h ASP 224 CO 0.04 0.70 -0.46 0.78 -1.72 0.00 0.00 179.24 178.58 1ae1 h ASN 225 N 1.17 0.81 0.50 6.45 2.35 -0.73 -2.76 115.58 123.37 1ae1 h ASN 225 Ca 0.34 -0.40 -0.07 0.00 -0.55 0.00 0.00 56.30 55.63 1ae1 h ASN 225 Cb -0.06 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.07 1ae1 h ASN 225 CO -0.09 1.15 -0.32 -0.26 -1.65 0.00 0.00 177.43 176.26 1ae1 h PHE 226 N 0.60 0.00 0.22 1.19 0.04 -0.86 -2.46 116.94 115.66 1ae1 h PHE 226 Ca 0.03 0.00 -0.32 0.00 2.80 0.00 0.00 57.97 60.48 1ae1 h PHE 226 Cb 1.03 0.00 0.03 0.00 2.20 0.00 0.00 35.95 39.21 1ae1 h PHE 226 CO 0.05 0.32 -1.41 0.82 -0.60 0.00 0.00 178.31 177.49 1ae1 h ILE 227 N 0.00 1.30 0.00 -0.55 2.04 -1.17 -2.15 117.51 116.98 1ae1 h ILE 227 Ca -0.00 -2.69 0.00 0.00 1.00 0.00 0.00 64.86 63.17 1ae1 h ILE 227 Cb 0.65 2.97 0.00 0.00 -0.74 0.00 0.00 36.82 39.70 1ae1 h ILE 227 CO 0.04 0.81 0.00 1.33 0.00 0.00 0.00 178.15 180.33 1ae1 n VAL 228 N -3.71 0.81 0.05 1.67 0.24 -1.06 -2.38 118.33 113.95 1ae1 n VAL 228 Ca -0.15 0.20 -0.07 0.00 -2.04 0.00 0.00 64.34 62.27 1ae1 n VAL 228 Cb 1.08 -1.12 -0.12 0.00 -1.47 0.00 0.00 33.84 32.20 1ae1 n VAL 228 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1ae1 h LYS 229 N 0.00 0.01 -5.99 7.34 6.56 -1.18 -3.44 116.57 119.87 1ae1 h LYS 229 Ca 0.00 -0.01 -0.58 0.00 -1.06 0.00 0.00 60.65 59.00 1ae1 h LYS 229 Cb 0.39 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 31.98 1ae1 h LYS 229 CO 0.00 0.93 0.70 0.95 -2.06 0.00 0.00 179.45 179.97 1ae1 s THR 230 N -2.69 4.72 0.41 -0.16 -4.23 -0.83 -4.67 115.64 108.19 1ae1 s THR 230 Ca 0.00 1.88 0.26 0.00 -1.18 0.00 0.00 61.69 62.65 1ae1 s THR 230 Cb 0.10 -4.25 0.44 0.00 1.34 0.00 0.00 72.50 70.12 1ae1 s THR 230 CO 0.82 -0.15 1.63 -0.65 -0.54 0.00 0.00 174.62 175.73 1ae1 h PRO 231 N 7.53 0.13 0.00 3.99 0.11 -1.80 0.68 132.00 142.65 1ae1 h PRO 231 Ca -0.20 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1ae1 h PRO 231 Cb 1.07 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1ae1 h PRO 231 CO 0.95 0.09 0.00 -1.33 -0.21 0.00 0.00 178.00 177.49 1ae1 n MET 232 N -4.82 0.16 -1.03 1.05 2.81 -0.98 -4.88 117.12 109.43 1ae1 n MET 232 Ca 0.36 0.34 -0.01 0.00 -1.81 0.00 0.00 57.70 56.58 1ae1 n MET 232 Cb 1.30 -1.78 -0.00 0.00 -0.71 0.00 0.00 33.22 32.03 1ae1 n MET 232 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ae1 n GLY 233 N 0.27 0.41 3.09 3.03 0.00 0.23 -4.97 105.19 107.26 1ae1 n GLY 233 Ca 0.03 -0.09 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 1ae1 n GLY 233 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ae1 s ARG 234 N -0.92 0.56 0.52 1.61 1.70 -1.26 -4.83 118.95 116.33 1ae1 s ARG 234 Ca 0.00 -0.87 -0.18 0.00 -0.47 0.00 0.00 55.73 54.21 1ae1 s ARG 234 Cb 0.00 0.21 -0.07 0.00 -0.57 0.00 0.00 34.95 34.52 1ae1 s ARG 234 CO 0.00 -0.13 1.01 0.00 -1.08 0.00 0.00 175.30 175.10 1ae1 s ALA 235 N -2.86 2.94 0.77 7.88 0.00 -1.26 -4.96 121.76 124.27 1ae1 s ALA 235 Ca -0.03 0.35 -0.11 0.00 0.00 0.00 0.00 51.96 52.17 1ae1 s ALA 235 Cb 0.00 -3.18 0.07 0.00 0.00 0.00 0.00 23.12 20.01 1ae1 s ALA 235 CO -0.06 -0.34 1.13 0.20 0.00 0.00 0.00 175.76 176.69 1ae1 s GLY 236 N -2.66 1.62 0.14 0.00 0.00 0.36 -4.87 107.32 101.90 1ae1 s GLY 236 Ca 0.62 -0.68 0.03 0.00 0.00 0.00 0.00 44.72 44.69 1ae1 s GLY 236 CO 0.28 -0.23 0.20 0.54 0.00 0.00 0.00 173.10 173.89 1ae1 s LYS 237 N -5.47 3.17 0.36 2.90 -0.14 -1.26 -2.03 119.74 117.28 1ae1 s LYS 237 Ca 0.61 -0.70 0.13 0.00 -1.36 0.00 0.00 55.97 54.64 1ae1 s LYS 237 Cb -0.11 -2.82 0.93 0.00 -1.68 0.00 0.00 37.83 34.15 1ae1 s LYS 237 CO 0.48 0.52 1.80 -1.35 -0.76 0.00 0.00 175.35 176.04 1ae1 h PRO 238 N 2.41 0.55 0.00 -1.68 0.11 -1.92 -1.70 132.00 129.77 1ae1 h PRO 238 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1ae1 h PRO 238 Cb 1.19 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1ae1 h PRO 238 CO 0.67 0.36 0.00 0.00 -0.21 0.00 0.00 178.00 178.82 1ae1 n GLN 239 N -4.65 0.22 0.15 1.05 0.00 -1.26 -1.89 117.38 111.00 1ae1 n GLN 239 Ca 0.23 0.02 0.13 0.00 0.00 0.00 0.00 57.00 57.38 1ae1 n GLN 239 Cb 0.68 -1.50 0.36 0.00 0.00 0.00 0.00 30.24 29.79 1ae1 n GLN 239 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1ae1 h GLU 240 N 0.00 0.00 0.07 2.61 5.08 -1.71 -2.46 114.58 118.17 1ae1 h GLU 240 Ca 0.00 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.00 1ae1 h GLU 240 Cb 0.36 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 1ae1 h GLU 240 CO 0.00 0.00 -2.06 0.28 -1.00 0.00 0.00 179.01 176.23 1ae1 n VAL 241 N -2.54 1.66 0.14 3.13 0.31 -0.79 -4.28 118.33 115.95 1ae1 n VAL 241 Ca 0.05 -0.53 -0.00 0.00 -0.01 0.00 0.00 64.34 63.85 1ae1 n VAL 241 Cb 0.43 -1.71 0.24 0.00 -0.91 0.00 0.00 33.84 31.89 1ae1 n VAL 241 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1ae1 h SER 242 N -0.18 0.06 -0.79 4.52 4.64 -1.52 -2.04 113.55 118.25 1ae1 h SER 242 Ca -0.47 -0.03 0.10 0.00 -0.47 0.00 0.00 61.79 60.92 1ae1 h SER 242 Cb 1.87 -0.02 -0.08 0.00 -0.31 0.00 0.00 62.40 63.86 1ae1 h SER 242 CO -0.04 0.55 0.42 0.00 -0.87 0.00 0.00 176.83 176.89 1ae1 h ALA 243 N 1.45 1.12 -0.03 5.18 0.00 -1.64 0.16 119.26 125.50 1ae1 h ALA 243 Ca -0.00 0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 1ae1 h ALA 243 Cb 0.90 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1ae1 h ALA 243 CO 0.07 0.00 -0.83 1.25 0.00 0.00 0.00 179.25 179.74 1ae1 h LEU 244 N 0.68 0.40 -0.66 0.00 5.85 -1.57 -2.54 115.31 117.48 1ae1 h LEU 244 Ca 0.39 -0.30 -0.13 0.00 0.84 0.00 0.00 57.88 58.69 1ae1 h LEU 244 Cb 0.43 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1ae1 h LEU 244 CO -0.28 1.07 -0.34 0.40 -0.34 0.00 0.00 178.44 178.95 1ae1 h ILE 245 N 0.20 1.29 -0.40 4.05 2.04 -0.89 -1.78 117.51 122.01 1ae1 h ILE 245 Ca -0.05 -1.48 -0.08 0.00 1.00 0.00 0.00 64.86 64.25 1ae1 h ILE 245 Cb 1.43 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.92 1ae1 h ILE 245 CO 0.14 0.48 -0.05 0.00 0.00 0.00 0.00 178.15 178.72 1ae1 h ALA 246 N 1.06 0.54 -0.40 1.87 0.00 -0.93 -2.92 119.26 118.49 1ae1 h ALA 246 Ca 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1ae1 h ALA 246 Cb 0.85 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1ae1 h ALA 246 CO 0.07 0.37 0.19 0.35 0.00 0.00 0.00 179.25 180.23 1ae1 h PHE 247 N 0.56 0.58 -0.04 0.00 3.57 -1.36 -2.29 116.94 117.96 1ae1 h PHE 247 Ca 0.11 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.59 1ae1 h PHE 247 Cb 0.55 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.11 1ae1 h PHE 247 CO 0.04 0.48 0.14 -0.07 -2.23 0.00 0.00 178.31 176.68 1ae1 h LEU 248 N 0.50 0.00 0.00 0.59 3.38 -1.28 -1.71 115.31 116.79 1ae1 h LEU 248 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1ae1 h LEU 248 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1ae1 h LEU 248 CO -0.02 0.00 -1.15 0.00 0.09 0.00 0.00 178.44 177.36 1ae1 n PHE 250 N -2.21 1.83 0.17 0.00 3.72 -0.64 -4.88 117.46 115.45 1ae1 n PHE 250 Ca 0.01 0.48 0.19 0.00 -0.05 0.00 0.00 57.45 58.07 1ae1 n PHE 250 Cb 0.49 -2.31 0.77 0.00 -0.94 0.00 0.00 39.48 37.49 1ae1 n PHE 250 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1ae1 h PRO 251 N 1.56 0.00 0.00 -1.08 0.11 -1.81 -0.78 132.00 130.00 1ae1 h PRO 251 Ca -0.48 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ae1 h PRO 251 Cb 1.31 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 1ae1 h PRO 251 CO 0.57 0.00 -0.02 0.00 -0.21 0.00 0.00 178.00 178.34 1ae1 h ALA 252 N 1.48 1.75 -0.67 -0.75 0.00 -1.57 -2.84 119.26 116.67 1ae1 h ALA 252 Ca 0.13 -0.02 -0.43 0.00 0.00 0.00 0.00 54.91 54.59 1ae1 h ALA 252 Cb 0.90 -0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.49 1ae1 h ALA 252 CO -0.00 0.03 0.55 0.00 0.00 0.00 0.00 179.25 179.83 1ae1 n ALA 253 N -2.44 5.31 0.25 0.00 0.00 -0.30 -4.70 120.51 118.63 1ae1 n ALA 253 Ca -0.03 -2.24 0.14 0.00 0.00 0.00 0.00 53.44 51.31 1ae1 n ALA 253 Cb 0.11 -1.46 0.55 0.00 0.00 0.00 0.00 19.45 18.64 1ae1 n ALA 253 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ae1 h SER 254 N 1.39 0.00 -0.52 0.00 4.64 -1.69 -2.59 113.55 114.79 1ae1 h SER 254 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1ae1 h SER 254 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1ae1 h SER 254 CO 0.99 0.09 0.00 0.00 -0.87 0.00 0.00 176.83 177.04 1ae1 n TYR 255 N -3.22 0.79 -3.57 4.77 9.36 -1.26 -4.88 117.16 119.16 1ae1 n TYR 255 Ca 0.01 -0.53 -0.41 0.00 3.32 0.00 0.00 57.90 60.29 1ae1 n TYR 255 Cb 0.37 -0.05 -0.09 0.00 -0.63 0.00 0.00 39.34 38.95 1ae1 n TYR 255 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1ae1 s ILE 256 N -1.17 4.17 0.02 2.97 1.01 -0.98 -5.05 121.20 122.17 1ae1 s ILE 256 Ca 0.37 -1.87 0.00 0.00 0.00 0.00 0.00 60.65 59.15 1ae1 s ILE 256 Cb 0.20 -3.75 -0.02 0.00 0.01 0.00 0.00 42.46 38.91 1ae1 s ILE 256 CO 0.23 -0.78 -0.03 0.28 0.00 0.00 0.00 174.94 174.63 1ae1 s THR 257 N 1.26 0.17 0.00 2.92 -1.32 -1.26 -4.76 115.64 112.64 1ae1 s THR 257 Ca 0.07 -0.82 0.00 0.00 -1.21 0.00 0.00 61.69 59.73 1ae1 s THR 257 Cb -0.25 -0.28 0.00 0.00 -1.51 0.00 0.00 72.50 70.45 1ae1 s THR 257 CO -0.01 -0.42 0.00 0.61 -2.21 0.00 0.00 174.62 172.59 1ae1 n GLY 258 N 1.77 0.48 3.92 6.08 0.00 0.99 -4.97 105.19 113.46 1ae1 n GLY 258 Ca -0.22 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 44.86 1ae1 n GLY 258 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ae1 s GLN 259 N -1.23 3.56 -0.17 1.61 -1.52 -1.25 -4.65 119.66 116.01 1ae1 s GLN 259 Ca 0.00 -0.21 0.01 0.00 -1.95 0.00 0.00 55.36 53.20 1ae1 s GLN 259 Cb 0.00 -2.76 0.03 0.00 -0.22 0.00 0.00 33.01 30.06 1ae1 s GLN 259 CO 0.00 0.32 -0.13 0.42 -0.25 0.00 0.00 175.29 175.65 1ae1 s ILE 260 N -1.97 1.60 -0.19 1.08 1.09 -1.26 -1.04 121.20 120.52 1ae1 s ILE 260 Ca 0.40 -0.77 -0.01 0.00 -1.10 0.00 0.00 60.65 59.18 1ae1 s ILE 260 Cb -0.11 -1.57 0.01 0.00 -1.06 0.00 0.00 42.46 39.74 1ae1 s ILE 260 CO 0.30 0.36 -0.15 -0.63 -0.10 0.00 0.00 174.94 174.72 1ae1 s ILE 261 N 1.45 2.54 -0.12 2.92 1.01 -0.43 -4.98 121.20 123.60 1ae1 s ILE 261 Ca 0.03 -0.78 -0.27 0.00 0.00 0.00 0.00 60.65 59.63 1ae1 s ILE 261 Cb -0.14 -2.10 -0.02 0.00 0.01 0.00 0.00 42.46 40.21 1ae1 s ILE 261 CO -0.10 0.50 0.89 0.26 0.00 0.00 0.00 174.94 176.49 1ae1 s TRP 262 N 1.27 3.49 -0.79 3.97 0.51 -1.26 -0.20 118.94 125.93 1ae1 s TRP 262 Ca 0.04 1.40 -0.07 0.00 -2.12 0.00 0.00 56.10 55.35 1ae1 s TRP 262 Cb -0.14 -3.06 0.20 0.00 -0.81 0.00 0.00 33.47 29.67 1ae1 s TRP 262 CO -0.08 -0.18 0.68 0.00 -0.51 0.00 0.00 176.95 176.86 1ae1 s ALA 263 N 1.86 3.99 -0.00 0.98 0.00 -0.59 -4.88 121.76 123.12 1ae1 s ALA 263 Ca 0.43 -3.45 0.01 0.00 0.00 0.00 0.00 51.96 48.94 1ae1 s ALA 263 Cb -0.18 -3.09 0.01 0.00 0.00 0.00 0.00 23.12 19.86 1ae1 s ALA 263 CO 0.16 -2.19 0.69 -0.40 0.00 0.00 0.00 175.76 174.02 1ae1 n ASP 264 N 3.38 0.24 -1.39 0.00 5.68 -1.26 -1.64 116.55 121.55 1ae1 n ASP 264 Ca 0.14 -1.41 -0.18 0.00 -0.50 0.00 0.00 54.79 52.83 1ae1 n ASP 264 Cb 0.41 -0.07 -0.08 0.00 -1.14 0.00 0.00 41.12 40.25 1ae1 n ASP 264 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ae1 n GLY 265 N -0.09 1.74 0.00 6.12 0.00 -1.26 -1.81 105.19 109.90 1ae1 n GLY 265 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1ae1 n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ae1 n GLY 266 N -0.34 0.45 0.38 -0.02 0.00 -1.26 -2.32 105.19 102.08 1ae1 n GLY 266 Ca -0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.76 1ae1 n GLY 266 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1ae1 h PHE 267 N 0.00 -1.16 0.00 1.61 3.04 -1.63 -1.27 116.94 117.54 1ae1 h PHE 267 Ca 0.00 0.07 -0.02 0.00 3.98 0.00 0.00 57.97 62.00 1ae1 h PHE 267 Cb 0.00 0.58 -0.00 0.00 2.56 0.00 0.00 35.95 39.08 1ae1 h PHE 267 CO 0.00 -0.42 -0.11 1.79 -2.02 0.00 0.00 178.31 177.56 1ae1 h THR 268 N -0.25 0.28 0.00 4.41 1.35 -1.93 -2.05 112.91 114.72 1ae1 h THR 268 Ca 0.18 -0.79 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 1ae1 h THR 268 Cb 0.57 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 1ae1 h THR 268 CO -0.63 0.11 0.00 0.00 -0.25 0.00 0.00 175.52 174.74 1ae1 h ALA 269 N 1.89 1.00 -2.52 6.62 0.00 -1.65 -3.44 119.26 121.17 1ae1 h ALA 269 Ca -0.00 0.00 -0.71 0.00 0.00 0.00 0.00 54.91 54.20 1ae1 h ALA 269 Cb 0.61 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.20 1ae1 h ALA 269 CO 0.01 0.00 -0.40 1.21 0.00 0.00 0.00 179.25 180.08 1ae1 s ASN 270 N -4.67 6.12 -0.07 0.00 3.04 -0.77 -4.94 114.94 113.64 1ae1 s ASN 270 Ca 0.07 -0.77 -0.08 0.00 0.04 0.00 0.00 52.86 52.12 1ae1 s ASN 270 Cb 0.10 -2.17 -0.29 0.00 -1.54 0.00 0.00 41.25 37.36 1ae1 s ASN 270 CO 0.53 -0.43 0.58 1.23 -3.04 0.00 0.00 177.10 175.96 1ae1 h GLY 271 N 8.68 0.38 0.00 1.21 0.00 -1.86 -3.44 103.07 108.03 1ae1 h GLY 271 Ca -0.28 -0.96 0.00 0.00 0.00 0.00 0.00 47.33 46.09 1ae1 h GLY 271 CO 0.72 0.84 0.00 0.61 0.00 0.00 0.00 176.54 178.72 1ae1 n GLY 272 N 1.88 -1.22 0.00 4.60 0.00 -1.26 -5.24 105.19 103.95 1ae1 n GLY 272 Ca -0.26 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.91 1ae1 n GLY 272 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01