#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1og0 s ALA 19 N 0.00 3.37 -0.84 4.61 0.00 -1.26 -4.99 121.76 122.65 1og0 s ALA 19 Ca 0.00 0.66 -0.20 0.00 0.00 0.00 0.00 51.96 52.41 1og0 s ALA 19 Cb 0.00 -3.44 0.10 0.00 0.00 0.00 0.00 23.12 19.78 1og0 s ALA 19 CO 0.00 -0.50 1.09 -2.00 0.00 0.00 0.00 175.76 174.35 1og0 s GLU 20 N 1.50 3.43 0.13 0.00 2.12 -1.26 -4.99 118.70 119.63 1og0 s GLU 20 Ca 0.55 -1.40 0.07 0.00 0.36 0.00 0.00 54.97 54.55 1og0 s GLU 20 Cb -0.25 -4.72 -0.04 0.00 0.26 0.00 0.00 34.13 29.39 1og0 s GLU 20 CO 0.25 -1.82 -0.17 -2.00 -0.54 0.00 0.00 175.26 170.98 1og0 s GLU 21 N 3.31 1.13 -1.41 4.30 2.12 -1.26 -4.85 118.70 122.04 1og0 s GLU 21 Ca 0.30 -1.26 -0.10 0.00 0.36 0.00 0.00 54.97 54.27 1og0 s GLU 21 Cb -0.09 -1.19 0.03 0.00 0.26 0.00 0.00 34.13 33.14 1og0 s GLU 21 CO -0.03 0.25 1.09 -0.25 -0.54 0.00 0.00 175.26 175.78 1og0 n ASP 22 N 0.63 -6.04 0.21 -1.70 9.92 -1.26 -4.91 116.55 113.40 1og0 n ASP 22 Ca -0.16 -0.56 0.10 0.00 -0.53 0.00 0.00 54.79 53.63 1og0 n ASP 22 Cb 0.56 -4.77 0.23 0.00 -0.64 0.00 0.00 41.12 36.49 1og0 n ASP 22 CO 0.00 0.00 0.00 -0.37 0.13 0.00 0.00 177.20 176.96 1og0 h VAL 23 N -2.45 0.29 -0.40 2.53 -1.51 -2.01 -3.10 116.25 109.60 1og0 h VAL 23 Ca -0.57 -1.28 0.00 0.00 -1.23 0.00 0.00 66.70 63.63 1og0 h VAL 23 Cb 1.37 2.03 0.00 0.00 -2.13 0.00 0.00 31.29 32.56 1og0 h VAL 23 CO 0.58 0.15 0.00 0.54 -1.23 0.00 0.00 177.57 177.62 1og0 n ARG 24 N -3.16 2.91 -3.53 5.19 1.74 -1.26 -4.87 116.66 113.68 1og0 n ARG 24 Ca 0.03 -2.25 -0.42 0.00 -0.77 0.00 0.00 57.85 54.44 1og0 n ARG 24 Cb 0.55 -1.40 -0.09 0.00 -1.02 0.00 0.00 32.46 30.50 1og0 n ARG 24 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1og0 s ILE 25 N -1.25 4.56 0.34 0.55 -1.09 -1.17 -4.95 121.20 118.18 1og0 s ILE 25 Ca 0.30 -1.33 0.38 0.00 -2.23 0.00 0.00 60.65 57.77 1og0 s ILE 25 Cb 0.17 -3.78 0.41 0.00 -1.58 0.00 0.00 42.46 37.68 1og0 s ILE 25 CO 0.17 -0.56 2.14 -0.07 -1.23 0.00 0.00 174.94 175.40 1og0 h LEU 26 N 8.53 0.00 0.00 2.97 3.38 -1.89 -3.48 115.31 124.82 1og0 h LEU 26 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1og0 h LEU 26 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1og0 h LEU 26 CO 0.81 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.95 1og0 n GLY 27 N -0.43 3.84 3.84 0.83 0.00 -1.26 -5.14 105.19 106.87 1og0 n GLY 27 Ca -0.01 -1.12 -0.23 0.00 0.00 0.00 0.00 46.02 44.65 1og0 n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1og0 s TYR 28 N -2.00 3.19 0.02 1.61 1.51 -1.26 -5.13 117.35 115.29 1og0 s TYR 28 Ca 0.00 -0.06 0.04 0.00 -1.01 0.00 0.00 57.07 56.04 1og0 s TYR 28 Cb 0.00 -1.47 -0.02 0.00 -0.11 0.00 0.00 41.96 40.36 1og0 s TYR 28 CO 0.00 0.51 -0.12 -0.51 -1.11 0.00 0.00 175.55 174.32 1og0 s ASP 29 N -3.58 1.44 0.36 2.29 1.01 -1.26 -5.11 116.67 111.81 1og0 s ASP 29 Ca 0.32 -0.36 -0.28 0.00 0.71 0.00 0.00 52.55 52.94 1og0 s ASP 29 Cb -0.09 -0.11 -0.11 0.00 1.01 0.00 0.00 42.92 43.62 1og0 s ASP 29 CO 0.25 0.05 1.52 -0.81 0.21 0.00 0.00 175.17 176.39 1og0 n PRO 30 N 2.21 2.70 -4.10 8.23 -0.04 -1.26 -5.00 135.00 137.74 1og0 n PRO 30 Ca -0.17 0.95 -0.26 0.00 -0.04 0.00 0.00 63.50 63.98 1og0 n PRO 30 Cb 0.55 -2.70 -0.17 0.00 -0.04 0.00 0.00 33.50 31.15 1og0 n PRO 30 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1og0 s LEU 31 N -1.73 1.34 0.29 1.53 2.96 -1.26 -4.92 118.68 116.88 1og0 s LEU 31 Ca 0.55 -0.31 -0.30 0.00 -0.22 0.00 0.00 54.13 53.86 1og0 s LEU 31 Cb -0.48 -0.84 -0.12 0.00 0.50 0.00 0.00 46.19 45.25 1og0 s LEU 31 CO 0.61 -0.07 1.50 0.00 -1.32 0.00 0.00 176.35 177.06 1og0 n ALA 32 N 4.60 2.01 -1.43 5.97 0.00 -1.26 -4.95 120.51 125.44 1og0 n ALA 32 Ca -0.16 0.38 -0.30 0.00 0.00 0.00 0.00 53.44 53.36 1og0 n ALA 32 Cb 0.50 -2.38 0.10 0.00 0.00 0.00 0.00 19.45 17.67 1og0 n ALA 32 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1og0 s SER 33 N 0.28 4.30 0.11 0.00 1.04 -1.26 -4.81 113.70 113.36 1og0 s SER 33 Ca 0.63 1.44 -0.24 0.00 0.48 0.00 0.00 55.95 58.26 1og0 s SER 33 Cb -0.54 -2.17 -0.10 0.00 0.10 0.00 0.00 66.02 63.31 1og0 s SER 33 CO 0.52 -2.11 1.70 -0.65 0.98 0.00 0.00 173.24 173.68 1og0 h PRO 34 N -1.18 -0.16 -0.70 4.02 0.11 -1.79 -0.47 132.00 131.83 1og0 h PRO 34 Ca -0.47 0.01 0.14 0.00 0.11 0.00 0.00 66.00 65.79 1og0 h PRO 34 Cb 1.26 0.04 -0.09 0.00 0.11 0.00 0.00 31.00 32.32 1og0 h PRO 34 CO 0.57 -0.11 0.22 0.00 -0.21 0.00 0.00 178.00 178.47 1og0 h ALA 35 N 0.80 0.92 -0.17 -0.75 0.00 -0.71 0.32 119.26 119.68 1og0 h ALA 35 Ca 0.03 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1og0 h ALA 35 Cb 0.21 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1og0 h ALA 35 CO -0.09 -0.27 0.07 1.25 0.00 0.00 0.00 179.25 180.22 1og0 h LEU 36 N 0.35 0.22 -0.82 0.00 5.85 -1.67 -2.66 115.31 116.58 1og0 h LEU 36 Ca 0.38 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 1og0 h LEU 36 Cb 0.59 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1og0 h LEU 36 CO -0.42 0.30 0.44 0.25 -0.34 0.00 0.00 178.44 178.67 1og0 h LEU 37 N 0.13 1.02 -1.73 2.25 7.12 0.02 -1.36 115.31 122.77 1og0 h LEU 37 Ca 0.06 -0.10 0.00 0.00 0.13 0.00 0.00 57.88 57.96 1og0 h LEU 37 Cb 0.14 -0.26 0.00 0.00 -0.53 0.00 0.00 40.66 40.01 1og0 h LEU 37 CO -0.01 0.83 0.00 1.56 -0.13 0.00 0.00 178.44 180.70 1og0 h GLN 38 N 1.14 0.00 0.07 1.25 4.20 -0.20 0.16 115.11 121.72 1og0 h GLN 38 Ca 0.29 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.67 1og0 h GLN 38 Cb 0.04 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 1og0 h GLN 38 CO -0.05 0.00 -1.83 0.28 -0.67 0.00 0.00 178.83 176.57 1og0 n VAL 39 N -2.69 1.66 -0.03 -0.54 0.31 -0.82 -3.44 118.33 112.78 1og0 n VAL 39 Ca -0.01 -0.42 -0.09 0.00 -0.01 0.00 0.00 64.34 63.81 1og0 n VAL 39 Cb 0.15 -1.82 -0.03 0.00 -0.91 0.00 0.00 33.84 31.23 1og0 n VAL 39 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1og0 h GLN 40 N -0.36 0.10 -3.19 5.55 4.20 -0.75 -3.27 115.11 117.38 1og0 h GLN 40 Ca -0.43 -0.01 -0.65 0.00 0.06 0.00 0.00 58.65 57.62 1og0 h GLN 40 Cb 1.75 -0.02 -0.40 0.00 0.30 0.00 0.00 27.48 29.12 1og0 h GLN 40 CO -0.06 0.07 -0.41 0.42 -0.67 0.00 0.00 178.83 178.17 1og0 s ILE 41 N -6.19 3.39 0.62 2.54 1.01 -0.00 -5.09 121.20 117.47 1og0 s ILE 41 Ca -0.13 -4.06 -0.16 0.00 0.00 0.00 0.00 60.65 56.30 1og0 s ILE 41 Cb 0.09 -3.18 -0.02 0.00 0.01 0.00 0.00 42.46 39.36 1og0 s ILE 41 CO 0.68 -1.02 1.10 -2.16 0.00 0.00 0.00 174.94 173.55 1og0 s PRO 42 N -1.32 3.04 -0.19 2.79 0.04 -1.22 -4.62 135.00 133.52 1og0 s PRO 42 Ca 0.25 1.41 -0.17 0.00 0.04 0.00 0.00 61.00 62.53 1og0 s PRO 42 Cb -0.07 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 1og0 s PRO 42 CO -0.14 -1.06 0.47 0.00 0.04 0.00 0.00 177.00 176.31 1og0 s ALA 43 N -2.21 3.54 0.76 8.56 0.00 -1.26 -5.02 121.76 126.13 1og0 s ALA 43 Ca 0.68 -0.44 -0.12 0.00 0.00 0.00 0.00 51.96 52.08 1og0 s ALA 43 Cb -0.20 -2.73 0.06 0.00 0.00 0.00 0.00 23.12 20.25 1og0 s ALA 43 CO 0.37 -0.35 1.12 0.95 0.00 0.00 0.00 175.76 177.85 1og0 s THR 44 N 1.43 2.91 0.41 0.00 -4.23 -1.26 -4.79 115.64 110.12 1og0 s THR 44 Ca 0.22 0.35 0.13 0.00 -1.18 0.00 0.00 61.69 61.21 1og0 s THR 44 Cb -0.15 -2.77 0.33 0.00 1.34 0.00 0.00 72.50 71.25 1og0 s THR 44 CO 0.09 -0.33 1.95 -0.65 -0.54 0.00 0.00 174.62 175.14 1og0 h PRO 45 N -0.83 0.48 0.08 3.99 0.11 -1.99 -1.21 132.00 132.62 1og0 h PRO 45 Ca -0.45 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1og0 h PRO 45 Cb 1.25 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1og0 h PRO 45 CO 0.50 0.31 -0.04 1.15 -0.21 0.00 0.00 178.00 179.72 1og0 h THR 46 N 0.49 1.07 -0.52 -1.15 2.02 -1.91 -0.98 112.91 111.93 1og0 h THR 46 Ca 0.32 -0.51 0.10 0.00 0.77 0.00 0.00 66.41 67.09 1og0 h THR 46 Cb 0.59 1.40 -0.09 0.00 -1.74 0.00 0.00 68.15 68.31 1og0 h THR 46 CO -0.10 0.13 0.00 0.28 0.37 0.00 0.00 175.52 176.20 1og0 h SER 47 N -0.34 -0.22 0.28 4.18 0.02 -1.36 0.49 113.55 116.60 1og0 h SER 47 Ca -0.01 0.13 -0.07 0.00 -0.84 0.00 0.00 61.79 61.00 1og0 h SER 47 Cb 0.29 0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1og0 h SER 47 CO 0.02 -0.08 -0.31 -0.07 -1.14 0.00 0.00 176.83 175.25 1og0 h LEU 48 N 0.12 0.05 0.04 5.07 3.38 -1.21 -1.94 115.31 120.82 1og0 h LEU 48 Ca 0.26 -0.01 -0.21 0.00 0.09 0.00 0.00 57.88 58.01 1og0 h LEU 48 Cb 0.40 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 41.16 1og0 h LEU 48 CO -0.44 0.36 -0.85 -0.08 0.09 0.00 0.00 178.44 177.52 1og0 h GLU 49 N 0.05 0.50 -0.58 1.13 4.57 0.33 -2.92 114.58 117.65 1og0 h GLU 49 Ca 0.00 -0.59 0.07 0.00 -1.18 0.00 0.00 59.36 57.66 1og0 h GLU 49 Cb 0.57 0.18 -0.06 0.00 -0.16 0.00 0.00 28.75 29.28 1og0 h GLU 49 CO 0.04 1.22 0.27 1.15 -1.18 0.00 0.00 179.01 180.52 1og0 h THR 50 N 0.04 0.89 -0.64 0.32 2.02 0.08 -0.89 112.91 114.73 1og0 h THR 50 Ca -0.12 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 1og0 h THR 50 Cb 1.55 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 68.27 1og0 h THR 50 CO 0.16 0.09 0.38 0.00 0.37 0.00 0.00 175.52 176.53 1og0 h ALA 51 N 1.35 0.82 -0.55 6.16 0.00 -1.39 -1.31 119.26 124.33 1og0 h ALA 51 Ca 0.27 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1og0 h ALA 51 Cb 0.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1og0 h ALA 51 CO -0.22 0.30 -0.03 0.87 0.00 0.00 0.00 179.25 180.17 1og0 h LYS 52 N 0.87 0.98 -0.05 0.00 1.57 -1.22 -2.67 116.57 116.04 1og0 h LYS 52 Ca 0.23 -0.33 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1og0 h LYS 52 Cb -0.01 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1og0 h LYS 52 CO -0.04 1.00 0.03 -0.09 -0.57 0.00 0.00 179.45 179.78 1og0 h ARG 53 N 0.86 0.08 -0.81 3.15 2.43 -0.90 -1.99 114.38 117.20 1og0 h ARG 53 Ca 0.15 -0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.44 1og0 h ARG 53 Cb 0.57 -0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 30.02 1og0 h ARG 53 CO 0.03 0.14 0.42 0.78 -1.51 0.00 0.00 179.97 179.83 1og0 h GLY 54 N -0.00 1.29 1.00 2.80 0.00 -1.16 -0.55 103.07 106.44 1og0 h GLY 54 Ca 0.02 -0.25 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 1og0 h GLY 54 CO -0.00 0.01 0.07 3.21 0.00 0.00 0.00 176.54 179.82 1og0 h ARG 55 N 0.64 0.87 0.19 4.80 3.08 -1.23 -0.83 114.38 121.90 1og0 h ARG 55 Ca 0.43 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 1og0 h ARG 55 Cb 0.54 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1og0 h ARG 55 CO -0.33 0.86 -0.09 0.00 -1.07 0.00 0.00 179.97 179.35 1og0 h ARG 56 N 0.75 -0.25 -0.41 0.04 3.08 -0.49 0.81 114.38 117.92 1og0 h ARG 56 Ca 0.15 0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.23 1og0 h ARG 56 Cb 0.43 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 1og0 h ARG 56 CO 0.01 -0.13 0.26 0.93 -1.07 0.00 0.00 179.97 179.97 1og0 h GLU 57 N -0.29 0.51 -0.52 0.04 5.08 -1.11 -0.72 114.58 117.57 1og0 h GLU 57 Ca -0.03 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1og0 h GLU 57 Cb 0.23 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1og0 h GLU 57 CO 0.04 0.34 0.33 0.00 -1.00 0.00 0.00 179.01 178.72 1og0 h ALA 58 N 1.16 0.66 -0.31 3.43 0.00 -1.01 -1.56 119.26 121.63 1og0 h ALA 58 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1og0 h ALA 58 Cb -0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1og0 h ALA 58 CO -0.05 0.06 0.20 0.82 0.00 0.00 0.00 179.25 180.28 1og0 h ILE 59 N 0.66 1.07 -0.73 0.00 2.04 -0.40 -1.56 117.51 118.59 1og0 h ILE 59 Ca 0.20 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 1og0 h ILE 59 Cb -0.03 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1og0 h ILE 59 CO -0.07 0.08 0.41 0.44 0.00 0.00 0.00 178.15 179.01 1og0 h ASP 60 N 0.42 0.91 -0.13 1.72 3.32 -0.86 -2.17 116.42 119.62 1og0 h ASP 60 Ca 0.12 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1og0 h ASP 60 Cb -0.04 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.27 1og0 h ASP 60 CO -0.03 0.73 -0.01 0.40 -1.72 0.00 0.00 179.24 178.61 1og0 h ILE 61 N 1.01 1.27 0.00 0.35 2.04 -1.07 0.07 117.51 121.18 1og0 h ILE 61 Ca 0.26 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 65.22 1og0 h ILE 61 Cb 0.02 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 1og0 h ILE 61 CO -0.04 0.26 0.00 2.30 0.00 0.00 0.00 178.15 180.67 1og0 n ILE 62 N -4.75 0.71 0.97 -0.67 -5.35 -0.61 -2.79 119.36 106.88 1og0 n ILE 62 Ca -0.06 0.06 0.12 0.00 -0.27 0.00 0.00 62.75 62.60 1og0 n ILE 62 Cb 0.23 -0.92 0.08 0.00 -1.74 0.00 0.00 39.64 37.29 1og0 n ILE 62 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1og0 n THR 63 N -2.10 0.00 -0.02 7.28 -2.24 -0.82 -1.01 114.28 115.36 1og0 n THR 63 Ca 0.04 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1og0 n THR 63 Cb 0.29 1.45 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 1og0 n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1og0 n GLY 64 N 1.33 0.58 0.20 3.38 0.00 -1.05 -4.95 105.19 104.68 1og0 n GLY 64 Ca 0.13 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.29 1og0 n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1og0 h LYS 65 N 3.73 0.00 -4.64 1.61 1.57 -1.25 -3.43 116.57 114.16 1og0 h LYS 65 Ca 0.00 0.00 -0.43 0.00 -1.87 0.00 0.00 60.65 58.35 1og0 h LYS 65 Cb 0.00 0.00 -0.31 0.00 0.08 0.00 0.00 32.23 32.00 1og0 h LYS 65 CO 0.00 0.00 -0.79 0.34 -0.57 0.00 0.00 179.45 178.43 1og0 s ASP 66 N -4.99 1.25 0.00 0.86 2.15 -0.87 -4.94 116.67 110.14 1og0 s ASP 66 Ca 0.03 -0.19 0.17 0.00 0.43 0.00 0.00 52.55 52.99 1og0 s ASP 66 Cb 0.09 -0.32 0.74 0.00 -0.30 0.00 0.00 42.92 43.12 1og0 s ASP 66 CO 0.48 0.07 1.51 -0.90 -0.17 0.00 0.00 175.17 176.17 1og0 n ASP 67 N 3.26 0.96 -4.83 -0.34 5.68 -1.26 -4.51 116.55 115.50 1og0 n ASP 67 Ca -0.18 -1.68 -0.29 0.00 -0.50 0.00 0.00 54.79 52.14 1og0 n ASP 67 Cb 0.54 -0.08 0.11 0.00 -1.14 0.00 0.00 41.12 40.55 1og0 n ASP 67 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1og0 s ARG 68 N -1.85 1.69 -0.18 0.11 0.52 -1.26 -4.98 118.95 113.00 1og0 s ARG 68 Ca 0.26 0.13 -0.04 0.00 -0.52 0.00 0.00 55.73 55.57 1og0 s ARG 68 Cb 0.13 -1.92 -0.02 0.00 0.52 0.00 0.00 34.95 33.67 1og0 s ARG 68 CO 0.21 -1.79 -0.04 0.08 0.02 0.00 0.00 175.30 173.78 1og0 s VAL 69 N -3.52 3.72 -0.05 3.52 1.01 -0.84 -4.91 120.40 119.34 1og0 s VAL 69 Ca 0.63 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 1og0 s VAL 69 Cb -0.12 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 1og0 s VAL 69 CO 0.50 0.46 1.29 -0.22 0.00 0.00 0.00 175.10 177.13 1og0 s LEU 70 N 0.75 4.28 -0.20 3.92 2.96 -0.41 -2.33 118.68 127.65 1og0 s LEU 70 Ca -0.02 1.92 0.01 0.00 -0.22 0.00 0.00 54.13 55.82 1og0 s LEU 70 Cb -0.14 -3.56 0.03 0.00 0.50 0.00 0.00 46.19 43.02 1og0 s LEU 70 CO 0.02 -0.66 -0.17 -0.69 -1.32 0.00 0.00 176.35 173.53 1og0 s VAL 71 N 2.44 2.04 -0.62 1.68 1.01 -0.22 -1.27 120.40 125.47 1og0 s VAL 71 Ca 0.59 -1.09 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 1og0 s VAL 71 Cb -0.27 -1.93 0.16 0.00 0.00 0.00 0.00 36.38 34.34 1og0 s VAL 71 CO 0.23 0.38 0.54 -0.63 0.00 0.00 0.00 175.10 175.62 1og0 s ILE 72 N 1.26 4.94 0.09 2.22 -1.09 -0.53 -1.25 121.20 126.83 1og0 s ILE 72 Ca 0.01 -2.01 0.09 0.00 -2.23 0.00 0.00 60.65 56.51 1og0 s ILE 72 Cb -0.15 -4.15 -0.03 0.00 -1.58 0.00 0.00 42.46 36.55 1og0 s ILE 72 CO -0.11 -0.90 -0.23 0.54 -1.23 0.00 0.00 174.94 173.02 1og0 s VAL 73 N 0.94 1.85 -5.00 2.92 0.11 -0.83 -1.02 120.40 119.37 1og0 s VAL 73 Ca 0.10 -1.47 0.00 0.00 -2.93 0.00 0.00 61.98 57.67 1og0 s VAL 73 Cb -0.22 -1.64 0.00 0.00 -1.53 0.00 0.00 36.38 32.99 1og0 s VAL 73 CO -0.02 0.09 0.00 0.61 -3.33 0.00 0.00 175.10 172.45 1og0 n GLY 74 N 1.34 -1.27 3.45 6.54 0.00 -0.57 -0.17 105.19 114.52 1og0 n GLY 74 Ca -0.18 -1.58 -0.34 0.00 0.00 0.00 0.00 46.02 43.92 1og0 n GLY 74 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1og0 n PRO 75 N -1.31 0.01 -0.19 1.61 -0.02 0.58 -0.73 135.00 134.95 1og0 n PRO 75 Ca 0.00 0.05 -0.09 0.00 -2.02 0.00 0.00 63.50 61.44 1og0 n PRO 75 Cb 0.00 -1.88 0.02 0.00 -0.02 0.00 0.00 33.50 31.62 1og0 n PRO 75 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1og0 s SER 77 N -6.41 -0.53 -0.22 0.00 1.04 -1.26 -4.56 113.70 101.76 1og0 s SER 77 Ca -0.12 0.63 -0.11 0.00 0.48 0.00 0.00 55.95 56.83 1og0 s SER 77 Cb 0.13 0.59 -0.05 0.00 0.10 0.00 0.00 66.02 66.79 1og0 s SER 77 CO 0.83 -0.51 0.20 -0.63 0.98 0.00 0.00 173.24 174.11 1og0 s ILE 78 N -0.99 5.35 0.00 -1.02 -1.09 -0.44 -4.81 121.20 118.19 1og0 s ILE 78 Ca -0.10 0.29 0.00 0.00 -2.23 0.00 0.00 60.65 58.61 1og0 s ILE 78 Cb -0.02 -3.54 0.00 0.00 -1.58 0.00 0.00 42.46 37.32 1og0 s ILE 78 CO 0.07 0.36 0.22 0.00 -1.23 0.00 0.00 174.94 174.37 1og0 n HIS 79 N 4.02 0.00 -3.62 3.97 1.44 -1.26 -4.60 115.22 115.17 1og0 n HIS 79 Ca -0.14 0.00 -0.27 0.00 -2.01 0.00 0.00 57.72 55.30 1og0 n HIS 79 Cb 0.52 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.46 1og0 n HIS 79 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1og0 s ASP 80 N -0.06 2.59 0.42 4.39 -1.08 -1.26 -4.99 116.67 116.67 1og0 s ASP 80 Ca 0.00 -0.74 0.17 0.00 -0.52 0.00 0.00 52.55 51.46 1og0 s ASP 80 Cb 0.00 -0.31 0.91 0.00 -1.46 0.00 0.00 42.92 42.07 1og0 s ASP 80 CO 0.00 -0.36 1.89 -0.07 0.52 0.00 0.00 175.17 177.15 1og0 h LEU 81 N 8.39 0.00 0.14 -1.34 4.07 -1.98 -1.03 115.31 123.57 1og0 h LEU 81 Ca -0.16 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.80 1og0 h LEU 81 Cb 1.13 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.87 1og0 h LEU 81 CO 0.32 0.29 -0.07 -0.33 -1.08 0.00 0.00 178.44 177.57 1og0 h GLU 82 N 0.00 -0.19 -0.79 1.13 3.07 -1.99 -1.79 114.58 114.03 1og0 h GLU 82 Ca -0.00 0.01 0.06 0.00 -0.50 0.00 0.00 59.36 58.93 1og0 h GLU 82 Cb 0.57 0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 28.47 1og0 h GLU 82 CO 0.04 0.26 0.52 0.00 -1.40 0.00 0.00 179.01 178.43 1og0 h ALA 83 N -0.20 1.63 -0.10 3.43 0.00 -1.98 0.71 119.26 122.75 1og0 h ALA 83 Ca -0.02 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1og0 h ALA 83 Cb 0.54 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1og0 h ALA 83 CO 0.03 0.26 -0.32 0.00 0.00 0.00 0.00 179.25 179.22 1og0 h ALA 84 N 1.57 1.29 -0.10 0.00 0.00 -1.18 -2.11 119.26 118.74 1og0 h ALA 84 Ca 0.34 -0.33 -0.23 0.00 0.00 0.00 0.00 54.91 54.69 1og0 h ALA 84 Cb 0.22 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.94 1og0 h ALA 84 CO -0.12 0.49 -0.85 0.37 0.00 0.00 0.00 179.25 179.15 1og0 h GLN 85 N 0.16 0.69 -0.31 0.00 5.75 0.00 -1.01 115.11 120.39 1og0 h GLN 85 Ca 0.02 -0.62 -0.01 0.00 -0.15 0.00 0.00 58.65 57.89 1og0 h GLN 85 Cb 0.65 0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.33 1og0 h GLN 85 CO 0.05 1.22 0.14 1.49 -2.65 0.00 0.00 178.83 179.08 1og0 h GLU 86 N 0.45 0.45 -0.51 1.69 4.81 -1.00 -1.67 114.58 118.80 1og0 h GLU 86 Ca -0.07 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.10 1og0 h GLU 86 Cb 1.48 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.75 1og0 h GLU 86 CO 0.17 0.44 0.32 -0.92 -0.73 0.00 0.00 179.01 178.28 1og0 h TYR 87 N 0.36 0.60 -0.65 0.92 5.03 -1.37 -2.12 116.97 119.74 1og0 h TYR 87 Ca 0.11 0.02 0.06 0.00 2.58 0.00 0.00 58.73 61.49 1og0 h TYR 87 Cb 0.14 -0.20 -0.05 0.00 1.55 0.00 0.00 36.73 38.17 1og0 h TYR 87 CO -0.01 0.35 0.35 0.00 -1.32 0.00 0.00 178.16 177.53 1og0 h ALA 88 N 1.21 0.86 -0.25 1.82 0.00 -0.79 0.45 119.26 122.56 1og0 h ALA 88 Ca 0.20 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.15 1og0 h ALA 88 Cb -0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1og0 h ALA 88 CO -0.07 0.02 0.10 -0.07 0.00 0.00 0.00 179.25 179.23 1og0 h LEU 89 N 0.65 0.13 0.04 0.00 -0.00 -0.74 0.30 115.31 115.70 1og0 h LEU 89 Ca 0.29 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.20 1og0 h LEU 89 Cb 0.19 -0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.84 1og0 h LEU 89 CO -0.18 0.11 -0.06 0.03 -0.00 0.00 0.00 178.44 178.34 1og0 h ARG 90 N 0.22 -0.11 -0.09 1.13 3.08 -0.76 -1.80 114.38 116.05 1og0 h ARG 90 Ca 0.11 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 1og0 h ARG 90 Cb 0.06 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1og0 h ARG 90 CO -0.10 -0.08 -0.07 1.25 -1.07 0.00 0.00 179.97 179.91 1og0 h LEU 91 N -0.12 0.11 -0.37 3.04 5.85 -0.64 -2.42 115.31 120.76 1og0 h LEU 91 Ca 0.01 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.58 1og0 h LEU 91 Cb 0.13 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1og0 h LEU 91 CO -0.03 0.21 -0.31 0.50 -0.34 0.00 0.00 178.44 178.47 1og0 h LYS 92 N 0.12 0.86 0.55 1.25 1.63 0.10 -0.04 116.57 121.03 1og0 h LYS 92 Ca 0.03 -0.43 -0.03 0.00 -0.85 0.00 0.00 60.65 59.37 1og0 h LYS 92 Cb 0.21 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 31.85 1og0 h LYS 92 CO 0.01 1.07 -0.26 -0.22 -3.45 0.00 0.00 179.45 176.60 1og0 h LYS 93 N 0.66 -0.71 -1.00 1.90 3.64 -0.92 -2.60 116.57 117.54 1og0 h LYS 93 Ca 0.07 0.05 0.28 0.00 -1.27 0.00 0.00 60.65 59.78 1og0 h LYS 93 Cb 0.89 0.16 -0.14 0.00 -0.41 0.00 0.00 32.23 32.73 1og0 h LYS 93 CO 0.08 -0.47 0.58 1.25 -2.27 0.00 0.00 179.45 178.62 1og0 h LEU 94 N -0.78 0.60 -1.09 5.20 5.85 -1.50 0.41 115.31 124.00 1og0 h LEU 94 Ca -0.08 0.16 0.09 0.00 0.84 0.00 0.00 57.88 58.90 1og0 h LEU 94 Cb 0.56 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.61 1og0 h LEU 94 CO 0.12 -0.01 0.62 -1.28 -0.34 0.00 0.00 178.44 177.55 1og0 h SER 95 N 0.46 0.92 0.02 1.25 0.87 -0.77 -0.83 113.55 115.46 1og0 h SER 95 Ca 0.69 0.02 -0.19 0.00 -1.23 0.00 0.00 61.79 61.08 1og0 h SER 95 Cb 1.44 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 63.23 1og0 h SER 95 CO -0.54 0.55 -0.67 0.44 -0.53 0.00 0.00 176.83 176.08 1og0 h ASP 96 N 1.02 0.70 -0.47 6.23 3.32 0.19 0.35 116.42 127.76 1og0 h ASP 96 Ca 0.44 -0.42 0.01 0.00 0.02 0.00 0.00 57.03 57.08 1og0 h ASP 96 Cb 0.34 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1og0 h ASP 96 CO -0.20 1.18 0.31 -0.08 -1.72 0.00 0.00 179.24 178.73 1og0 h GLU 97 N 0.44 0.58 -0.14 3.56 4.81 -0.48 -2.98 114.58 120.37 1og0 h GLU 97 Ca -0.02 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1og0 h GLU 97 Cb 1.25 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1og0 h GLU 97 CO 0.13 0.38 0.00 1.28 -0.73 0.00 0.00 179.01 180.07 1og0 n LEU 98 N -4.47 2.20 0.00 1.64 4.77 -0.66 -4.72 117.00 115.76 1og0 n LEU 98 Ca 0.04 -1.66 0.00 0.00 -0.03 0.00 0.00 56.01 54.37 1og0 n LEU 98 Cb 0.09 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1og0 n LEU 98 CO 0.35 0.53 0.14 2.29 -1.33 0.00 0.00 177.39 179.37 1og0 n LYS 99 N 0.19 0.00 0.04 3.23 2.85 0.12 -0.33 118.16 124.26 1og0 n LYS 99 Ca 0.06 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.43 1og0 n LYS 99 Cb 0.29 -1.42 -0.07 0.00 -0.65 0.00 0.00 35.03 33.18 1og0 n LYS 99 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1og0 n GLY 100 N -0.76 -1.21 0.00 2.58 0.00 -1.26 -4.54 105.19 100.00 1og0 n GLY 100 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1og0 n GLY 100 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1og0 n ASP 101 N -2.31 4.32 -4.26 1.61 8.00 0.55 -4.92 116.55 119.54 1og0 n ASP 101 Ca -0.01 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.18 1og0 n ASP 101 Cb 0.53 0.36 -0.16 0.00 -0.02 0.00 0.00 41.12 41.82 1og0 n ASP 101 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1og0 s LEU 102 N -3.92 2.05 -0.36 0.64 1.43 -0.55 -1.99 118.68 115.98 1og0 s LEU 102 Ca 0.00 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.50 1og0 s LEU 102 Cb 0.00 -1.33 0.02 0.00 0.03 0.00 0.00 46.19 44.91 1og0 s LEU 102 CO 0.00 0.25 0.20 -0.55 0.23 0.00 0.00 176.35 176.48 1og0 s SER 103 N -0.22 5.72 -0.07 2.29 0.15 -0.99 -4.06 113.70 116.52 1og0 s SER 103 Ca -0.01 -0.88 -0.04 0.00 0.70 0.00 0.00 55.95 55.71 1og0 s SER 103 Cb -0.13 -2.03 -0.04 0.00 -1.71 0.00 0.00 66.02 62.11 1og0 s SER 103 CO 0.03 -0.35 0.11 -0.63 1.20 0.00 0.00 173.24 173.60 1og0 s ILE 104 N 1.58 5.14 -0.04 6.45 1.01 -1.26 -1.05 121.20 133.03 1og0 s ILE 104 Ca 0.03 -0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.63 1og0 s ILE 104 Cb -0.19 -3.28 0.01 0.00 0.01 0.00 0.00 42.46 39.01 1og0 s ILE 104 CO 0.07 0.50 -0.07 -0.63 0.00 0.00 0.00 174.94 174.81 1og0 s ILE 105 N -1.10 0.66 0.26 2.92 1.01 -0.38 -4.50 121.20 120.07 1og0 s ILE 105 Ca 0.19 -0.24 -0.23 0.00 0.00 0.00 0.00 60.65 60.37 1og0 s ILE 105 Cb -0.12 -0.63 -0.09 0.00 0.01 0.00 0.00 42.46 41.63 1og0 s ILE 105 CO 0.09 0.23 0.82 -0.32 0.00 0.00 0.00 174.94 175.76 1og0 s MET 106 N 0.56 4.40 -0.34 2.79 -2.45 0.17 -1.97 119.30 122.47 1og0 s MET 106 Ca -0.08 1.07 -0.29 0.00 -1.25 0.00 0.00 55.69 55.14 1og0 s MET 106 Cb -0.12 -2.87 0.02 0.00 1.25 0.00 0.00 34.83 33.11 1og0 s MET 106 CO 0.01 0.36 1.12 1.03 1.05 0.00 0.00 175.02 178.59 1og0 s ARG 107 N -1.96 3.99 -0.58 4.11 0.52 0.77 -0.81 118.95 124.99 1og0 s ARG 107 Ca 0.45 1.02 0.06 0.00 -0.52 0.00 0.00 55.73 56.75 1og0 s ARG 107 Cb -0.18 -3.79 0.28 0.00 0.52 0.00 0.00 34.95 31.78 1og0 s ARG 107 CO 0.22 -1.01 0.77 0.00 0.02 0.00 0.00 175.30 175.30 1og0 n ALA 108 N 7.15 3.89 -2.42 2.13 0.00 0.25 -4.06 120.51 127.45 1og0 n ALA 108 Ca 0.12 -4.50 -0.40 0.00 0.00 0.00 0.00 53.44 48.67 1og0 n ALA 108 Cb 0.47 -0.85 -0.05 0.00 0.00 0.00 0.00 19.45 19.03 1og0 n ALA 108 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1og0 s TYR 109 N -2.56 3.72 0.08 0.00 1.51 -1.26 -4.49 117.35 114.35 1og0 s TYR 109 Ca 0.42 1.44 0.10 0.00 -1.01 0.00 0.00 57.07 58.02 1og0 s TYR 109 Cb 0.20 -2.80 0.00 0.00 -0.11 0.00 0.00 41.96 39.25 1og0 s TYR 109 CO -0.06 0.27 1.40 -0.07 -1.11 0.00 0.00 175.55 175.98 1og0 h LEU 110 N 5.73 0.00 -7.39 -1.29 -0.00 -1.89 -1.18 115.31 109.29 1og0 h LEU 110 Ca -0.44 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.38 1og0 h LEU 110 Cb 1.20 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 41.73 1og0 h LEU 110 CO 0.71 0.78 -0.08 -1.83 -0.00 0.00 0.00 178.44 178.02 1og0 s GLU 111 N -2.96 1.03 0.09 1.13 -1.05 -1.26 -1.30 118.70 114.38 1og0 s GLU 111 Ca 0.01 -0.63 -0.08 0.00 -0.15 0.00 0.00 54.97 54.12 1og0 s GLU 111 Cb 0.10 0.46 -0.06 0.00 -0.44 0.00 0.00 34.13 34.19 1og0 s GLU 111 CO 0.78 -0.39 0.39 -1.59 0.95 0.00 0.00 175.26 175.40 1og0 s LYS 112 N -3.50 3.71 0.00 -4.83 0.00 -1.26 -4.90 119.74 108.97 1og0 s LYS 112 Ca 0.01 0.10 0.00 0.00 0.00 0.00 0.00 55.97 56.08 1og0 s LYS 112 Cb 0.01 -2.96 0.00 0.00 0.00 0.00 0.00 37.83 34.88 1og0 s LYS 112 CO -0.10 0.54 0.00 -0.35 0.00 0.00 0.00 175.35 175.44 1og0 n PRO 113 N 0.73 0.00 -0.58 1.78 -0.04 -1.26 -4.99 135.00 130.63 1og0 n PRO 113 Ca -0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 1og0 n PRO 113 Cb 0.52 -1.32 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 1og0 n PRO 113 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 1og0 n TRP 119 N 1.31 0.00 0.27 0.54 -0.00 -1.26 -5.17 117.44 113.13 1og0 n TRP 119 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.50 57.61 1og0 n TRP 119 Cb 0.00 -0.26 0.75 0.00 -0.00 0.00 0.00 31.31 31.80 1og0 n TRP 119 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 177.69 179.26 1og0 h LYS 120 N 2.68 0.00 0.00 5.87 2.10 -1.97 -3.49 116.57 121.76 1og0 h LYS 120 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1og0 h LYS 120 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1og0 h LYS 120 CO 0.00 0.02 0.00 0.41 -2.00 0.00 0.00 179.45 177.88 1og0 n GLY 121 N -1.36 0.84 0.12 0.07 0.00 -1.26 -4.76 105.19 98.84 1og0 n GLY 121 Ca -0.03 -1.99 -0.17 0.00 0.00 0.00 0.00 46.02 43.82 1og0 n GLY 121 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1og0 h LEU 122 N 0.00 0.29 -0.09 0.99 5.85 -1.45 -2.83 115.31 118.08 1og0 h LEU 122 Ca 0.00 -0.65 -0.02 0.00 0.84 0.00 0.00 57.88 58.06 1og0 h LEU 122 Cb 0.00 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 40.93 1og0 h LEU 122 CO 0.00 1.58 -0.00 0.40 -0.34 0.00 0.00 178.44 180.08 1og0 h ILE 123 N 0.05 1.25 0.55 4.05 2.04 -1.81 -2.76 117.51 120.88 1og0 h ILE 123 Ca -0.37 -0.81 -0.03 0.00 1.00 0.00 0.00 64.86 64.65 1og0 h ILE 123 Cb 2.03 1.61 0.01 0.00 -0.74 0.00 0.00 36.82 39.73 1og0 h ILE 123 CO 0.09 0.23 -0.26 0.78 0.00 0.00 0.00 178.15 178.99 1og0 h ASN 124 N -0.12 -0.62 -2.29 1.72 4.21 -1.86 -3.33 115.58 113.29 1og0 h ASN 124 Ca 0.03 0.02 -0.60 0.00 1.21 0.00 0.00 56.30 56.96 1og0 h ASN 124 Cb 0.36 0.16 -0.41 0.00 -1.12 0.00 0.00 38.32 37.30 1og0 h ASN 124 CO 0.01 -0.22 -0.68 -0.67 -1.29 0.00 0.00 177.43 174.57 1og0 n ASP 125 N -5.27 2.96 0.22 5.81 2.03 -1.07 -1.45 116.55 119.78 1og0 n ASP 125 Ca -0.09 -3.26 0.05 0.00 0.52 0.00 0.00 54.79 52.01 1og0 n ASP 125 Cb 0.29 -0.67 0.49 0.00 -0.72 0.00 0.00 41.12 40.51 1og0 n ASP 125 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1og0 h PRO 126 N 4.36 0.00 0.00 -0.67 0.13 -1.62 -1.47 132.00 132.72 1og0 h PRO 126 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1og0 h PRO 126 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1og0 h PRO 126 CO 0.75 0.21 0.00 -0.44 -0.23 0.00 0.00 178.00 178.28 1og0 h ASP 127 N 0.00 0.00 -5.86 1.44 3.32 -1.91 -3.47 116.42 109.95 1og0 h ASP 127 Ca -0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 1og0 h ASP 127 Cb 0.36 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.02 1og0 h ASP 127 CO 0.03 0.00 -0.75 0.52 -1.72 0.00 0.00 179.24 177.31 1og0 n VAL 128 N -2.81 -7.57 -2.69 -1.35 0.31 -0.55 -4.91 118.33 98.75 1og0 n VAL 128 Ca 0.00 -0.89 -0.07 0.00 -0.01 0.00 0.00 64.34 63.37 1og0 n VAL 128 Cb 0.23 -5.44 0.11 0.00 -0.91 0.00 0.00 33.84 27.83 1og0 n VAL 128 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1og0 n ASN 129 N -2.68 -1.31 -3.84 4.52 0.23 -1.26 -4.41 115.26 106.50 1og0 n ASN 129 Ca -0.08 -2.48 -0.33 0.00 -0.53 0.00 0.00 54.58 51.16 1og0 n ASN 129 Cb 0.59 0.74 -0.06 0.00 -2.08 0.00 0.00 39.78 38.97 1og0 n ASN 129 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1og0 n ASN 130 N -0.57 -1.42 -4.47 0.53 5.15 -1.26 -4.92 115.26 108.30 1og0 n ASN 130 Ca -0.02 -0.94 -0.22 0.00 -0.60 0.00 0.00 54.58 52.80 1og0 n ASN 130 Cb 0.85 -1.24 -0.11 0.00 -0.53 0.00 0.00 39.78 38.75 1og0 n ASN 130 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1og0 s THR 131 N -2.73 1.31 0.31 -0.44 -4.23 -1.26 -5.16 115.64 103.44 1og0 s THR 131 Ca 0.64 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 59.24 1og0 s THR 131 Cb -0.37 -2.81 -0.05 0.00 1.34 0.00 0.00 72.50 70.61 1og0 s THR 131 CO 0.79 -0.01 0.01 -0.36 -0.54 0.00 0.00 174.62 174.50 1og0 s PHE 132 N -3.21 2.60 0.00 3.99 0.40 -1.26 -4.30 117.98 116.19 1og0 s PHE 132 Ca 0.36 -0.35 0.00 0.00 -0.60 0.00 0.00 56.93 56.35 1og0 s PHE 132 Cb 0.09 -1.37 0.00 0.00 0.51 0.00 0.00 43.02 42.25 1og0 s PHE 132 CO 0.16 0.53 0.00 -1.71 0.70 0.00 0.00 175.22 174.89 1og0 n ASN 133 N -0.94 0.00 -0.08 1.36 2.85 -0.53 -4.99 115.26 112.94 1og0 n ASN 133 Ca -0.05 0.00 0.07 0.00 -0.11 0.00 0.00 54.58 54.49 1og0 n ASN 133 Cb 0.61 0.00 0.43 0.00 1.24 0.00 0.00 39.78 42.05 1og0 n ASN 133 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1og0 h ILE 134 N 0.00 1.02 -0.20 -1.44 5.03 -1.72 -1.20 117.51 119.00 1og0 h ILE 134 Ca 0.00 -0.20 -0.00 0.00 -0.12 0.00 0.00 64.86 64.54 1og0 h ILE 134 Cb 0.00 0.39 -0.01 0.00 -3.03 0.00 0.00 36.82 34.17 1og0 h ILE 134 CO 0.00 0.10 0.12 0.78 -0.68 0.00 0.00 178.15 178.47 1og0 h ASN 135 N 0.57 0.24 0.18 1.72 2.35 -1.91 0.23 115.58 118.96 1og0 h ASN 135 Ca 0.24 -0.05 -0.13 0.00 -0.55 0.00 0.00 56.30 55.80 1og0 h ASN 135 Cb 0.21 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1og0 h ASN 135 CO -0.07 0.23 -0.48 0.50 -1.65 0.00 0.00 177.43 175.96 1og0 h LYS 136 N 0.24 0.36 -0.40 0.81 3.64 -1.84 -2.37 116.57 116.99 1og0 h LYS 136 Ca 0.07 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.24 1og0 h LYS 136 Cb 0.03 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1og0 h LYS 136 CO -0.01 0.76 0.20 0.78 -2.27 0.00 0.00 179.45 178.91 1og0 h GLY 137 N 1.23 0.62 1.79 5.01 0.00 -0.70 0.28 103.07 111.31 1og0 h GLY 137 Ca 0.02 -0.30 -0.06 0.00 0.00 0.00 0.00 47.33 46.98 1og0 h GLY 137 CO 0.08 0.29 -0.19 1.41 0.00 0.00 0.00 176.54 178.13 1og0 h LEU 138 N 0.51 0.24 0.08 3.11 3.38 -0.46 0.16 115.31 122.34 1og0 h LEU 138 Ca 0.14 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1og0 h LEU 138 Cb 0.11 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1og0 h LEU 138 CO -0.02 0.45 -0.04 1.56 0.09 0.00 0.00 178.44 180.49 1og0 h GLN 139 N 0.24 -0.10 -0.04 1.13 4.20 -0.87 -0.78 115.11 118.89 1og0 h GLN 139 Ca 0.04 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.78 1og0 h GLN 139 Cb 0.48 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.26 1og0 h GLN 139 CO 0.03 0.22 -0.07 0.77 -0.67 0.00 0.00 178.83 179.11 1og0 h SER 140 N -0.43 -0.21 -0.23 1.46 0.02 -0.69 0.20 113.55 113.66 1og0 h SER 140 Ca -0.01 0.04 0.06 0.00 -0.84 0.00 0.00 61.79 61.03 1og0 h SER 140 Cb 0.37 0.10 -0.07 0.00 0.14 0.00 0.00 62.40 62.93 1og0 h SER 140 CO 0.02 -0.10 -0.36 0.00 -1.14 0.00 0.00 176.83 175.24 1og0 h ALA 141 N 0.92 -0.39 -0.48 3.77 0.00 -0.64 0.17 119.26 122.60 1og0 h ALA 141 Ca 0.04 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1og0 h ALA 141 Cb 0.16 0.72 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1og0 h ALA 141 CO -0.10 -0.82 -0.09 -0.09 0.00 0.00 0.00 179.25 178.15 1og0 h ARG 142 N -0.38 0.87 -0.38 0.00 2.43 -0.83 -1.58 114.38 114.50 1og0 h ARG 142 Ca 0.11 -0.29 -0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1og0 h ARG 142 Cb 0.57 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 1og0 h ARG 142 CO -0.44 0.92 0.23 0.37 -1.51 0.00 0.00 179.97 179.54 1og0 h GLN 143 N 0.79 0.53 0.21 0.20 5.75 -0.10 -0.70 115.11 121.78 1og0 h GLN 143 Ca 0.13 -0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.59 1og0 h GLN 143 Cb 0.60 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 29.01 1og0 h GLN 143 CO 0.04 0.40 -0.34 1.25 -2.65 0.00 0.00 178.83 177.53 1og0 h LEU 144 N 0.50 -0.96 -1.15 -2.39 5.85 -0.42 0.31 115.31 117.06 1og0 h LEU 144 Ca 0.14 0.10 0.13 0.00 0.84 0.00 0.00 57.88 59.08 1og0 h LEU 144 Cb 0.02 0.35 -0.08 0.00 0.37 0.00 0.00 40.66 41.32 1og0 h LEU 144 CO -0.02 -0.45 0.60 -0.26 -0.34 0.00 0.00 178.44 177.97 1og0 h PHE 145 N -0.62 0.99 -0.16 1.25 -1.00 -1.08 -0.67 116.94 115.63 1og0 h PHE 145 Ca 0.01 0.03 -0.05 0.00 2.81 0.00 0.00 57.97 60.76 1og0 h PHE 145 Cb 0.61 -0.31 -0.00 0.00 3.61 0.00 0.00 35.95 39.86 1og0 h PHE 145 CO -0.26 0.38 -0.10 0.28 -1.61 0.00 0.00 178.31 177.00 1og0 h VAL 146 N 0.85 1.32 -0.49 -0.55 2.07 -0.26 -2.02 116.25 117.18 1og0 h VAL 146 Ca 0.47 -1.19 0.08 0.00 0.82 0.00 0.00 66.70 66.87 1og0 h VAL 146 Cb 0.58 1.76 -0.06 0.00 -1.52 0.00 0.00 31.29 32.05 1og0 h VAL 146 CO -0.23 0.35 0.14 0.78 0.02 0.00 0.00 177.57 178.63 1og0 h ASN 147 N 0.02 0.09 0.45 0.57 2.35 0.56 0.27 115.58 119.89 1og0 h ASN 147 Ca 0.03 0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.83 1og0 h ASN 147 Cb 0.60 0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.06 1og0 h ASN 147 CO 0.03 0.08 -0.22 -0.07 -1.65 0.00 0.00 177.43 175.60 1og0 h LEU 148 N 0.29 -0.52 -2.34 1.61 3.38 -1.14 -3.12 115.31 113.48 1og0 h LEU 148 Ca 0.24 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.25 1og0 h LEU 148 Cb 0.29 0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1og0 h LEU 148 CO -0.28 -0.27 0.21 0.71 0.09 0.00 0.00 178.44 178.89 1og0 h THR 149 N -0.80 0.18 0.00 0.22 1.35 -1.37 -0.98 112.91 111.51 1og0 h THR 149 Ca -0.06 0.00 -0.07 0.00 -0.55 0.00 0.00 66.41 65.73 1og0 h THR 149 Cb 0.47 0.81 -0.01 0.00 -1.73 0.00 0.00 68.15 67.69 1og0 h THR 149 CO 0.10 0.00 -0.34 -1.13 -0.25 0.00 0.00 175.52 173.91 1og0 h ASN 150 N 0.00 0.00 -0.37 5.36 -1.24 -0.87 -2.19 115.58 116.28 1og0 h ASN 150 Ca 0.04 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.05 1og0 h ASN 150 Cb 0.45 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.50 1og0 h ASN 150 CO -0.00 0.34 0.00 2.30 -1.29 0.00 0.00 177.43 178.78 1og0 n ILE 151 N -4.03 0.64 -0.58 2.57 -5.35 -0.37 -4.66 119.36 107.58 1og0 n ILE 151 Ca -0.02 -0.54 0.00 0.00 -0.27 0.00 0.00 62.75 61.92 1og0 n ILE 151 Cb 0.39 0.16 0.00 0.00 -1.74 0.00 0.00 39.64 38.45 1og0 n ILE 151 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1og0 n GLY 152 N 0.99 0.69 3.37 3.28 0.00 -0.82 -5.05 105.19 107.65 1og0 n GLY 152 Ca 0.13 -0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 1og0 n GLY 152 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1og0 s LEU 153 N 0.00 4.48 0.93 0.99 2.96 -1.24 -4.97 118.68 121.84 1og0 s LEU 153 Ca 0.00 -0.89 -0.10 0.00 -0.22 0.00 0.00 54.13 52.91 1og0 s LEU 153 Cb 0.00 -1.99 0.16 0.00 0.50 0.00 0.00 46.19 44.86 1og0 s LEU 153 CO 0.00 -0.32 1.13 -2.84 -1.32 0.00 0.00 176.35 173.00 1og0 s PRO 154 N 1.54 0.87 0.09 0.98 0.02 -1.26 -3.54 135.00 133.71 1og0 s PRO 154 Ca 0.02 1.45 0.02 0.00 0.02 0.00 0.00 61.00 62.51 1og0 s PRO 154 Cb -0.19 -1.72 -0.04 0.00 0.02 0.00 0.00 34.50 32.58 1og0 s PRO 154 CO 0.06 -2.70 -0.07 0.96 -0.33 0.00 0.00 177.00 174.92 1og0 s ILE 155 N -2.65 0.71 0.07 2.83 -4.36 -1.26 -0.66 121.20 115.88 1og0 s ILE 155 Ca 0.67 -1.76 0.03 0.00 -0.26 0.00 0.00 60.65 59.33 1og0 s ILE 155 Cb -0.23 -1.46 -0.03 0.00 1.25 0.00 0.00 42.46 41.99 1og0 s ILE 155 CO 0.59 -0.75 -0.10 -0.83 0.24 0.00 0.00 174.94 174.09 1og0 s GLY 156 N -2.73 0.71 0.21 6.27 0.00 0.01 -0.71 107.32 111.07 1og0 s GLY 156 Ca 0.07 -0.98 -0.14 0.00 0.00 0.00 0.00 44.72 43.68 1og0 s GLY 156 CO -0.03 -1.04 0.44 -0.45 0.00 0.00 0.00 173.10 172.02 1og0 s SER 157 N -1.97 -0.12 0.05 1.64 0.15 -0.90 -0.58 113.70 111.98 1og0 s SER 157 Ca -0.02 -0.75 -0.23 0.00 0.70 0.00 0.00 55.95 55.65 1og0 s SER 157 Cb -0.07 0.54 -0.06 0.00 -1.71 0.00 0.00 66.02 64.73 1og0 s SER 157 CO 0.00 -1.04 0.71 -0.70 1.20 0.00 0.00 173.24 173.40 1og0 s GLU 158 N -3.95 4.43 -1.05 5.44 2.12 -1.26 -1.75 118.70 122.68 1og0 s GLU 158 Ca 0.16 0.96 -0.19 0.00 0.36 0.00 0.00 54.97 56.26 1og0 s GLU 158 Cb 0.00 -3.33 0.11 0.00 0.26 0.00 0.00 34.13 31.17 1og0 s GLU 158 CO 0.02 0.39 1.35 -1.64 -0.54 0.00 0.00 175.26 174.84 1og0 s MET 159 N -0.37 3.73 0.03 4.30 -1.94 -0.71 -4.88 119.30 119.46 1og0 s MET 159 Ca 0.35 -1.74 -0.15 0.00 -1.71 0.00 0.00 55.69 52.44 1og0 s MET 159 Cb -0.20 -5.15 -0.07 0.00 2.01 0.00 0.00 34.83 31.41 1og0 s MET 159 CO 0.22 -1.96 1.22 -0.07 -0.01 0.00 0.00 175.02 174.42 1og0 h LEU 160 N 11.26 -0.52 0.00 -0.03 3.38 -1.94 -3.47 115.31 123.99 1og0 h LEU 160 Ca 0.23 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1og0 h LEU 160 Cb 0.98 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1og0 h LEU 160 CO 1.27 -0.29 0.00 -0.90 0.09 0.00 0.00 178.44 178.61 1og0 n ASP 161 N -3.52 1.46 -1.25 -0.43 5.75 -1.26 -5.03 116.55 112.26 1og0 n ASP 161 Ca -0.06 -0.52 0.09 0.00 -0.01 0.00 0.00 54.79 54.30 1og0 n ASP 161 Cb 0.20 0.00 0.28 0.00 -1.03 0.00 0.00 41.12 40.57 1og0 n ASP 161 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 1og0 n THR 162 N 0.00 1.18 0.00 2.12 5.66 -1.26 -4.49 114.28 117.49 1og0 n THR 162 Ca 0.00 -0.89 0.00 0.00 -3.05 0.00 0.00 64.05 60.11 1og0 n THR 162 Cb 0.00 0.22 0.00 0.00 -1.55 0.00 0.00 70.33 69.00 1og0 n THR 162 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 1og0 n ILE 163 N 1.08 0.00 -0.27 1.09 5.41 -1.26 -4.47 119.36 120.94 1og0 n ILE 163 Ca 0.21 0.00 0.08 0.00 1.00 0.00 0.00 62.75 64.04 1og0 n ILE 163 Cb 0.64 -0.42 0.22 0.00 -0.71 0.00 0.00 39.64 39.38 1og0 n ILE 163 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1og0 h SER 164 N 0.00 0.07 -0.97 4.38 0.02 -1.99 -1.33 113.55 113.73 1og0 h SER 164 Ca 0.00 0.16 0.19 0.00 -0.84 0.00 0.00 61.79 61.29 1og0 h SER 164 Cb 0.51 0.20 -0.11 0.00 0.14 0.00 0.00 62.40 63.14 1og0 h SER 164 CO 0.00 -0.05 0.57 -0.65 -1.14 0.00 0.00 176.83 175.56 1og0 h PRO 165 N 0.29 0.69 -0.31 3.45 0.11 -1.88 -0.57 132.00 133.78 1og0 h PRO 165 Ca 0.47 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 66.63 1og0 h PRO 165 Cb 0.84 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 1og0 h PRO 165 CO -0.54 0.46 0.32 1.96 -0.21 0.00 0.00 178.00 179.99 1og0 h GLN 166 N 0.71 0.00 -0.01 1.05 1.08 -1.56 0.43 115.11 116.81 1og0 h GLN 166 Ca 0.56 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.76 1og0 h GLN 166 Cb 0.88 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.31 1og0 h GLN 166 CO -0.39 0.00 -0.30 0.66 -0.95 0.00 0.00 178.83 177.85 1og0 n TYR 167 N -3.81 0.00 -0.78 2.96 4.02 -0.23 -4.63 117.16 114.69 1og0 n TYR 167 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1og0 n TYR 167 Cb 0.48 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.72 1og0 n TYR 167 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1og0 n LEU 168 N -0.39 0.00 -0.27 7.72 4.77 0.09 -4.83 117.00 124.09 1og0 n LEU 168 Ca 0.12 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.17 1og0 n LEU 168 Cb 0.39 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.69 1og0 n LEU 168 CO 0.26 0.04 1.03 0.00 -1.33 0.00 0.00 177.39 177.38 1og0 h ALA 169 N 0.00 1.15 -0.97 -1.18 0.00 -0.52 -1.71 119.26 116.03 1og0 h ALA 169 Ca 0.00 0.12 0.24 0.00 0.00 0.00 0.00 54.91 55.28 1og0 h ALA 169 Cb 0.19 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 1og0 h ALA 169 CO 0.00 -0.22 0.65 0.38 0.00 0.00 0.00 179.25 180.06 1og0 h ASP 170 N 0.45 0.31 0.10 0.00 2.03 -1.92 -1.78 116.42 115.61 1og0 h ASP 170 Ca 0.45 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.79 1og0 h ASP 170 Cb 0.71 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.20 1og0 h ASP 170 CO -0.43 0.10 -0.46 0.18 -1.03 0.00 0.00 179.24 177.60 1og0 n LEU 171 N -4.47 1.49 -4.84 0.15 4.77 -0.65 -4.87 117.00 108.57 1og0 n LEU 171 Ca 0.21 -0.52 -0.37 0.00 -0.03 0.00 0.00 56.01 55.31 1og0 n LEU 171 Cb 0.84 -0.06 -0.06 0.00 -2.33 0.00 0.00 43.42 41.82 1og0 n LEU 171 CO 0.31 0.29 0.17 -0.69 -1.33 0.00 0.00 177.39 176.14 1og0 s VAL 172 N -2.57 4.94 -0.07 4.08 1.01 -0.67 -4.60 120.40 122.51 1og0 s VAL 172 Ca 0.19 0.83 0.10 0.00 0.00 0.00 0.00 61.98 63.10 1og0 s VAL 172 Cb 0.18 -3.74 -0.15 0.00 0.00 0.00 0.00 36.38 32.68 1og0 s VAL 172 CO 0.60 0.42 0.11 -0.24 0.00 0.00 0.00 175.10 175.98 1og0 n SER 173 N 1.31 2.40 -3.89 3.32 2.88 0.11 -4.92 113.62 114.83 1og0 n SER 173 Ca -0.10 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.31 1og0 n SER 173 Cb 0.52 1.03 -0.14 0.00 -0.75 0.00 0.00 64.21 64.87 1og0 n SER 173 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1og0 s PHE 174 N -2.44 0.15 -0.11 0.66 5.36 -1.12 -4.21 117.98 116.28 1og0 s PHE 174 Ca -0.05 -0.03 0.04 0.00 -0.96 0.00 0.00 56.93 55.93 1og0 s PHE 174 Cb 0.05 -0.11 -0.00 0.00 -0.34 0.00 0.00 43.02 42.62 1og0 s PHE 174 CO 0.45 -0.01 -0.23 0.20 -1.46 0.00 0.00 175.22 174.17 1og0 s GLY 175 N -0.00 1.35 -0.11 13.12 0.00 0.12 -2.11 107.32 119.68 1og0 s GLY 175 Ca 0.00 -0.98 0.03 0.00 0.00 0.00 0.00 44.72 43.78 1og0 s GLY 175 CO -0.00 -0.29 -0.22 0.00 0.00 0.00 0.00 173.10 172.59 1og0 s ALA 176 N 0.39 2.27 -0.26 3.20 0.00 -0.72 0.79 121.76 127.43 1og0 s ALA 176 Ca -0.17 -0.98 -0.12 0.00 0.00 0.00 0.00 51.96 50.69 1og0 s ALA 176 Cb -0.18 -0.92 -0.05 0.00 0.00 0.00 0.00 23.12 21.97 1og0 s ALA 176 CO 0.08 0.22 0.21 0.42 0.00 0.00 0.00 175.76 176.69 1og0 s ILE 177 N 0.44 5.30 0.91 0.00 -1.09 0.62 -1.74 121.20 125.65 1og0 s ILE 177 Ca -0.15 0.25 -0.10 0.00 -2.23 0.00 0.00 60.65 58.42 1og0 s ILE 177 Cb -0.17 -3.55 0.15 0.00 -1.58 0.00 0.00 42.46 37.30 1og0 s ILE 177 CO 0.06 0.27 1.13 -0.83 -1.23 0.00 0.00 174.94 174.35 1og0 s GLY 178 N 1.46 1.68 0.31 6.18 0.00 -1.26 -2.67 107.32 113.01 1og0 s GLY 178 Ca 0.09 0.50 0.02 0.00 0.00 0.00 0.00 44.72 45.33 1og0 s GLY 178 CO 0.08 0.93 1.89 0.00 0.00 0.00 0.00 173.10 176.01 1og0 h ALA 179 N -1.84 1.56 0.00 3.20 0.00 -1.82 -0.98 119.26 119.38 1og0 h ALA 179 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1og0 h ALA 179 Cb 1.27 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1og0 h ALA 179 CO 0.43 0.28 0.00 0.54 0.00 0.00 0.00 179.25 180.50 1og0 n ARG 180 N -4.52 0.09 0.00 0.00 1.74 -1.26 -3.58 116.66 109.13 1og0 n ARG 180 Ca 0.15 0.17 0.00 0.00 -0.77 0.00 0.00 57.85 57.40 1og0 n ARG 180 Cb 0.26 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 1og0 n ARG 180 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1og0 n THR 181 N -1.43 0.00 -0.15 0.55 -2.24 -0.48 -4.75 114.28 105.79 1og0 n THR 181 Ca 0.06 -0.42 0.27 0.00 -2.27 0.00 0.00 64.05 61.69 1og0 n THR 181 Cb 0.19 1.05 0.72 0.00 -2.10 0.00 0.00 70.33 70.19 1og0 n THR 181 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1og0 h THR 182 N 0.05 0.56 0.00 4.28 2.02 -1.33 0.23 112.91 118.72 1og0 h THR 182 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1og0 h THR 182 Cb 0.03 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1og0 h THR 182 CO 0.00 0.00 -0.52 -0.33 0.37 0.00 0.00 175.52 175.04 1og0 h GLU 183 N 0.00 0.00 -6.20 6.66 5.08 -1.85 -3.43 114.58 114.84 1og0 h GLU 183 Ca 0.40 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 58.20 1og0 h GLU 183 Cb 1.62 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.87 1og0 h GLU 183 CO -0.00 0.00 1.31 0.45 -1.00 0.00 0.00 179.01 179.76 1og0 s SER 184 N -4.41 6.04 0.27 1.42 0.15 0.80 -4.87 113.70 113.09 1og0 s SER 184 Ca 0.07 2.07 -0.01 0.00 0.70 0.00 0.00 55.95 58.78 1og0 s SER 184 Cb 0.13 -2.52 0.53 0.00 -1.71 0.00 0.00 66.02 62.44 1og0 s SER 184 CO 0.70 -1.47 1.78 -0.61 1.20 0.00 0.00 173.24 174.85 1og0 h GLN 185 N 12.38 0.70 -0.70 5.44 5.75 -1.89 -0.78 115.11 136.00 1og0 h GLN 185 Ca -0.42 -0.04 0.08 0.00 -0.15 0.00 0.00 58.65 58.12 1og0 h GLN 185 Cb 1.21 -0.16 -0.06 0.00 1.07 0.00 0.00 27.48 29.54 1og0 h GLN 185 CO 0.97 0.47 0.37 1.25 -2.65 0.00 0.00 178.83 179.24 1og0 h LEU 186 N 0.72 0.52 -0.35 -2.39 5.85 -1.93 -0.92 115.31 116.81 1og0 h LEU 186 Ca 0.46 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 59.22 1og0 h LEU 186 Cb 0.59 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 1og0 h LEU 186 CO -0.33 0.32 -0.04 0.45 -0.34 0.00 0.00 178.44 178.50 1og0 h HIS 187 N 0.66 0.00 0.06 1.25 3.86 -1.46 -2.19 115.15 117.32 1og0 h HIS 187 Ca 0.33 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 59.27 1og0 h HIS 187 Cb 0.29 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.78 1og0 h HIS 187 CO -0.09 0.04 -1.09 0.00 0.86 0.00 0.00 177.93 177.65 1og0 h ARG 188 N 0.00 0.64 -0.54 2.45 3.08 -0.46 -2.25 114.38 117.31 1og0 h ARG 188 Ca -0.00 -0.77 -0.06 0.00 0.07 0.00 0.00 59.98 59.23 1og0 h ARG 188 Cb 0.92 0.24 -0.02 0.00 0.08 0.00 0.00 29.97 31.18 1og0 h ARG 188 CO 0.01 1.34 0.11 0.93 -1.07 0.00 0.00 179.97 181.28 1og0 h GLU 189 N 0.29 0.88 -0.80 0.04 5.08 -1.17 -2.29 114.58 116.61 1og0 h GLU 189 Ca -0.15 -0.22 0.02 0.00 -1.00 0.00 0.00 59.36 58.01 1og0 h GLU 189 Cb 1.76 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.86 1og0 h GLU 189 CO 0.21 0.84 0.52 1.25 -1.00 0.00 0.00 179.01 180.83 1og0 h LEU 190 N 0.77 0.88 -1.16 1.33 5.85 -1.40 -2.33 115.31 119.24 1og0 h LEU 190 Ca 0.17 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.80 1og0 h LEU 190 Cb 0.37 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1og0 h LEU 190 CO 0.01 0.62 -0.16 0.00 -0.34 0.00 0.00 178.44 178.57 1og0 h ALA 191 N 1.31 1.30 0.00 1.25 0.00 -1.15 -2.30 119.26 119.67 1og0 h ALA 191 Ca 0.30 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1og0 h ALA 191 Cb -0.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1og0 h ALA 191 CO -0.09 0.46 0.00 -1.13 0.00 0.00 0.00 179.25 178.50 1og0 n SER 192 N -4.20 0.00 -0.01 0.00 3.41 -0.88 -2.42 113.62 109.52 1og0 n SER 192 Ca 0.00 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 1og0 n SER 192 Cb 0.32 -0.31 0.01 0.00 -0.26 0.00 0.00 64.21 63.97 1og0 n SER 192 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1og0 n GLY 193 N -0.47 1.22 3.83 5.00 0.00 -0.87 -1.38 105.19 112.52 1og0 n GLY 193 Ca 0.04 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1og0 n GLY 193 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1og0 s LEU 194 N -0.76 4.17 -0.13 0.99 1.43 -1.01 -4.97 118.68 118.40 1og0 s LEU 194 Ca 0.01 1.35 0.01 0.00 -1.03 0.00 0.00 54.13 54.48 1og0 s LEU 194 Cb 0.01 -3.90 0.21 0.00 0.03 0.00 0.00 46.19 42.53 1og0 s LEU 194 CO 0.00 -0.12 1.25 -1.20 0.23 0.00 0.00 176.35 176.52 1og0 n SER 195 N 0.06 3.18 -3.84 2.29 7.64 -1.26 -4.88 113.62 116.81 1og0 n SER 195 Ca 0.01 -2.48 -0.07 0.00 1.01 0.00 0.00 58.87 57.35 1og0 n SER 195 Cb 0.52 -0.60 -0.02 0.00 -1.01 0.00 0.00 64.21 63.10 1og0 n SER 195 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1og0 s PHE 196 N -1.03 -0.18 0.37 1.43 -0.12 -1.26 -5.05 117.98 112.14 1og0 s PHE 196 Ca 0.17 -0.26 -0.28 0.00 -0.05 0.00 0.00 56.93 56.51 1og0 s PHE 196 Cb 0.14 0.70 -0.10 0.00 -0.63 0.00 0.00 43.02 43.14 1og0 s PHE 196 CO 0.03 -1.19 1.37 -2.14 -0.05 0.00 0.00 175.22 173.25 1og0 s PRO 197 N -3.82 4.12 -0.09 1.99 0.02 -1.26 -4.80 135.00 131.16 1og0 s PRO 197 Ca 0.11 2.33 0.04 0.00 0.02 0.00 0.00 61.00 63.50 1og0 s PRO 197 Cb -0.05 -2.93 0.00 0.00 0.02 0.00 0.00 34.50 31.54 1og0 s PRO 197 CO 0.06 -0.43 -0.21 0.08 -0.33 0.00 0.00 177.00 176.18 1og0 s VAL 198 N -1.17 1.80 -0.22 3.83 1.01 -0.54 -0.70 120.40 124.41 1og0 s VAL 198 Ca 0.53 -0.87 -0.08 0.00 0.00 0.00 0.00 61.98 61.56 1og0 s VAL 198 Cb -0.42 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 1og0 s VAL 198 CO 0.55 0.50 0.09 -0.83 0.00 0.00 0.00 175.10 175.42 1og0 s GLY 199 N 0.39 1.88 -0.32 4.51 0.00 0.24 -1.65 107.32 112.37 1og0 s GLY 199 Ca -0.17 -0.90 -0.12 0.00 0.00 0.00 0.00 44.72 43.54 1og0 s GLY 199 CO 0.07 0.28 0.20 -1.36 0.00 0.00 0.00 173.10 172.30 1og0 s PHE 200 N 0.92 3.21 0.51 1.90 0.08 -0.22 -0.28 117.98 124.11 1og0 s PHE 200 Ca 0.05 -0.23 -0.19 0.00 0.12 0.00 0.00 56.93 56.67 1og0 s PHE 200 Cb -0.14 -2.42 -0.07 0.00 -0.57 0.00 0.00 43.02 39.82 1og0 s PHE 200 CO 0.03 -0.34 1.05 0.15 -0.10 0.00 0.00 175.22 176.00 1og0 s LYS 201 N 1.70 3.68 0.90 0.44 1.02 -1.09 -1.15 119.74 125.24 1og0 s LYS 201 Ca 0.06 1.33 -0.12 0.00 0.02 0.00 0.00 55.97 57.27 1og0 s LYS 201 Cb -0.17 -2.08 0.13 0.00 -0.52 0.00 0.00 37.83 35.20 1og0 s LYS 201 CO 0.09 -0.53 1.09 0.54 -0.92 0.00 0.00 175.35 175.63 1og0 s ASN 202 N -2.16 3.44 0.84 2.83 4.22 -0.88 -4.56 114.94 118.67 1og0 s ASN 202 Ca 0.67 1.40 -0.13 0.00 -2.14 0.00 0.00 52.86 52.65 1og0 s ASN 202 Cb -0.17 -2.08 0.06 0.00 1.28 0.00 0.00 41.25 40.34 1og0 s ASN 202 CO 0.24 -2.65 0.85 0.61 -2.04 0.00 0.00 177.10 174.11 1og0 n GLY 203 N -1.26 -0.89 0.06 0.45 0.00 -0.38 -4.61 105.19 98.56 1og0 n GLY 203 Ca 0.07 -0.57 0.08 0.00 0.00 0.00 0.00 46.02 45.60 1og0 n GLY 203 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1og0 n THR 204 N -3.33 1.04 0.54 2.61 -2.24 -1.26 -1.42 114.28 110.22 1og0 n THR 204 Ca 0.11 0.31 0.07 0.00 -2.27 0.00 0.00 64.05 62.27 1og0 n THR 204 Cb 0.51 -1.18 0.20 0.00 -2.10 0.00 0.00 70.33 67.76 1og0 n THR 204 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1og0 n ASP 205 N -1.85 2.48 0.00 3.42 3.85 -1.26 -1.82 116.55 121.36 1og0 n ASP 205 Ca 0.02 -2.05 0.00 0.00 -0.71 0.00 0.00 54.79 52.05 1og0 n ASP 205 Cb 0.16 -0.32 0.00 0.00 -1.35 0.00 0.00 41.12 39.61 1og0 n ASP 205 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1og0 n GLY 206 N 1.13 1.28 3.90 6.12 0.00 -0.51 -2.54 105.19 114.57 1og0 n GLY 206 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 1og0 n GLY 206 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1og0 s THR 207 N -3.42 4.95 -0.30 2.61 -4.23 -1.26 -4.74 115.64 109.25 1og0 s THR 207 Ca 0.00 0.15 0.16 0.00 -1.18 0.00 0.00 61.69 60.82 1og0 s THR 207 Cb 0.00 -3.79 -0.23 0.00 1.34 0.00 0.00 72.50 69.82 1og0 s THR 207 CO 0.00 -0.56 0.48 0.18 -0.54 0.00 0.00 174.62 174.18 1og0 n LEU 208 N -1.54 0.29 -0.24 4.79 4.77 -1.26 -1.24 117.00 122.56 1og0 n LEU 208 Ca -0.01 -0.19 0.03 0.00 -0.03 0.00 0.00 56.01 55.82 1og0 n LEU 208 Cb 0.55 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.76 1og0 n LEU 208 CO 0.50 0.07 0.79 0.78 -1.33 0.00 0.00 177.39 178.20 1og0 h ASN 209 N 0.00 -0.43 -0.55 -1.43 4.21 -1.98 0.08 115.58 115.48 1og0 h ASN 209 Ca 0.00 0.19 -0.02 0.00 1.21 0.00 0.00 56.30 57.68 1og0 h ASN 209 Cb 0.61 0.36 -0.03 0.00 -1.12 0.00 0.00 38.32 38.14 1og0 h ASN 209 CO 0.00 -0.19 0.28 -0.37 -1.29 0.00 0.00 177.43 175.86 1og0 h VAL 210 N 0.07 1.19 -0.05 2.81 -1.51 -1.97 -0.14 116.25 116.66 1og0 h VAL 210 Ca 0.37 -0.55 -0.18 0.00 -1.23 0.00 0.00 66.70 65.11 1og0 h VAL 210 Cb 0.62 0.45 -0.01 0.00 -2.13 0.00 0.00 31.29 30.23 1og0 h VAL 210 CO -0.66 0.23 -0.76 0.00 -1.23 0.00 0.00 177.57 175.15 1og0 h ALA 211 N 1.48 0.61 -0.35 5.19 0.00 -1.37 -1.41 119.26 123.42 1og0 h ALA 211 Ca 0.20 -0.63 -0.09 0.00 0.00 0.00 0.00 54.91 54.39 1og0 h ALA 211 Cb 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1og0 h ALA 211 CO -0.03 0.80 -0.12 0.28 0.00 0.00 0.00 179.25 180.18 1og0 h VAL 212 N 0.20 1.28 -0.55 0.00 2.07 -0.51 -2.08 116.25 116.66 1og0 h VAL 212 Ca -0.03 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.22 1og0 h VAL 212 Cb 1.34 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 32.42 1og0 h VAL 212 CO 0.12 0.40 0.13 0.44 0.02 0.00 0.00 177.57 178.68 1og0 h ASP 213 N 0.49 0.79 -0.26 0.57 3.32 -0.99 -2.03 116.42 118.32 1og0 h ASP 213 Ca 0.08 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 57.00 1og0 h ASP 213 Cb 0.65 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1og0 h ASP 213 CO 0.04 0.78 0.14 0.00 -1.72 0.00 0.00 179.24 178.48 1og0 h ALA 214 N 1.32 0.32 -0.71 3.45 0.00 -0.98 -0.02 119.26 122.65 1og0 h ALA 214 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1og0 h ALA 214 Cb 0.31 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1og0 h ALA 214 CO -0.00 -0.25 0.42 0.00 0.00 0.00 0.00 179.25 179.42 1og0 h GLN 216 N 0.96 0.34 -0.20 0.00 1.08 -0.97 -2.69 115.11 113.64 1og0 h GLN 216 Ca 0.25 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.40 1og0 h GLN 216 Cb -0.01 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 1og0 h GLN 216 CO -0.05 0.28 0.06 0.00 -0.95 0.00 0.00 178.83 178.18 1og0 h ALA 217 N 1.04 0.26 0.00 3.87 0.00 -0.64 -2.71 119.26 121.08 1og0 h ALA 217 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1og0 h ALA 217 Cb 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1og0 h ALA 217 CO -0.02 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.11 1og0 n ALA 218 N -2.26 1.18 0.41 0.00 0.00 0.37 -1.21 120.51 119.00 1og0 n ALA 218 Ca -0.04 0.14 0.12 0.00 0.00 0.00 0.00 53.44 53.67 1og0 n ALA 218 Cb 0.14 -1.28 0.27 0.00 0.00 0.00 0.00 19.45 18.58 1og0 n ALA 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1og0 h ALA 219 N 2.07 0.97 -1.73 0.00 0.00 -1.14 0.26 119.26 119.69 1og0 h ALA 219 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.46 1og0 h ALA 219 Cb 0.08 0.00 0.07 0.00 0.00 0.00 0.00 17.79 17.94 1og0 h ALA 219 CO 0.00 0.00 0.09 -1.01 0.00 0.00 0.00 179.25 178.33 1og0 s HIS 220 N -3.16 2.29 0.01 0.00 3.76 -0.35 -3.96 115.29 113.88 1og0 s HIS 220 Ca 0.08 -0.02 -0.19 0.00 -0.15 0.00 0.00 55.06 54.78 1og0 s HIS 220 Cb 0.09 -3.00 -0.06 0.00 1.11 0.00 0.00 32.58 30.72 1og0 s HIS 220 CO 0.64 -1.40 0.56 0.45 -0.85 0.00 0.00 174.74 174.14 1og0 s SER 221 N -4.59 6.96 0.15 1.40 0.15 -1.26 -3.62 113.70 112.89 1og0 s SER 221 Ca 0.62 1.14 0.06 0.00 0.70 0.00 0.00 55.95 58.47 1og0 s SER 221 Cb -0.08 -2.34 -0.04 0.00 -1.71 0.00 0.00 66.02 61.84 1og0 s SER 221 CO 0.43 0.17 -0.13 -1.00 1.20 0.00 0.00 173.24 173.90 1og0 s HIS 222 N -0.48 1.45 -0.33 3.44 3.76 -1.25 -4.93 115.29 116.95 1og0 s HIS 222 Ca 0.29 -0.60 0.03 0.00 -0.15 0.00 0.00 55.06 54.63 1og0 s HIS 222 Cb -0.18 -0.73 0.09 0.00 1.11 0.00 0.00 32.58 32.87 1og0 s HIS 222 CO 0.17 0.18 0.03 -1.01 -0.85 0.00 0.00 174.74 173.26 1og0 s HIS 223 N -2.57 3.53 0.26 1.40 3.76 -1.26 -0.68 115.29 119.73 1og0 s HIS 223 Ca 0.14 -2.81 0.02 0.00 -0.15 0.00 0.00 55.06 52.26 1og0 s HIS 223 Cb -0.02 -2.69 -0.01 0.00 1.11 0.00 0.00 32.58 30.97 1og0 s HIS 223 CO 0.03 -0.93 0.06 1.97 -0.85 0.00 0.00 174.74 175.02 1og0 n PHE 224 N 4.32 0.27 -4.13 1.40 1.16 -0.79 -4.93 117.46 114.76 1og0 n PHE 224 Ca 0.01 -1.52 -0.34 0.00 -1.87 0.00 0.00 57.45 53.73 1og0 n PHE 224 Cb 0.42 -0.06 -0.14 0.00 -1.61 0.00 0.00 39.48 38.08 1og0 n PHE 224 CO 0.00 0.00 0.00 -1.64 -1.87 0.00 0.00 176.76 173.25 1og0 s MET 225 N -2.97 3.32 0.00 3.97 -1.94 -1.26 0.65 119.30 121.08 1og0 s MET 225 Ca 0.08 -0.67 0.00 0.00 -1.71 0.00 0.00 55.69 53.40 1og0 s MET 225 Cb 0.00 -2.86 0.00 0.00 2.01 0.00 0.00 34.83 33.98 1og0 s MET 225 CO 0.06 -0.10 0.00 0.45 -0.01 0.00 0.00 175.02 175.42 1og0 n SER 226 N 4.48 0.45 -4.46 3.03 2.88 -0.85 -4.95 113.62 114.19 1og0 n SER 226 Ca -0.19 -0.46 -0.30 0.00 -1.33 0.00 0.00 58.87 56.60 1og0 n SER 226 Cb 0.51 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.85 1og0 n SER 226 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1og0 s VAL 227 N -1.11 2.74 0.96 2.46 -7.23 -1.26 -0.96 120.40 116.01 1og0 s VAL 227 Ca 0.00 -1.39 -0.16 0.00 -1.81 0.00 0.00 61.98 58.62 1og0 s VAL 227 Cb 0.00 -2.21 0.20 0.00 0.56 0.00 0.00 36.38 34.93 1og0 s VAL 227 CO 0.00 0.21 1.32 0.42 -0.31 0.00 0.00 175.10 176.73 1og0 s THR 228 N -1.04 1.99 0.64 5.32 -4.23 0.13 -4.87 115.64 113.58 1og0 s THR 228 Ca 0.16 0.00 0.38 0.00 -1.18 0.00 0.00 61.69 61.05 1og0 s THR 228 Cb -0.10 -2.99 0.41 0.00 1.34 0.00 0.00 72.50 71.15 1og0 s THR 228 CO 0.08 0.00 2.31 0.11 -0.54 0.00 0.00 174.62 176.58 1og0 h LYS 229 N -1.64 0.00 -0.58 3.99 1.79 -1.95 -1.63 116.57 116.56 1og0 h LYS 229 Ca -0.44 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 1og0 h LYS 229 Cb 1.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 1og0 h LYS 229 CO 0.39 0.00 0.00 0.72 -1.08 0.00 0.00 179.45 179.48 1og0 n HIS 230 N -3.40 0.93 -1.08 -1.35 8.25 -1.26 0.04 115.22 117.35 1og0 n HIS 230 Ca -0.03 -0.40 -0.03 0.00 -0.26 0.00 0.00 57.72 57.00 1og0 n HIS 230 Cb 0.09 -0.12 -0.01 0.00 1.12 0.00 0.00 29.99 31.07 1og0 n HIS 230 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1og0 n GLY 231 N 1.08 0.61 3.68 -1.41 0.00 -0.61 -4.88 105.19 103.66 1og0 n GLY 231 Ca 0.18 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 45.25 1og0 n GLY 231 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1og0 s VAL 232 N -2.05 4.09 0.20 1.61 1.01 -1.26 -4.83 120.40 119.17 1og0 s VAL 232 Ca 0.00 -0.78 -0.30 0.00 0.00 0.00 0.00 61.98 60.90 1og0 s VAL 232 Cb 0.00 -2.88 -0.08 0.00 0.00 0.00 0.00 36.38 33.42 1og0 s VAL 232 CO 0.00 0.26 1.09 0.00 0.00 0.00 0.00 175.10 176.45 1og0 s ALA 233 N -1.19 3.38 0.17 5.51 0.00 -1.26 0.20 121.76 128.57 1og0 s ALA 233 Ca 0.23 0.82 -0.14 0.00 0.00 0.00 0.00 51.96 52.87 1og0 s ALA 233 Cb -0.12 -3.34 0.02 0.00 0.00 0.00 0.00 23.12 19.68 1og0 s ALA 233 CO 0.14 -0.18 0.41 0.00 0.00 0.00 0.00 175.76 176.14 1og0 s ALA 234 N -0.49 -0.60 -0.49 0.00 0.00 -0.13 -4.89 121.76 115.15 1og0 s ALA 234 Ca 0.48 -0.43 -0.25 0.00 0.00 0.00 0.00 51.96 51.76 1og0 s ALA 234 Cb -0.30 0.81 0.03 0.00 0.00 0.00 0.00 23.12 23.66 1og0 s ALA 234 CO 0.36 -0.71 0.92 0.42 0.00 0.00 0.00 175.76 176.74 1og0 s ILE 235 N -3.89 4.46 0.26 0.00 1.01 -1.26 -2.00 121.20 119.78 1og0 s ILE 235 Ca 0.10 0.55 -0.16 0.00 0.00 0.00 0.00 60.65 61.14 1og0 s ILE 235 Cb 0.01 -4.46 -0.08 0.00 0.01 0.00 0.00 42.46 37.94 1og0 s ILE 235 CO -0.04 -0.92 0.70 -0.89 0.00 0.00 0.00 174.94 173.79 1og0 s THR 236 N 3.78 4.68 -0.14 2.92 2.01 0.21 -4.93 115.64 124.16 1og0 s THR 236 Ca 0.34 1.02 -0.01 0.00 0.31 0.00 0.00 61.69 63.35 1og0 s THR 236 Cb -0.11 -3.71 0.03 0.00 0.01 0.00 0.00 72.50 68.72 1og0 s THR 236 CO 0.23 0.00 -0.05 -0.89 -0.69 0.00 0.00 174.62 173.22 1og0 s THR 237 N -1.76 1.01 0.36 -0.82 2.01 -1.26 -1.88 115.64 113.30 1og0 s THR 237 Ca 0.48 -0.45 -0.01 0.00 0.31 0.00 0.00 61.69 62.02 1og0 s THR 237 Cb -0.13 -1.13 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 1og0 s THR 237 CO 0.19 0.21 0.58 0.42 -0.69 0.00 0.00 174.62 175.34 1og0 s THR 238 N 1.69 5.07 -0.09 -0.82 -4.23 0.14 -4.96 115.64 112.44 1og0 s THR 238 Ca 0.03 -0.29 0.15 0.00 -1.18 0.00 0.00 61.69 60.39 1og0 s THR 238 Cb -0.14 -3.84 -0.17 0.00 1.34 0.00 0.00 72.50 69.69 1og0 s THR 238 CO -0.08 -0.57 0.78 0.50 -0.54 0.00 0.00 174.62 174.71 1og0 h LYS 239 N 0.81 0.00 0.00 3.99 3.64 -1.86 -3.32 116.57 119.82 1og0 h LYS 239 Ca -0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1og0 h LYS 239 Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1og0 h LYS 239 CO 0.62 0.38 0.00 0.41 -2.27 0.00 0.00 179.45 178.59 1og0 n GLY 240 N 1.45 2.70 3.20 5.01 0.00 -0.48 -4.39 105.19 112.68 1og0 n GLY 240 Ca -0.12 -1.60 -0.34 0.00 0.00 0.00 0.00 46.02 43.96 1og0 n GLY 240 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1og0 s ASN 241 N 0.00 3.82 0.00 1.61 3.84 0.93 -4.85 114.94 120.28 1og0 s ASN 241 Ca 0.00 -0.63 0.22 0.00 0.21 0.00 0.00 52.86 52.65 1og0 s ASN 241 Cb 0.00 -1.61 0.54 0.00 -0.55 0.00 0.00 41.25 39.63 1og0 s ASN 241 CO 0.00 -0.04 1.45 -1.84 -2.79 0.00 0.00 177.10 173.88 1og0 n GLU 242 N 4.68 2.22 -1.98 0.43 0.00 -1.26 -3.53 120.64 121.20 1og0 n GLU 242 Ca -0.19 -1.85 -0.33 0.00 0.00 0.00 0.00 57.16 54.80 1og0 n GLU 242 Cb 0.49 -1.46 0.03 0.00 0.00 0.00 0.00 31.44 30.50 1og0 n GLU 242 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1og0 n HIS 243 N 1.05 3.12 -4.35 -1.84 8.25 -1.26 -4.90 115.22 115.30 1og0 n HIS 243 Ca 0.18 -2.68 -0.34 0.00 -0.26 0.00 0.00 57.72 54.63 1og0 n HIS 243 Cb 0.50 -0.79 -0.12 0.00 1.12 0.00 0.00 29.99 30.70 1og0 n HIS 243 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1og0 s PHE 245 N 0.40 1.85 -0.06 0.00 -0.71 -0.66 -4.67 117.98 114.14 1og0 s PHE 245 Ca -0.03 -1.08 -0.08 0.00 -1.04 0.00 0.00 56.93 54.70 1og0 s PHE 245 Cb -0.14 -1.20 -0.04 0.00 -1.21 0.00 0.00 43.02 40.43 1og0 s PHE 245 CO 0.03 -0.13 0.22 0.08 -1.34 0.00 0.00 175.22 174.08 1og0 s VAL 246 N -3.33 5.38 -0.13 -2.49 1.01 -1.26 -1.06 120.40 118.52 1og0 s VAL 246 Ca 0.33 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.58 1og0 s VAL 246 Cb 0.07 -3.50 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 1og0 s VAL 246 CO 0.15 0.53 -0.17 -0.63 0.00 0.00 0.00 175.10 174.98 1og0 s ILE 247 N -1.13 2.64 -0.24 2.22 1.01 -0.30 -0.54 121.20 124.85 1og0 s ILE 247 Ca 0.20 -0.80 -0.16 0.00 0.00 0.00 0.00 60.65 59.89 1og0 s ILE 247 Cb -0.13 -2.09 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 1og0 s ILE 247 CO 0.10 0.53 0.42 -0.76 0.00 0.00 0.00 174.94 175.23 1og0 s LEU 248 N 0.49 4.08 -0.03 2.97 1.43 0.22 -2.07 118.68 125.77 1og0 s LEU 248 Ca -0.11 0.43 0.08 0.00 -1.03 0.00 0.00 54.13 53.49 1og0 s LEU 248 Cb -0.16 -2.52 0.14 0.00 0.03 0.00 0.00 46.19 43.68 1og0 s LEU 248 CO 0.05 -0.18 1.06 -2.11 0.23 0.00 0.00 176.35 175.40 1og0 n ARG 249 N 5.10 0.26 0.00 1.70 -4.01 -1.26 -0.33 116.66 118.13 1og0 n ARG 249 Ca -0.07 -1.51 0.00 0.00 -1.04 0.00 0.00 57.85 55.23 1og0 n ARG 249 Cb 0.51 -0.62 0.00 0.00 -3.04 0.00 0.00 32.46 29.31 1og0 n ARG 249 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1og0 n GLY 250 N -0.18 -1.86 0.00 2.89 0.00 -1.26 -2.23 105.19 102.55 1og0 n GLY 250 Ca 0.04 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.67 1og0 n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1og0 n GLY 251 N 0.00 -0.18 0.23 -0.02 0.00 -1.07 -4.12 105.19 100.03 1og0 n GLY 251 Ca 0.00 -1.07 0.14 0.00 0.00 0.00 0.00 46.02 45.09 1og0 n GLY 251 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1og0 h LYS 252 N 0.00 0.00 -0.51 1.61 1.57 -1.34 -2.29 116.57 115.60 1og0 h LYS 252 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1og0 h LYS 252 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1og0 h LYS 252 CO 0.00 0.00 0.00 0.36 -0.57 0.00 0.00 179.45 179.24 1og0 n LYS 253 N -2.94 2.30 0.00 3.15 0.00 -1.05 -4.89 118.16 114.72 1og0 n LYS 253 Ca 0.02 -1.64 0.00 0.00 -0.00 0.00 0.00 58.31 56.70 1og0 n LYS 253 Cb 0.39 -1.47 0.00 0.00 -0.00 0.00 0.00 35.03 33.95 1og0 n LYS 253 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1og0 n GLY 254 N 1.02 -2.75 3.73 2.58 0.00 -0.86 -4.94 105.19 103.97 1og0 n GLY 254 Ca 0.15 -1.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.13 1og0 n GLY 254 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1og0 s THR 255 N -0.75 2.71 -0.22 2.61 -4.23 -1.26 -2.61 115.64 111.89 1og0 s THR 255 Ca 0.00 0.29 0.21 0.00 -1.18 0.00 0.00 61.69 61.00 1og0 s THR 255 Cb 0.00 -2.69 0.46 0.00 1.34 0.00 0.00 72.50 71.61 1og0 s THR 255 CO 0.00 -0.25 1.19 -0.46 -0.54 0.00 0.00 174.62 174.56 1og0 n ASN 256 N -3.23 0.81 -0.00 3.99 0.23 -1.26 -4.85 115.26 110.95 1og0 n ASN 256 Ca 0.11 -2.05 0.09 0.00 -0.53 0.00 0.00 54.58 52.20 1og0 n ASN 256 Cb 0.52 -0.20 -0.12 0.00 -2.08 0.00 0.00 39.78 37.89 1og0 n ASN 256 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1og0 n TYR 257 N -0.58 0.00 -1.04 -2.53 0.18 -1.26 -4.48 117.16 107.45 1og0 n TYR 257 Ca 0.01 0.00 -0.29 0.00 1.88 0.00 0.00 57.90 59.50 1og0 n TYR 257 Cb 0.86 -0.14 0.18 0.00 -0.38 0.00 0.00 39.34 39.86 1og0 n TYR 257 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 1og0 s ASP 258 N -3.29 2.50 0.26 9.48 -4.77 -1.26 -4.75 116.67 114.85 1og0 s ASP 258 Ca 0.03 1.36 -0.02 0.00 -3.30 0.00 0.00 52.55 50.61 1og0 s ASP 258 Cb 0.14 -2.04 0.42 0.00 -1.09 0.00 0.00 42.92 40.35 1og0 s ASP 258 CO 0.81 -3.23 1.86 0.00 0.70 0.00 0.00 175.17 175.31 1og0 h ALA 259 N -1.96 1.35 -0.31 2.11 0.00 -1.94 -2.10 119.26 116.42 1og0 h ALA 259 Ca -0.54 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.21 1og0 h ALA 259 Cb 1.32 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1og0 h ALA 259 CO 0.55 0.32 -0.41 -0.22 0.00 0.00 0.00 179.25 179.49 1og0 h LYS 260 N 1.05 0.83 -0.18 0.00 3.64 -1.98 -2.98 116.57 116.96 1og0 h LYS 260 Ca 0.43 -0.48 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 1og0 h LYS 260 Cb 0.26 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1og0 h LYS 260 CO -0.20 1.11 -0.08 0.77 -2.27 0.00 0.00 179.45 178.78 1og0 h SER 261 N 0.61 0.27 -0.27 4.20 0.02 -1.79 -2.50 113.55 114.08 1og0 h SER 261 Ca 0.04 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1og0 h SER 261 Cb 1.01 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 1og0 h SER 261 CO 0.10 0.39 0.11 0.58 -1.14 0.00 0.00 176.83 176.87 1og0 h VAL 262 N 0.27 1.17 -0.64 2.27 2.07 -1.24 -1.45 116.25 118.70 1og0 h VAL 262 Ca 0.06 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1og0 h VAL 262 Cb 0.32 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 1og0 h VAL 262 CO 0.02 0.17 0.41 0.00 0.02 0.00 0.00 177.57 178.19 1og0 h ALA 263 N 0.96 0.81 -0.67 1.67 0.00 -1.31 0.35 119.26 121.06 1og0 h ALA 263 Ca 0.09 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1og0 h ALA 263 Cb 0.16 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1og0 h ALA 263 CO -0.01 0.25 0.31 0.93 0.00 0.00 0.00 179.25 180.74 1og0 h GLU 264 N 0.86 0.95 0.44 0.00 5.08 -1.38 0.46 114.58 121.00 1og0 h GLU 264 Ca 0.23 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1og0 h GLU 264 Cb -0.08 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.00 1og0 h GLU 264 CO -0.05 0.74 -0.21 0.00 -1.00 0.00 0.00 179.01 178.49 1og0 h ALA 265 N 1.40 -0.60 0.00 3.43 0.00 -0.14 -1.37 119.26 121.98 1og0 h ALA 265 Ca 0.23 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1og0 h ALA 265 Cb 0.11 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1og0 h ALA 265 CO -0.03 -0.73 -0.01 1.57 0.00 0.00 0.00 179.25 180.05 1og0 h LYS 266 N -0.80 0.00 -0.01 0.00 2.10 -0.03 -1.07 116.57 116.76 1og0 h LYS 266 Ca -0.06 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.42 1og0 h LYS 266 Cb 0.55 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.86 1og0 h LYS 266 CO 0.10 0.01 -0.78 0.00 -2.00 0.00 0.00 179.45 176.77 1og0 h ALA 267 N 1.99 0.67 0.00 0.07 0.00 0.11 -3.25 119.26 118.86 1og0 h ALA 267 Ca -0.00 -0.68 -0.20 0.00 0.00 0.00 0.00 54.91 54.03 1og0 h ALA 267 Cb 0.42 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1og0 h ALA 267 CO 0.00 0.89 -0.88 1.96 0.00 0.00 0.00 179.25 181.23 1og0 h GLN 268 N 0.08 0.18 -6.69 0.00 4.20 -0.05 -3.46 115.11 109.37 1og0 h GLN 268 Ca -0.02 -0.20 -0.50 0.00 0.06 0.00 0.00 58.65 57.98 1og0 h GLN 268 Cb 1.37 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 29.19 1og0 h GLN 268 CO 0.11 0.95 0.26 -0.48 -0.67 0.00 0.00 178.83 179.00 1og0 s LEU 269 N -7.40 4.49 0.00 1.46 0.05 -0.96 -5.06 118.68 111.25 1og0 s LEU 269 Ca -0.03 1.73 0.00 0.00 0.05 0.00 0.00 54.13 55.88 1og0 s LEU 269 Cb 0.10 -3.63 0.00 0.00 -2.05 0.00 0.00 46.19 40.61 1og0 s LEU 269 CO 0.83 0.08 0.00 -0.81 -0.55 0.00 0.00 176.35 175.90 1og0 n PRO 270 N 1.10 -0.88 -2.62 1.48 -0.04 -1.26 -4.98 135.00 127.81 1og0 n PRO 270 Ca -0.02 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.09 1og0 n PRO 270 Cb 0.49 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.91 1og0 n PRO 270 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1og0 s ALA 271 N -2.00 3.00 -0.91 0.55 0.00 -1.26 -4.17 121.76 116.97 1og0 s ALA 271 Ca 0.00 0.59 -0.13 0.00 0.00 0.00 0.00 51.96 52.42 1og0 s ALA 271 Cb 0.00 -3.23 0.02 0.00 0.00 0.00 0.00 23.12 19.91 1og0 s ALA 271 CO 0.00 -0.15 0.59 0.41 0.00 0.00 0.00 175.76 176.60 1og0 n GLY 272 N -0.08 -1.04 3.01 0.00 0.00 -1.26 -4.95 105.19 100.87 1og0 n GLY 272 Ca 0.07 0.46 -0.28 0.00 0.00 0.00 0.00 46.02 46.27 1og0 n GLY 272 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1og0 s SER 273 N -3.20 2.39 0.35 1.61 1.04 -1.26 -5.11 113.70 109.51 1og0 s SER 273 Ca 0.18 -0.40 -0.10 0.00 0.48 0.00 0.00 55.95 56.11 1og0 s SER 273 Cb -0.10 -1.03 -0.09 0.00 0.10 0.00 0.00 66.02 64.89 1og0 s SER 273 CO 0.86 -0.03 -0.15 0.59 0.98 0.00 0.00 173.24 175.49 1og0 n ASN 274 N 4.50 -2.41 -4.51 7.02 3.02 -1.26 -4.89 115.26 116.73 1og0 n ASN 274 Ca -0.17 0.33 -0.30 0.00 -0.03 0.00 0.00 54.58 54.40 1og0 n ASN 274 Cb 0.51 -0.49 0.20 0.00 -0.61 0.00 0.00 39.78 39.39 1og0 n ASN 274 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1og0 n GLY 275 N 1.58 -1.50 3.89 7.41 0.00 -0.18 -4.77 105.19 111.62 1og0 n GLY 275 Ca 0.04 -0.91 -0.30 0.00 0.00 0.00 0.00 46.02 44.85 1og0 n GLY 275 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1og0 s LEU 276 N -5.44 3.96 0.09 0.99 1.43 -0.30 -4.30 118.68 115.11 1og0 s LEU 276 Ca 0.65 0.93 0.10 0.00 -1.03 0.00 0.00 54.13 54.77 1og0 s LEU 276 Cb -0.22 -3.77 -0.03 0.00 0.03 0.00 0.00 46.19 42.19 1og0 s LEU 276 CO 0.63 -0.28 -0.25 -0.32 0.23 0.00 0.00 176.35 176.35 1og0 s MET 277 N -3.64 1.48 -0.10 1.70 -2.45 0.29 -1.94 119.30 114.64 1og0 s MET 277 Ca 0.48 -1.22 0.03 0.00 -1.25 0.00 0.00 55.69 53.73 1og0 s MET 277 Cb -0.11 -1.82 0.01 0.00 1.25 0.00 0.00 34.83 34.16 1og0 s MET 277 CO 0.30 0.44 -0.21 0.42 1.05 0.00 0.00 175.02 177.03 1og0 s ILE 278 N -0.97 1.83 -0.26 10.11 1.01 -0.11 0.72 121.20 133.52 1og0 s ILE 278 Ca 0.12 -0.87 -0.16 0.00 0.00 0.00 0.00 60.65 59.73 1og0 s ILE 278 Cb -0.10 -1.60 -0.03 0.00 0.01 0.00 0.00 42.46 40.73 1og0 s ILE 278 CO 0.04 0.51 0.43 -0.62 0.00 0.00 0.00 174.94 175.30 1og0 s ASP 279 N 0.55 6.33 0.31 3.58 -1.08 0.56 0.15 116.67 127.07 1og0 s ASP 279 Ca -0.15 0.39 0.15 0.00 -0.52 0.00 0.00 52.55 52.42 1og0 s ASP 279 Cb -0.17 -2.24 0.45 0.00 -1.46 0.00 0.00 42.92 39.50 1og0 s ASP 279 CO 0.05 -0.22 1.63 1.88 0.52 0.00 0.00 175.17 179.03 1og0 h TYR 280 N 8.09 0.00 -3.57 -5.34 0.05 -1.50 -3.42 116.97 111.28 1og0 h TYR 280 Ca -0.31 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.47 1og0 h TYR 280 Cb 1.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.89 1og0 h TYR 280 CO 0.75 0.51 0.00 0.45 -1.05 0.00 0.00 178.16 178.83 1og0 n SER 281 N -3.57 0.00 0.00 3.88 2.88 -1.26 -3.89 113.62 111.66 1og0 n SER 281 Ca -0.00 -0.97 0.00 0.00 -1.33 0.00 0.00 58.87 56.57 1og0 n SER 281 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 1og0 n SER 281 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1og0 n HIS 282 N -1.16 0.00 -0.17 0.66 8.25 -1.26 -2.94 115.22 118.60 1og0 n HIS 282 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 1og0 n HIS 282 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1og0 n HIS 282 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1og0 h GLY 283 N 0.00 1.02 0.27 -1.41 0.00 -1.79 -2.91 103.07 98.24 1og0 h GLY 283 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 47.33 46.50 1og0 h GLY 283 CO 0.00 0.76 0.00 0.70 0.00 0.00 0.00 176.54 178.00 1og0 n ASN 284 N -4.22 0.00 -0.09 0.19 3.02 -1.05 -2.86 115.26 110.25 1og0 n ASN 284 Ca 0.01 -1.34 0.01 0.00 -0.03 0.00 0.00 54.58 53.23 1og0 n ASN 284 Cb 0.39 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.56 1og0 n ASN 284 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1og0 n SER 285 N -0.64 1.05 -4.03 6.41 7.64 -1.10 -4.85 113.62 118.10 1og0 n SER 285 Ca 0.05 -1.02 -0.38 0.00 1.01 0.00 0.00 58.87 58.53 1og0 n SER 285 Cb 0.02 0.16 -0.00 0.00 -1.01 0.00 0.00 64.21 63.38 1og0 n SER 285 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1og0 n ASN 286 N -0.04 -2.88 -3.57 6.43 5.03 -1.13 -2.64 115.26 116.45 1og0 n ASN 286 Ca 0.01 -1.21 -0.17 0.00 0.87 0.00 0.00 54.58 54.08 1og0 n ASN 286 Cb 0.06 -2.16 0.00 0.00 -1.02 0.00 0.00 39.78 36.67 1og0 n ASN 286 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1og0 n LYS 287 N -4.72 -1.47 0.00 3.52 4.76 -1.26 -4.99 118.16 114.00 1og0 n LYS 287 Ca -0.18 0.97 0.00 0.00 -2.87 0.00 0.00 58.31 56.24 1og0 n LYS 287 Cb 0.61 -3.35 0.00 0.00 -1.84 0.00 0.00 35.03 30.45 1og0 n LYS 287 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1og0 n ASP 288 N -2.37 0.00 0.00 4.39 -0.08 -1.08 -5.02 116.55 112.38 1og0 n ASP 288 Ca -0.22 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.12 1og0 n ASP 288 Cb 0.64 0.00 0.27 0.00 2.34 0.00 0.00 41.12 44.36 1og0 n ASP 288 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 1og0 n PHE 289 N 0.00 0.00 0.20 -0.67 -1.74 -1.26 -2.58 117.46 111.41 1og0 n PHE 289 Ca 0.00 0.00 0.06 0.00 -0.56 0.00 0.00 57.45 56.95 1og0 n PHE 289 Cb 0.00 -0.49 0.42 0.00 1.52 0.00 0.00 39.48 40.92 1og0 n PHE 289 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1og0 h ARG 290 N 0.00 0.00 0.00 3.97 3.08 -1.93 -2.92 114.38 116.57 1og0 h ARG 290 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1og0 h ARG 290 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1og0 h ARG 290 CO 0.00 0.33 0.00 0.09 -1.07 0.00 0.00 179.97 179.32 1og0 n ASN 291 N -3.75 0.00 0.07 7.04 3.02 -1.07 -3.87 115.26 116.70 1og0 n ASN 291 Ca -0.01 -1.02 -0.13 0.00 -0.03 0.00 0.00 54.58 53.39 1og0 n ASN 291 Cb 0.42 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.52 1og0 n ASN 291 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1og0 h GLN 292 N 0.00 -0.08 -0.28 3.52 1.08 -1.73 -0.22 115.11 117.40 1og0 h GLN 292 Ca 0.00 0.01 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 1og0 h GLN 292 Cb 0.00 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.43 1og0 h GLN 292 CO 0.00 -0.02 -0.10 -1.35 -0.95 0.00 0.00 178.83 176.41 1og0 h PRO 293 N -0.12 0.46 0.47 1.46 0.11 -1.82 -1.00 132.00 131.56 1og0 h PRO 293 Ca -0.01 -0.12 -0.02 0.00 0.11 0.00 0.00 66.00 65.96 1og0 h PRO 293 Cb 0.10 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.16 1og0 h PRO 293 CO 0.01 0.57 -0.26 0.87 -0.21 0.00 0.00 178.00 178.99 1og0 h LYS 294 N 0.44 -0.65 -0.97 1.05 6.56 -1.66 0.86 116.57 122.20 1og0 h LYS 294 Ca 0.08 0.04 0.16 0.00 -1.06 0.00 0.00 60.65 59.88 1og0 h LYS 294 Cb 0.44 0.15 -0.09 0.00 -0.57 0.00 0.00 32.23 32.17 1og0 h LYS 294 CO 0.02 -0.44 0.61 0.28 -2.06 0.00 0.00 179.45 177.87 1og0 h VAL 295 N -0.68 0.80 0.35 0.50 2.07 -0.82 -1.58 116.25 116.89 1og0 h VAL 295 Ca -0.06 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 1og0 h VAL 295 Cb 0.54 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1og0 h VAL 295 CO 0.08 0.14 -0.17 -1.13 0.02 0.00 0.00 177.57 176.52 1og0 h ASN 296 N 0.78 -0.39 -0.75 0.57 -1.24 -0.49 -0.76 115.58 113.30 1og0 h ASN 296 Ca 0.51 -0.03 0.14 0.00 0.71 0.00 0.00 56.30 57.63 1og0 h ASN 296 Cb 0.75 0.10 -0.10 0.00 0.73 0.00 0.00 38.32 39.81 1og0 h ASN 296 CO -0.28 -0.23 0.29 0.44 -1.29 0.00 0.00 177.43 176.36 1og0 h ASP 297 N -0.53 0.25 0.26 1.15 3.32 0.10 0.94 116.42 121.91 1og0 h ASP 297 Ca -0.05 0.11 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 1og0 h ASP 297 Cb 0.40 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1og0 h ASP 297 CO 0.08 0.09 -0.34 0.58 -1.72 0.00 0.00 179.24 177.93 1og0 h VAL 298 N 0.42 1.26 0.22 -1.35 2.07 -1.22 -1.32 116.25 116.32 1og0 h VAL 298 Ca 0.41 -1.25 -0.30 0.00 0.82 0.00 0.00 66.70 66.38 1og0 h VAL 298 Cb 0.64 1.59 0.03 0.00 -1.52 0.00 0.00 31.29 32.03 1og0 h VAL 298 CO -0.41 0.37 -1.33 0.58 0.02 0.00 0.00 177.57 176.79 1og0 h VAL 299 N 0.11 1.30 -0.77 2.57 2.07 0.11 -2.98 116.25 118.65 1og0 h VAL 299 Ca 0.01 -2.63 -0.02 0.00 0.82 0.00 0.00 66.70 64.89 1og0 h VAL 299 Cb 0.65 3.05 -0.04 0.00 -1.52 0.00 0.00 31.29 33.43 1og0 h VAL 299 CO 0.05 0.79 0.41 0.00 0.02 0.00 0.00 177.57 178.84 1og0 h GLU 301 N 1.06 0.90 0.00 0.00 4.22 -1.30 0.52 114.58 119.99 1og0 h GLU 301 Ca 0.27 -0.05 -0.17 0.00 0.08 0.00 0.00 59.36 59.49 1og0 h GLU 301 Cb 0.05 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 1og0 h GLU 301 CO -0.04 0.60 -0.80 1.96 -2.18 0.00 0.00 179.01 178.54 1og0 h GLN 302 N 0.93 0.00 -0.09 1.92 4.20 -1.16 -3.23 115.11 117.68 1og0 h GLN 302 Ca 0.46 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 59.08 1og0 h GLN 302 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1og0 h GLN 302 CO -0.22 0.80 -0.30 0.82 -0.67 0.00 0.00 178.83 179.26 1og0 h ILE 303 N 0.00 1.40 0.00 2.54 1.08 0.72 -2.20 117.51 121.05 1og0 h ILE 303 Ca -0.01 -1.65 0.00 0.00 -0.39 0.00 0.00 64.86 62.82 1og0 h ILE 303 Cb 1.46 2.21 0.00 0.00 -3.07 0.00 0.00 36.82 37.43 1og0 h ILE 303 CO 0.10 0.48 0.00 0.00 -0.69 0.00 0.00 178.15 178.04 1og0 n ALA 304 N -2.49 1.67 -0.04 1.87 0.00 0.16 -2.66 120.51 119.02 1og0 n ALA 304 Ca -0.08 -0.05 0.02 0.00 0.00 0.00 0.00 53.44 53.34 1og0 n ALA 304 Cb 0.48 -1.15 0.06 0.00 0.00 0.00 0.00 19.45 18.84 1og0 n ALA 304 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1og0 n ASN 305 N -1.20 2.26 0.00 0.00 5.03 -1.22 -4.51 115.26 115.62 1og0 n ASN 305 Ca 0.05 -1.92 0.00 0.00 0.87 0.00 0.00 54.58 53.58 1og0 n ASN 305 Cb 0.06 -0.08 0.00 0.00 -1.02 0.00 0.00 39.78 38.74 1og0 n ASN 305 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1og0 n GLY 306 N -0.07 0.82 3.55 7.41 0.00 -1.09 -5.05 105.19 110.77 1og0 n GLY 306 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1og0 n GLY 306 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1og0 s GLU 307 N -0.41 2.61 0.00 1.61 2.56 -0.83 -4.77 118.70 119.47 1og0 s GLU 307 Ca 0.00 0.52 0.27 0.00 0.00 0.00 0.00 54.97 55.76 1og0 s GLU 307 Cb 0.00 -4.46 0.75 0.00 2.00 0.00 0.00 34.13 32.42 1og0 s GLU 307 CO 0.00 -2.80 1.57 0.09 -0.56 0.00 0.00 175.26 173.55 1og0 n ASN 308 N 12.91 1.77 0.12 -1.70 5.03 -1.26 -4.04 115.26 128.09 1og0 n ASN 308 Ca 0.22 -1.50 0.03 0.00 0.87 0.00 0.00 54.58 54.20 1og0 n ASN 308 Cb 0.52 0.06 0.01 0.00 -1.02 0.00 0.00 39.78 39.34 1og0 n ASN 308 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1og0 h ALA 309 N 4.28 0.68 -1.57 5.41 0.00 -1.97 -3.41 119.26 122.68 1og0 h ALA 309 Ca 0.00 -0.50 -0.63 0.00 0.00 0.00 0.00 54.91 53.78 1og0 h ALA 309 Cb 0.62 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.28 1og0 h ALA 309 CO 0.00 0.63 0.95 0.42 0.00 0.00 0.00 179.25 181.25 1og0 s ILE 310 N -2.98 4.28 -2.47 0.00 1.01 -1.26 -1.15 121.20 118.63 1og0 s ILE 310 Ca 0.02 -0.77 0.23 0.00 0.00 0.00 0.00 60.65 60.13 1og0 s ILE 310 Cb 0.08 -4.84 0.41 0.00 0.01 0.00 0.00 42.46 38.12 1og0 s ILE 310 CO 0.76 -1.65 1.44 0.35 0.00 0.00 0.00 174.94 175.84 1og0 n THR 311 N 6.08 0.35 -3.57 2.92 -2.24 -0.82 -4.94 114.28 112.06 1og0 n THR 311 Ca 0.16 -0.58 -0.07 0.00 -2.27 0.00 0.00 64.05 61.29 1og0 n THR 311 Cb 0.49 0.82 -0.03 0.00 -2.10 0.00 0.00 70.33 69.50 1og0 n THR 311 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1og0 s GLY 312 N -1.57 -0.29 0.08 3.38 0.00 -1.14 -1.28 107.32 106.49 1og0 s GLY 312 Ca 0.36 1.71 0.02 0.00 0.00 0.00 0.00 44.72 46.80 1og0 s GLY 312 CO 0.30 0.68 -0.07 -1.34 0.00 0.00 0.00 173.10 172.67 1og0 s VAL 313 N -2.08 0.62 -0.07 1.40 -7.23 -0.39 -0.93 120.40 111.72 1og0 s VAL 313 Ca 0.05 -1.62 0.05 0.00 -1.81 0.00 0.00 61.98 58.65 1og0 s VAL 313 Cb -0.01 -1.28 -0.00 0.00 0.56 0.00 0.00 36.38 35.65 1og0 s VAL 313 CO -0.04 -0.70 -0.22 -0.32 -0.31 0.00 0.00 175.10 173.51 1og0 s MET 314 N -3.01 2.45 -0.03 4.82 1.75 0.12 -1.45 119.30 123.97 1og0 s MET 314 Ca 0.04 -0.80 0.02 0.00 -1.25 0.00 0.00 55.69 53.70 1og0 s MET 314 Cb -0.00 -2.01 0.01 0.00 2.84 0.00 0.00 34.83 35.67 1og0 s MET 314 CO -0.03 0.27 -0.07 0.42 -0.65 0.00 0.00 175.02 174.96 1og0 s ILE 315 N 0.08 0.65 -0.79 10.11 1.01 -0.19 -1.30 121.20 130.77 1og0 s ILE 315 Ca -0.09 -0.27 -0.16 0.00 0.00 0.00 0.00 60.65 60.13 1og0 s ILE 315 Cb -0.15 -0.59 0.17 0.00 0.01 0.00 0.00 42.46 41.90 1og0 s ILE 315 CO 0.05 0.21 0.82 -1.61 0.00 0.00 0.00 174.94 174.42 1og0 s GLU 316 N 0.32 3.45 0.26 2.79 2.02 -1.26 -1.51 118.70 124.76 1og0 s GLU 316 Ca -0.04 -2.01 0.07 0.00 0.02 0.00 0.00 54.97 53.00 1og0 s GLU 316 Cb -0.09 -4.51 -0.04 0.00 0.10 0.00 0.00 34.13 29.59 1og0 s GLU 316 CO 0.00 -1.46 0.21 0.45 0.02 0.00 0.00 175.26 174.48 1og0 s SER 317 N 2.92 5.55 0.09 -0.19 0.15 0.09 -2.45 113.70 119.87 1og0 s SER 317 Ca 0.19 -0.25 -0.25 0.00 0.70 0.00 0.00 55.95 56.34 1og0 s SER 317 Cb -0.13 -1.40 0.08 0.00 -1.71 0.00 0.00 66.02 62.86 1og0 s SER 317 CO -0.05 -0.06 0.68 0.21 1.20 0.00 0.00 173.24 175.22 1og0 s ASN 318 N -3.86 -0.53 0.25 5.45 3.84 -0.83 -0.30 114.94 118.96 1og0 s ASN 318 Ca 0.33 0.10 -0.05 0.00 0.21 0.00 0.00 52.86 53.45 1og0 s ASN 318 Cb -0.08 0.54 0.49 0.00 -0.55 0.00 0.00 41.25 41.66 1og0 s ASN 318 CO 0.25 -0.84 1.65 0.40 -2.79 0.00 0.00 177.10 175.77 1og0 h ILE 319 N 2.14 0.37 -4.25 -5.21 5.03 -1.85 -0.80 117.51 112.94 1og0 h ILE 319 Ca -0.30 -0.05 -0.52 0.00 -0.12 0.00 0.00 64.86 63.86 1og0 h ILE 319 Cb 1.27 0.20 -0.29 0.00 -3.03 0.00 0.00 36.82 34.98 1og0 h ILE 319 CO 0.37 0.03 -0.82 0.20 -0.68 0.00 0.00 178.15 177.24 1og0 s ASN 320 N -5.18 1.90 1.03 1.72 0.01 -0.70 -2.62 114.94 111.10 1og0 s ASN 320 Ca -0.13 -0.32 -0.12 0.00 -0.71 0.00 0.00 52.86 51.58 1og0 s ASN 320 Cb 0.23 -0.20 0.21 0.00 0.41 0.00 0.00 41.25 41.90 1og0 s ASN 320 CO 0.76 0.18 1.07 -1.83 -1.51 0.00 0.00 177.10 175.77 1og0 s GLU 321 N -0.48 0.13 2.07 -0.60 -1.05 -1.26 -4.52 118.70 112.99 1og0 s GLU 321 Ca 0.06 0.91 0.00 0.00 -0.15 0.00 0.00 54.97 55.78 1og0 s GLU 321 Cb -0.06 -1.67 0.00 0.00 -0.44 0.00 0.00 34.13 31.95 1og0 s GLU 321 CO -0.00 -3.04 0.00 0.41 0.95 0.00 0.00 175.26 173.58 1og0 n GLY 322 N -0.06 -0.01 3.61 -3.83 0.00 0.64 -4.85 105.19 100.69 1og0 n GLY 322 Ca 0.06 -1.33 -0.00 0.00 0.00 0.00 0.00 46.02 44.75 1og0 n GLY 322 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1og0 s ASN 323 N -4.00 -0.07 0.34 1.61 4.22 -1.26 -0.99 114.94 114.78 1og0 s ASN 323 Ca 0.00 -0.08 0.07 0.00 -2.14 0.00 0.00 52.86 50.71 1og0 s ASN 323 Cb 0.00 0.14 -0.03 0.00 1.28 0.00 0.00 41.25 42.64 1og0 s ASN 323 CO 0.00 -0.25 0.27 0.00 -2.04 0.00 0.00 177.10 175.09 1og0 s GLN 324 N -2.37 1.78 0.53 3.55 -2.07 0.45 -4.93 119.66 116.60 1og0 s GLN 324 Ca 0.13 -2.04 0.06 0.00 -1.82 0.00 0.00 55.36 51.69 1og0 s GLN 324 Cb 0.03 0.28 0.04 0.00 -1.09 0.00 0.00 33.01 32.27 1og0 s GLN 324 CO -0.04 -0.65 0.45 0.20 -1.32 0.00 0.00 175.29 173.93 1og0 s GLY 325 N -3.39 2.26 -0.45 2.60 0.00 -1.26 -4.46 107.32 102.62 1og0 s GLY 325 Ca 0.40 -1.46 -0.17 0.00 0.00 0.00 0.00 44.72 43.49 1og0 s GLY 325 CO 0.27 -1.88 0.45 -0.42 0.00 0.00 0.00 173.10 171.53 1og0 s ILE 326 N -2.73 5.09 0.00 0.90 1.01 -1.26 -4.98 121.20 119.24 1og0 s ILE 326 Ca 0.39 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.47 1og0 s ILE 326 Cb -0.03 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.34 1og0 s ILE 326 CO 0.24 -0.53 0.00 -2.65 0.00 0.00 0.00 174.94 172.00 1og0 n PRO 327 N 5.59 0.13 -2.70 2.79 -0.02 -1.26 -5.05 135.00 134.48 1og0 n PRO 327 Ca -0.09 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.33 1og0 n PRO 327 Cb 0.46 0.00 0.09 0.00 -0.02 0.00 0.00 33.50 34.04 1og0 n PRO 327 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1og0 n ALA 328 N -3.00 -1.80 0.00 3.55 0.00 -1.26 -5.05 120.51 112.95 1og0 n ALA 328 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.41 1og0 n ALA 328 Cb 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.49 1og0 n ALA 328 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1og0 n ALA 332 N 0.57 0.00 -2.87 0.00 0.00 -1.26 -5.09 120.51 111.86 1og0 n ALA 332 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.05 1og0 n ALA 332 Cb 0.72 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.17 1og0 n ALA 332 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1og0 n GLY 333 N 0.00 5.57 3.87 0.00 0.00 -1.26 -5.02 105.19 108.35 1og0 n GLY 333 Ca 0.00 -2.64 -0.30 0.00 0.00 0.00 0.00 46.02 43.07 1og0 n GLY 333 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1og0 s LEU 334 N -3.44 3.65 0.05 0.99 1.02 -1.26 -4.96 118.68 114.73 1og0 s LEU 334 Ca 0.35 1.25 -0.30 0.00 0.02 0.00 0.00 54.13 55.45 1og0 s LEU 334 Cb 0.12 -4.19 -0.05 0.00 0.02 0.00 0.00 46.19 42.08 1og0 s LEU 334 CO 0.00 -0.55 1.20 -1.59 0.02 0.00 0.00 176.35 175.43 1og0 s LYS 335 N -4.27 4.42 0.55 1.70 0.00 -1.26 -4.97 119.74 115.91 1og0 s LYS 335 Ca 0.53 1.76 -0.21 0.00 0.00 0.00 0.00 55.97 58.05 1og0 s LYS 335 Cb -0.10 -3.37 -0.06 0.00 0.00 0.00 0.00 37.83 34.30 1og0 s LYS 335 CO 0.37 -0.28 1.11 0.98 0.00 0.00 0.00 175.35 177.53 1og0 n TYR 336 N 4.07 1.40 -2.20 1.78 9.36 -1.26 -3.24 117.16 127.08 1og0 n TYR 336 Ca 0.09 0.46 -0.18 0.00 3.32 0.00 0.00 57.90 61.58 1og0 n TYR 336 Cb 0.46 -2.23 -0.03 0.00 -0.63 0.00 0.00 39.34 36.92 1og0 n TYR 336 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1og0 n GLY 337 N 1.09 0.05 2.91 2.98 0.00 -1.26 -4.84 105.19 106.12 1og0 n GLY 337 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1og0 n GLY 337 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1og0 s VAL 338 N -2.84 1.22 0.19 1.61 1.01 -1.20 -1.72 120.40 118.67 1og0 s VAL 338 Ca 0.00 -0.69 -0.32 0.00 0.00 0.00 0.00 61.98 60.97 1og0 s VAL 338 Cb 0.00 -1.36 -0.15 0.00 0.00 0.00 0.00 36.38 34.87 1og0 s VAL 338 CO 0.00 0.15 1.21 -1.54 0.00 0.00 0.00 175.10 174.93 1og0 n SER 339 N 4.84 1.66 -1.59 3.32 3.41 -1.26 -4.50 113.62 119.50 1og0 n SER 339 Ca -0.13 1.14 0.04 0.00 -0.26 0.00 0.00 58.87 59.67 1og0 n SER 339 Cb 0.48 -1.27 0.30 0.00 -0.26 0.00 0.00 64.21 63.46 1og0 n SER 339 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1og0 n ILE 340 N 1.53 2.15 0.00 -1.33 -5.35 -1.26 -0.41 119.36 114.69 1og0 n ILE 340 Ca 0.14 -1.09 0.00 0.00 -0.27 0.00 0.00 62.75 61.53 1og0 n ILE 340 Cb 0.26 -0.35 0.00 0.00 -1.74 0.00 0.00 39.64 37.82 1og0 n ILE 340 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1og0 n THR 341 N 0.41 0.00 -2.27 7.28 -2.24 -1.26 -4.82 114.28 111.37 1og0 n THR 341 Ca 0.23 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.65 1og0 n THR 341 Cb 1.00 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1og0 n THR 341 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1og0 s ASP 342 N 1.00 5.78 0.43 3.42 1.01 -1.26 -4.75 116.67 122.29 1og0 s ASP 342 Ca 0.00 2.18 -0.24 0.00 0.71 0.00 0.00 52.55 55.20 1og0 s ASP 342 Cb 0.00 -2.58 -0.08 0.00 1.01 0.00 0.00 42.92 41.27 1og0 s ASP 342 CO 0.00 -1.18 1.17 0.00 0.21 0.00 0.00 175.17 175.37 1og0 s ALA 343 N -1.76 3.07 0.29 5.23 0.00 -1.26 -4.75 121.76 122.59 1og0 s ALA 343 Ca 0.72 0.96 0.03 0.00 0.00 0.00 0.00 51.96 53.67 1og0 s ALA 343 Cb -0.24 -3.38 -0.06 0.00 0.00 0.00 0.00 23.12 19.44 1og0 s ALA 343 CO 0.27 -0.60 0.05 0.00 0.00 0.00 0.00 175.76 175.48 1og0 s ILE 345 N -3.39 4.91 1.44 0.00 -4.36 -1.02 -0.26 121.20 118.52 1og0 s ILE 345 Ca 0.35 0.70 -0.23 0.00 -0.26 0.00 0.00 60.65 61.20 1og0 s ILE 345 Cb 0.08 -3.70 0.37 0.00 1.25 0.00 0.00 42.46 40.46 1og0 s ILE 345 CO 0.14 0.18 0.92 -0.83 0.24 0.00 0.00 174.94 175.59 1og0 s GLY 346 N -1.86 1.40 -0.02 6.27 0.00 -1.26 -1.96 107.32 109.89 1og0 s GLY 346 Ca 0.39 -0.82 -0.24 0.00 0.00 0.00 0.00 44.72 44.05 1og0 s GLY 346 CO 0.19 0.20 1.15 -0.25 0.00 0.00 0.00 173.10 174.39 1og0 h TRP 347 N -3.49 0.23 -0.44 1.90 2.91 -0.89 -2.71 115.95 113.47 1og0 h TRP 347 Ca -0.43 -0.10 0.09 0.00 1.13 0.00 0.00 58.89 59.58 1og0 h TRP 347 Cb 1.34 -0.04 -0.08 0.00 -0.51 0.00 0.00 29.16 29.87 1og0 h TRP 347 CO -3.43 0.79 -0.11 0.93 -1.03 0.00 0.00 178.44 175.59 1og0 h GLU 348 N -0.39 0.00 -0.91 2.65 3.07 -1.88 0.30 114.58 117.43 1og0 h GLU 348 Ca -0.01 -0.00 0.10 0.00 -0.50 0.00 0.00 59.36 58.95 1og0 h GLU 348 Cb 0.81 -0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 28.64 1og0 h GLU 348 CO 0.03 0.00 0.55 1.15 -1.40 0.00 0.00 179.01 179.34 1og0 h THR 349 N 0.00 0.94 -0.45 1.13 2.02 -1.92 -1.83 112.91 112.80 1og0 h THR 349 Ca 0.21 -0.31 -0.04 0.00 0.77 0.00 0.00 66.41 67.04 1og0 h THR 349 Cb 0.32 -0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.66 1og0 h THR 349 CO -0.45 0.17 0.13 0.74 0.37 0.00 0.00 175.52 176.47 1og0 h THR 350 N 0.91 1.23 -0.73 3.16 2.02 -0.17 -0.41 112.91 118.92 1og0 h THR 350 Ca 0.43 -0.76 -0.00 0.00 0.77 0.00 0.00 66.41 66.85 1og0 h THR 350 Cb 0.38 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.63 1og0 h THR 350 CO -0.24 0.27 0.45 -0.08 0.37 0.00 0.00 175.52 176.29 1og0 h GLU 351 N 0.58 0.99 0.29 6.66 4.81 -0.40 -0.55 114.58 126.95 1og0 h GLU 351 Ca 0.14 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1og0 h GLU 351 Cb 0.29 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1og0 h GLU 351 CO -0.00 0.69 -0.42 0.22 -0.73 0.00 0.00 179.01 178.78 1og0 h ASP 352 N 1.00 -1.17 -0.97 1.04 1.82 -0.96 -2.00 116.42 115.17 1og0 h ASP 352 Ca 0.26 0.11 0.06 0.00 -0.39 0.00 0.00 57.03 57.08 1og0 h ASP 352 Cb -0.04 0.41 -0.06 0.00 0.68 0.00 0.00 39.33 40.32 1og0 h ASP 352 CO -0.05 -0.53 0.63 0.58 -1.61 0.00 0.00 179.24 178.26 1og0 h VAL 353 N -0.76 1.09 0.00 2.25 2.07 -0.66 -1.52 116.25 118.73 1og0 h VAL 353 Ca -0.01 -0.39 -0.10 0.00 0.82 0.00 0.00 66.70 67.02 1og0 h VAL 353 Cb 0.72 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1og0 h VAL 353 CO -0.14 0.21 -0.45 -0.07 0.02 0.00 0.00 177.57 177.14 1og0 h LEU 354 N 1.14 0.00 -0.12 2.57 3.38 -0.97 -1.71 115.31 119.61 1og0 h LEU 354 Ca 0.41 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.26 1og0 h LEU 354 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1og0 h LEU 354 CO -0.16 0.45 -0.40 0.03 0.09 0.00 0.00 178.44 178.46 1og0 h ARG 355 N 0.00 0.48 -0.34 1.13 2.47 -0.77 0.24 114.38 117.58 1og0 h ARG 355 Ca -0.00 -0.36 -0.08 0.00 -1.26 0.00 0.00 59.98 58.28 1og0 h ARG 355 Cb 1.06 0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 29.43 1og0 h ARG 355 CO 0.06 0.98 -0.12 0.87 0.56 0.00 0.00 179.97 182.32 1og0 h LYS 356 N 0.07 0.59 -0.27 0.04 1.57 -1.24 0.24 116.57 117.57 1og0 h LYS 356 Ca -0.02 -0.18 -0.16 0.00 -1.87 0.00 0.00 60.65 58.43 1og0 h LYS 356 Cb 1.03 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 1og0 h LYS 356 CO 0.08 0.70 -0.46 1.25 -0.57 0.00 0.00 179.45 180.45 1og0 h LEU 357 N 0.54 0.76 -0.54 2.94 5.85 -1.21 -0.72 115.31 122.92 1og0 h LEU 357 Ca 0.10 -0.37 -0.06 0.00 0.84 0.00 0.00 57.88 58.39 1og0 h LEU 357 Cb 0.53 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1og0 h LEU 357 CO 0.03 1.10 0.10 0.00 -0.34 0.00 0.00 178.44 179.33 1og0 h ALA 358 N 0.93 0.72 -0.94 1.25 0.00 0.07 -0.73 119.26 120.55 1og0 h ALA 358 Ca 0.03 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.77 1og0 h ALA 358 Cb 1.01 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.53 1og0 h ALA 358 CO 0.10 0.45 0.59 0.00 0.00 0.00 0.00 179.25 180.39 1og0 h ALA 359 N 1.00 1.31 -0.30 0.00 0.00 -0.09 -2.07 119.26 119.11 1og0 h ALA 359 Ca 0.17 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1og0 h ALA 359 Cb 0.39 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1og0 h ALA 359 CO 0.01 0.34 -0.15 0.00 0.00 0.00 0.00 179.25 179.45 1og0 h ALA 360 N 1.44 0.42 -0.09 0.00 0.00 -0.59 -2.30 119.26 118.14 1og0 h ALA 360 Ca 0.41 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1og0 h ALA 360 Cb 0.21 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1og0 h ALA 360 CO -0.19 0.31 -0.01 0.28 0.00 0.00 0.00 179.25 179.65 1og0 h VAL 361 N 0.38 1.07 0.01 0.00 2.07 -0.67 -1.14 116.25 117.96 1og0 h VAL 361 Ca 0.07 -0.28 -0.15 0.00 0.82 0.00 0.00 66.70 67.16 1og0 h VAL 361 Cb 0.67 1.01 0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1og0 h VAL 361 CO 0.04 0.09 -0.58 0.03 0.02 0.00 0.00 177.57 177.18 1og0 h ARG 362 N 0.13 0.38 -0.86 1.57 3.08 -1.29 -2.97 114.38 114.41 1og0 h ARG 362 Ca 0.03 -0.42 0.05 0.00 0.07 0.00 0.00 59.98 59.72 1og0 h ARG 362 Cb 0.11 0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.23 1og0 h ARG 362 CO 0.00 1.09 0.56 0.37 -1.07 0.00 0.00 179.97 180.93 1og0 h GLN 363 N -0.16 0.98 -0.48 0.04 5.75 -0.93 -1.25 115.11 119.06 1og0 h GLN 363 Ca -0.07 -0.06 -0.08 0.00 -0.15 0.00 0.00 58.65 58.28 1og0 h GLN 363 Cb 1.30 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 29.61 1og0 h GLN 363 CO 0.11 0.65 -0.04 -0.09 -2.65 0.00 0.00 178.83 176.81 1og0 h ARG 364 N 1.00 0.81 -0.38 1.69 2.43 -1.27 -1.49 114.38 117.19 1og0 h ARG 364 Ca 0.36 -0.24 0.11 0.00 -0.81 0.00 0.00 59.98 59.40 1og0 h ARG 364 Cb 0.15 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 1og0 h ARG 364 CO -0.12 0.84 0.28 0.00 -1.51 0.00 0.00 179.97 179.46 1og0 h ARG 365 N 0.75 0.00 0.00 0.20 3.08 -1.06 -2.07 114.38 115.28 1og0 h ARG 365 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1og0 h ARG 365 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1og0 h ARG 365 CO 0.03 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.32 1og0 n GLU 366 N -4.37 0.00 -0.42 0.04 -0.58 -0.62 -3.76 120.64 110.92 1og0 n GLU 366 Ca 0.06 0.26 0.32 0.00 -0.42 0.00 0.00 57.16 57.38 1og0 n GLU 366 Cb 0.47 -0.96 0.49 0.00 -0.57 0.00 0.00 31.44 30.86 1og0 n GLU 366 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1og0 n VAL 367 N -1.28 -0.01 -1.68 2.62 0.31 -0.82 -4.40 118.33 113.07 1og0 n VAL 367 Ca 0.00 0.90 -0.18 0.00 -0.01 0.00 0.00 64.34 65.05 1og0 n VAL 367 Cb 0.00 -1.50 0.12 0.00 -0.91 0.00 0.00 33.84 31.55 1og0 n VAL 367 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1og0 n ASN 368 N -3.18 0.16 0.00 4.52 4.13 -0.80 -4.98 115.26 115.12 1og0 n ASN 368 Ca 0.27 -1.35 0.00 0.00 1.68 0.00 0.00 54.58 55.18 1og0 n ASN 368 Cb 1.20 -0.60 0.00 0.00 -1.54 0.00 0.00 39.78 38.84 1og0 n ASN 368 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71