#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t03 s ILE 2 N 0.00 4.74 0.20 4.25 -1.09 -1.26 -4.84 121.20 123.20 1t03 s ILE 2 Ca 0.00 -1.02 -0.20 0.00 -2.23 0.00 0.00 60.65 57.20 1t03 s ILE 2 Cb 0.00 -3.46 -0.08 0.00 -1.58 0.00 0.00 42.46 37.34 1t03 s ILE 2 CO 0.00 -0.15 0.70 -0.44 -1.23 0.00 0.00 174.94 173.82 1t03 s SER 3 N -3.29 7.08 -0.07 3.58 0.01 -1.14 -4.60 113.70 115.28 1t03 s SER 3 Ca 0.32 1.41 0.05 0.00 1.31 0.00 0.00 55.95 59.04 1t03 s SER 3 Cb -0.10 -2.41 0.26 0.00 0.21 0.00 0.00 66.02 63.98 1t03 s SER 3 CO 0.25 0.08 0.92 -2.65 0.41 0.00 0.00 173.24 172.25 1t03 n PRO 4 N 0.93 2.24 -2.67 12.44 -0.02 -1.26 -4.75 135.00 141.91 1t03 n PRO 4 Ca -0.04 -1.02 -0.36 0.00 -2.02 0.00 0.00 63.50 60.07 1t03 n PRO 4 Cb 0.51 -1.72 -0.05 0.00 -0.02 0.00 0.00 33.50 32.21 1t03 n PRO 4 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1t03 s ILE 5 N -1.58 4.01 0.68 4.25 1.01 -1.26 -5.01 121.20 123.30 1t03 s ILE 5 Ca 0.18 1.51 -0.17 0.00 0.00 0.00 0.00 60.65 62.17 1t03 s ILE 5 Cb 0.13 -3.77 0.01 0.00 0.01 0.00 0.00 42.46 38.85 1t03 s ILE 5 CO 0.05 -0.02 1.24 -0.70 0.00 0.00 0.00 174.94 175.52 1t03 s GLU 6 N -2.50 2.40 -0.25 2.79 2.12 -1.26 -4.90 118.70 117.10 1t03 s GLU 6 Ca 0.56 1.89 -0.13 0.00 0.36 0.00 0.00 54.97 57.65 1t03 s GLU 6 Cb -0.18 -1.85 -0.04 0.00 0.26 0.00 0.00 34.13 32.32 1t03 s GLU 6 CO 0.23 -1.67 0.30 0.95 -0.54 0.00 0.00 175.26 174.53 1t03 s THR 7 N -1.70 5.24 0.05 -1.70 -4.23 -1.26 -4.98 115.64 107.06 1t03 s THR 7 Ca 0.78 0.45 -0.31 0.00 -1.18 0.00 0.00 61.69 61.43 1t03 s THR 7 Cb -0.33 -3.63 -0.08 0.00 1.34 0.00 0.00 72.50 69.80 1t03 s THR 7 CO 0.41 0.24 1.61 -0.69 -0.54 0.00 0.00 174.62 175.65 1t03 s VAL 8 N 1.61 3.18 -0.02 2.29 1.01 -1.26 -4.83 120.40 122.38 1t03 s VAL 8 Ca 0.13 0.61 -0.30 0.00 0.00 0.00 0.00 61.98 62.41 1t03 s VAL 8 Cb -0.15 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 1t03 s VAL 8 CO 0.08 -0.00 1.18 -2.16 0.00 0.00 0.00 175.10 174.20 1t03 s PRO 9 N 2.65 4.39 -0.04 2.72 0.04 -1.26 -4.31 135.00 139.18 1t03 s PRO 9 Ca 0.72 1.68 0.06 0.00 0.04 0.00 0.00 61.00 63.50 1t03 s PRO 9 Cb -0.38 -3.50 -0.01 0.00 0.04 0.00 0.00 34.50 30.65 1t03 s PRO 9 CO 0.31 -0.37 -0.23 0.14 0.04 0.00 0.00 177.00 176.89 1t03 s VAL 10 N 1.83 1.85 0.47 -0.36 -7.23 -1.26 -5.12 120.40 110.58 1t03 s VAL 10 Ca 0.56 -0.97 0.06 0.00 -1.81 0.00 0.00 61.98 59.83 1t03 s VAL 10 Cb -0.26 -1.56 -0.01 0.00 0.56 0.00 0.00 36.38 35.12 1t03 s VAL 10 CO 0.24 0.52 0.31 -0.54 -0.31 0.00 0.00 175.10 175.32 1t03 s LYS 11 N -0.24 2.32 0.26 4.82 1.02 -1.26 -4.81 119.74 121.85 1t03 s LYS 11 Ca 0.00 -1.85 -0.02 0.00 0.02 0.00 0.00 55.97 54.12 1t03 s LYS 11 Cb -0.12 -2.12 -0.04 0.00 -0.52 0.00 0.00 37.83 35.03 1t03 s LYS 11 CO 0.02 -0.34 0.48 -0.51 -0.92 0.00 0.00 175.35 174.08 1t03 s LEU 12 N -4.11 4.12 0.26 3.17 1.43 -1.26 -1.93 118.68 120.36 1t03 s LEU 12 Ca 0.39 0.54 -0.28 0.00 -1.03 0.00 0.00 54.13 53.74 1t03 s LEU 12 Cb -0.00 -3.34 -0.15 0.00 0.03 0.00 0.00 46.19 42.73 1t03 s LEU 12 CO 0.23 -0.15 0.90 0.29 0.23 0.00 0.00 176.35 177.85 1t03 n LYS 13 N -0.96 1.00 -1.61 1.70 5.02 0.24 -4.51 118.16 119.05 1t03 n LYS 13 Ca -0.03 0.35 -0.65 0.00 -2.02 0.00 0.00 58.31 55.96 1t03 n LYS 13 Cb 0.54 -1.64 -0.10 0.00 -0.02 0.00 0.00 35.03 33.81 1t03 n LYS 13 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1t03 n PRO 14 N 0.87 0.08 -0.02 1.97 -0.02 -1.26 -1.72 135.00 134.90 1t03 n PRO 14 Ca 0.12 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 1t03 n PRO 14 Cb 0.30 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 1t03 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1t03 n GLY 15 N 4.98 2.33 2.74 -1.23 0.00 -1.26 -5.03 105.19 107.72 1t03 n GLY 15 Ca 0.37 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.20 1t03 n GLY 15 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1t03 n MET 16 N -2.00 -0.69 -4.01 1.61 2.81 -0.70 -5.12 117.12 109.02 1t03 n MET 16 Ca 0.00 -1.57 -0.09 0.00 -1.81 0.00 0.00 57.70 54.24 1t03 n MET 16 Cb 0.00 -0.86 -0.09 0.00 -0.71 0.00 0.00 33.22 31.57 1t03 n MET 16 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1t03 s ASP 17 N -4.32 0.26 1.05 7.83 2.15 -1.26 -4.94 116.67 117.43 1t03 s ASP 17 Ca 0.52 -0.93 -0.18 0.00 0.43 0.00 0.00 52.55 52.39 1t03 s ASP 17 Cb -0.02 0.31 0.03 0.00 -0.30 0.00 0.00 42.92 42.95 1t03 s ASP 17 CO 0.36 -0.72 -0.11 0.61 -0.17 0.00 0.00 175.17 175.14 1t03 n GLY 18 N -0.05 -2.57 3.68 2.66 0.00 -1.26 -4.92 105.19 102.73 1t03 n GLY 18 Ca -0.11 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 1t03 n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1t03 s PRO 19 N -3.24 4.31 -0.66 1.61 0.04 -1.26 -4.99 135.00 130.81 1t03 s PRO 19 Ca 0.53 0.94 0.06 0.00 0.04 0.00 0.00 61.00 62.57 1t03 s PRO 19 Cb -0.12 -3.55 0.21 0.00 0.04 0.00 0.00 34.50 31.08 1t03 s PRO 19 CO 0.68 -0.25 0.63 1.63 0.04 0.00 0.00 177.00 179.73 1t03 n LYS 20 N 4.94 2.16 -3.76 4.56 5.02 -1.24 -0.93 118.16 128.92 1t03 n LYS 20 Ca 0.03 -4.54 -0.37 0.00 -2.02 0.00 0.00 58.31 51.41 1t03 n LYS 20 Cb 0.49 -2.24 -0.13 0.00 -0.02 0.00 0.00 35.03 33.14 1t03 n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1t03 s VAL 21 N -1.99 4.07 0.53 -0.18 1.01 0.18 -4.84 120.40 119.17 1t03 s VAL 21 Ca 0.33 -0.51 -0.19 0.00 0.00 0.00 0.00 61.98 61.62 1t03 s VAL 21 Cb 0.07 -3.03 -0.11 0.00 0.00 0.00 0.00 36.38 33.31 1t03 s VAL 21 CO -0.08 0.17 0.30 2.29 0.00 0.00 0.00 175.10 177.78 1t03 n LYS 22 N 4.89 0.33 -3.68 2.72 0.00 -1.26 -3.86 118.16 117.30 1t03 n LYS 22 Ca -0.15 0.13 -0.34 0.00 -0.00 0.00 0.00 58.31 57.95 1t03 n LYS 22 Cb 0.49 -1.43 -0.05 0.00 -0.00 0.00 0.00 35.03 34.04 1t03 n LYS 22 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 1t03 s GLN 23 N -1.64 3.65 -0.04 -1.58 2.00 -1.26 -4.50 119.66 116.29 1t03 s GLN 23 Ca 0.64 0.01 -0.10 0.00 -2.00 0.00 0.00 55.36 53.91 1t03 s GLN 23 Cb -0.48 -3.01 -0.05 0.00 0.80 0.00 0.00 33.01 30.26 1t03 s GLN 23 CO 0.59 0.59 0.28 -1.58 -0.50 0.00 0.00 175.29 174.67 1t03 s TRP 24 N -1.39 3.64 0.81 1.67 0.51 -1.26 -5.06 118.94 117.86 1t03 s TRP 24 Ca 0.32 0.73 -0.13 0.00 -2.12 0.00 0.00 56.10 54.90 1t03 s TRP 24 Cb -0.13 -2.09 0.09 0.00 -0.81 0.00 0.00 33.47 30.52 1t03 s TRP 24 CO 0.18 0.67 1.18 -2.14 -0.51 0.00 0.00 176.95 176.33 1t03 s PRO 25 N -1.23 1.64 0.27 4.98 0.02 -1.26 -4.92 135.00 134.50 1t03 s PRO 25 Ca 0.22 1.65 0.03 0.00 0.02 0.00 0.00 61.00 62.92 1t03 s PRO 25 Cb -0.14 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 1t03 s PRO 25 CO 0.11 -2.19 0.20 -0.51 -0.33 0.00 0.00 177.00 174.28 1t03 s LEU 26 N -5.83 1.49 0.45 -5.54 1.43 -1.26 -5.15 118.68 104.27 1t03 s LEU 26 Ca 0.71 -1.58 -0.21 0.00 -1.03 0.00 0.00 54.13 52.02 1t03 s LEU 26 Cb -0.26 0.44 -0.10 0.00 0.03 0.00 0.00 46.19 46.30 1t03 s LEU 26 CO 0.52 -0.95 1.00 0.42 0.23 0.00 0.00 176.35 177.57 1t03 s THR 27 N -3.76 4.03 0.39 5.49 -4.23 -1.26 -4.82 115.64 111.47 1t03 s THR 27 Ca 0.39 1.30 0.14 0.00 -1.18 0.00 0.00 61.69 62.34 1t03 s THR 27 Cb 0.05 -3.55 0.35 0.00 1.34 0.00 0.00 72.50 70.69 1t03 s THR 27 CO 0.20 -0.23 1.86 -0.08 -0.54 0.00 0.00 174.62 175.83 1t03 h GLU 28 N 1.84 0.51 0.77 3.99 4.81 -1.98 0.51 114.58 125.02 1t03 h GLU 28 Ca -0.49 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 58.67 1t03 h GLU 28 Cb 1.20 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 30.48 1t03 h GLU 28 CO 0.60 0.34 -0.37 1.49 -0.73 0.00 0.00 179.01 180.34 1t03 h GLU 29 N 0.53 -0.99 -0.04 1.92 4.81 -1.98 -0.49 114.58 118.33 1t03 h GLU 29 Ca 0.46 0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.78 1t03 h GLU 29 Cb 0.96 0.23 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 1t03 h GLU 29 CO -0.20 -0.66 -0.08 0.87 -0.73 0.00 0.00 179.01 178.22 1t03 h LYS 30 N -1.06 -0.12 0.13 1.92 1.57 -0.99 -1.71 116.57 116.31 1t03 h LYS 30 Ca -0.11 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1t03 h LYS 30 Cb 0.80 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 1t03 h LYS 30 CO 0.17 -0.08 -0.09 0.82 -0.57 0.00 0.00 179.45 179.70 1t03 h ILE 31 N -0.12 0.00 0.00 1.86 2.04 -0.14 0.33 117.51 121.48 1t03 h ILE 31 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.91 1t03 h ILE 31 Cb 0.19 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.27 1t03 h ILE 31 CO -0.12 0.00 0.40 0.50 0.00 0.00 0.00 178.15 178.94 1t03 h LYS 32 N -0.21 0.00 0.00 2.37 1.63 -1.11 0.53 116.57 119.78 1t03 h LYS 32 Ca -0.02 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1t03 h LYS 32 Cb 0.17 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.80 1t03 h LYS 32 CO 0.01 0.00 -0.00 0.00 -3.45 0.00 0.00 179.45 176.01 1t03 h ALA 33 N 1.02 -0.01 -0.88 5.00 0.00 -0.27 -3.20 119.26 120.93 1t03 h ALA 33 Ca 0.00 -0.15 0.15 0.00 0.00 0.00 0.00 54.91 54.91 1t03 h ALA 33 Cb 0.80 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.50 1t03 h ALA 33 CO 0.00 -0.01 0.47 -0.07 0.00 0.00 0.00 179.25 179.64 1t03 h LEU 34 N -1.00 0.59 -1.07 0.00 3.38 0.38 0.34 115.31 117.93 1t03 h LEU 34 Ca -0.00 0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.14 1t03 h LEU 34 Cb 0.31 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.98 1t03 h LEU 34 CO 0.00 0.25 0.62 0.58 0.09 0.00 0.00 178.44 179.98 1t03 h VAL 35 N 0.67 1.02 0.14 1.22 2.07 -0.91 0.44 116.25 120.89 1t03 h VAL 35 Ca 0.48 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.64 1t03 h VAL 35 Cb 0.67 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1t03 h VAL 35 CO -0.36 0.19 -0.22 -0.33 0.02 0.00 0.00 177.57 176.88 1t03 h GLU 36 N 1.05 -0.36 -0.38 1.57 5.08 -0.91 0.15 114.58 120.77 1t03 h GLU 36 Ca 0.44 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1t03 h GLU 36 Cb 0.31 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 1t03 h GLU 36 CO -0.19 -0.24 0.23 -0.84 -1.00 0.00 0.00 179.01 176.97 1t03 h ILE 37 N -0.37 1.12 0.00 3.13 3.07 -1.41 -1.98 117.51 121.06 1t03 h ILE 37 Ca -0.02 -0.29 -0.01 0.00 1.55 0.00 0.00 64.86 66.10 1t03 h ILE 37 Cb 0.35 0.62 -0.00 0.00 -0.27 0.00 0.00 36.82 37.51 1t03 h ILE 37 CO -0.07 0.13 -0.05 0.00 -1.05 0.00 0.00 178.15 177.10 1t03 h THR 39 N 0.00 1.58 -0.56 0.00 2.02 -0.42 -2.84 112.91 112.69 1t03 h THR 39 Ca -0.00 -1.91 0.10 0.00 0.77 0.00 0.00 66.41 65.37 1t03 h THR 39 Cb 0.15 2.82 -0.08 0.00 -1.74 0.00 0.00 68.15 69.29 1t03 h THR 39 CO 0.01 0.51 0.09 -0.08 0.37 0.00 0.00 175.52 176.42 1t03 h GLU 40 N -0.61 0.21 -0.65 6.66 4.57 -0.78 0.42 114.58 124.40 1t03 h GLU 40 Ca -0.02 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 1t03 h GLU 40 Cb 0.93 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.44 1t03 h GLU 40 CO 0.03 0.14 0.32 0.52 -1.18 0.00 0.00 179.01 178.85 1t03 h MET 41 N 0.22 0.92 -0.23 1.92 2.86 -1.35 -0.48 114.93 118.79 1t03 h MET 41 Ca 0.29 -0.11 -0.05 0.00 -2.06 0.00 0.00 59.70 57.76 1t03 h MET 41 Cb 0.42 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1t03 h MET 41 CO -0.39 0.70 -0.08 1.49 1.06 0.00 0.00 176.91 179.68 1t03 h GLU 42 N 0.92 0.36 0.02 1.72 4.81 -0.70 -1.20 114.58 120.50 1t03 h GLU 42 Ca 0.23 -0.08 -0.23 0.00 -0.13 0.00 0.00 59.36 59.15 1t03 h GLU 42 Cb 0.08 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1t03 h GLU 42 CO -0.03 0.45 -0.98 -0.22 -0.73 0.00 0.00 179.01 177.50 1t03 h LYS 43 N 0.34 0.40 0.00 1.92 3.64 -0.17 -3.03 116.57 119.66 1t03 h LYS 43 Ca 0.07 -0.45 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1t03 h LYS 43 Cb 0.37 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1t03 h LYS 43 CO 0.02 1.12 0.00 0.39 -2.27 0.00 0.00 179.45 178.71 1t03 n GLU 44 N -3.72 0.93 -0.56 1.90 1.02 -0.30 -4.84 120.64 115.06 1t03 n GLU 44 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 1t03 n GLU 44 Cb 0.86 -1.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.28 1t03 n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1t03 n GLY 45 N 0.44 0.94 0.28 0.62 0.00 -0.96 -4.85 105.19 101.65 1t03 n GLY 45 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1t03 n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1t03 h LYS 46 N 1.60 0.28 -4.35 1.61 1.79 -1.50 -3.44 116.57 112.57 1t03 h LYS 46 Ca 0.00 -0.02 -0.19 0.00 -2.18 0.00 0.00 60.65 58.26 1t03 h LYS 46 Cb 0.00 -0.06 -0.14 0.00 -1.58 0.00 0.00 32.23 30.45 1t03 h LYS 46 CO 0.00 0.21 -0.53 0.96 -1.08 0.00 0.00 179.45 179.01 1t03 s ILE 47 N -5.22 0.04 0.17 1.86 -4.36 -1.21 -1.55 121.20 110.94 1t03 s ILE 47 Ca -0.07 -1.83 0.01 0.00 -0.26 0.00 0.00 60.65 58.50 1t03 s ILE 47 Cb 0.17 -2.25 -0.04 0.00 1.25 0.00 0.00 42.46 41.59 1t03 s ILE 47 CO 0.71 -0.18 0.04 -0.44 0.24 0.00 0.00 174.94 175.31 1t03 s SER 48 N -3.09 0.84 -0.17 4.36 0.01 0.12 -4.41 113.70 111.37 1t03 s SER 48 Ca 0.30 -1.23 -0.17 0.00 1.31 0.00 0.00 55.95 56.16 1t03 s SER 48 Cb 0.06 0.20 -0.04 0.00 0.21 0.00 0.00 66.02 66.45 1t03 s SER 48 CO 0.07 -0.66 0.43 -0.75 0.41 0.00 0.00 173.24 172.74 1t03 s LYS 49 N -3.99 4.25 0.41 12.44 2.20 -1.26 -0.57 119.74 133.22 1t03 s LYS 49 Ca 0.27 0.30 0.02 0.00 -0.36 0.00 0.00 55.97 56.20 1t03 s LYS 49 Cb 0.07 -3.49 -0.01 0.00 -1.51 0.00 0.00 37.83 32.89 1t03 s LYS 49 CO 0.05 0.05 0.61 0.42 -0.36 0.00 0.00 175.35 176.13 1t03 s ILE 50 N 1.00 4.14 0.76 5.43 1.01 -1.07 -4.91 121.20 127.55 1t03 s ILE 50 Ca 0.22 -0.60 -0.11 0.00 0.00 0.00 0.00 60.65 60.16 1t03 s ILE 50 Cb -0.15 -3.51 0.17 0.00 0.01 0.00 0.00 42.46 38.99 1t03 s ILE 50 CO 0.08 -0.32 1.04 0.61 0.00 0.00 0.00 174.94 176.35 1t03 n GLY 51 N -1.95 -0.98 0.21 6.18 0.00 -1.26 -4.79 105.19 102.60 1t03 n GLY 51 Ca 0.00 -1.77 0.10 0.00 0.00 0.00 0.00 46.02 44.35 1t03 n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t03 h PRO 52 N 0.00 0.00 0.00 1.61 0.13 -2.01 -3.24 132.00 128.49 1t03 h PRO 52 Ca -0.34 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1t03 h PRO 52 Cb 0.98 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.11 1t03 h PRO 52 CO 0.26 0.13 -0.00 1.05 -0.23 0.00 0.00 178.00 179.20 1t03 h GLU 53 N 0.00 0.00 -6.26 0.86 9.09 -2.04 -3.41 114.58 112.82 1t03 h GLU 53 Ca -0.00 0.00 -0.57 0.00 0.05 0.00 0.00 59.36 58.83 1t03 h GLU 53 Cb 1.03 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.11 1t03 h GLU 53 CO 0.02 0.00 1.25 1.21 0.05 0.00 0.00 179.01 181.54 1t03 s ASN 54 N -5.44 6.00 0.07 3.06 3.84 -1.22 -4.82 114.94 116.42 1t03 s ASN 54 Ca -0.02 1.45 0.26 0.00 0.21 0.00 0.00 52.86 54.76 1t03 s ASN 54 Cb 0.11 -2.53 0.69 0.00 -0.55 0.00 0.00 41.25 38.97 1t03 s ASN 54 CO 0.48 -1.60 1.57 -0.81 -2.79 0.00 0.00 177.10 173.95 1t03 n PRO 55 N 8.25 0.13 -2.84 0.43 -0.04 -1.26 -4.91 135.00 134.76 1t03 n PRO 55 Ca 0.22 0.06 -0.33 0.00 -0.04 0.00 0.00 63.50 63.42 1t03 n PRO 55 Cb 0.46 -1.61 -0.06 0.00 -0.04 0.00 0.00 33.50 32.25 1t03 n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1t03 s TYR 56 N -3.07 3.34 -0.21 0.54 1.51 -1.26 -4.78 117.35 113.41 1t03 s TYR 56 Ca 0.10 1.51 -0.26 0.00 -1.01 0.00 0.00 57.07 57.41 1t03 s TYR 56 Cb 0.16 -2.78 0.07 0.00 -0.11 0.00 0.00 41.96 39.30 1t03 s TYR 56 CO 0.65 -0.10 0.70 1.21 -1.11 0.00 0.00 175.55 176.90 1t03 s ASN 57 N -2.31 -0.72 -0.00 2.29 2.47 -0.11 -4.55 114.94 112.01 1t03 s ASN 57 Ca 0.60 1.25 0.05 0.00 0.42 0.00 0.00 52.86 55.18 1t03 s ASN 57 Cb -0.09 1.22 -0.01 0.00 -1.45 0.00 0.00 41.25 40.92 1t03 s ASN 57 CO 0.16 -0.34 -0.16 0.42 -3.72 0.00 0.00 177.10 173.46 1t03 s THR 58 N -0.02 1.24 0.55 -5.21 -4.23 -0.99 0.50 115.64 107.47 1t03 s THR 58 Ca -0.03 -0.72 -0.21 0.00 -1.18 0.00 0.00 61.69 59.55 1t03 s THR 58 Cb -0.04 -1.04 -0.06 0.00 1.34 0.00 0.00 72.50 72.70 1t03 s THR 58 CO 0.03 0.31 1.08 -2.65 -0.54 0.00 0.00 174.62 172.85 1t03 n PRO 59 N 2.58 1.21 -3.30 3.99 -0.02 -1.25 -4.33 135.00 133.89 1t03 n PRO 59 Ca -0.15 0.45 -0.06 0.00 -2.02 0.00 0.00 63.50 61.73 1t03 n PRO 59 Cb 0.55 -2.25 -0.06 0.00 -0.02 0.00 0.00 33.50 31.71 1t03 n PRO 59 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1t03 s VAL 60 N -1.40 -0.70 0.18 -1.45 0.11 -1.26 -2.22 120.40 113.66 1t03 s VAL 60 Ca 0.72 -0.05 0.01 0.00 -2.93 0.00 0.00 61.98 59.73 1t03 s VAL 60 Cb -0.45 -0.86 0.01 0.00 -1.53 0.00 0.00 36.38 33.55 1t03 s VAL 60 CO 0.50 -0.09 0.10 2.22 -3.33 0.00 0.00 175.10 174.49 1t03 n PHE 61 N 5.38 -0.73 -4.17 1.54 -0.00 -0.91 -4.96 117.46 113.61 1t03 n PHE 61 Ca -0.03 -0.80 -0.12 0.00 -0.00 0.00 0.00 57.45 56.50 1t03 n PHE 61 Cb 0.50 -0.14 -0.10 0.00 -0.00 0.00 0.00 39.48 39.74 1t03 n PHE 61 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1t03 s ALA 62 N -2.28 1.05 0.01 1.98 0.00 -1.26 -2.13 121.76 119.13 1t03 s ALA 62 Ca 0.07 -1.30 -0.13 0.00 0.00 0.00 0.00 51.96 50.61 1t03 s ALA 62 Cb -0.01 0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.24 1t03 s ALA 62 CO 0.05 -0.16 0.28 -1.50 0.00 0.00 0.00 175.76 174.42 1t03 s ILE 63 N -3.18 0.07 -0.11 0.00 1.10 -0.89 -4.96 121.20 113.24 1t03 s ILE 63 Ca 0.10 -0.61 -0.02 0.00 -0.51 0.00 0.00 60.65 59.61 1t03 s ILE 63 Cb 0.02 -0.73 -0.03 0.00 0.15 0.00 0.00 42.46 41.87 1t03 s ILE 63 CO -0.03 -0.34 -0.04 -1.59 -2.11 0.00 0.00 174.94 170.84 1t03 s LYS 64 N -1.86 3.21 -0.53 3.50 -2.85 -1.26 -0.31 119.74 119.64 1t03 s LYS 64 Ca -0.10 -0.50 -0.27 0.00 -1.00 0.00 0.00 55.97 54.10 1t03 s LYS 64 Cb -0.04 -2.78 0.03 0.00 -2.06 0.00 0.00 37.83 32.98 1t03 s LYS 64 CO 0.01 0.50 1.10 0.21 0.10 0.00 0.00 175.35 177.27 1t03 s LYS 65 N -0.33 3.56 0.48 1.78 2.47 -0.86 -4.89 119.74 121.94 1t03 s LYS 65 Ca 0.06 0.26 0.37 0.00 -1.56 0.00 0.00 55.97 55.10 1t03 s LYS 65 Cb -0.12 -3.97 1.28 0.00 -1.46 0.00 0.00 37.83 33.56 1t03 s LYS 65 CO 0.02 -1.50 1.26 1.63 0.16 0.00 0.00 175.35 176.92 1t03 n LYS 66 N 7.94 0.00 0.00 4.03 4.76 -1.26 -0.97 118.16 132.66 1t03 n LYS 66 Ca 0.08 0.90 0.00 0.00 -2.87 0.00 0.00 58.31 56.42 1t03 n LYS 66 Cb 0.49 -2.11 0.00 0.00 -1.84 0.00 0.00 35.03 31.56 1t03 n LYS 66 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1t03 n ASP 67 N -3.44 0.00 0.32 4.39 2.03 -1.26 -4.06 116.55 114.53 1t03 n ASP 67 Ca 0.33 0.00 0.19 0.00 0.52 0.00 0.00 54.79 55.83 1t03 n ASP 67 Cb 1.60 0.00 1.06 0.00 -0.72 0.00 0.00 41.12 43.06 1t03 n ASP 67 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1t03 h SER 68 N 0.00 0.00 -0.32 1.67 0.02 -2.00 -3.45 113.55 109.47 1t03 h SER 68 Ca 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 1t03 h SER 68 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1t03 h SER 68 CO 0.00 0.00 -0.06 0.41 -1.14 0.00 0.00 176.83 176.04 1t03 n THR 69 N -3.50 -0.10 -2.20 -2.27 -1.04 -0.15 -5.05 114.28 99.97 1t03 n THR 69 Ca -0.03 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.71 1t03 n THR 69 Cb 0.08 -0.78 0.16 0.00 -1.82 0.00 0.00 70.33 67.97 1t03 n THR 69 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1t03 s LYS 70 N -3.79 0.94 0.23 -2.82 -2.85 -1.25 -4.80 119.74 105.41 1t03 s LYS 70 Ca 0.00 -0.74 0.12 0.00 -1.00 0.00 0.00 55.97 54.35 1t03 s LYS 70 Cb 0.00 -2.03 -0.05 0.00 -2.06 0.00 0.00 37.83 33.69 1t03 s LYS 70 CO 0.00 -2.11 -0.22 -1.58 0.10 0.00 0.00 175.35 171.54 1t03 s TRP 71 N -3.63 2.29 0.01 1.78 0.52 -1.26 -2.03 118.94 116.62 1t03 s TRP 71 Ca 0.72 -0.35 -0.01 0.00 0.02 0.00 0.00 56.10 56.49 1t03 s TRP 71 Cb -0.04 -1.06 -0.01 0.00 -1.15 0.00 0.00 33.47 31.21 1t03 s TRP 71 CO 0.50 0.60 -0.00 1.03 0.02 0.00 0.00 176.95 179.10 1t03 s ARG 72 N -3.07 0.18 -0.61 4.98 0.52 0.57 -4.96 118.95 116.56 1t03 s ARG 72 Ca 0.25 -0.30 -0.21 0.00 -0.52 0.00 0.00 55.73 54.95 1t03 s ARG 72 Cb -0.06 0.07 0.08 0.00 0.52 0.00 0.00 34.95 35.55 1t03 s ARG 72 CO 0.12 -0.03 0.84 0.21 0.02 0.00 0.00 175.30 176.46 1t03 s LYS 73 N -0.77 3.11 -0.18 3.54 2.20 -1.26 -2.08 119.74 124.30 1t03 s LYS 73 Ca -0.08 -0.94 -0.13 0.00 -0.36 0.00 0.00 55.97 54.45 1t03 s LYS 73 Cb -0.05 -4.21 -0.05 0.00 -1.51 0.00 0.00 37.83 32.01 1t03 s LYS 73 CO -0.00 -1.63 0.27 -1.17 -0.36 0.00 0.00 175.35 172.45 1t03 s LEU 74 N 3.46 4.22 -0.14 5.43 2.96 -0.91 -5.02 118.68 128.67 1t03 s LEU 74 Ca 0.19 0.43 -0.02 0.00 -0.22 0.00 0.00 54.13 54.51 1t03 s LEU 74 Cb -0.19 -2.32 -0.02 0.00 0.50 0.00 0.00 46.19 44.15 1t03 s LEU 74 CO 0.10 0.09 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.44 1t03 s VAL 75 N 0.61 3.48 -1.09 1.68 1.01 -1.26 -2.13 120.40 122.69 1t03 s VAL 75 Ca 0.15 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.46 1t03 s VAL 75 Cb -0.13 -2.49 0.15 0.00 0.00 0.00 0.00 36.38 33.91 1t03 s VAL 75 CO 0.03 0.51 1.32 -0.62 0.00 0.00 0.00 175.10 176.35 1t03 s ASP 76 N 0.28 6.86 0.00 3.32 2.15 -0.94 -4.80 116.67 123.53 1t03 s ASP 76 Ca -0.06 -2.53 0.00 0.00 0.43 0.00 0.00 52.55 50.38 1t03 s ASP 76 Cb -0.15 -2.41 0.00 0.00 -0.30 0.00 0.00 42.92 40.06 1t03 s ASP 76 CO 0.04 -0.92 0.79 0.49 -0.17 0.00 0.00 175.17 175.40 1t03 n PHE 77 N 6.22 0.00 -0.39 -5.34 3.72 -1.26 -4.36 117.46 116.06 1t03 n PHE 77 Ca 0.32 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.64 1t03 n PHE 77 Cb 0.46 -0.02 -0.05 0.00 -0.94 0.00 0.00 39.48 38.92 1t03 n PHE 77 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1t03 n ARG 78 N -0.36 -0.35 -0.12 -1.08 0.63 -1.26 -1.46 116.66 112.66 1t03 n ARG 78 Ca 0.00 1.44 -0.04 0.00 -0.92 0.00 0.00 57.85 58.34 1t03 n ARG 78 Cb 0.06 -2.13 0.18 0.00 0.45 0.00 0.00 32.46 31.02 1t03 n ARG 78 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1t03 h GLU 79 N 0.00 0.82 0.08 -0.14 4.39 -2.00 -2.77 114.58 114.95 1t03 h GLU 79 Ca 0.21 -0.19 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 1t03 h GLU 79 Cb 0.45 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1t03 h GLU 79 CO -0.91 0.77 -0.04 1.25 -1.16 0.00 0.00 179.01 178.92 1t03 h LEU 80 N 0.78 -0.09 -1.85 1.33 6.46 -1.58 -1.37 115.31 118.99 1t03 h LEU 80 Ca 0.16 -0.04 0.17 0.00 -0.12 0.00 0.00 57.88 58.06 1t03 h LEU 80 Cb 0.36 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.28 1t03 h LEU 80 CO 0.01 -0.02 0.47 0.78 -0.62 0.00 0.00 178.44 179.06 1t03 h ASN 81 N -0.15 0.14 0.92 1.25 2.35 -1.25 2.32 115.58 121.15 1t03 h ASN 81 Ca -0.01 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1t03 h ASN 81 Cb 0.12 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1t03 h ASN 81 CO 0.02 0.07 0.00 0.11 -1.65 0.00 0.00 177.43 175.98 1t03 h LYS 82 N 0.15 0.00 -0.02 0.81 1.57 -0.98 -3.09 116.57 115.01 1t03 h LYS 82 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1t03 h LYS 82 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1t03 h LYS 82 CO -0.05 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.37 1t03 n ARG 83 N -2.99 0.02 -2.91 3.15 1.74 0.74 -4.92 116.66 111.49 1t03 n ARG 83 Ca 0.01 -0.91 -0.41 0.00 -0.77 0.00 0.00 57.85 55.76 1t03 n ARG 83 Cb 0.28 -1.12 -0.04 0.00 -1.02 0.00 0.00 32.46 30.56 1t03 n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1t03 s THR 84 N -0.53 4.93 0.80 0.55 2.01 0.15 -0.59 115.64 122.97 1t03 s THR 84 Ca 0.07 1.64 -0.17 0.00 0.31 0.00 0.00 61.69 63.54 1t03 s THR 84 Cb 0.05 -4.14 -0.14 0.00 0.01 0.00 0.00 72.50 68.29 1t03 s THR 84 CO 0.07 0.12 -0.46 0.00 -0.69 0.00 0.00 174.62 173.67 1t03 n GLN 85 N 4.53 0.01 -3.09 4.92 10.64 -0.81 -4.51 117.38 129.07 1t03 n GLN 85 Ca 0.03 0.01 -0.35 0.00 -1.83 0.00 0.00 57.00 54.85 1t03 n GLN 85 Cb 0.50 -1.07 -0.06 0.00 -0.86 0.00 0.00 30.24 28.75 1t03 n GLN 85 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.06 175.39 1t03 s ASP 86 N -1.05 7.01 0.23 2.61 3.84 -1.26 -4.87 116.67 123.18 1t03 s ASP 86 Ca 0.48 1.41 0.08 0.00 -0.00 0.00 0.00 52.55 54.51 1t03 s ASP 86 Cb -0.30 -2.42 -0.04 0.00 -1.38 0.00 0.00 42.92 38.78 1t03 s ASP 86 CO 0.75 -0.02 0.10 -0.36 -0.00 0.00 0.00 175.17 175.64 1t03 s PHE 87 N -1.63 2.95 -0.61 2.11 0.08 -1.26 -5.05 117.98 114.58 1t03 s PHE 87 Ca 0.46 -0.14 -0.20 0.00 0.12 0.00 0.00 56.93 57.17 1t03 s PHE 87 Cb -0.15 -1.35 0.10 0.00 -0.57 0.00 0.00 43.02 41.04 1t03 s PHE 87 CO 0.20 0.55 0.76 -0.46 -0.10 0.00 0.00 175.22 176.17 1t03 s TRP 88 N -2.08 2.92 0.26 0.36 -0.11 -1.26 -5.00 118.94 114.04 1t03 s TRP 88 Ca 0.31 -0.87 -0.31 0.00 1.22 0.00 0.00 56.10 56.45 1t03 s TRP 88 Cb -0.08 -4.08 -0.13 0.00 -1.50 0.00 0.00 33.47 27.69 1t03 s TRP 88 CO 0.22 -1.37 1.49 0.39 -4.62 0.00 0.00 176.95 173.05 1t03 n GLU 89 N 6.63 2.32 -0.05 5.86 -0.58 -1.26 -4.91 120.64 128.65 1t03 n GLU 89 Ca -0.08 0.82 -0.11 0.00 -0.42 0.00 0.00 57.16 57.37 1t03 n GLU 89 Cb 0.43 -2.53 -0.14 0.00 -0.57 0.00 0.00 31.44 28.62 1t03 n GLU 89 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1t03 n VAL 90 N 1.98 1.55 -1.78 2.62 0.31 -1.26 -4.85 118.33 116.91 1t03 n VAL 90 Ca 0.10 -0.78 -0.42 0.00 -0.01 0.00 0.00 64.34 63.23 1t03 n VAL 90 Cb 0.34 -0.98 -0.03 0.00 -0.91 0.00 0.00 33.84 32.26 1t03 n VAL 90 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1t03 s GLN 91 N -2.55 4.04 -0.54 5.55 2.00 -1.26 -4.90 119.66 122.00 1t03 s GLN 91 Ca -0.11 2.39 0.07 0.00 -2.00 0.00 0.00 55.36 55.71 1t03 s GLN 91 Cb 0.07 -4.13 0.30 0.00 0.80 0.00 0.00 33.01 30.05 1t03 s GLN 91 CO 0.80 -1.06 0.78 -0.11 -0.50 0.00 0.00 175.29 175.21 1t03 n LEU 92 N 7.88 2.98 0.00 3.68 7.94 -1.26 -5.05 117.00 133.17 1t03 n LEU 92 Ca 0.20 -5.34 0.00 0.00 -1.11 0.00 0.00 56.01 49.76 1t03 n LEU 92 Cb 0.42 -0.20 0.00 0.00 0.53 0.00 0.00 43.42 44.17 1t03 n LEU 92 CO 0.66 2.20 0.00 0.61 -1.11 0.00 0.00 177.39 179.76 1t03 n GLY 93 N 0.45 2.76 3.75 -3.96 0.00 -1.26 -5.05 105.19 101.88 1t03 n GLY 93 Ca 0.28 -1.50 -0.40 0.00 0.00 0.00 0.00 46.02 44.40 1t03 n GLY 93 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1t03 s ILE 94 N -0.72 4.20 0.68 -0.61 -5.25 -1.26 -5.03 121.20 113.21 1t03 s ILE 94 Ca 0.00 2.06 -0.15 0.00 -0.99 0.00 0.00 60.65 61.56 1t03 s ILE 94 Cb 0.00 -4.31 0.01 0.00 2.95 0.00 0.00 42.46 41.11 1t03 s ILE 94 CO 0.00 0.46 1.15 -2.16 -1.79 0.00 0.00 174.94 172.59 1t03 s PRO 95 N -0.90 2.56 -0.00 0.37 0.04 -1.26 -5.04 135.00 130.78 1t03 s PRO 95 Ca 0.42 1.53 0.06 0.00 0.04 0.00 0.00 61.00 63.05 1t03 s PRO 95 Cb -0.25 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.36 1t03 s PRO 95 CO 0.31 -1.46 -0.20 -1.58 0.04 0.00 0.00 177.00 174.11 1t03 s HIS 96 N -2.20 1.78 0.52 0.56 2.46 -1.26 -5.03 115.29 112.12 1t03 s HIS 96 Ca 0.70 -0.34 0.21 0.00 0.47 0.00 0.00 55.06 56.09 1t03 s HIS 96 Cb -0.24 -1.13 1.32 0.00 -0.13 0.00 0.00 32.58 32.41 1t03 s HIS 96 CO 0.42 -0.01 2.07 -1.00 -2.47 0.00 0.00 174.74 173.75 1t03 h PRO 97 N 5.50 0.01 -0.88 2.88 0.13 -1.96 -0.45 132.00 137.22 1t03 h PRO 97 Ca -0.39 -0.00 0.18 0.00 -0.87 0.00 0.00 66.00 64.92 1t03 h PRO 97 Cb 1.15 -0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.21 1t03 h PRO 97 CO 0.47 0.01 0.58 0.00 -0.23 0.00 0.00 178.00 178.83 1t03 h ALA 98 N 1.86 2.10 -0.00 -0.56 0.00 -1.84 0.30 119.26 121.12 1t03 h ALA 98 Ca 0.14 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1t03 h ALA 98 Cb 0.52 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1t03 h ALA 98 CO -0.00 -0.37 0.00 0.41 0.00 0.00 0.00 179.25 179.29 1t03 n GLY 99 N -1.49 -0.99 3.82 0.00 0.00 -0.18 -3.25 105.19 103.10 1t03 n GLY 99 Ca 0.18 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1t03 n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t03 s LEU 100 N -1.88 4.27 0.09 0.99 1.43 0.11 -4.87 118.68 118.81 1t03 s LEU 100 Ca 0.42 1.40 0.02 0.00 -1.03 0.00 0.00 54.13 54.94 1t03 s LEU 100 Cb 0.19 -3.73 -0.04 0.00 0.03 0.00 0.00 46.19 42.65 1t03 s LEU 100 CO 0.33 -0.03 0.16 -0.54 0.23 0.00 0.00 176.35 176.49 1t03 s LYS 101 N -2.24 3.14 -0.32 1.70 1.02 -1.26 -1.61 119.74 120.18 1t03 s LYS 101 Ca 0.46 -0.61 -0.28 0.00 0.02 0.00 0.00 55.97 55.56 1t03 s LYS 101 Cb -0.15 -2.85 -0.03 0.00 -0.52 0.00 0.00 37.83 34.27 1t03 s LYS 101 CO 0.20 0.57 1.98 0.15 -0.92 0.00 0.00 175.35 177.32 1t03 s LYS 102 N -2.62 3.16 0.04 1.68 1.02 -1.26 -4.96 119.74 116.80 1t03 s LYS 102 Ca 0.32 1.58 0.03 0.00 0.02 0.00 0.00 55.97 57.92 1t03 s LYS 102 Cb -0.12 -4.29 -0.04 0.00 -0.52 0.00 0.00 37.83 32.86 1t03 s LYS 102 CO 0.25 -2.07 -0.00 0.15 -0.92 0.00 0.00 175.35 172.76 1t03 s LYS 103 N 6.11 2.67 0.00 1.68 -0.14 -1.26 -5.00 119.74 123.80 1t03 s LYS 103 Ca 0.87 -0.73 0.00 0.00 -1.36 0.00 0.00 55.97 54.75 1t03 s LYS 103 Cb -0.25 -2.60 0.00 0.00 -1.68 0.00 0.00 37.83 33.30 1t03 s LYS 103 CO 0.33 0.58 0.92 1.63 -0.76 0.00 0.00 175.35 178.06 1t03 n LYS 104 N 0.98 0.00 -4.37 1.68 4.76 -1.14 -4.74 118.16 115.33 1t03 n LYS 104 Ca -0.13 0.53 -0.35 0.00 -2.87 0.00 0.00 58.31 55.50 1t03 n LYS 104 Cb 0.52 -1.42 -0.09 0.00 -1.84 0.00 0.00 35.03 32.19 1t03 n LYS 104 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1t03 s SER 105 N -2.21 5.25 0.02 4.39 0.01 0.31 -4.99 113.70 116.48 1t03 s SER 105 Ca 0.00 0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.42 1t03 s SER 105 Cb 0.00 -1.48 -0.01 0.00 0.21 0.00 0.00 66.02 64.74 1t03 s SER 105 CO 0.00 0.38 -0.06 -0.69 0.41 0.00 0.00 173.24 173.28 1t03 s VAL 106 N -0.89 0.41 0.03 3.43 1.01 -1.26 -0.54 120.40 122.59 1t03 s VAL 106 Ca 0.13 -0.64 -0.00 0.00 0.00 0.00 0.00 61.98 61.48 1t03 s VAL 106 Cb -0.11 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 1t03 s VAL 106 CO 0.02 -0.16 -0.03 -0.89 0.00 0.00 0.00 175.10 174.04 1t03 s THR 107 N -0.77 0.18 -0.04 3.92 2.01 0.30 -4.55 115.64 116.68 1t03 s THR 107 Ca -0.05 -1.19 0.02 0.00 0.31 0.00 0.00 61.69 60.77 1t03 s THR 107 Cb -0.06 -0.66 0.01 0.00 0.01 0.00 0.00 72.50 71.80 1t03 s THR 107 CO 0.00 -0.64 -0.07 -0.69 -0.69 0.00 0.00 174.62 172.53 1t03 s VAL 108 N -2.19 0.65 0.32 3.82 1.01 -1.00 -0.35 120.40 122.66 1t03 s VAL 108 Ca -0.09 -0.24 0.06 0.00 0.00 0.00 0.00 61.98 61.72 1t03 s VAL 108 Cb -0.05 -0.63 -0.06 0.00 0.00 0.00 0.00 36.38 35.64 1t03 s VAL 108 CO -0.04 0.23 -0.02 -0.76 0.00 0.00 0.00 175.10 174.52 1t03 s LEU 109 N 0.58 2.47 -0.13 3.92 1.43 0.10 -0.92 118.68 126.14 1t03 s LEU 109 Ca -0.08 -1.27 -0.09 0.00 -1.03 0.00 0.00 54.13 51.66 1t03 s LEU 109 Cb -0.12 -0.63 0.04 0.00 0.03 0.00 0.00 46.19 45.51 1t03 s LEU 109 CO 0.01 -0.42 0.32 -1.81 0.23 0.00 0.00 176.35 174.67 1t03 s ASP 110 N -3.51 -0.36 0.13 2.29 -0.00 -1.26 -1.20 116.67 112.77 1t03 s ASP 110 Ca 0.32 0.67 -0.11 0.00 -0.00 0.00 0.00 52.55 53.43 1t03 s ASP 110 Cb 0.06 0.61 -0.06 0.00 -0.00 0.00 0.00 42.92 43.53 1t03 s ASP 110 CO 0.14 -0.14 0.48 -0.69 -0.00 0.00 0.00 175.17 174.95 1t03 s VAL 111 N 0.75 4.98 0.13 -1.27 1.01 -1.05 -3.89 120.40 121.07 1t03 s VAL 111 Ca -0.05 0.59 -0.06 0.00 0.00 0.00 0.00 61.98 62.47 1t03 s VAL 111 Cb -0.06 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.59 1t03 s VAL 111 CO -0.05 0.22 0.38 -0.83 0.00 0.00 0.00 175.10 174.81 1t03 s GLY 112 N -1.84 2.25 -1.60 4.51 0.00 0.73 -4.28 107.32 107.08 1t03 s GLY 112 Ca 0.37 -0.53 -0.13 0.00 0.00 0.00 0.00 44.72 44.43 1t03 s GLY 112 CO 0.19 -0.42 0.74 1.22 0.00 0.00 0.00 173.10 174.83 1t03 n ASP 113 N 0.26 -2.90 0.00 1.64 8.00 -1.26 -4.36 116.55 117.93 1t03 n ASP 113 Ca -0.04 -0.97 0.00 0.00 0.71 0.00 0.00 54.79 54.50 1t03 n ASP 113 Cb 0.52 -3.04 0.00 0.00 -0.02 0.00 0.00 41.12 38.58 1t03 n ASP 113 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1t03 n ALA 114 N -4.45 -0.01 0.09 2.24 0.00 -1.26 -1.30 120.51 115.82 1t03 n ALA 114 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.30 1t03 n ALA 114 Cb 0.54 0.33 -0.05 0.00 0.00 0.00 0.00 19.45 20.27 1t03 n ALA 114 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1t03 h TYR 115 N 0.00 -0.55 0.00 0.00 0.05 -1.89 -1.00 116.97 113.58 1t03 h TYR 115 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1t03 h TYR 115 Cb 0.00 0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.98 1t03 h TYR 115 CO -0.36 -0.30 0.00 1.19 -1.05 0.00 0.00 178.16 177.64 1t03 n PHE 116 N -5.34 0.00 0.21 4.88 3.72 -1.07 -1.28 117.46 118.59 1t03 n PHE 116 Ca -0.06 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.36 1t03 n PHE 116 Cb 0.25 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.78 1t03 n PHE 116 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1t03 n SER 117 N -0.57 0.60 -4.56 4.37 7.64 -0.38 -4.90 113.62 115.83 1t03 n SER 117 Ca 0.00 -0.80 -0.35 0.00 1.01 0.00 0.00 58.87 58.73 1t03 n SER 117 Cb 0.00 0.68 -0.11 0.00 -1.01 0.00 0.00 64.21 63.77 1t03 n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1t03 s VAL 118 N -1.10 4.47 0.62 0.44 1.01 -0.40 -2.88 120.40 122.56 1t03 s VAL 118 Ca 0.03 -0.14 -0.18 0.00 0.00 0.00 0.00 61.98 61.69 1t03 s VAL 118 Cb 0.04 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.35 1t03 s VAL 118 CO 0.14 0.44 0.85 -2.65 0.00 0.00 0.00 175.10 173.89 1t03 n PRO 119 N 3.84 0.73 -4.53 2.72 -0.02 -1.26 -0.49 135.00 135.99 1t03 n PRO 119 Ca -0.17 0.29 -0.34 0.00 -2.02 0.00 0.00 63.50 61.26 1t03 n PRO 119 Cb 0.52 -2.07 -0.11 0.00 -0.02 0.00 0.00 33.50 31.82 1t03 n PRO 119 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1t03 s LEU 120 N -1.56 3.26 -0.30 2.45 2.96 0.12 -4.42 118.68 121.18 1t03 s LEU 120 Ca 0.74 -0.02 -0.40 0.00 -0.22 0.00 0.00 54.13 54.24 1t03 s LEU 120 Cb -0.41 -1.73 -0.18 0.00 0.50 0.00 0.00 46.19 44.37 1t03 s LEU 120 CO 0.49 0.32 1.28 -0.67 -1.32 0.00 0.00 176.35 176.45 1t03 n ASP 121 N 2.51 0.73 -0.11 3.68 -0.08 -1.26 -4.82 116.55 117.19 1t03 n ASP 121 Ca -0.18 1.06 -0.12 0.00 -1.51 0.00 0.00 54.79 54.04 1t03 n ASP 121 Cb 0.53 -0.80 -0.06 0.00 2.34 0.00 0.00 41.12 43.12 1t03 n ASP 121 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1t03 h GLU 122 N 3.89 -0.36 -0.04 -0.67 4.57 -1.93 -1.63 114.58 118.41 1t03 h GLU 122 Ca -0.41 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.79 1t03 h GLU 122 Cb 1.24 0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.92 1t03 h GLU 122 CO 0.78 -0.24 0.00 -0.25 -1.18 0.00 0.00 179.01 178.12 1t03 n ASP 123 N -5.41 0.04 0.00 1.04 9.92 -1.26 -2.92 116.55 117.97 1t03 n ASP 123 Ca -0.02 -0.42 0.00 0.00 -0.53 0.00 0.00 54.79 53.82 1t03 n ASP 123 Cb 0.35 -0.02 0.00 0.00 -0.64 0.00 0.00 41.12 40.81 1t03 n ASP 123 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1t03 n PHE 124 N -0.31 0.00 -0.34 1.24 7.35 -0.62 -4.81 117.46 119.96 1t03 n PHE 124 Ca 0.00 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.74 1t03 n PHE 124 Cb 0.01 0.00 0.12 0.00 0.35 0.00 0.00 39.48 39.97 1t03 n PHE 124 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1t03 n ARG 125 N -1.89 -0.10 -0.59 -4.13 1.74 -1.15 0.15 116.66 110.70 1t03 n ARG 125 Ca 0.00 1.48 0.47 0.00 -0.77 0.00 0.00 57.85 59.03 1t03 n ARG 125 Cb 0.45 -2.20 0.76 0.00 -1.02 0.00 0.00 32.46 30.45 1t03 n ARG 125 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1t03 h LYS 126 N 0.00 0.00 0.00 5.56 2.10 -1.87 3.16 116.57 125.52 1t03 h LYS 126 Ca 0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.09 1t03 h LYS 126 Cb 0.68 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.01 1t03 h LYS 126 CO -0.97 0.00 -0.02 1.88 -2.00 0.00 0.00 179.45 178.34 1t03 h TYR 127 N 0.00 0.00 -0.09 0.07 0.05 -0.66 -2.95 116.97 113.39 1t03 h TYR 127 Ca 0.83 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.61 1t03 h TYR 127 Cb 3.47 0.00 0.00 0.00 1.01 0.00 0.00 36.73 41.21 1t03 h TYR 127 CO 0.00 0.00 0.00 0.25 -1.05 0.00 0.00 178.16 177.36 1t03 n THR 128 N -2.84 0.11 -1.50 -2.88 -2.24 1.05 -4.74 114.28 101.25 1t03 n THR 128 Ca 0.04 -0.15 -0.39 0.00 -2.27 0.00 0.00 64.05 61.29 1t03 n THR 128 Cb 0.50 0.01 0.03 0.00 -2.10 0.00 0.00 70.33 68.77 1t03 n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1t03 n ALA 129 N -0.27 -0.84 -3.53 6.98 0.00 -1.11 -4.17 120.51 117.57 1t03 n ALA 129 Ca 0.11 0.02 -0.15 0.00 0.00 0.00 0.00 53.44 53.43 1t03 n ALA 129 Cb 0.15 -1.89 -0.05 0.00 0.00 0.00 0.00 19.45 17.66 1t03 n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1t03 s PHE 130 N -1.62 -0.54 -0.01 0.00 -0.12 0.72 -2.35 117.98 114.06 1t03 s PHE 130 Ca 0.69 0.85 0.03 0.00 -0.05 0.00 0.00 56.93 58.45 1t03 s PHE 130 Cb -0.46 0.44 -0.03 0.00 -0.63 0.00 0.00 43.02 42.33 1t03 s PHE 130 CO 0.54 -0.54 -0.06 0.99 -0.05 0.00 0.00 175.22 176.09 1t03 s THR 131 N -1.50 3.70 -0.51 -4.49 2.01 -1.26 -1.35 115.64 112.25 1t03 s THR 131 Ca -0.06 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.24 1t03 s THR 131 Cb -0.00 -2.60 0.13 0.00 0.01 0.00 0.00 72.50 70.04 1t03 s THR 131 CO 0.04 0.42 0.25 -0.51 -0.69 0.00 0.00 174.62 174.13 1t03 s ILE 132 N -0.98 2.73 0.35 1.82 2.07 -0.78 -4.66 121.20 121.74 1t03 s ILE 132 Ca 0.17 -3.09 -0.19 0.00 -1.41 0.00 0.00 60.65 56.13 1t03 s ILE 132 Cb -0.11 -2.89 -0.14 0.00 0.13 0.00 0.00 42.46 39.45 1t03 s ILE 132 CO 0.07 -0.78 0.08 -0.81 -1.91 0.00 0.00 174.94 171.59 1t03 n PRO 133 N 3.37 0.00 -2.91 3.50 -0.04 -1.26 -2.33 135.00 135.33 1t03 n PRO 133 Ca 0.05 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.18 1t03 n PRO 133 Cb 0.35 -0.88 -0.06 0.00 -0.04 0.00 0.00 33.50 32.86 1t03 n PRO 133 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1t03 s SER 134 N -0.88 6.84 0.34 3.54 1.04 -1.26 -4.80 113.70 118.52 1t03 s SER 134 Ca 0.52 1.51 0.12 0.00 0.48 0.00 0.00 55.95 58.58 1t03 s SER 134 Cb -0.56 -2.47 1.08 0.00 0.10 0.00 0.00 66.02 64.17 1t03 s SER 134 CO 0.55 -0.32 1.57 0.00 0.98 0.00 0.00 173.24 176.03 1t03 n ILE 135 N -0.63 -0.42 -2.53 -1.02 3.06 -1.26 -4.74 119.36 111.83 1t03 n ILE 135 Ca 0.05 2.11 0.00 0.00 -2.50 0.00 0.00 62.75 62.41 1t03 n ILE 135 Cb 0.54 -3.26 0.00 0.00 0.54 0.00 0.00 39.64 37.46 1t03 n ILE 135 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 1t03 n ASN 136 N -5.37 0.33 0.00 9.51 0.23 -1.26 -4.85 115.26 113.85 1t03 n ASN 136 Ca 0.31 0.00 0.08 0.00 -0.53 0.00 0.00 54.58 54.44 1t03 n ASN 136 Cb 1.05 0.00 0.48 0.00 -2.08 0.00 0.00 39.78 39.23 1t03 n ASN 136 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1t03 n ASN 137 N 0.00 0.00 -3.72 0.53 5.15 -1.26 -4.80 115.26 111.15 1t03 n ASN 137 Ca 0.00 -0.66 0.00 0.00 -0.60 0.00 0.00 54.58 53.32 1t03 n ASN 137 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1t03 n ASN 137 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1t03 n GLU 138 N -0.93 0.79 -1.60 1.20 2.13 -1.26 -4.88 120.64 116.08 1t03 n GLU 138 Ca 0.12 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.52 1t03 n GLU 138 Cb 0.06 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.77 1t03 n GLU 138 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1t03 n THR 139 N -1.18 2.35 -0.95 6.31 5.66 -1.26 -4.89 114.28 120.32 1t03 n THR 139 Ca 0.00 -0.50 -0.36 0.00 -3.05 0.00 0.00 64.05 60.14 1t03 n THR 139 Cb 0.00 -1.13 0.06 0.00 -1.55 0.00 0.00 70.33 67.71 1t03 n THR 139 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1t03 n PRO 140 N 0.24 -0.15 0.00 1.09 -0.04 -1.26 -4.59 135.00 130.29 1t03 n PRO 140 Ca 0.09 -0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1t03 n PRO 140 Cb 0.38 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 1t03 n PRO 140 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1t03 n GLY 141 N 3.08 -2.92 3.76 0.55 0.00 -1.26 -4.66 105.19 103.73 1t03 n GLY 141 Ca -0.00 -1.31 -0.37 0.00 0.00 0.00 0.00 46.02 44.34 1t03 n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1t03 s ILE 142 N -0.39 5.27 -0.16 -0.61 1.01 -0.98 -4.87 121.20 120.47 1t03 s ILE 142 Ca 0.00 0.61 -0.15 0.00 0.00 0.00 0.00 60.65 61.11 1t03 s ILE 142 Cb 0.00 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 1t03 s ILE 142 CO 0.00 0.43 0.34 -0.13 0.00 0.00 0.00 174.94 175.59 1t03 s ARG 143 N 0.12 4.26 0.06 2.79 1.81 -1.26 -1.87 118.95 124.85 1t03 s ARG 143 Ca 0.18 0.17 0.04 0.00 -1.72 0.00 0.00 55.73 54.41 1t03 s ARG 143 Cb -0.14 -3.45 -0.03 0.00 -0.45 0.00 0.00 34.95 30.89 1t03 s ARG 143 CO 0.06 0.17 -0.12 0.71 -0.68 0.00 0.00 175.30 175.44 1t03 s TYR 144 N 0.66 1.03 0.07 -0.53 2.02 -0.46 -2.61 117.35 117.54 1t03 s TYR 144 Ca 0.19 -0.47 0.05 0.00 -0.37 0.00 0.00 57.07 56.46 1t03 s TYR 144 Cb -0.14 -0.59 -0.03 0.00 -0.40 0.00 0.00 41.96 40.80 1t03 s TYR 144 CO 0.06 0.01 -0.14 -1.14 -1.57 0.00 0.00 175.55 172.77 1t03 s GLN 145 N -1.69 0.83 0.28 -0.62 0.74 0.26 -0.20 119.66 119.26 1t03 s GLN 145 Ca -0.05 -0.97 -0.16 0.00 0.05 0.00 0.00 55.36 54.22 1t03 s GLN 145 Cb -0.10 -0.82 -0.09 0.00 1.10 0.00 0.00 33.01 33.10 1t03 s GLN 145 CO 0.02 0.18 0.72 0.71 -0.55 0.00 0.00 175.29 176.37 1t03 s TYR 146 N -1.35 3.48 0.00 1.67 2.02 -1.26 -0.70 117.35 121.21 1t03 s TYR 146 Ca -0.01 1.26 0.00 0.00 -0.37 0.00 0.00 57.07 57.95 1t03 s TYR 146 Cb -0.10 -2.55 0.00 0.00 -0.40 0.00 0.00 41.96 38.91 1t03 s TYR 146 CO 0.02 0.20 0.00 0.09 -1.57 0.00 0.00 175.55 174.29 1t03 n ASN 147 N 0.07 2.92 -4.47 2.29 3.02 -0.59 -4.65 115.26 113.85 1t03 n ASN 147 Ca 0.01 -0.20 -0.23 0.00 -0.03 0.00 0.00 54.58 54.13 1t03 n ASN 147 Cb 0.52 0.99 -0.10 0.00 -0.61 0.00 0.00 39.78 40.58 1t03 n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1t03 s VAL 148 N -1.58 1.97 -0.63 2.41 -7.23 -1.21 0.13 120.40 114.26 1t03 s VAL 148 Ca 0.00 -2.20 -0.33 0.00 -1.81 0.00 0.00 61.98 57.64 1t03 s VAL 148 Cb 0.00 -2.46 -0.15 0.00 0.56 0.00 0.00 36.38 34.33 1t03 s VAL 148 CO 0.00 -0.31 2.42 0.18 -0.31 0.00 0.00 175.10 177.08 1t03 n LEU 149 N -0.64 1.34 -4.76 1.32 4.77 0.35 -4.67 117.00 114.71 1t03 n LEU 149 Ca -0.05 0.16 -0.41 0.00 -0.03 0.00 0.00 56.01 55.67 1t03 n LEU 149 Cb 0.63 -1.17 -0.02 0.00 -2.33 0.00 0.00 43.42 40.53 1t03 n LEU 149 CO 0.40 -0.92 1.07 -2.84 -1.33 0.00 0.00 177.39 173.77 1t03 s PRO 150 N 7.64 4.28 0.09 3.23 0.02 -1.26 -4.08 135.00 144.92 1t03 s PRO 150 Ca 1.18 2.31 -0.30 0.00 0.02 0.00 0.00 61.00 64.20 1t03 s PRO 150 Cb -0.93 -3.08 -0.06 0.00 0.02 0.00 0.00 34.50 30.45 1t03 s PRO 150 CO 0.46 -0.36 1.14 -1.14 -0.33 0.00 0.00 177.00 176.77 1t03 s GLN 151 N -1.03 4.50 0.00 5.54 0.74 -1.26 -3.18 119.66 124.97 1t03 s GLN 151 Ca 0.55 1.71 0.00 0.00 0.05 0.00 0.00 55.36 57.67 1t03 s GLN 151 Cb -0.42 -3.34 0.00 0.00 1.10 0.00 0.00 33.01 30.36 1t03 s GLN 151 CO 0.49 -0.12 0.00 0.41 -0.55 0.00 0.00 175.29 175.52 1t03 n GLY 152 N 2.76 0.76 3.89 2.59 0.00 -1.26 -4.90 105.19 109.03 1t03 n GLY 152 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1t03 n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1t03 s TRP 153 N -2.11 3.57 0.14 1.61 -0.00 -1.19 -4.68 118.94 116.28 1t03 s TRP 153 Ca 0.00 0.47 -0.26 0.00 -0.00 0.00 0.00 56.10 56.31 1t03 s TRP 153 Cb 0.00 -1.91 -0.01 0.00 -0.00 0.00 0.00 33.47 31.55 1t03 s TRP 153 CO 0.00 0.66 1.59 -0.22 -0.00 0.00 0.00 176.95 178.98 1t03 h LYS 154 N 4.18 -0.37 0.00 5.86 3.64 -1.92 -2.05 116.57 125.90 1t03 h LYS 154 Ca -0.51 0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 58.86 1t03 h LYS 154 Cb 1.20 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 33.10 1t03 h LYS 154 CO 0.65 -0.25 -0.18 0.78 -2.27 0.00 0.00 179.45 178.18 1t03 h GLY 155 N -0.38 0.00 -0.96 5.01 0.00 -1.95 -3.35 103.07 101.44 1t03 h GLY 155 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.56 1t03 h GLY 155 CO -0.45 0.00 -0.47 -1.26 0.00 0.00 0.00 176.54 174.37 1t03 n SER 156 N -3.42 -0.81 0.12 0.19 2.88 -0.77 -1.50 113.62 110.31 1t03 n SER 156 Ca -0.00 1.69 -0.09 0.00 -1.33 0.00 0.00 58.87 59.14 1t03 n SER 156 Cb 0.37 -0.31 -0.05 0.00 -0.75 0.00 0.00 64.21 63.48 1t03 n SER 156 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1t03 h PRO 157 N 0.00 -0.45 -0.88 -1.46 0.11 -1.74 -2.06 132.00 125.52 1t03 h PRO 157 Ca 0.25 0.03 0.11 0.00 0.11 0.00 0.00 66.00 66.49 1t03 h PRO 157 Cb 0.49 0.10 -0.07 0.00 0.11 0.00 0.00 31.00 31.63 1t03 h PRO 157 CO -0.93 -0.30 0.57 0.00 -0.21 0.00 0.00 178.00 177.13 1t03 h ALA 158 N -1.23 1.68 0.28 -0.75 0.00 -1.75 -2.45 119.26 115.04 1t03 h ALA 158 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1t03 h ALA 158 Cb 0.42 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1t03 h ALA 158 CO -0.07 0.12 -0.13 0.82 0.00 0.00 0.00 179.25 179.99 1t03 h ILE 159 N 0.83 0.75 -0.24 0.00 2.04 -1.15 -2.67 117.51 117.06 1t03 h ILE 159 Ca 0.42 -0.59 0.07 0.00 1.00 0.00 0.00 64.86 65.76 1t03 h ILE 159 Cb 0.47 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1t03 h ILE 159 CO -0.18 0.12 0.27 0.15 0.00 0.00 0.00 178.15 178.51 1t03 h PHE 160 N -0.70 0.00 0.20 1.37 3.57 -1.15 -1.83 116.94 118.40 1t03 h PHE 160 Ca -0.04 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 1t03 h PHE 160 Cb 0.48 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.22 1t03 h PHE 160 CO 0.02 0.00 -0.10 1.96 -2.23 0.00 0.00 178.31 177.97 1t03 h GLN 161 N 0.00 -0.26 -0.64 1.11 4.20 -1.12 -1.72 115.11 116.68 1t03 h GLN 161 Ca 0.12 0.02 0.10 0.00 0.06 0.00 0.00 58.65 58.94 1t03 h GLN 161 Cb 0.66 0.06 -0.08 0.00 0.30 0.00 0.00 27.48 28.43 1t03 h GLN 161 CO -0.00 0.10 0.25 1.03 -0.67 0.00 0.00 178.83 179.54 1t03 h SER 162 N -0.67 0.26 -0.16 1.46 0.87 -1.13 0.12 113.55 114.29 1t03 h SER 162 Ca -0.03 0.08 0.05 0.00 -1.23 0.00 0.00 61.79 60.66 1t03 h SER 162 Cb 0.48 0.05 -0.06 0.00 -0.44 0.00 0.00 62.40 62.43 1t03 h SER 162 CO 0.05 0.15 -0.26 0.28 -0.53 0.00 0.00 176.83 176.51 1t03 h SER 163 N 0.44 -0.81 -0.29 6.23 0.02 -1.26 0.63 113.55 118.51 1t03 h SER 163 Ca 0.33 0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.39 1t03 h SER 163 Cb 0.41 0.36 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 1t03 h SER 163 CO -0.31 -0.30 0.12 -0.03 -1.14 0.00 0.00 176.83 175.17 1t03 h MET 164 N -0.31 0.50 0.16 3.45 -1.53 -0.34 -0.51 114.93 116.35 1t03 h MET 164 Ca 0.11 -0.06 -0.01 0.00 -3.44 0.00 0.00 59.70 56.30 1t03 h MET 164 Cb 0.48 -0.09 0.00 0.00 -0.55 0.00 0.00 31.60 31.43 1t03 h MET 164 CO -0.34 0.43 -0.08 1.15 0.14 0.00 0.00 176.91 178.21 1t03 h THR 165 N 0.49 0.93 -0.61 -0.77 2.02 0.56 -1.90 112.91 113.64 1t03 h THR 165 Ca 0.12 -1.02 0.09 0.00 0.77 0.00 0.00 66.41 66.37 1t03 h THR 165 Cb 0.13 1.50 -0.04 0.00 -1.74 0.00 0.00 68.15 68.00 1t03 h THR 165 CO -0.01 0.22 0.41 0.11 0.37 0.00 0.00 175.52 176.61 1t03 h LYS 166 N -0.76 0.44 -0.24 6.66 1.57 0.43 -1.17 116.57 123.50 1t03 h LYS 166 Ca -0.02 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 1t03 h LYS 166 Cb 0.52 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1t03 h LYS 166 CO 0.04 0.29 -0.17 0.82 -0.57 0.00 0.00 179.45 179.85 1t03 h ILE 167 N 0.45 1.31 0.00 1.86 2.04 -1.09 -3.18 117.51 118.90 1t03 h ILE 167 Ca 0.28 -1.30 -0.07 0.00 1.00 0.00 0.00 64.86 64.77 1t03 h ILE 167 Cb 0.49 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 1t03 h ILE 167 CO -0.08 0.40 -0.34 -0.07 0.00 0.00 0.00 178.15 178.06 1t03 h LEU 168 N 0.26 0.00 -0.88 1.44 3.38 -0.40 -3.34 115.31 115.75 1t03 h LEU 168 Ca 0.05 0.00 0.22 0.00 0.09 0.00 0.00 57.88 58.23 1t03 h LEU 168 Cb 0.70 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.29 1t03 h LEU 168 CO 0.05 0.34 -0.01 -0.33 0.09 0.00 0.00 178.44 178.58 1t03 h GLU 169 N 0.00 0.05 -0.01 1.13 4.39 -1.25 -0.89 114.58 118.00 1t03 h GLU 169 Ca -0.00 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1t03 h GLU 169 Cb 0.73 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.37 1t03 h GLU 169 CO 0.04 0.04 0.01 -1.35 -1.16 0.00 0.00 179.01 176.59 1t03 h PRO 170 N 0.06 0.02 -0.74 2.33 0.10 -1.77 -2.91 132.00 129.08 1t03 h PRO 170 Ca 0.50 -0.00 0.06 0.00 0.10 0.00 0.00 66.00 66.66 1t03 h PRO 170 Cb 0.94 -0.00 -0.06 0.00 0.10 0.00 0.00 31.00 31.98 1t03 h PRO 170 CO -0.81 0.02 0.43 0.35 0.10 0.00 0.00 178.00 178.09 1t03 h PHE 171 N 0.01 0.80 0.18 0.65 3.57 -1.42 -2.45 116.94 118.28 1t03 h PHE 171 Ca 0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1t03 h PHE 171 Cb 0.00 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.49 1t03 h PHE 171 CO -0.08 0.40 -0.11 0.87 -2.23 0.00 0.00 178.31 177.16 1t03 h LYS 172 N 0.80 -0.27 -0.25 1.11 1.57 -1.19 -1.95 116.57 116.39 1t03 h LYS 172 Ca 0.32 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 59.19 1t03 h LYS 172 Cb 0.17 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1t03 h LYS 172 CO -0.17 -0.18 0.82 -0.22 -0.57 0.00 0.00 179.45 179.13 1t03 h LYS 173 N -0.28 0.00 0.18 3.15 3.64 -1.43 0.92 116.57 122.76 1t03 h LYS 173 Ca -0.02 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.04 1t03 h LYS 173 Cb 0.22 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 32.07 1t03 h LYS 173 CO 0.03 0.00 -1.35 1.96 -2.27 0.00 0.00 179.45 177.82 1t03 h GLN 174 N 0.00 0.56 -2.16 1.90 1.08 -0.90 -3.38 115.11 112.22 1t03 h GLN 174 Ca 0.12 -0.84 -0.56 0.00 -1.45 0.00 0.00 58.65 55.92 1t03 h GLN 174 Cb 1.76 0.30 -0.41 0.00 -0.05 0.00 0.00 27.48 29.08 1t03 h GLN 174 CO -0.00 1.39 -0.84 0.09 -0.95 0.00 0.00 178.83 178.52 1t03 n ASN 175 N -3.74 2.85 0.00 1.46 3.02 0.31 -4.94 115.26 114.23 1t03 n ASN 175 Ca -0.15 -3.34 0.00 0.00 -0.03 0.00 0.00 54.58 51.06 1t03 n ASN 175 Cb 1.04 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 1t03 n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1t03 n PRO 176 N 0.28 0.00 -1.30 3.52 -0.04 -0.64 -1.96 135.00 134.86 1t03 n PRO 176 Ca 0.28 0.05 -0.15 0.00 -0.04 0.00 0.00 63.50 63.64 1t03 n PRO 176 Cb 0.49 -1.52 0.12 0.00 -0.04 0.00 0.00 33.50 32.54 1t03 n PRO 176 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1t03 n ASP 177 N -0.93 4.03 -3.82 3.54 9.92 -1.26 -4.90 116.55 123.13 1t03 n ASP 177 Ca 0.00 -3.79 -0.18 0.00 -0.53 0.00 0.00 54.79 50.29 1t03 n ASP 177 Cb 0.02 -0.57 -0.16 0.00 -0.64 0.00 0.00 41.12 39.76 1t03 n ASP 177 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1t03 s ILE 178 N -3.96 0.24 -0.06 0.53 1.01 -0.83 -4.63 121.20 113.51 1t03 s ILE 178 Ca 0.49 0.07 -0.16 0.00 0.00 0.00 0.00 60.65 61.06 1t03 s ILE 178 Cb 0.42 -0.34 -0.05 0.00 0.01 0.00 0.00 42.46 42.50 1t03 s ILE 178 CO 0.00 0.17 0.41 0.68 0.00 0.00 0.00 174.94 176.21 1t03 s VAL 179 N 1.17 5.11 -0.45 2.92 -7.23 -0.74 -4.95 120.40 116.23 1t03 s VAL 179 Ca -0.08 0.83 0.03 0.00 -1.81 0.00 0.00 61.98 60.95 1t03 s VAL 179 Cb -0.13 -3.73 0.13 0.00 0.56 0.00 0.00 36.38 33.20 1t03 s VAL 179 CO -0.02 0.48 0.22 -0.63 -0.31 0.00 0.00 175.10 174.84 1t03 s ILE 180 N -0.37 1.85 -0.73 -0.62 1.01 -1.25 -1.64 121.20 119.45 1t03 s ILE 180 Ca 0.23 -2.70 -0.27 0.00 0.00 0.00 0.00 60.65 57.91 1t03 s ILE 180 Cb -0.16 -2.30 0.02 0.00 0.01 0.00 0.00 42.46 40.03 1t03 s ILE 180 CO 0.11 -0.82 1.39 -0.31 0.00 0.00 0.00 174.94 175.31 1t03 s TYR 181 N 0.29 2.18 -0.20 3.97 2.02 0.16 -4.85 117.35 120.92 1t03 s TYR 181 Ca 0.16 0.07 -0.11 0.00 -0.37 0.00 0.00 57.07 56.81 1t03 s TYR 181 Cb -0.24 -4.54 -0.05 0.00 -0.40 0.00 0.00 41.96 36.73 1t03 s TYR 181 CO -0.03 -2.11 0.20 1.14 -1.57 0.00 0.00 175.55 173.18 1t03 s GLN 182 N 5.94 4.18 -0.20 -0.62 -2.07 -1.26 -0.98 119.66 124.65 1t03 s GLN 182 Ca 0.41 -0.12 -0.04 0.00 -1.82 0.00 0.00 55.36 53.79 1t03 s GLN 182 Cb -0.08 -3.45 0.07 0.00 -1.09 0.00 0.00 33.01 28.45 1t03 s GLN 182 CO 0.15 0.21 0.07 -0.47 -1.32 0.00 0.00 175.29 173.94 1t03 s TYR 183 N 0.59 0.63 0.00 9.60 5.04 -0.39 -5.00 117.35 127.82 1t03 s TYR 183 Ca 0.11 -0.67 0.00 0.00 -2.44 0.00 0.00 57.07 54.07 1t03 s TYR 183 Cb -0.12 -0.90 0.00 0.00 0.35 0.00 0.00 41.96 41.28 1t03 s TYR 183 CO 0.01 -0.60 0.00 -0.12 -1.34 0.00 0.00 175.55 173.50 1t03 n MET 184 N 5.16 0.00 -1.78 4.97 1.56 -1.26 -1.80 117.12 123.97 1t03 n MET 184 Ca -0.07 0.00 -0.34 0.00 -0.27 0.00 0.00 57.70 57.01 1t03 n MET 184 Cb 0.47 0.00 0.05 0.00 2.15 0.00 0.00 33.22 35.89 1t03 n MET 184 CO 0.00 0.00 0.00 -0.40 -0.73 0.00 0.00 175.97 174.84 1t03 n ASP 185 N 6.96 6.92 -3.85 6.12 5.75 -1.26 -4.93 116.55 132.26 1t03 n ASP 185 Ca 0.00 -3.79 -0.13 0.00 -0.01 0.00 0.00 54.79 50.86 1t03 n ASP 185 Cb 0.00 -0.87 -0.15 0.00 -1.03 0.00 0.00 41.12 39.08 1t03 n ASP 185 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1t03 s ASP 186 N -1.99 0.05 -0.06 -1.12 -1.08 -0.75 -2.51 116.67 109.21 1t03 s ASP 186 Ca 0.56 0.01 0.02 0.00 -0.52 0.00 0.00 52.55 52.62 1t03 s ASP 186 Cb 0.46 -0.03 0.01 0.00 -1.46 0.00 0.00 42.92 41.90 1t03 s ASP 186 CO -0.18 -0.03 -0.11 -0.76 0.52 0.00 0.00 175.17 174.61 1t03 s LEU 187 N 0.30 1.64 -0.41 -1.34 1.43 -0.34 -1.26 118.68 118.70 1t03 s LEU 187 Ca -0.02 -0.27 -0.10 0.00 -1.03 0.00 0.00 54.13 52.70 1t03 s LEU 187 Cb -0.04 -0.77 0.06 0.00 0.03 0.00 0.00 46.19 45.48 1t03 s LEU 187 CO -0.01 0.03 0.25 -0.47 0.23 0.00 0.00 176.35 176.39 1t03 s TYR 188 N 0.61 3.30 -0.11 0.29 6.14 -0.15 0.03 117.35 127.45 1t03 s TYR 188 Ca -0.13 -1.29 -0.00 0.00 0.64 0.00 0.00 57.07 56.29 1t03 s TYR 188 Cb -0.15 -2.79 -0.02 0.00 0.42 0.00 0.00 41.96 39.42 1t03 s TYR 188 CO 0.03 -0.78 -0.09 0.08 0.64 0.00 0.00 175.55 175.43 1t03 s VAL 189 N 1.49 3.46 0.14 3.14 1.01 0.53 0.35 120.40 130.52 1t03 s VAL 189 Ca 0.03 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 1t03 s VAL 189 Cb -0.22 -2.45 0.01 0.00 0.00 0.00 0.00 36.38 33.72 1t03 s VAL 189 CO 0.04 0.54 0.31 -0.83 0.00 0.00 0.00 175.10 175.16 1t03 s GLY 190 N -0.08 0.17 -0.10 4.51 0.00 -0.65 0.11 107.32 111.28 1t03 s GLY 190 Ca -0.00 -0.59 -0.32 0.00 0.00 0.00 0.00 44.72 43.81 1t03 s GLY 190 CO 0.03 -0.66 1.14 -1.35 0.00 0.00 0.00 173.10 172.26 1t03 s SER 191 N -2.90 -0.17 -0.42 1.64 1.04 0.30 -1.79 113.70 111.40 1t03 s SER 191 Ca 0.10 -0.05 -0.02 0.00 0.48 0.00 0.00 55.95 56.47 1t03 s SER 191 Cb 0.03 0.22 0.24 0.00 0.10 0.00 0.00 66.02 66.61 1t03 s SER 191 CO -0.05 -0.36 2.13 0.47 0.98 0.00 0.00 173.24 176.40 1t03 n ASP 192 N -0.22 6.74 -4.95 7.02 8.00 -1.26 -0.53 116.55 131.35 1t03 n ASP 192 Ca -0.03 -3.24 -0.19 0.00 0.71 0.00 0.00 54.79 52.03 1t03 n ASP 192 Cb 0.60 -1.07 -0.01 0.00 -0.02 0.00 0.00 41.12 40.62 1t03 n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1t03 s LEU 193 N -2.30 3.77 0.44 0.64 1.43 -1.26 -4.86 118.68 116.54 1t03 s LEU 193 Ca 0.42 -0.36 -0.23 0.00 -1.03 0.00 0.00 54.13 52.93 1t03 s LEU 193 Cb 0.32 -2.53 -0.08 0.00 0.03 0.00 0.00 46.19 43.93 1t03 s LEU 193 CO -0.05 -0.48 1.09 -1.61 0.23 0.00 0.00 176.35 175.53 1t03 s GLU 194 N -4.15 3.94 0.10 1.70 0.41 -1.26 -4.04 118.70 115.40 1t03 s GLU 194 Ca 0.46 1.57 0.03 0.00 -0.41 0.00 0.00 54.97 56.61 1t03 s GLU 194 Cb -0.08 -2.40 0.15 0.00 -1.78 0.00 0.00 34.13 30.03 1t03 s GLU 194 CO 0.30 -0.35 0.83 -0.89 -0.49 0.00 0.00 175.26 174.66 1t03 n ILE 195 N -0.41 0.68 -0.09 -1.63 2.08 -1.26 -1.63 119.36 117.10 1t03 n ILE 195 Ca 0.07 0.58 -0.09 0.00 0.56 0.00 0.00 62.75 63.86 1t03 n ILE 195 Cb 0.50 -1.58 -0.03 0.00 -0.75 0.00 0.00 39.64 37.78 1t03 n ILE 195 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1t03 n GLY 196 N -1.22 -0.73 0.28 7.39 0.00 -1.26 -3.48 105.19 106.18 1t03 n GLY 196 Ca -0.00 -0.22 0.13 0.00 0.00 0.00 0.00 46.02 45.93 1t03 n GLY 196 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1t03 h GLN 197 N -1.00 0.00 0.43 1.61 4.20 -1.80 -0.65 115.11 117.90 1t03 h GLN 197 Ca -0.07 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1t03 h GLN 197 Cb 0.85 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.64 1t03 h GLN 197 CO -0.04 0.04 -0.21 1.25 -0.67 0.00 0.00 178.83 179.21 1t03 h HIS 198 N 0.00 -0.53 -1.01 2.96 2.76 -1.52 -2.36 115.15 115.44 1t03 h HIS 198 Ca -0.00 -0.01 0.24 0.00 -2.20 0.00 0.00 60.37 58.40 1t03 h HIS 198 Cb 0.10 0.18 -0.10 0.00 1.55 0.00 0.00 27.41 29.14 1t03 h HIS 198 CO 0.00 -0.33 0.64 -0.09 -1.30 0.00 0.00 177.93 176.85 1t03 h ARG 199 N -1.08 0.48 0.00 5.26 9.65 -1.50 2.00 114.38 129.19 1t03 h ARG 199 Ca -0.06 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.79 1t03 h ARG 199 Cb 0.44 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 1t03 h ARG 199 CO 0.10 0.32 0.00 1.15 2.80 0.00 0.00 179.97 184.34 1t03 h THR 200 N 0.50 0.00 0.00 0.20 2.02 -1.09 -2.01 112.91 112.53 1t03 h THR 200 Ca 0.58 -0.36 -0.27 0.00 0.77 0.00 0.00 66.41 67.14 1t03 h THR 200 Cb 1.30 1.21 -0.04 0.00 -1.74 0.00 0.00 68.15 68.89 1t03 h THR 200 CO -0.33 0.00 -1.45 1.17 0.37 0.00 0.00 175.52 175.29 1t03 n LYS 201 N -2.61 0.57 -0.21 6.66 3.00 0.65 -2.98 118.16 123.24 1t03 n LYS 201 Ca 0.02 0.53 0.01 0.00 -0.00 0.00 0.00 58.31 58.86 1t03 n LYS 201 Cb 0.27 -1.71 0.09 0.00 0.00 0.00 0.00 35.03 33.68 1t03 n LYS 201 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 1t03 h ILE 202 N -0.97 0.43 0.42 3.15 1.08 -0.57 0.24 117.51 121.29 1t03 h ILE 202 Ca -0.40 -0.02 -0.01 0.00 -0.39 0.00 0.00 64.86 64.04 1t03 h ILE 202 Cb 1.36 0.35 -0.02 0.00 -3.07 0.00 0.00 36.82 35.45 1t03 h ILE 202 CO -0.23 0.01 -0.45 -0.08 -0.69 0.00 0.00 178.15 176.71 1t03 h GLU 203 N 0.07 -0.85 -1.53 2.37 4.57 -1.53 0.32 114.58 118.00 1t03 h GLU 203 Ca 0.33 0.06 0.44 0.00 -1.18 0.00 0.00 59.36 59.01 1t03 h GLU 203 Cb 0.53 0.19 -0.06 0.00 -0.16 0.00 0.00 28.75 29.25 1t03 h GLU 203 CO -0.59 -0.57 1.17 1.49 -1.18 0.00 0.00 179.01 179.34 1t03 h GLU 204 N -0.88 0.00 0.17 1.92 4.81 -0.71 0.47 114.58 120.36 1t03 h GLU 204 Ca -0.05 0.00 -0.34 0.00 -0.13 0.00 0.00 59.36 58.84 1t03 h GLU 204 Cb 0.77 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.16 1t03 h GLU 204 CO -0.07 0.00 -1.68 1.25 -0.73 0.00 0.00 179.01 177.78 1t03 h LEU 205 N 0.00 0.57 -0.88 1.64 6.46 0.15 -3.21 115.31 120.05 1t03 h LEU 205 Ca 0.73 -0.92 -0.01 0.00 -0.12 0.00 0.00 57.88 57.56 1t03 h LEU 205 Cb 3.06 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 42.76 1t03 h LEU 205 CO -0.01 1.76 0.53 0.03 -0.62 0.00 0.00 178.44 180.12 1t03 h ARG 206 N 0.02 1.19 -0.87 1.25 3.08 0.35 -1.73 114.38 117.68 1t03 h ARG 206 Ca -0.34 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 59.60 1t03 h ARG 206 Cb 2.03 -0.25 -0.04 0.00 0.08 0.00 0.00 29.97 31.79 1t03 h ARG 206 CO 0.15 0.84 0.54 1.96 -1.07 0.00 0.00 179.97 182.39 1t03 h GLN 207 N 1.21 1.17 0.41 0.04 4.20 -1.35 0.14 115.11 120.92 1t03 h GLN 207 Ca 0.31 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.91 1t03 h GLN 207 Cb -0.04 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 27.48 1t03 h GLN 207 CO -0.06 0.81 -0.25 1.25 -0.67 0.00 0.00 178.83 179.91 1t03 h HIS 208 N 1.19 -0.65 -0.75 2.96 2.76 -1.32 0.73 115.15 120.06 1t03 h HIS 208 Ca 0.31 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.46 1t03 h HIS 208 Cb -0.07 0.23 -0.04 0.00 1.55 0.00 0.00 27.41 29.09 1t03 h HIS 208 CO -0.00 -0.38 0.41 -0.07 -1.30 0.00 0.00 177.93 176.58 1t03 h LEU 209 N -0.63 0.95 0.05 0.26 3.38 -1.35 -0.71 115.31 117.27 1t03 h LEU 209 Ca -0.04 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.85 1t03 h LEU 209 Cb 0.51 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 1t03 h LEU 209 CO 0.05 0.78 -0.34 0.25 0.09 0.00 0.00 178.44 179.27 1t03 h LEU 210 N 1.04 -1.00 -2.41 1.67 5.85 -0.51 0.76 115.31 120.71 1t03 h LEU 210 Ca 0.26 0.12 0.01 0.00 0.84 0.00 0.00 57.88 59.12 1t03 h LEU 210 Cb 0.05 0.39 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 1t03 h LEU 210 CO -0.04 -0.41 0.19 0.03 -0.34 0.00 0.00 178.44 177.87 1t03 h ARG 211 N -0.52 0.00 -0.48 1.25 2.47 0.96 -0.74 114.38 117.32 1t03 h ARG 211 Ca 0.05 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 1t03 h ARG 211 Cb 0.59 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.91 1t03 h ARG 211 CO -0.24 0.00 0.00 0.91 0.56 0.00 0.00 179.97 181.20 1t03 n TRP 212 N -3.16 1.67 0.00 3.04 7.02 0.22 -4.92 117.44 121.30 1t03 n TRP 212 Ca -0.01 -0.77 0.00 0.00 -1.02 0.00 0.00 57.50 55.70 1t03 n TRP 212 Cb 0.26 -0.43 0.00 0.00 -2.42 0.00 0.00 31.31 28.72 1t03 n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1t03 n GLY 213 N 0.29 2.45 3.50 6.99 0.00 -0.27 -4.55 105.19 113.60 1t03 n GLY 213 Ca 0.25 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 1t03 n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t03 s LEU 214 N 0.00 4.03 -0.04 0.99 2.01 0.13 -4.82 118.68 120.98 1t03 s LEU 214 Ca 0.00 -0.63 -0.30 0.00 0.01 0.00 0.00 54.13 53.21 1t03 s LEU 214 Cb 0.00 -2.62 -0.03 0.00 0.01 0.00 0.00 46.19 43.55 1t03 s LEU 214 CO 0.00 -1.44 1.17 0.28 1.01 0.00 0.00 176.35 177.37 1t03 s THR 215 N 4.36 4.31 -0.95 5.49 -1.32 -1.26 -2.26 115.64 124.00 1t03 s THR 215 Ca 0.28 1.63 -0.03 0.00 -1.21 0.00 0.00 61.69 62.36 1t03 s THR 215 Cb -0.13 -4.05 0.24 0.00 -1.51 0.00 0.00 72.50 67.04 1t03 s THR 215 CO 0.15 0.02 0.88 0.35 -2.21 0.00 0.00 174.62 173.81 1t03 n THR 216 N 4.48 3.42 -0.80 5.08 -2.24 -1.26 -0.20 114.28 122.77 1t03 n THR 216 Ca 0.10 -5.20 -0.34 0.00 -2.27 0.00 0.00 64.05 56.34 1t03 n THR 216 Cb 0.47 -2.41 0.12 0.00 -2.10 0.00 0.00 70.33 66.40 1t03 n THR 216 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1t03 n PRO 217 N 2.32 -0.88 -0.92 -0.78 -0.02 -1.25 -4.82 135.00 128.65 1t03 n PRO 217 Ca 0.23 -0.24 -0.13 0.00 -2.02 0.00 0.00 63.50 61.34 1t03 n PRO 217 Cb 0.37 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.31 1t03 n PRO 217 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1t03 n ASP 218 N 0.04 5.88 -1.75 2.55 8.00 -1.26 -3.88 116.55 126.13 1t03 n ASP 218 Ca 0.01 -2.78 -0.15 0.00 0.71 0.00 0.00 54.79 52.59 1t03 n ASP 218 Cb 0.64 -1.20 0.07 0.00 -0.02 0.00 0.00 41.12 40.60 1t03 n ASP 218 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1t03 n LYS 219 N 1.27 2.91 -4.11 -1.24 2.85 -1.26 -5.04 118.16 113.54 1t03 n LYS 219 Ca 0.28 -3.86 -0.31 0.00 -1.05 0.00 0.00 58.31 53.37 1t03 n LYS 219 Cb 0.63 -2.01 -0.07 0.00 -0.65 0.00 0.00 35.03 32.92 1t03 n LYS 219 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 1t03 s LYS 220 N -3.44 2.81 -0.24 -1.58 0.00 -1.25 -4.64 119.74 111.41 1t03 s LYS 220 Ca 0.46 -0.68 -0.22 0.00 0.00 0.00 0.00 55.97 55.53 1t03 s LYS 220 Cb 0.39 -2.69 -0.02 0.00 0.00 0.00 0.00 37.83 35.51 1t03 s LYS 220 CO 0.00 0.58 0.68 -1.01 0.00 0.00 0.00 175.35 175.61 1t03 s HIS 221 N -1.29 3.31 -0.03 1.78 3.76 -0.10 -4.98 115.29 117.75 1t03 s HIS 221 Ca 0.26 0.93 0.01 0.00 -0.15 0.00 0.00 55.06 56.11 1t03 s HIS 221 Cb -0.12 -2.88 0.02 0.00 1.11 0.00 0.00 32.58 30.70 1t03 s HIS 221 CO 0.18 -0.30 -0.04 1.14 -0.85 0.00 0.00 174.74 174.87 1t03 s GLN 222 N 2.43 0.63 -0.63 1.40 -2.07 -1.26 -2.37 119.66 117.78 1t03 s GLN 222 Ca 0.29 -0.10 -0.06 0.00 -1.82 0.00 0.00 55.36 53.68 1t03 s GLN 222 Cb -0.16 -0.66 0.05 0.00 -1.09 0.00 0.00 33.01 31.16 1t03 s GLN 222 CO 0.09 -0.04 0.17 1.63 -1.32 0.00 0.00 175.29 175.82 1t03 n LYS 223 N 3.77 -2.52 -0.65 9.60 5.02 -1.26 -4.78 118.16 127.33 1t03 n LYS 223 Ca -0.23 0.15 0.03 0.00 -2.02 0.00 0.00 58.31 56.24 1t03 n LYS 223 Cb 0.52 -4.70 0.21 0.00 -0.02 0.00 0.00 35.03 31.04 1t03 n LYS 223 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1t03 n GLU 224 N -2.98 1.65 -1.64 1.97 1.02 -1.26 -5.06 120.64 114.35 1t03 n GLU 224 Ca 0.00 -3.27 -0.40 0.00 -0.02 0.00 0.00 57.16 53.47 1t03 n GLU 224 Cb 0.51 -1.67 0.03 0.00 -0.02 0.00 0.00 31.44 30.28 1t03 n GLU 224 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1t03 n PRO 225 N -1.13 1.34 -1.97 3.49 -0.04 -1.26 -4.30 135.00 131.14 1t03 n PRO 225 Ca 0.23 0.49 -0.40 0.00 -0.04 0.00 0.00 63.50 63.77 1t03 n PRO 225 Cb 0.78 -2.17 -0.01 0.00 -0.04 0.00 0.00 33.50 32.06 1t03 n PRO 225 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1t03 s PRO 226 N -2.32 4.12 -0.17 0.54 0.02 -1.26 -5.10 135.00 130.83 1t03 s PRO 226 Ca 0.67 2.34 -0.15 0.00 0.02 0.00 0.00 61.00 63.88 1t03 s PRO 226 Cb -0.49 -2.93 -0.04 0.00 0.02 0.00 0.00 34.50 31.05 1t03 s PRO 226 CO 0.54 -0.43 0.33 -0.06 -0.33 0.00 0.00 177.00 177.05 1t03 s PHE 227 N -1.17 3.43 -1.18 6.54 2.99 -0.99 -4.80 117.98 122.80 1t03 s PHE 227 Ca 0.53 0.60 -0.14 0.00 0.00 0.00 0.00 56.93 57.92 1t03 s PHE 227 Cb -0.42 -2.41 0.17 0.00 0.00 0.00 0.00 43.02 40.36 1t03 s PHE 227 CO 0.56 0.15 1.41 -0.51 -0.00 0.00 0.00 175.22 176.82 1t03 s LEU 228 N 0.77 5.05 -0.18 -0.37 1.43 -1.26 -0.51 118.68 123.60 1t03 s LEU 228 Ca 0.17 -2.91 -0.04 0.00 -1.03 0.00 0.00 54.13 50.33 1t03 s LEU 228 Cb -0.14 -2.40 -0.02 0.00 0.03 0.00 0.00 46.19 43.66 1t03 s LEU 228 CO 0.06 -0.78 -0.04 0.86 0.23 0.00 0.00 176.35 176.68 1t03 s TRP 229 N 1.68 2.98 -1.15 0.29 -0.00 -1.20 -4.69 118.94 116.85 1t03 s TRP 229 Ca 0.42 -0.56 0.00 0.00 -0.00 0.00 0.00 56.10 55.96 1t03 s TRP 229 Cb -0.03 -2.02 0.00 0.00 -0.00 0.00 0.00 33.47 31.42 1t03 s TRP 229 CO -0.01 -0.25 0.00 -1.33 -0.00 0.00 0.00 176.95 175.36 1t03 n MET 230 N 4.07 -1.93 -0.36 5.86 2.81 -1.26 -0.79 117.12 125.52 1t03 n MET 230 Ca -0.18 0.65 0.00 0.00 -1.81 0.00 0.00 57.70 56.36 1t03 n MET 230 Cb 0.52 -5.14 0.00 0.00 -0.71 0.00 0.00 33.22 27.89 1t03 n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1t03 n GLY 231 N -0.63 0.82 0.00 3.03 0.00 -1.26 -5.06 105.19 102.08 1t03 n GLY 231 Ca -0.14 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1t03 n GLY 231 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1t03 n TYR 232 N -2.36 -0.02 -3.72 1.61 4.02 0.03 -2.40 117.16 114.33 1t03 n TYR 232 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.74 1t03 n TYR 232 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 39.34 39.17 1t03 n TYR 232 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 1t03 s GLU 233 N -0.49 0.03 -0.25 -0.72 2.02 -0.07 -3.23 118.70 115.98 1t03 s GLU 233 Ca 0.00 0.38 -0.08 0.00 0.02 0.00 0.00 54.97 55.29 1t03 s GLU 233 Cb 0.00 -0.26 -0.04 0.00 0.10 0.00 0.00 34.13 33.94 1t03 s GLU 233 CO 0.00 -0.22 0.10 -0.51 0.02 0.00 0.00 175.26 174.65 1t03 s LEU 234 N 1.56 3.63 -0.06 1.80 1.43 0.33 -1.98 118.68 125.39 1t03 s LEU 234 Ca -0.04 -0.12 -0.00 0.00 -1.03 0.00 0.00 54.13 52.94 1t03 s LEU 234 Cb -0.12 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 1t03 s LEU 234 CO -0.05 -0.01 -0.02 -1.00 0.23 0.00 0.00 176.35 175.51 1t03 s HIS 235 N 1.47 3.08 0.45 0.29 3.76 0.37 -2.34 115.29 122.37 1t03 s HIS 235 Ca 0.06 0.13 0.32 0.00 -0.15 0.00 0.00 55.06 55.41 1t03 s HIS 235 Cb -0.15 -1.74 1.45 0.00 1.11 0.00 0.00 32.58 33.25 1t03 s HIS 235 CO 0.05 0.43 1.63 -1.35 -0.85 0.00 0.00 174.74 174.65 1t03 h PRO 236 N 5.01 0.08 0.00 8.40 0.11 -1.98 -1.87 132.00 141.75 1t03 h PRO 236 Ca -0.50 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.46 1t03 h PRO 236 Cb 1.18 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 1t03 h PRO 236 CO 0.54 0.05 -1.73 -0.25 -0.21 0.00 0.00 178.00 176.40 1t03 n ASP 237 N -4.61 2.12 -2.26 -2.05 8.00 -1.26 -4.87 116.55 111.61 1t03 n ASP 237 Ca 0.37 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.77 1t03 n ASP 237 Cb 1.47 1.04 -0.03 0.00 -0.02 0.00 0.00 41.12 43.57 1t03 n ASP 237 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1t03 n LYS 238 N -2.28 0.31 -3.73 -1.24 4.76 -0.70 -4.53 118.16 110.75 1t03 n LYS 238 Ca -0.14 -1.84 -0.13 0.00 -2.87 0.00 0.00 58.31 53.33 1t03 n LYS 238 Cb 0.71 1.61 -0.10 0.00 -1.84 0.00 0.00 35.03 35.40 1t03 n LYS 238 CO 0.00 0.00 0.00 1.67 -1.37 0.00 0.00 177.40 177.70 1t03 s TRP 239 N -3.19 -0.45 0.17 2.13 1.48 -1.09 0.14 118.94 118.13 1t03 s TRP 239 Ca 0.21 1.08 0.10 0.00 -1.06 0.00 0.00 56.10 56.43 1t03 s TRP 239 Cb 0.00 0.15 -0.04 0.00 -1.16 0.00 0.00 33.47 32.43 1t03 s TRP 239 CO 0.15 -0.23 -0.21 -0.08 -4.06 0.00 0.00 176.95 172.52 1t03 s THR 240 N 0.16 2.04 0.02 0.66 -1.32 -0.83 -1.35 115.64 115.02 1t03 s THR 240 Ca -0.00 -1.94 -0.24 0.00 -1.21 0.00 0.00 61.69 58.29 1t03 s THR 240 Cb -0.03 -1.94 -0.05 0.00 -1.51 0.00 0.00 72.50 68.97 1t03 s THR 240 CO 0.01 -0.21 0.74 0.54 -2.21 0.00 0.00 174.62 173.48 1t03 s VAL 241 N -1.82 4.80 0.11 5.08 0.11 -1.26 -0.89 120.40 126.52 1t03 s VAL 241 Ca 0.17 1.56 -0.34 0.00 -2.93 0.00 0.00 61.98 60.43 1t03 s VAL 241 Cb -0.07 -4.08 -0.14 0.00 -1.53 0.00 0.00 36.38 30.56 1t03 s VAL 241 CO 0.08 0.35 1.58 0.00 -3.33 0.00 0.00 175.10 173.78 1t03 n GLN 242 N 2.93 1.97 -0.77 1.54 6.02 -1.01 -4.79 117.38 123.27 1t03 n GLN 242 Ca -0.03 0.71 -0.27 0.00 -0.01 0.00 0.00 57.00 57.40 1t03 n GLN 242 Cb 0.50 -2.47 -0.02 0.00 1.02 0.00 0.00 30.24 29.28 1t03 n GLN 242 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1t03 n PRO 243 N 3.70 0.00 -3.82 -1.09 -0.04 -1.26 -4.94 135.00 127.54 1t03 n PRO 243 Ca 0.18 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.28 1t03 n PRO 243 Cb 0.27 -0.58 -0.13 0.00 -0.04 0.00 0.00 33.50 33.02 1t03 n PRO 243 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1t03 s ILE 244 N -0.49 3.28 -1.19 0.52 2.07 -1.26 -5.03 121.20 119.11 1t03 s ILE 244 Ca 0.37 -1.56 -0.09 0.00 -1.41 0.00 0.00 60.65 57.95 1t03 s ILE 244 Cb -0.53 -3.01 0.22 0.00 0.13 0.00 0.00 42.46 39.27 1t03 s ILE 244 CO 0.31 -0.33 1.53 1.33 -1.91 0.00 0.00 174.94 175.87 1t03 n VAL 245 N 4.66 4.58 -1.73 4.00 0.24 -1.26 -5.02 118.33 123.80 1t03 n VAL 245 Ca -0.09 -5.01 -0.42 0.00 -2.04 0.00 0.00 64.34 56.78 1t03 n VAL 245 Cb 0.43 -2.37 -0.01 0.00 -1.47 0.00 0.00 33.84 30.41 1t03 n VAL 245 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1t03 n LEU 246 N 3.60 4.05 -4.69 1.34 -0.00 -1.26 -4.91 117.00 115.14 1t03 n LEU 246 Ca 0.33 1.16 -0.42 0.00 -0.00 0.00 0.00 56.01 57.08 1t03 n LEU 246 Cb 0.38 -1.55 -0.03 0.00 -0.00 0.00 0.00 43.42 42.22 1t03 n LEU 246 CO 0.68 -0.05 1.50 -2.84 -0.00 0.00 0.00 177.39 176.68 1t03 s PRO 247 N -0.83 4.13 -0.17 1.47 0.02 -1.26 -4.89 135.00 133.47 1t03 s PRO 247 Ca 0.63 2.61 0.16 0.00 0.02 0.00 0.00 61.00 64.42 1t03 s PRO 247 Cb -0.53 -3.67 0.38 0.00 0.02 0.00 0.00 34.50 30.70 1t03 s PRO 247 CO 0.52 -0.86 1.24 -0.85 -0.33 0.00 0.00 177.00 176.72 1t03 n GLU 248 N 5.93 1.68 -0.84 5.54 0.28 -1.26 -4.97 120.64 126.99 1t03 n GLU 248 Ca 0.18 -2.86 -0.34 0.00 -0.16 0.00 0.00 57.16 53.98 1t03 n GLU 248 Cb 0.38 -1.62 0.10 0.00 1.43 0.00 0.00 31.44 31.74 1t03 n GLU 248 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1t03 n LYS 249 N -1.18 -0.53 -0.07 3.44 5.02 -1.26 -4.99 118.16 118.59 1t03 n LYS 249 Ca 0.19 -0.14 -0.12 0.00 -2.02 0.00 0.00 58.31 56.23 1t03 n LYS 249 Cb 0.73 -1.48 -0.11 0.00 -0.02 0.00 0.00 35.03 34.16 1t03 n LYS 249 CO 0.00 0.00 0.00 0.38 -0.52 0.00 0.00 177.40 177.26 1t03 h ASP 250 N -1.48 0.00 -3.59 4.39 3.04 -2.06 -3.45 116.42 113.28 1t03 h ASP 250 Ca -0.46 -0.82 -0.61 0.00 -3.24 0.00 0.00 57.03 51.90 1t03 h ASP 250 Cb 1.33 0.00 -0.13 0.00 -1.04 0.00 0.00 39.33 39.49 1t03 h ASP 250 CO 0.31 0.91 -0.18 -0.94 -2.04 0.00 0.00 179.24 177.30 1t03 s SER 251 N -6.11 6.36 -0.24 4.15 1.04 -1.26 -5.07 113.70 112.58 1t03 s SER 251 Ca -0.16 0.42 -0.07 0.00 0.48 0.00 0.00 55.95 56.63 1t03 s SER 251 Cb -0.02 -2.23 -0.03 0.00 0.10 0.00 0.00 66.02 63.84 1t03 s SER 251 CO 0.57 -0.15 0.06 0.26 0.98 0.00 0.00 173.24 174.95 1t03 s TRP 252 N 1.78 3.09 0.18 5.02 0.52 -1.26 -5.06 118.94 123.21 1t03 s TRP 252 Ca 0.18 -0.39 0.09 0.00 0.02 0.00 0.00 56.10 55.99 1t03 s TRP 252 Cb -0.15 -2.20 -0.04 0.00 -1.15 0.00 0.00 33.47 29.92 1t03 s TRP 252 CO 0.09 -0.31 -0.10 0.95 0.02 0.00 0.00 176.95 177.60 1t03 s THR 253 N 1.43 3.14 0.29 2.01 -4.23 -1.26 -0.15 115.64 116.87 1t03 s THR 253 Ca 0.05 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 1t03 s THR 253 Cb -0.15 -2.56 0.35 0.00 1.34 0.00 0.00 72.50 71.49 1t03 s THR 253 CO 0.03 -0.12 1.61 1.62 -0.54 0.00 0.00 174.62 177.22 1t03 h VAL 254 N 2.75 0.17 0.39 2.29 3.04 -1.70 -1.61 116.25 121.59 1t03 h VAL 254 Ca -0.47 -0.03 -0.01 0.00 -1.01 0.00 0.00 66.70 65.19 1t03 h VAL 254 Cb 1.21 0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 30.56 1t03 h VAL 254 CO 0.54 0.01 -0.27 -1.13 -1.01 0.00 0.00 177.57 175.71 1t03 h ASN 255 N 0.08 -0.70 -0.15 3.17 -0.73 -1.83 -1.84 115.58 113.59 1t03 h ASN 255 Ca 0.55 0.05 0.04 0.00 1.87 0.00 0.00 56.30 58.81 1t03 h ASN 255 Cb 1.10 0.22 -0.01 0.00 0.27 0.00 0.00 38.32 39.90 1t03 h ASN 255 CO -0.79 -0.42 0.29 0.44 -0.37 0.00 0.00 177.43 176.58 1t03 h ASP 256 N -0.65 0.00 -0.19 1.15 3.32 -1.62 -0.15 116.42 118.28 1t03 h ASP 256 Ca -0.04 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 1t03 h ASP 256 Cb 0.55 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.10 1t03 h ASP 256 CO 0.02 0.00 -0.13 0.40 -1.72 0.00 0.00 179.24 177.81 1t03 h ILE 257 N 0.00 1.32 -0.92 0.35 2.04 -1.01 -3.00 117.51 116.30 1t03 h ILE 257 Ca 0.07 -1.24 0.14 0.00 1.00 0.00 0.00 64.86 64.83 1t03 h ILE 257 Cb 0.64 1.72 -0.07 0.00 -0.74 0.00 0.00 36.82 38.37 1t03 h ILE 257 CO -0.00 0.37 0.59 0.00 0.00 0.00 0.00 178.15 179.11 1t03 h LYS 259 N 0.76 0.00 0.00 0.00 3.64 -1.46 -1.45 116.57 118.07 1t03 h LYS 259 Ca 0.46 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.84 1t03 h LYS 259 Cb 0.67 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 1t03 h LYS 259 CO -0.22 0.08 -0.18 1.25 -2.27 0.00 0.00 179.45 178.10 1t03 h LEU 260 N 0.00 0.00 -0.93 5.20 5.85 -0.45 -3.24 115.31 121.74 1t03 h LEU 260 Ca -0.00 0.00 0.16 0.00 0.84 0.00 0.00 57.88 58.88 1t03 h LEU 260 Cb 0.48 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 41.35 1t03 h LEU 260 CO 0.01 0.30 -0.32 1.62 -0.34 0.00 0.00 178.44 179.71 1t03 h VAL 261 N -0.42 0.04 0.22 1.05 3.04 -0.85 0.33 116.25 119.67 1t03 h VAL 261 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1t03 h VAL 261 Cb 0.18 0.04 -0.04 0.00 -2.01 0.00 0.00 31.29 29.46 1t03 h VAL 261 CO 0.00 0.00 -0.50 1.23 -1.01 0.00 0.00 177.57 177.29 1t03 h GLY 262 N -0.02 -1.19 -0.13 3.17 0.00 -1.46 -0.24 103.07 103.20 1t03 h GLY 262 Ca 0.37 0.63 0.13 0.00 0.00 0.00 0.00 47.33 48.46 1t03 h GLY 262 CO -0.94 -0.30 -0.05 0.50 0.00 0.00 0.00 176.54 175.74 1t03 h LYS 263 N -0.79 0.07 -0.61 4.80 1.57 -1.01 0.21 116.57 120.82 1t03 h LYS 263 Ca -0.02 -0.00 0.11 0.00 -1.87 0.00 0.00 60.65 58.86 1t03 h LYS 263 Cb 0.76 -0.02 -0.12 0.00 0.08 0.00 0.00 32.23 32.94 1t03 h LYS 263 CO -0.22 0.05 -0.32 -0.07 -0.57 0.00 0.00 179.45 178.32 1t03 h LEU 264 N 0.07 -1.11 -0.05 2.94 3.38 0.57 0.31 115.31 121.41 1t03 h LEU 264 Ca 0.32 0.23 0.04 0.00 0.09 0.00 0.00 57.88 58.55 1t03 h LEU 264 Cb 0.51 0.56 -0.06 0.00 0.09 0.00 0.00 40.66 41.77 1t03 h LEU 264 CO -0.57 -0.30 -0.37 0.78 0.09 0.00 0.00 178.44 178.07 1t03 h ASN 265 N -0.14 -1.14 -1.32 -0.43 2.35 0.11 0.27 115.58 115.27 1t03 h ASN 265 Ca 0.24 0.15 0.39 0.00 -0.55 0.00 0.00 56.30 56.53 1t03 h ASN 265 Cb 0.55 0.46 -0.07 0.00 0.05 0.00 0.00 38.32 39.30 1t03 h ASN 265 CO -0.69 -0.41 0.93 -0.25 -1.65 0.00 0.00 177.43 175.36 1t03 h TRP 266 N -0.50 0.18 0.00 1.19 2.91 0.12 0.86 115.95 120.72 1t03 h TRP 266 Ca 0.07 0.01 -0.24 0.00 1.13 0.00 0.00 58.89 59.85 1t03 h TRP 266 Cb 0.60 -0.05 -0.04 0.00 -0.51 0.00 0.00 29.16 29.17 1t03 h TRP 266 CO -0.41 -0.02 -1.27 0.00 -1.03 0.00 0.00 178.44 175.72 1t03 h ALA 267 N 1.40 0.51 0.00 2.65 0.00 0.21 -3.32 119.26 120.70 1t03 h ALA 267 Ca 0.67 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1t03 h ALA 267 Cb 2.46 0.09 0.00 0.00 0.00 0.00 0.00 17.79 20.33 1t03 h ALA 267 CO -0.11 1.38 0.33 0.77 0.00 0.00 0.00 179.25 181.62 1t03 h SER 268 N 0.00 0.00 0.46 0.00 0.02 0.35 -1.14 113.55 113.24 1t03 h SER 268 Ca -0.11 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.63 1t03 h SER 268 Cb 1.86 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.40 1t03 h SER 268 CO 0.11 0.00 -0.86 0.06 -1.14 0.00 0.00 176.83 175.00 1t03 h GLN 269 N 0.00 0.28 0.00 3.45 3.07 -1.64 -3.16 115.11 117.12 1t03 h GLN 269 Ca 0.00 -0.29 -0.07 0.00 0.09 0.00 0.00 58.65 58.38 1t03 h GLN 269 Cb 0.66 0.08 -0.01 0.00 0.08 0.00 0.00 27.48 28.29 1t03 h GLN 269 CO 0.00 0.99 -1.26 1.51 0.09 0.00 0.00 178.83 180.16 1t03 n ILE 270 N -3.71 0.26 -2.40 1.86 0.13 -0.54 -0.21 119.36 114.74 1t03 n ILE 270 Ca -0.04 -0.13 -0.42 0.00 -1.10 0.00 0.00 62.75 61.05 1t03 n ILE 270 Cb 0.79 -0.79 -0.02 0.00 -0.84 0.00 0.00 39.64 38.78 1t03 n ILE 270 CO 0.00 0.00 0.00 -0.31 2.80 0.00 0.00 176.55 179.04 1t03 s TYR 271 N -2.09 2.37 -0.16 9.51 2.02 -0.58 -4.67 117.35 123.74 1t03 s TYR 271 Ca -0.04 0.55 -0.42 0.00 -0.37 0.00 0.00 57.07 56.80 1t03 s TYR 271 Cb 0.01 -4.38 -0.19 0.00 -0.40 0.00 0.00 41.96 37.01 1t03 s TYR 271 CO 0.13 -1.91 1.34 -2.30 -1.57 0.00 0.00 175.55 171.24 1t03 n PRO 272 N 8.41 0.29 -1.83 -1.71 -0.02 -1.26 -4.32 135.00 134.56 1t03 n PRO 272 Ca 0.13 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1t03 n PRO 272 Cb 0.49 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 1t03 n PRO 272 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1t03 n GLY 273 N 2.67 -0.50 2.82 -1.23 0.00 -1.26 -5.02 105.19 102.66 1t03 n GLY 273 Ca 0.24 -0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 1t03 n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1t03 s ILE 274 N -0.05 0.35 -0.21 -0.61 -1.09 -1.26 -5.02 121.20 113.30 1t03 s ILE 274 Ca 0.00 0.04 -0.10 0.00 -2.23 0.00 0.00 60.65 58.36 1t03 s ILE 274 Cb 0.00 -0.45 -0.05 0.00 -1.58 0.00 0.00 42.46 40.38 1t03 s ILE 274 CO 0.00 0.21 0.14 -0.54 -1.23 0.00 0.00 174.94 173.52 1t03 s LYS 275 N 1.35 4.15 0.00 2.79 1.02 -1.26 -4.91 119.74 122.88 1t03 s LYS 275 Ca -0.05 -0.24 0.00 0.00 0.02 0.00 0.00 55.97 55.71 1t03 s LYS 275 Cb -0.13 -3.45 0.00 0.00 -0.52 0.00 0.00 37.83 33.73 1t03 s LYS 275 CO -0.02 0.23 0.00 0.28 -0.92 0.00 0.00 175.35 174.91 1t03 n VAL 276 N 3.76 0.00 -0.18 3.17 0.31 -1.26 -4.74 118.33 119.39 1t03 n VAL 276 Ca -0.16 -0.06 0.29 0.00 -0.01 0.00 0.00 64.34 64.41 1t03 n VAL 276 Cb 0.52 0.46 0.73 0.00 -0.91 0.00 0.00 33.84 34.64 1t03 n VAL 276 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1t03 h ARG 277 N 0.00 0.00 0.00 5.55 9.65 -1.99 -0.96 114.38 126.63 1t03 h ARG 277 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1t03 h ARG 277 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1t03 h ARG 277 CO 0.00 0.00 0.00 1.04 2.80 0.00 0.00 179.97 183.81 1t03 n GLN 278 N -4.16 0.00 0.00 0.20 1.13 -1.26 -2.72 117.38 110.57 1t03 n GLN 278 Ca 0.19 0.41 0.04 0.00 -1.94 0.00 0.00 57.00 55.70 1t03 n GLN 278 Cb 1.01 -1.27 0.23 0.00 0.11 0.00 0.00 30.24 30.32 1t03 n GLN 278 CO 0.00 0.00 0.00 1.47 -1.44 0.00 0.00 177.06 177.09 1t03 n LEU 279 N -1.53 0.00 0.17 1.08 -0.00 -1.00 -3.64 117.00 112.08 1t03 n LEU 279 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.90 1t03 n LEU 279 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.35 1t03 n LEU 279 CO 0.00 0.00 0.38 -1.28 -0.00 0.00 0.00 177.39 176.49 1t03 h SER 280 N 0.00 -0.41 0.00 1.45 0.87 -0.98 -2.99 113.55 111.49 1t03 h SER 280 Ca 0.00 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.42 1t03 h SER 280 Cb 0.00 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1t03 h SER 280 CO 0.00 0.03 0.03 0.29 -0.53 0.00 0.00 176.83 176.65 1t03 n LYS 281 N -5.12 0.00 0.25 2.24 4.76 -1.23 -0.22 118.16 118.84 1t03 n LYS 281 Ca -0.09 0.06 0.15 0.00 -2.87 0.00 0.00 58.31 55.57 1t03 n LYS 281 Cb 0.27 -1.53 0.53 0.00 -1.84 0.00 0.00 35.03 32.46 1t03 n LYS 281 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1t03 h LEU 282 N 0.00 0.00 0.00 -0.35 3.38 -1.75 -2.94 115.31 113.65 1t03 h LEU 282 Ca 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1t03 h LEU 282 Cb 0.05 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1t03 h LEU 282 CO 0.00 0.00 -1.77 0.18 0.09 0.00 0.00 178.44 176.94 1t03 n LEU 283 N -3.00 0.46 -4.05 1.67 4.77 0.69 -4.98 117.00 112.56 1t03 n LEU 283 Ca 0.02 0.20 -0.37 0.00 -0.03 0.00 0.00 56.01 55.83 1t03 n LEU 283 Cb 0.36 0.16 0.05 0.00 -2.33 0.00 0.00 43.42 41.66 1t03 n LEU 283 CO 0.28 0.19 -1.51 0.54 -1.33 0.00 0.00 177.39 175.56 1t03 n ARG 284 N -2.71 -0.12 -0.70 3.23 5.12 -1.11 -4.64 116.66 115.73 1t03 n ARG 284 Ca -0.14 -0.03 0.02 0.00 -1.93 0.00 0.00 57.85 55.77 1t03 n ARG 284 Cb 0.85 -1.11 -0.01 0.00 -1.16 0.00 0.00 32.46 31.03 1t03 n ARG 284 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1t03 n GLY 285 N 3.26 -3.29 3.56 -0.13 0.00 -1.26 -4.59 105.19 102.74 1t03 n GLY 285 Ca -0.01 -1.13 -0.20 0.00 0.00 0.00 0.00 46.02 44.67 1t03 n GLY 285 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t03 s THR 286 N -4.42 3.08 0.14 2.61 2.01 -1.26 -4.90 115.64 112.89 1t03 s THR 286 Ca 0.00 -0.05 0.02 0.00 0.31 0.00 0.00 61.69 61.97 1t03 s THR 286 Cb 0.00 -3.19 0.02 0.00 0.01 0.00 0.00 72.50 69.34 1t03 s THR 286 CO 0.00 -0.18 0.16 0.29 -0.69 0.00 0.00 174.62 174.20 1t03 n LYS 287 N 8.87 1.05 0.00 4.92 5.02 -1.26 -5.15 118.16 131.61 1t03 n LYS 287 Ca 0.43 -0.80 0.00 0.00 -2.02 0.00 0.00 58.31 55.92 1t03 n LYS 287 Cb 0.46 -0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.47 1t03 n LYS 287 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1t03 n ALA 288 N -2.79 0.00 0.00 7.82 0.00 -1.26 -5.09 120.51 119.18 1t03 n ALA 288 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1t03 n ALA 288 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.60 1t03 n ALA 288 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1t03 n LEU 289 N 0.00 0.00 -0.00 0.00 7.94 -1.26 -4.87 117.00 118.81 1t03 n LEU 289 Ca 0.00 0.00 0.02 0.00 -1.11 0.00 0.00 56.01 54.92 1t03 n LEU 289 Cb 0.00 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 43.92 1t03 n LEU 289 CO 0.00 0.00 -0.24 0.41 -1.11 0.00 0.00 177.39 176.45 1t03 n THR 290 N -0.19 0.00 -1.63 1.96 -1.04 -1.26 -3.37 114.28 108.74 1t03 n THR 290 Ca 0.00 -0.27 -0.48 0.00 -2.04 0.00 0.00 64.05 61.26 1t03 n THR 290 Cb 0.00 0.74 -0.04 0.00 -1.82 0.00 0.00 70.33 69.21 1t03 n THR 290 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1t03 n GLU 291 N -1.36 1.69 -1.16 -2.82 2.13 -1.26 -4.75 120.64 113.11 1t03 n GLU 291 Ca 0.00 0.61 -0.29 0.00 0.66 0.00 0.00 57.16 58.13 1t03 n GLU 291 Cb 0.10 -2.27 0.16 0.00 0.27 0.00 0.00 31.44 29.70 1t03 n GLU 291 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1t03 s VAL 292 N 0.36 2.42 -0.23 6.31 1.01 -1.26 -2.13 120.40 126.88 1t03 s VAL 292 Ca 0.77 0.14 -0.18 0.00 0.00 0.00 0.00 61.98 62.70 1t03 s VAL 292 Cb -0.77 -2.60 0.06 0.00 0.00 0.00 0.00 36.38 33.07 1t03 s VAL 292 CO 0.46 -0.18 0.60 -0.51 0.00 0.00 0.00 175.10 175.47 1t03 s ILE 293 N -2.92 -0.00 0.19 2.22 1.10 0.79 -4.66 121.20 117.91 1t03 s ILE 293 Ca 0.64 0.01 -0.30 0.00 -0.51 0.00 0.00 60.65 60.50 1t03 s ILE 293 Cb -0.19 -0.85 -0.08 0.00 0.15 0.00 0.00 42.46 41.49 1t03 s ILE 293 CO 0.57 0.01 1.20 -2.16 -2.11 0.00 0.00 174.94 172.45 1t03 s PRO 294 N 0.86 4.49 -1.03 3.50 0.04 -1.26 -4.50 135.00 137.10 1t03 s PRO 294 Ca -0.04 1.88 -0.21 0.00 0.04 0.00 0.00 61.00 62.67 1t03 s PRO 294 Cb -0.05 -3.24 0.09 0.00 0.04 0.00 0.00 34.50 31.34 1t03 s PRO 294 CO -0.07 -0.09 1.37 -1.17 0.04 0.00 0.00 177.00 177.08 1t03 s LEU 295 N -0.26 4.13 0.86 -3.56 2.96 -1.26 -5.01 118.68 116.54 1t03 s LEU 295 Ca 0.53 -1.82 -0.14 0.00 -0.22 0.00 0.00 54.13 52.47 1t03 s LEU 295 Cb -0.33 -2.50 -0.01 0.00 0.50 0.00 0.00 46.19 43.85 1t03 s LEU 295 CO 0.37 -1.29 0.36 0.41 -1.32 0.00 0.00 176.35 174.88 1t03 n THR 296 N 6.26 0.74 0.07 3.68 -1.04 -1.26 -4.67 114.28 118.05 1t03 n THR 296 Ca 0.32 -0.30 -0.08 0.00 -2.04 0.00 0.00 64.05 61.95 1t03 n THR 296 Cb 0.49 -0.62 -0.12 0.00 -1.82 0.00 0.00 70.33 68.27 1t03 n THR 296 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1t03 h GLU 297 N -1.01 0.03 -0.80 -2.82 4.81 -1.95 0.52 114.58 113.37 1t03 h GLU 297 Ca -0.44 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.72 1t03 h GLU 297 Cb 1.31 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.67 1t03 h GLU 297 CO 0.37 1.02 0.47 0.93 -0.73 0.00 0.00 179.01 181.07 1t03 h GLU 298 N 0.01 1.08 0.12 1.92 5.08 -1.97 0.21 114.58 121.02 1t03 h GLU 298 Ca -0.03 -0.10 -0.27 0.00 -1.00 0.00 0.00 59.36 57.96 1t03 h GLU 298 Cb 1.79 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 30.82 1t03 h GLU 298 CO 0.14 0.76 -1.21 0.00 -1.00 0.00 0.00 179.01 177.70 1t03 h ALA 299 N 1.42 0.11 0.00 3.43 0.00 -1.80 -3.05 119.26 119.37 1t03 h ALA 299 Ca 0.29 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1t03 h ALA 299 Cb -0.03 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1t03 h ALA 299 CO -0.05 0.90 0.00 0.39 0.00 0.00 0.00 179.25 180.48 1t03 n GLU 300 N -3.61 0.04 0.05 0.00 -0.58 0.18 -1.45 120.64 115.27 1t03 n GLU 300 Ca -0.09 0.40 -0.15 0.00 -0.42 0.00 0.00 57.16 56.90 1t03 n GLU 300 Cb 0.99 -1.60 -0.14 0.00 -0.57 0.00 0.00 31.44 30.13 1t03 n GLU 300 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1t03 h LEU 301 N 0.00 0.30 0.07 -4.62 -0.00 -0.53 -3.03 115.31 107.51 1t03 h LEU 301 Ca 0.00 -0.44 -0.00 0.00 -0.00 0.00 0.00 57.88 57.44 1t03 h LEU 301 Cb 0.15 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 40.72 1t03 h LEU 301 CO 0.00 1.37 -0.03 1.05 -0.00 0.00 0.00 178.44 180.83 1t03 h GLU 302 N 0.05 -0.09 -0.84 1.13 -0.00 -1.30 -2.23 114.58 111.29 1t03 h GLU 302 Ca -0.24 0.01 0.10 0.00 -0.00 0.00 0.00 59.36 59.23 1t03 h GLU 302 Cb 1.99 0.02 -0.08 0.00 -0.00 0.00 0.00 28.75 30.69 1t03 h GLU 302 CO 0.14 0.19 0.48 1.25 -0.00 0.00 0.00 179.01 181.07 1t03 h LEU 303 N -0.37 0.68 0.60 3.06 5.85 -1.64 0.21 115.31 123.70 1t03 h LEU 303 Ca -0.01 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 1t03 h LEU 303 Cb 0.32 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1t03 h LEU 303 CO 0.02 0.37 -0.47 0.00 -0.34 0.00 0.00 178.44 178.02 1t03 h ALA 304 N 1.48 -1.12 -0.50 1.25 0.00 -1.38 0.22 119.26 119.22 1t03 h ALA 304 Ca 0.41 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1t03 h ALA 304 Cb 0.41 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1t03 h ALA 304 CO -0.26 -1.16 0.28 0.93 0.00 0.00 0.00 179.25 179.04 1t03 h GLU 305 N -1.04 0.70 0.11 0.00 5.08 -1.09 -2.48 114.58 115.87 1t03 h GLU 305 Ca -0.07 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1t03 h GLU 305 Cb 0.87 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1t03 h GLU 305 CO 0.01 0.54 -0.05 -0.91 -1.00 0.00 0.00 179.01 177.59 1t03 h ASN 306 N 0.67 -0.13 -1.55 1.42 -0.26 -0.46 -1.85 115.58 113.42 1t03 h ASN 306 Ca 0.18 0.00 0.46 0.00 -0.56 0.00 0.00 56.30 56.38 1t03 h ASN 306 Cb 0.04 0.03 -0.08 0.00 -1.06 0.00 0.00 38.32 37.25 1t03 h ASN 306 CO -0.03 -0.09 1.09 0.03 -1.06 0.00 0.00 177.43 177.36 1t03 h ARG 307 N -0.15 0.04 0.12 0.81 3.08 -0.62 0.79 114.38 118.45 1t03 h ARG 307 Ca -0.02 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1t03 h ARG 307 Cb 0.12 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1t03 h ARG 307 CO 0.03 0.03 -0.06 0.93 -1.07 0.00 0.00 179.97 179.82 1t03 h GLU 308 N 0.04 -0.16 -0.08 0.04 4.39 -1.05 -2.34 114.58 115.42 1t03 h GLU 308 Ca 0.79 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 60.50 1t03 h GLU 308 Cb 2.94 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 31.63 1t03 h GLU 308 CO -0.12 0.05 0.05 0.82 -1.16 0.00 0.00 179.01 178.64 1t03 h ILE 309 N -0.35 1.06 0.00 3.13 2.04 0.14 -2.05 117.51 121.48 1t03 h ILE 309 Ca -0.02 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1t03 h ILE 309 Cb 0.29 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1t03 h ILE 309 CO 0.03 0.05 0.17 -0.07 0.00 0.00 0.00 178.15 178.33 1t03 h LEU 310 N 0.07 0.00 0.48 1.44 3.38 -1.25 -2.62 115.31 116.81 1t03 h LEU 310 Ca 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1t03 h LEU 310 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1t03 h LEU 310 CO -0.01 0.00 -0.23 0.11 0.09 0.00 0.00 178.44 178.41 1t03 h LYS 311 N 0.00 -0.62 -5.97 1.13 1.79 -0.80 -3.40 116.57 108.71 1t03 h LYS 311 Ca 0.00 0.04 -0.60 0.00 -2.18 0.00 0.00 60.65 57.91 1t03 h LYS 311 Cb 0.33 0.14 -0.11 0.00 -1.58 0.00 0.00 32.23 31.01 1t03 h LYS 311 CO 0.00 -0.31 0.60 -1.83 -1.08 0.00 0.00 179.45 176.83 1t03 s GLU 312 N -4.63 3.38 0.78 3.15 1.03 -0.99 -5.03 118.70 116.40 1t03 s GLU 312 Ca -0.14 -0.15 -0.14 0.00 0.03 0.00 0.00 54.97 54.58 1t03 s GLU 312 Cb 0.02 -4.03 0.07 0.00 -0.80 0.00 0.00 34.13 29.39 1t03 s GLU 312 CO 0.48 -1.45 1.21 -1.25 -1.33 0.00 0.00 175.26 172.92 1t03 s PRO 313 N 3.98 1.80 0.00 -4.83 0.04 -1.26 -4.98 135.00 129.74 1t03 s PRO 313 Ca 0.33 1.76 0.00 0.00 0.04 0.00 0.00 61.00 63.12 1t03 s PRO 313 Cb -0.12 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.63 1t03 s PRO 313 CO 0.21 -2.10 0.00 1.33 0.04 0.00 0.00 177.00 176.48 1t03 n VAL 314 N -3.12 0.00 -3.58 -0.36 0.24 -1.26 -5.17 118.33 105.08 1t03 n VAL 314 Ca 0.13 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.32 1t03 n VAL 314 Cb 0.50 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.82 1t03 n VAL 314 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 1t03 s HIS 315 N 0.28 -0.45 0.49 6.34 -3.43 -1.26 -4.87 115.29 112.40 1t03 s HIS 315 Ca 0.00 0.82 0.07 0.00 -0.80 0.00 0.00 55.06 55.15 1t03 s HIS 315 Cb 0.00 0.43 0.02 0.00 -1.43 0.00 0.00 32.58 31.60 1t03 s HIS 315 CO 0.00 -0.38 0.45 0.20 -2.00 0.00 0.00 174.74 173.01 1t03 s GLY 316 N -0.92 2.17 0.22 -1.38 0.00 -0.46 -4.75 107.32 102.21 1t03 s GLY 316 Ca -0.03 -1.69 0.08 0.00 0.00 0.00 0.00 44.72 43.08 1t03 s GLY 316 CO 0.02 -1.79 -0.13 0.54 0.00 0.00 0.00 173.10 171.74 1t03 s VAL 317 N -2.62 1.72 0.83 1.40 0.11 -0.44 -2.68 120.40 118.72 1t03 s VAL 317 Ca 0.45 -2.20 -0.12 0.00 -2.93 0.00 0.00 61.98 57.18 1t03 s VAL 317 Cb -0.03 -2.13 0.09 0.00 -1.53 0.00 0.00 36.38 32.78 1t03 s VAL 317 CO 0.27 -0.53 1.12 -0.31 -3.33 0.00 0.00 175.10 172.32 1t03 s TYR 318 N -2.98 2.80 0.09 1.54 4.12 -1.26 -4.66 117.35 117.00 1t03 s TYR 318 Ca 0.24 0.98 -0.17 0.00 0.02 0.00 0.00 57.07 58.15 1t03 s TYR 318 Cb 0.00 -3.26 -0.07 0.00 -1.52 0.00 0.00 41.96 37.12 1t03 s TYR 318 CO 0.08 -1.90 0.53 -0.47 0.02 0.00 0.00 175.55 173.81 1t03 s TYR 319 N -3.28 3.72 -0.26 2.71 5.04 -0.63 -4.98 117.35 119.67 1t03 s TYR 319 Ca 0.62 1.14 0.03 0.00 -2.44 0.00 0.00 57.07 56.41 1t03 s TYR 319 Cb -0.14 -2.41 0.06 0.00 0.35 0.00 0.00 41.96 39.83 1t03 s TYR 319 CO 0.53 0.54 -0.10 0.34 -1.34 0.00 0.00 175.55 175.52 1t03 s ASP 320 N -1.34 4.38 0.01 4.32 -1.08 -1.26 -4.34 116.67 117.36 1t03 s ASP 320 Ca 0.31 -1.38 -0.03 0.00 -0.52 0.00 0.00 52.55 50.94 1t03 s ASP 320 Cb -0.17 -1.50 -0.01 0.00 -1.46 0.00 0.00 42.92 39.78 1t03 s ASP 320 CO 0.18 -0.20 0.86 -2.65 0.52 0.00 0.00 175.17 173.88 1t03 n PRO 321 N 4.46 -0.04 -0.15 4.34 -0.02 -1.26 -2.57 135.00 139.76 1t03 n PRO 321 Ca -0.14 0.86 -0.06 0.00 -2.02 0.00 0.00 63.50 62.15 1t03 n PRO 321 Cb 0.42 -1.28 0.01 0.00 -0.02 0.00 0.00 33.50 32.62 1t03 n PRO 321 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1t03 h SER 322 N 0.00 -0.97 -1.95 2.55 4.64 -2.06 -3.38 113.55 112.37 1t03 h SER 322 Ca 0.01 0.19 -0.49 0.00 -0.47 0.00 0.00 61.79 61.03 1t03 h SER 322 Cb 0.03 0.49 -0.04 0.00 -0.31 0.00 0.00 62.40 62.58 1t03 h SER 322 CO -0.08 -0.29 1.33 -0.54 -0.87 0.00 0.00 176.83 176.38 1t03 s LYS 323 N -6.05 2.64 1.06 4.77 1.02 -1.06 -4.97 119.74 117.15 1t03 s LYS 323 Ca -0.15 0.56 -0.23 0.00 0.02 0.00 0.00 55.97 56.17 1t03 s LYS 323 Cb 0.15 -4.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.01 1t03 s LYS 323 CO 0.69 -2.74 -0.77 -0.40 -0.92 0.00 0.00 175.35 171.21 1t03 n ASP 324 N 12.71 -2.69 -4.85 2.83 5.68 -1.26 -4.75 116.55 124.22 1t03 n ASP 324 Ca 0.20 -0.07 -0.34 0.00 -0.50 0.00 0.00 54.79 54.09 1t03 n ASP 324 Cb 0.52 -0.73 -0.06 0.00 -1.14 0.00 0.00 41.12 39.71 1t03 n ASP 324 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1t03 s LEU 325 N 3.26 4.17 -0.02 -2.12 1.02 -1.26 -4.66 118.68 119.07 1t03 s LEU 325 Ca 0.46 0.29 0.05 0.00 0.02 0.00 0.00 54.13 54.95 1t03 s LEU 325 Cb -0.00 -2.35 -0.01 0.00 0.02 0.00 0.00 46.19 43.84 1t03 s LEU 325 CO 0.66 0.30 -0.18 -0.63 0.02 0.00 0.00 176.35 176.52 1t03 s ILE 326 N -1.20 1.41 -0.14 -0.59 1.01 0.20 0.78 121.20 122.66 1t03 s ILE 326 Ca 0.23 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 60.13 1t03 s ILE 326 Cb -0.12 -1.18 0.02 0.00 0.01 0.00 0.00 42.46 41.19 1t03 s ILE 326 CO 0.13 0.40 -0.13 0.00 0.00 0.00 0.00 174.94 175.35 1t03 s ALA 327 N -0.31 1.75 -0.21 9.38 0.00 0.37 -0.09 121.76 132.64 1t03 s ALA 327 Ca 0.04 -0.83 -0.06 0.00 0.00 0.00 0.00 51.96 51.12 1t03 s ALA 327 Cb -0.08 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.99 1t03 s ALA 327 CO -0.00 -0.39 0.02 -2.00 0.00 0.00 0.00 175.76 173.38 1t03 s GLU 328 N 1.53 3.64 0.07 0.00 2.12 -0.77 -1.59 118.70 123.70 1t03 s GLU 328 Ca 0.05 -0.50 -0.06 0.00 0.36 0.00 0.00 54.97 54.81 1t03 s GLU 328 Cb -0.13 -3.13 -0.05 0.00 0.26 0.00 0.00 34.13 31.08 1t03 s GLU 328 CO -0.10 -0.01 0.33 0.42 -0.54 0.00 0.00 175.26 175.35 1t03 s ILE 329 N 1.08 5.22 0.11 -3.70 -1.09 -0.99 -1.68 121.20 120.15 1t03 s ILE 329 Ca 0.03 0.15 0.06 0.00 -2.23 0.00 0.00 60.65 58.66 1t03 s ILE 329 Cb -0.14 -3.61 -0.04 0.00 -1.58 0.00 0.00 42.46 37.09 1t03 s ILE 329 CO 0.02 0.24 -0.15 -1.10 -1.23 0.00 0.00 174.94 172.72 1t03 s GLN 330 N -2.11 0.98 -0.07 2.79 -1.52 0.23 -4.38 119.66 115.59 1t03 s GLN 330 Ca 0.33 -1.16 -0.05 0.00 -1.95 0.00 0.00 55.36 52.53 1t03 s GLN 330 Cb -0.13 -0.94 -0.04 0.00 -0.22 0.00 0.00 33.01 31.68 1t03 s GLN 330 CO 0.20 0.19 0.17 0.21 -0.25 0.00 0.00 175.29 175.81 1t03 s LYS 331 N -2.35 3.46 0.00 2.91 2.36 -1.26 -2.07 119.74 122.78 1t03 s LYS 331 Ca 0.06 -0.20 0.00 0.00 -2.55 0.00 0.00 55.97 53.28 1t03 s LYS 331 Cb -0.07 -3.15 0.00 0.00 -1.05 0.00 0.00 37.83 33.57 1t03 s LYS 331 CO 0.03 0.73 0.00 1.04 1.55 0.00 0.00 175.35 178.70 1t03 n GLN 332 N 1.50 1.10 -1.02 4.03 1.13 -1.05 -4.81 117.38 118.27 1t03 n GLN 332 Ca -0.16 0.00 -0.26 0.00 -1.94 0.00 0.00 57.00 54.64 1t03 n GLN 332 Cb 0.54 0.00 0.21 0.00 0.11 0.00 0.00 30.24 31.10 1t03 n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1t03 n GLY 333 N 3.19 -2.55 3.57 1.08 0.00 -1.26 -4.86 105.19 104.36 1t03 n GLY 333 Ca 0.00 -1.52 -0.40 0.00 0.00 0.00 0.00 46.02 44.10 1t03 n GLY 333 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1t03 s GLN 334 N -5.22 2.84 0.00 1.61 2.00 -1.26 -2.34 119.66 117.30 1t03 s GLN 334 Ca 0.62 1.02 0.00 0.00 -2.00 0.00 0.00 55.36 55.01 1t03 s GLN 334 Cb -0.05 -4.34 0.00 0.00 0.80 0.00 0.00 33.01 29.42 1t03 s GLN 334 CO 0.47 -2.45 0.00 0.41 -0.50 0.00 0.00 175.29 173.22 1t03 n GLY 335 N 5.63 2.10 3.84 2.59 0.00 -1.26 -5.09 105.19 113.01 1t03 n GLY 335 Ca 0.23 -0.40 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 1t03 n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1t03 s GLN 336 N 0.00 4.01 0.19 1.61 -0.21 -0.99 -4.19 119.66 120.08 1t03 s GLN 336 Ca 0.00 0.79 -0.10 0.00 0.02 0.00 0.00 55.36 56.07 1t03 s GLN 336 Cb 0.00 -2.32 -0.01 0.00 1.00 0.00 0.00 33.01 31.69 1t03 s GLN 336 CO 0.00 0.02 0.34 -1.58 -2.12 0.00 0.00 175.29 171.94 1t03 s TRP 337 N -2.19 0.41 0.06 0.91 0.52 0.24 -2.52 118.94 116.37 1t03 s TRP 337 Ca 0.56 -0.76 -0.06 0.00 0.02 0.00 0.00 56.10 55.87 1t03 s TRP 337 Cb -0.10 -0.00 -0.01 0.00 -1.15 0.00 0.00 33.47 32.20 1t03 s TRP 337 CO 0.21 -0.79 0.10 0.99 0.02 0.00 0.00 176.95 177.47 1t03 s THR 338 N -3.99 0.16 -0.02 2.01 2.01 -0.88 -2.18 115.64 112.75 1t03 s THR 338 Ca 0.19 -1.29 -0.17 0.00 0.31 0.00 0.00 61.69 60.73 1t03 s THR 338 Cb 0.02 -1.20 0.03 0.00 0.01 0.00 0.00 72.50 71.36 1t03 s THR 338 CO 0.03 -0.71 0.37 -0.72 -0.69 0.00 0.00 174.62 172.89 1t03 s TYR 339 N -3.36 -0.25 -0.15 4.92 -0.85 -0.58 0.78 117.35 117.85 1t03 s TYR 339 Ca 0.01 0.39 -0.01 0.00 -0.52 0.00 0.00 57.07 56.95 1t03 s TYR 339 Cb 0.03 0.15 0.04 0.00 0.38 0.00 0.00 41.96 42.56 1t03 s TYR 339 CO -0.08 -0.43 -0.06 -0.65 -1.52 0.00 0.00 175.55 172.81 1t03 s GLN 340 N -1.37 1.43 -0.21 -3.49 1.11 -0.67 -1.62 119.66 114.83 1t03 s GLN 340 Ca -0.13 -0.42 -0.15 0.00 0.01 0.00 0.00 55.36 54.67 1t03 s GLN 340 Cb -0.04 -1.86 -0.04 0.00 -1.01 0.00 0.00 33.01 30.05 1t03 s GLN 340 CO 0.05 -0.39 0.34 0.42 0.01 0.00 0.00 175.29 175.72 1t03 s ILE 341 N 1.67 5.24 0.31 1.08 1.01 0.71 -1.85 121.20 129.37 1t03 s ILE 341 Ca 0.02 0.58 -0.08 0.00 0.00 0.00 0.00 60.65 61.16 1t03 s ILE 341 Cb -0.14 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 38.66 1t03 s ILE 341 CO -0.08 0.27 0.51 -0.72 0.00 0.00 0.00 174.94 174.92 1t03 s TYR 342 N 1.27 0.68 0.00 3.97 1.13 0.87 -0.11 117.35 125.15 1t03 s TYR 342 Ca 0.16 -1.02 0.00 0.00 -1.41 0.00 0.00 57.07 54.80 1t03 s TYR 342 Cb -0.14 0.13 0.00 0.00 -1.10 0.00 0.00 41.96 40.85 1t03 s TYR 342 CO 0.07 -1.13 0.00 1.04 -2.51 0.00 0.00 175.55 173.02 1t03 n GLN 343 N -0.48 0.00 -3.04 -3.49 6.02 -1.26 -0.63 117.38 114.50 1t03 n GLN 343 Ca -0.01 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.79 1t03 n GLN 343 Cb 0.62 -0.88 0.04 0.00 1.02 0.00 0.00 30.24 31.03 1t03 n GLN 343 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1t03 s GLU 344 N -1.84 2.53 0.05 -1.09 2.56 -1.26 -4.93 118.70 114.72 1t03 s GLU 344 Ca 0.00 -1.47 -0.10 0.00 0.00 0.00 0.00 54.97 53.39 1t03 s GLU 344 Cb 0.00 -2.69 -0.02 0.00 2.00 0.00 0.00 34.13 33.42 1t03 s GLU 344 CO 0.00 -0.60 1.11 -0.35 -0.56 0.00 0.00 175.26 174.86 1t03 n PRO 345 N -2.06 -0.14 -2.51 4.30 -0.04 -1.26 -3.66 135.00 129.62 1t03 n PRO 345 Ca 0.12 1.10 -0.10 0.00 -0.04 0.00 0.00 63.50 64.58 1t03 n PRO 345 Cb 0.61 -1.64 0.04 0.00 -0.04 0.00 0.00 33.50 32.46 1t03 n PRO 345 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1t03 n PHE 346 N -3.72 1.89 -3.51 0.54 3.72 -1.26 -4.97 117.46 110.15 1t03 n PHE 346 Ca 0.01 -2.22 -0.42 0.00 -0.05 0.00 0.00 57.45 54.76 1t03 n PHE 346 Cb 0.09 -0.27 -0.06 0.00 -0.94 0.00 0.00 39.48 38.29 1t03 n PHE 346 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1t03 s LYS 347 N -3.69 3.01 0.27 -1.08 -0.14 -1.24 -5.05 119.74 111.81 1t03 s LYS 347 Ca 0.37 -2.35 -0.30 0.00 -1.36 0.00 0.00 55.97 52.33 1t03 s LYS 347 Cb 0.36 -4.08 -0.11 0.00 -1.68 0.00 0.00 37.83 32.32 1t03 s LYS 347 CO -0.01 -1.23 1.56 -0.80 -0.76 0.00 0.00 175.35 174.11 1t03 s ASN 348 N 1.75 6.46 -0.22 2.83 0.01 -1.26 -4.00 114.94 120.50 1t03 s ASN 348 Ca 0.15 2.86 -0.20 0.00 -0.71 0.00 0.00 52.86 54.96 1t03 s ASN 348 Cb -0.17 -2.63 -0.17 0.00 0.41 0.00 0.00 41.25 38.68 1t03 s ASN 348 CO -0.05 -0.86 0.08 0.18 -1.51 0.00 0.00 177.10 174.95 1t03 n LEU 349 N 2.39 1.88 -3.48 0.60 4.77 0.84 -1.32 117.00 122.67 1t03 n LEU 349 Ca 0.08 0.40 -0.16 0.00 -0.03 0.00 0.00 56.01 56.31 1t03 n LEU 349 Cb 0.38 -0.93 -0.04 0.00 -2.33 0.00 0.00 43.42 40.49 1t03 n LEU 349 CO 0.63 0.34 0.43 -0.75 -1.33 0.00 0.00 177.39 176.71 1t03 s LYS 350 N -2.40 1.13 0.12 3.23 2.20 -1.01 -4.32 119.74 118.69 1t03 s LYS 350 Ca -0.31 -0.01 0.02 0.00 -0.36 0.00 0.00 55.97 55.31 1t03 s LYS 350 Cb 0.08 0.53 -0.04 0.00 -1.51 0.00 0.00 37.83 36.88 1t03 s LYS 350 CO 0.57 -0.41 -0.07 0.95 -0.36 0.00 0.00 175.35 176.03 1t03 s THR 351 N -2.14 0.82 0.09 3.43 -4.23 0.70 -0.21 115.64 114.11 1t03 s THR 351 Ca -0.06 -1.97 -0.10 0.00 -1.18 0.00 0.00 61.69 58.37 1t03 s THR 351 Cb -0.00 -1.77 0.04 0.00 1.34 0.00 0.00 72.50 72.10 1t03 s THR 351 CO 0.01 -0.80 0.50 0.61 -0.54 0.00 0.00 174.62 174.40 1t03 n GLY 352 N -0.10 0.98 2.93 3.99 0.00 -0.64 -3.74 105.19 108.61 1t03 n GLY 352 Ca -0.11 -1.04 -0.11 0.00 0.00 0.00 0.00 46.02 44.76 1t03 n GLY 352 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t03 s LYS 353 N -2.03 0.12 -0.10 1.61 0.00 -1.26 -1.53 119.74 116.55 1t03 s LYS 353 Ca 0.11 -0.14 -0.00 0.00 0.00 0.00 0.00 55.97 55.94 1t03 s LYS 353 Cb -0.01 0.05 -0.02 0.00 0.00 0.00 0.00 37.83 37.84 1t03 s LYS 353 CO 0.03 -0.02 -0.09 -0.47 0.00 0.00 0.00 175.35 174.80 1t03 s TYR 354 N -0.41 2.89 0.00 1.78 5.04 -0.93 -4.95 117.35 120.77 1t03 s TYR 354 Ca -0.05 -0.24 0.00 0.00 -2.44 0.00 0.00 57.07 54.34 1t03 s TYR 354 Cb -0.03 -1.79 0.00 0.00 0.35 0.00 0.00 41.96 40.49 1t03 s TYR 354 CO -0.00 0.09 0.00 0.00 -1.34 0.00 0.00 175.55 174.30 1t03 n ALA 355 N 2.86 1.39 -1.64 3.97 0.00 -1.26 -0.59 120.51 125.24 1t03 n ALA 355 Ca -0.18 0.00 -0.49 0.00 0.00 0.00 0.00 53.44 52.77 1t03 n ALA 355 Cb 0.53 0.07 -0.05 0.00 0.00 0.00 0.00 19.45 20.00 1t03 n ALA 355 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1t03 n ARG 356 N -1.03 1.75 -3.53 0.00 0.63 -1.26 -4.61 116.66 108.61 1t03 n ARG 356 Ca 0.00 0.63 -0.42 0.00 -0.92 0.00 0.00 57.85 57.15 1t03 n ARG 356 Cb 0.13 -2.36 -0.09 0.00 0.45 0.00 0.00 32.46 30.59 1t03 n ARG 356 CO 0.00 0.00 0.00 1.41 -2.51 0.00 0.00 177.63 176.53 1t03 s MET 357 N 1.16 2.66 -0.35 -0.14 -2.45 -1.26 -5.05 119.30 113.87 1t03 s MET 357 Ca 0.83 -1.55 -0.29 0.00 -1.25 0.00 0.00 55.69 53.43 1t03 s MET 357 Cb -0.80 -3.92 -0.01 0.00 1.25 0.00 0.00 34.83 31.36 1t03 s MET 357 CO 0.43 -1.06 1.65 1.03 1.05 0.00 0.00 175.02 178.12 1t03 s ARG 358 N 1.45 3.46 0.28 4.11 1.81 -1.26 -4.78 118.95 124.01 1t03 s ARG 358 Ca 0.04 1.28 0.00 0.00 -1.72 0.00 0.00 55.73 55.33 1t03 s ARG 358 Cb -0.25 -4.12 0.00 0.00 -0.45 0.00 0.00 34.95 30.13 1t03 s ARG 358 CO 0.02 -1.71 0.00 0.41 -0.68 0.00 0.00 175.30 173.34 1t03 n GLY 359 N 5.25 -2.16 0.24 -3.53 0.00 -1.26 -4.82 105.19 98.92 1t03 n GLY 359 Ca 0.20 -1.86 -0.04 0.00 0.00 0.00 0.00 46.02 44.32 1t03 n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t03 n ALA 360 N 0.06 1.01 -2.73 4.61 0.00 -1.26 -4.85 120.51 117.35 1t03 n ALA 360 Ca 0.00 -0.48 -0.42 0.00 0.00 0.00 0.00 53.44 52.53 1t03 n ALA 360 Cb 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 19.45 19.46 1t03 n ALA 360 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1t03 s HIS 361 N -2.06 2.67 0.24 0.00 3.76 -1.26 -3.47 115.29 115.17 1t03 s HIS 361 Ca -0.14 -0.75 0.00 0.00 -0.15 0.00 0.00 55.06 54.02 1t03 s HIS 361 Cb 0.02 -4.47 -0.00 0.00 1.11 0.00 0.00 32.58 29.24 1t03 s HIS 361 CO 0.21 -1.78 0.01 -2.37 -0.85 0.00 0.00 174.74 169.97 1t03 n THR 362 N 6.17 0.00 0.00 1.30 5.66 -0.62 -4.92 114.28 121.87 1t03 n THR 362 Ca 0.15 -1.17 0.00 0.00 -3.05 0.00 0.00 64.05 59.98 1t03 n THR 362 Cb 0.49 0.26 0.00 0.00 -1.55 0.00 0.00 70.33 69.53 1t03 n THR 362 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1t03 n ASN 363 N -1.25 0.41 0.00 1.09 0.23 -1.26 -1.23 115.26 113.24 1t03 n ASN 363 Ca -0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.96 1t03 n ASN 363 Cb 0.31 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.01 1t03 n ASN 363 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1t03 n ASP 364 N 0.00 2.50 -0.03 0.53 9.92 -1.26 -4.25 116.55 123.96 1t03 n ASP 364 Ca 0.00 -0.17 -0.15 0.00 -0.53 0.00 0.00 54.79 53.94 1t03 n ASP 364 Cb 0.00 0.84 -0.12 0.00 -0.64 0.00 0.00 41.12 41.20 1t03 n ASP 364 CO 0.00 0.00 0.00 -0.37 0.13 0.00 0.00 177.20 176.96 1t03 h VAL 365 N 0.00 1.58 -0.44 2.53 -1.51 -1.96 -2.84 116.25 113.61 1t03 h VAL 365 Ca 0.00 -1.94 0.04 0.00 -1.23 0.00 0.00 66.70 63.57 1t03 h VAL 365 Cb 0.00 2.83 -0.06 0.00 -2.13 0.00 0.00 31.29 31.93 1t03 h VAL 365 CO 0.00 0.52 -0.30 0.11 -1.23 0.00 0.00 177.57 176.68 1t03 h LYS 366 N -0.60 -0.05 -0.60 5.19 1.57 -1.99 0.85 116.57 120.94 1t03 h LYS 366 Ca -0.02 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.88 1t03 h LYS 366 Cb 0.95 0.01 -0.12 0.00 0.08 0.00 0.00 32.23 33.15 1t03 h LYS 366 CO 0.03 -0.03 -0.21 1.96 -0.57 0.00 0.00 179.45 180.63 1t03 h GLN 367 N -0.05 -0.06 -0.48 3.15 1.08 -1.74 0.46 115.11 117.48 1t03 h GLN 367 Ca 0.07 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 57.33 1t03 h GLN 367 Cb 0.23 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.63 1t03 h GLN 367 CO -0.44 -0.04 0.21 1.25 -0.95 0.00 0.00 178.83 178.87 1t03 h LEU 368 N -0.06 0.28 -0.04 1.46 5.85 -0.36 0.96 115.31 123.40 1t03 h LEU 368 Ca 0.28 0.04 0.01 0.00 0.84 0.00 0.00 57.88 59.05 1t03 h LEU 368 Cb 0.49 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 1t03 h LEU 368 CO -0.65 0.19 -0.17 0.74 -0.34 0.00 0.00 178.44 178.22 1t03 h THR 369 N 0.42 0.00 -0.94 1.05 2.02 0.47 0.13 112.91 116.06 1t03 h THR 369 Ca 0.22 0.00 0.27 0.00 0.77 0.00 0.00 66.41 67.67 1t03 h THR 369 Cb 0.17 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.44 1t03 h THR 369 CO -0.19 0.00 0.42 -0.33 0.37 0.00 0.00 175.52 175.79 1t03 h GLU 370 N -0.18 0.30 0.12 6.66 5.08 0.52 0.18 114.58 127.26 1t03 h GLU 370 Ca 0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1t03 h GLU 370 Cb 0.21 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1t03 h GLU 370 CO -0.13 0.20 -0.12 0.00 -1.00 0.00 0.00 179.01 177.96 1t03 h ALA 371 N 1.80 -0.23 0.10 3.43 0.00 0.25 -1.05 119.26 123.55 1t03 h ALA 371 Ca 0.63 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.51 1t03 h ALA 371 Cb 1.34 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1t03 h ALA 371 CO -0.61 -0.65 -0.05 0.28 0.00 0.00 0.00 179.25 178.23 1t03 h VAL 372 N -0.26 0.92 -0.58 0.00 2.07 0.18 -1.08 116.25 117.51 1t03 h VAL 372 Ca 0.01 -0.08 0.07 0.00 0.82 0.00 0.00 66.70 67.51 1t03 h VAL 372 Cb 0.25 0.98 -0.10 0.00 -1.52 0.00 0.00 31.29 30.90 1t03 h VAL 372 CO -0.04 0.02 -0.51 -0.61 0.02 0.00 0.00 177.57 176.45 1t03 h GLN 373 N -0.18 -0.25 0.01 1.57 4.15 -0.51 0.83 115.11 120.73 1t03 h GLN 373 Ca -0.01 0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.44 1t03 h GLN 373 Cb 0.14 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.87 1t03 h GLN 373 CO 0.02 -0.17 -0.12 -0.22 -1.93 0.00 0.00 178.83 176.42 1t03 h LYS 374 N -0.26 -0.20 -0.73 1.69 1.63 -1.04 -2.51 116.57 115.16 1t03 h LYS 374 Ca 0.13 0.01 0.16 0.00 -0.85 0.00 0.00 60.65 60.10 1t03 h LYS 374 Cb 0.56 0.04 -0.11 0.00 -0.60 0.00 0.00 32.23 32.12 1t03 h LYS 374 CO -0.69 -0.13 0.17 0.82 -3.45 0.00 0.00 179.45 176.17 1t03 h ILE 375 N -0.20 0.51 0.00 2.00 1.08 0.00 -1.54 117.51 119.36 1t03 h ILE 375 Ca 0.04 -0.09 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 1t03 h ILE 375 Cb 0.25 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 34.23 1t03 h ILE 375 CO -0.11 0.05 0.00 0.41 -0.69 0.00 0.00 178.15 177.81 1t03 n THR 376 N -5.16 0.00 -0.23 -0.27 -1.04 0.17 -1.64 114.28 106.11 1t03 n THR 376 Ca 0.14 1.12 -0.05 0.00 -2.04 0.00 0.00 64.05 63.22 1t03 n THR 376 Cb 0.45 -1.91 -0.04 0.00 -1.82 0.00 0.00 70.33 67.02 1t03 n THR 376 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1t03 n THR 377 N -1.11 -0.35 0.10 12.58 -1.04 -1.08 0.26 114.28 123.64 1t03 n THR 377 Ca 0.00 1.31 0.20 0.00 -2.04 0.00 0.00 64.05 63.52 1t03 n THR 377 Cb 0.00 -1.64 0.72 0.00 -1.82 0.00 0.00 70.33 67.59 1t03 n THR 377 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1t03 h GLU 378 N 0.00 0.00 0.07 -2.82 4.81 -1.03 0.97 114.58 116.58 1t03 h GLU 378 Ca 0.11 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.14 1t03 h GLU 378 Cb 0.25 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 1t03 h GLU 378 CO -0.52 0.00 -1.03 0.77 -0.73 0.00 0.00 179.01 177.50 1t03 h SER 379 N 0.00 0.22 -0.87 1.04 0.02 0.45 -3.07 113.55 111.34 1t03 h SER 379 Ca 0.19 -0.81 0.20 0.00 -0.84 0.00 0.00 61.79 60.53 1t03 h SER 379 Cb 1.18 -0.07 -0.12 0.00 0.14 0.00 0.00 62.40 63.53 1t03 h SER 379 CO -0.00 1.44 0.39 0.40 -1.14 0.00 0.00 176.83 177.91 1t03 h ILE 380 N -0.61 0.54 -0.06 3.27 2.04 0.45 0.55 117.51 123.68 1t03 h ILE 380 Ca -0.24 -0.15 -0.09 0.00 1.00 0.00 0.00 64.86 65.38 1t03 h ILE 380 Cb 1.49 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 1t03 h ILE 380 CO -0.01 0.08 -0.38 0.58 0.00 0.00 0.00 178.15 178.42 1t03 h VAL 381 N 0.44 1.29 0.05 1.67 2.07 -1.17 0.45 116.25 121.06 1t03 h VAL 381 Ca 0.53 -1.40 -0.35 0.00 0.82 0.00 0.00 66.70 66.29 1t03 h VAL 381 Cb 0.94 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 32.34 1t03 h VAL 381 CO -0.49 0.41 -2.09 -0.38 0.02 0.00 0.00 177.57 175.04 1t03 n ILE 382 N -4.06 1.62 -0.07 4.57 5.41 0.62 -4.59 119.36 122.86 1t03 n ILE 382 Ca -0.02 -0.70 0.00 0.00 1.00 0.00 0.00 62.75 63.03 1t03 n ILE 382 Cb 0.44 -1.31 0.00 0.00 -0.71 0.00 0.00 39.64 38.07 1t03 n ILE 382 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1t03 n TRP 383 N -3.22 0.00 -1.14 1.39 8.01 0.16 -4.59 117.44 118.05 1t03 n TRP 383 Ca -0.32 0.00 -0.05 0.00 -1.31 0.00 0.00 57.50 55.82 1t03 n TRP 383 Cb 1.05 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 30.33 1t03 n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1t03 n GLY 384 N 0.48 0.60 3.22 6.99 0.00 0.16 -4.97 105.19 111.67 1t03 n GLY 384 Ca 0.00 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 1t03 n GLY 384 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1t03 s LYS 385 N -2.04 0.94 -0.03 1.61 2.20 -1.26 -4.90 119.74 116.25 1t03 s LYS 385 Ca 0.00 -1.05 -0.22 0.00 -0.36 0.00 0.00 55.97 54.34 1t03 s LYS 385 Cb 0.00 -1.03 -0.05 0.00 -1.51 0.00 0.00 37.83 35.24 1t03 s LYS 385 CO 0.00 0.23 0.67 0.99 -0.36 0.00 0.00 175.35 176.88 1t03 s THR 386 N -1.30 4.95 0.51 3.43 2.01 -1.26 -3.62 115.64 120.35 1t03 s THR 386 Ca 0.02 1.39 -0.10 0.00 0.31 0.00 0.00 61.69 63.31 1t03 s THR 386 Cb -0.10 -4.01 -0.05 0.00 0.01 0.00 0.00 72.50 68.36 1t03 s THR 386 CO 0.03 0.33 0.88 -2.16 -0.69 0.00 0.00 174.62 173.01 1t03 s PRO 387 N 0.32 3.67 -0.04 4.92 0.04 -1.26 -4.80 135.00 137.84 1t03 s PRO 387 Ca 0.35 0.52 -0.19 0.00 0.04 0.00 0.00 61.00 61.72 1t03 s PRO 387 Cb -0.18 -2.27 -0.05 0.00 0.04 0.00 0.00 34.50 32.04 1t03 s PRO 387 CO 0.18 -0.27 0.53 0.21 0.04 0.00 0.00 177.00 177.69 1t03 s LYS 388 N -4.56 4.27 0.11 4.56 2.20 0.23 -4.88 119.74 121.68 1t03 s LYS 388 Ca 0.52 0.60 0.03 0.00 -0.36 0.00 0.00 55.97 56.76 1t03 s LYS 388 Cb -0.10 -3.36 -0.04 0.00 -1.51 0.00 0.00 37.83 32.82 1t03 s LYS 388 CO 0.42 0.34 0.16 -0.06 -0.36 0.00 0.00 175.35 175.85 1t03 s PHE 389 N -0.03 3.30 -0.26 4.03 0.08 -1.12 -0.48 117.98 123.49 1t03 s PHE 389 Ca 0.29 0.09 0.00 0.00 0.12 0.00 0.00 56.93 57.43 1t03 s PHE 389 Cb -0.17 -1.62 0.08 0.00 -0.57 0.00 0.00 43.02 40.73 1t03 s PHE 389 CO 0.14 0.53 0.02 0.15 -0.10 0.00 0.00 175.22 175.97 1t03 s LYS 390 N -2.78 1.16 0.02 0.44 1.02 -0.62 -1.32 119.74 117.67 1t03 s LYS 390 Ca 0.32 -1.03 0.09 0.00 0.02 0.00 0.00 55.97 55.36 1t03 s LYS 390 Cb -0.11 -2.41 -0.03 0.00 -0.52 0.00 0.00 37.83 34.76 1t03 s LYS 390 CO 0.25 -0.77 -0.25 -0.51 -0.92 0.00 0.00 175.35 173.15 1t03 s LEU 391 N 1.48 2.19 -1.14 3.17 1.43 -0.89 -2.34 118.68 122.58 1t03 s LEU 391 Ca 0.02 -0.53 -0.20 0.00 -1.03 0.00 0.00 54.13 52.39 1t03 s LEU 391 Cb -0.18 -1.33 -0.05 0.00 0.03 0.00 0.00 46.19 44.66 1t03 s LEU 391 CO -0.12 0.28 1.95 -2.65 0.23 0.00 0.00 176.35 176.04 1t03 n PRO 392 N 1.96 2.18 -3.65 1.29 -0.02 -1.26 -2.82 135.00 132.68 1t03 n PRO 392 Ca -0.17 -2.48 -0.02 0.00 -2.02 0.00 0.00 63.50 58.82 1t03 n PRO 392 Cb 0.52 -3.34 -0.06 0.00 -0.02 0.00 0.00 33.50 30.59 1t03 n PRO 392 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1t03 s ILE 393 N 6.10 0.00 0.15 4.25 2.07 -1.26 -1.99 121.20 130.51 1t03 s ILE 393 Ca 0.57 0.00 -0.27 0.00 -1.41 0.00 0.00 60.65 59.55 1t03 s ILE 393 Cb 0.08 -1.00 -0.07 0.00 0.13 0.00 0.00 42.46 41.60 1t03 s ILE 393 CO 0.07 0.00 0.83 -1.10 -1.91 0.00 0.00 174.94 172.83 1t03 s GLN 394 N 1.26 4.63 0.27 3.50 -0.21 -1.26 -4.68 119.66 123.17 1t03 s GLN 394 Ca -0.09 1.24 0.03 0.00 0.02 0.00 0.00 55.36 56.57 1t03 s GLN 394 Cb -0.03 -3.30 0.70 0.00 1.00 0.00 0.00 33.01 31.38 1t03 s GLN 394 CO -0.14 0.45 1.36 1.63 -2.12 0.00 0.00 175.29 176.48 1t03 n LYS 395 N 1.99 -0.07 0.08 2.91 5.02 -1.26 0.24 118.16 127.07 1t03 n LYS 395 Ca -0.03 1.29 -0.16 0.00 -2.02 0.00 0.00 58.31 57.39 1t03 n LYS 395 Cb 0.49 -2.08 -0.10 0.00 -0.02 0.00 0.00 35.03 33.32 1t03 n LYS 395 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1t03 h GLU 396 N 0.00 -0.68 -0.67 1.97 5.08 -1.99 0.20 114.58 118.50 1t03 h GLU 396 Ca 0.54 0.05 0.14 0.00 -1.00 0.00 0.00 59.36 59.09 1t03 h GLU 396 Cb 1.16 0.15 -0.12 0.00 0.50 0.00 0.00 28.75 30.44 1t03 h GLU 396 CO -0.81 -0.45 -0.08 1.15 -1.00 0.00 0.00 179.01 177.82 1t03 h THR 397 N -0.71 0.38 0.29 1.13 2.02 -0.60 -1.99 112.91 113.44 1t03 h THR 397 Ca 0.00 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 1t03 h THR 397 Cb 0.73 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1t03 h THR 397 CO -0.32 0.01 -0.14 -0.25 0.37 0.00 0.00 175.52 175.19 1t03 h TRP 398 N 0.05 -0.36 -1.59 3.16 -0.00 -1.03 -2.22 115.95 113.96 1t03 h TRP 398 Ca 0.34 -0.01 0.49 0.00 -0.00 0.00 0.00 58.89 59.71 1t03 h TRP 398 Cb 0.55 0.12 -0.09 0.00 -0.00 0.00 0.00 29.16 29.74 1t03 h TRP 398 CO -0.46 -0.23 1.11 0.39 -0.00 0.00 0.00 178.44 179.25 1t03 n GLU 399 N -3.07 -0.01 0.09 2.65 1.02 0.02 0.15 120.64 121.48 1t03 n GLU 399 Ca -0.05 1.03 -0.23 0.00 -0.02 0.00 0.00 57.16 57.90 1t03 n GLU 399 Cb 0.15 -2.25 -0.15 0.00 -0.02 0.00 0.00 31.44 29.18 1t03 n GLU 399 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1t03 h THR 400 N 0.00 1.27 0.00 2.62 2.02 -1.28 -3.25 112.91 114.29 1t03 h THR 400 Ca 0.83 -2.58 0.00 0.00 0.77 0.00 0.00 66.41 65.43 1t03 h THR 400 Cb 3.10 3.01 0.00 0.00 -1.74 0.00 0.00 68.15 72.52 1t03 h THR 400 CO -0.16 0.77 0.00 1.87 0.37 0.00 0.00 175.52 178.37 1t03 n TRP 401 N -3.85 0.00 -0.23 3.16 -0.00 0.41 -2.23 117.44 114.69 1t03 n TRP 401 Ca -0.18 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.25 1t03 n TRP 401 Cb 0.99 -0.45 0.04 0.00 -0.00 0.00 0.00 31.31 31.89 1t03 n TRP 401 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 177.69 177.80 1t03 h TRP 402 N 0.00 0.96 -0.09 5.87 5.08 -1.73 0.16 115.95 126.21 1t03 h TRP 402 Ca 0.00 -0.06 0.02 0.00 1.08 0.00 0.00 58.89 59.93 1t03 h TRP 402 Cb 0.00 -0.29 -0.00 0.00 -3.00 0.00 0.00 29.16 25.86 1t03 h TRP 402 CO -0.38 0.74 0.20 0.00 -1.28 0.00 0.00 178.44 177.73 1t03 h THR 403 N 0.90 0.19 0.00 0.12 1.03 -1.58 -2.90 112.91 110.67 1t03 h THR 403 Ca 0.22 0.00 -0.31 0.00 -0.01 0.00 0.00 66.41 66.31 1t03 h THR 403 Cb 0.17 0.82 -0.05 0.00 -1.07 0.00 0.00 68.15 68.02 1t03 h THR 403 CO -0.02 0.00 -1.94 1.21 -0.01 0.00 0.00 175.52 174.76 1t03 n GLU 404 N -3.31 0.57 -1.54 0.00 2.13 -0.74 -4.98 120.64 112.77 1t03 n GLU 404 Ca -0.01 0.30 -0.52 0.00 0.66 0.00 0.00 57.16 57.60 1t03 n GLU 404 Cb 0.29 -1.52 -0.05 0.00 0.27 0.00 0.00 31.44 30.43 1t03 n GLU 404 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 1t03 n TYR 405 N -4.34 0.92 1.07 4.31 9.36 0.50 -4.84 117.16 124.14 1t03 n TYR 405 Ca -0.40 0.81 0.14 0.00 3.32 0.00 0.00 57.90 61.77 1t03 n TYR 405 Cb 0.75 -2.19 0.63 0.00 -0.63 0.00 0.00 39.34 37.90 1t03 n TYR 405 CO 0.00 0.00 0.00 -2.67 0.22 0.00 0.00 176.86 174.41 1t03 n TRP 406 N 1.46 0.00 -3.52 2.98 2.14 -1.26 -4.68 117.44 114.56 1t03 n TRP 406 Ca 0.17 0.00 -0.37 0.00 2.07 0.00 0.00 57.50 59.37 1t03 n TRP 406 Cb 0.19 -0.45 -0.07 0.00 -0.81 0.00 0.00 31.31 30.18 1t03 n TRP 406 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1t03 s GLN 407 N -2.90 4.18 0.52 -2.67 2.00 -1.26 -5.07 119.66 114.46 1t03 s GLN 407 Ca 0.17 0.18 -0.20 0.00 -2.00 0.00 0.00 55.36 53.51 1t03 s GLN 407 Cb 0.19 -3.39 -0.07 0.00 0.80 0.00 0.00 33.01 30.54 1t03 s GLN 407 CO 0.50 0.31 1.09 0.00 -0.50 0.00 0.00 175.29 176.69 1t03 s ALA 408 N 0.22 2.77 0.07 1.58 0.00 -1.26 -5.01 121.76 120.13 1t03 s ALA 408 Ca 0.19 0.73 -0.28 0.00 0.00 0.00 0.00 51.96 52.60 1t03 s ALA 408 Cb -0.14 -3.31 0.09 0.00 0.00 0.00 0.00 23.12 19.76 1t03 s ALA 408 CO 0.06 -0.58 1.11 0.95 0.00 0.00 0.00 175.76 177.31 1t03 s THR 409 N -1.87 0.00 0.01 0.00 -4.23 -1.26 -5.19 115.64 103.10 1t03 s THR 409 Ca 0.70 -0.43 -0.29 0.00 -1.18 0.00 0.00 61.69 60.49 1t03 s THR 409 Cb -0.21 -1.95 0.11 0.00 1.34 0.00 0.00 72.50 71.79 1t03 s THR 409 CO 0.24 0.00 1.25 0.86 -0.54 0.00 0.00 174.62 176.43 1t03 s TRP 410 N -2.87 -0.02 -0.02 3.99 -0.11 -1.26 -5.01 118.94 113.64 1t03 s TRP 410 Ca 0.13 -0.12 -0.03 0.00 1.22 0.00 0.00 56.10 57.30 1t03 s TRP 410 Cb 0.01 0.57 0.00 0.00 -1.50 0.00 0.00 33.47 32.56 1t03 s TRP 410 CO -0.01 -0.36 0.07 0.42 -4.62 0.00 0.00 176.95 172.44 1t03 s ILE 411 N -2.35 0.02 0.98 5.86 1.01 -1.26 -5.03 121.20 120.43 1t03 s ILE 411 Ca 0.19 -0.20 -0.13 0.00 0.00 0.00 0.00 60.65 60.51 1t03 s ILE 411 Cb 0.02 -0.17 0.18 0.00 0.01 0.00 0.00 42.46 42.50 1t03 s ILE 411 CO -0.02 -0.11 1.12 -2.16 0.00 0.00 0.00 174.94 173.77 1t03 s PRO 412 N -0.31 0.56 -0.17 2.79 0.04 -1.26 -4.87 135.00 131.77 1t03 s PRO 412 Ca -0.04 0.36 -0.31 0.00 0.04 0.00 0.00 61.00 61.05 1t03 s PRO 412 Cb -0.03 -1.77 -0.14 0.00 0.04 0.00 0.00 34.50 32.61 1t03 s PRO 412 CO 0.00 -2.61 0.94 -1.91 0.04 0.00 0.00 177.00 173.47 1t03 n GLU 413 N -4.06 0.00 -3.86 4.56 2.13 -1.26 -4.81 120.64 113.34 1t03 n GLU 413 Ca 0.06 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.81 1t03 n GLU 413 Cb 0.58 -1.07 -0.02 0.00 0.27 0.00 0.00 31.44 31.20 1t03 n GLU 413 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 1t03 s TRP 414 N 1.03 -0.14 0.32 4.31 1.48 -1.26 -2.78 118.94 121.89 1t03 s TRP 414 Ca 0.70 -0.30 0.03 0.00 -1.06 0.00 0.00 56.10 55.46 1t03 s TRP 414 Cb -0.98 0.66 -0.05 0.00 -1.16 0.00 0.00 33.47 31.93 1t03 s TRP 414 CO 0.49 -1.21 0.09 -2.00 -4.06 0.00 0.00 176.95 170.26 1t03 s GLU 415 N -3.93 1.63 -0.20 3.25 -6.30 -0.43 -4.97 118.70 107.75 1t03 s GLU 415 Ca 0.12 -1.92 -0.06 0.00 -2.50 0.00 0.00 54.97 50.61 1t03 s GLU 415 Cb -0.05 -0.61 -0.03 0.00 0.00 0.00 0.00 34.13 33.44 1t03 s GLU 415 CO 0.07 -0.28 0.03 0.12 0.02 0.00 0.00 175.26 175.21 1t03 s PHE 416 N -3.43 3.11 -0.24 5.30 5.36 -1.26 -2.10 117.98 124.72 1t03 s PHE 416 Ca 0.35 -0.25 -0.10 0.00 -0.96 0.00 0.00 56.93 55.97 1t03 s PHE 416 Cb 0.07 -2.09 -0.05 0.00 -0.34 0.00 0.00 43.02 40.61 1t03 s PHE 416 CO 0.15 -0.10 0.14 0.54 -1.46 0.00 0.00 175.22 174.49 1t03 s VAL 417 N 0.82 5.19 -0.67 3.12 0.11 -1.13 -4.91 120.40 122.94 1t03 s VAL 417 Ca 0.02 0.12 -0.26 0.00 -2.93 0.00 0.00 61.98 58.93 1t03 s VAL 417 Cb -0.14 -3.42 0.04 0.00 -1.53 0.00 0.00 36.38 31.33 1t03 s VAL 417 CO 0.02 0.35 1.14 0.21 -3.33 0.00 0.00 175.10 173.49 1t03 s ASN 418 N 1.10 6.24 -0.37 3.54 3.84 -1.26 -4.40 114.94 123.63 1t03 s ASN 418 Ca 0.07 -0.47 -0.03 0.00 0.21 0.00 0.00 52.86 52.64 1t03 s ASN 418 Cb -0.14 -2.51 0.19 0.00 -0.55 0.00 0.00 41.25 38.25 1t03 s ASN 418 CO 0.05 -1.60 0.92 0.28 -2.79 0.00 0.00 177.10 173.96 1t03 s THR 419 N 4.95 -0.49 1.15 -5.21 -1.32 -1.26 -5.17 115.64 108.29 1t03 s THR 419 Ca 0.33 -0.15 -0.15 0.00 -1.21 0.00 0.00 61.69 60.50 1t03 s THR 419 Cb -0.11 0.00 0.20 0.00 -1.51 0.00 0.00 72.50 71.08 1t03 s THR 419 CO 0.16 0.00 0.54 -2.65 -2.21 0.00 0.00 174.62 170.46 1t03 n PRO 420 N 3.58 -2.04 -1.74 7.08 -0.02 -1.26 -4.58 135.00 136.02 1t03 n PRO 420 Ca 0.09 -0.57 -0.42 0.00 -2.02 0.00 0.00 63.50 60.58 1t03 n PRO 420 Cb 0.61 -1.95 -0.03 0.00 -0.02 0.00 0.00 33.50 32.12 1t03 n PRO 420 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1t03 s PRO 421 N -3.94 4.13 0.53 0.52 0.04 -1.26 -5.01 135.00 130.01 1t03 s PRO 421 Ca 0.63 2.59 -0.05 0.00 0.04 0.00 0.00 61.00 64.21 1t03 s PRO 421 Cb -0.19 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 31.07 1t03 s PRO 421 CO 0.66 -0.78 0.82 -0.51 0.04 0.00 0.00 177.00 177.23 1t03 s LEU 422 N 1.74 3.44 -0.17 -3.56 1.43 -1.26 -4.61 118.68 115.68 1t03 s LEU 422 Ca 0.77 0.71 -0.04 0.00 -1.03 0.00 0.00 54.13 54.54 1t03 s LEU 422 Cb -0.48 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.13 1t03 s LEU 422 CO 0.33 -0.84 -0.04 -0.69 0.23 0.00 0.00 176.35 175.35 1t03 s VAL 423 N -2.83 3.73 0.15 -1.59 1.01 -0.84 -5.03 120.40 115.00 1t03 s VAL 423 Ca 0.51 -0.40 -0.22 0.00 0.00 0.00 0.00 61.98 61.86 1t03 s VAL 423 Cb -0.10 -2.65 0.07 0.00 0.00 0.00 0.00 36.38 33.69 1t03 s VAL 423 CO 0.44 0.47 0.58 -0.54 0.00 0.00 0.00 175.10 176.04 1t03 s LYS 424 N 0.69 1.25 0.09 2.72 1.02 -1.26 -4.44 119.74 119.81 1t03 s LYS 424 Ca -0.02 -0.49 -0.31 0.00 0.02 0.00 0.00 55.97 55.17 1t03 s LYS 424 Cb -0.14 0.58 -0.07 0.00 -0.52 0.00 0.00 37.83 37.67 1t03 s LYS 424 CO 0.02 -0.54 1.34 -0.51 -0.92 0.00 0.00 175.35 174.74 1t03 s LEU 425 N -2.74 4.36 0.34 3.17 1.43 -1.26 -4.91 118.68 119.08 1t03 s LEU 425 Ca 0.01 2.22 0.19 0.00 -1.03 0.00 0.00 54.13 55.52 1t03 s LEU 425 Cb -0.01 -3.58 0.18 0.00 0.03 0.00 0.00 46.19 42.81 1t03 s LEU 425 CO -0.13 -0.61 1.50 -0.50 0.23 0.00 0.00 176.35 176.85 1t03 h TRP 426 N 6.91 0.00 -2.47 0.29 4.06 -1.94 -3.47 115.95 119.33 1t03 h TRP 426 Ca -0.41 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.46 1t03 h TRP 426 Cb 1.21 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.35 1t03 h TRP 426 CO 0.67 0.28 -0.06 2.48 -3.56 0.00 0.00 178.44 178.25 1t03 n TYR 427 N -3.16 -0.33 -3.21 0.49 4.11 -1.26 -4.80 117.16 108.99 1t03 n TYR 427 Ca 0.03 -0.49 0.04 0.00 -0.00 0.00 0.00 57.90 57.48 1t03 n TYR 427 Cb 0.65 0.07 -0.02 0.00 -0.00 0.00 0.00 39.34 40.03 1t03 n TYR 427 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.86 175.72 1t03 s GLN 428 N -2.21 0.21 1.11 -3.48 0.74 -1.26 -5.07 119.66 109.70 1t03 s GLN 428 Ca 0.07 0.43 -0.13 0.00 0.05 0.00 0.00 55.36 55.77 1t03 s GLN 428 Cb 0.00 0.25 0.22 0.00 1.10 0.00 0.00 33.01 34.58 1t03 s GLN 428 CO 0.05 -0.17 0.84 1.28 -0.55 0.00 0.00 175.29 176.73 1t03 n LEU 429 N 5.25 -0.63 -4.92 3.68 4.77 -1.26 -4.70 117.00 119.18 1t03 n LEU 429 Ca -0.07 -0.02 -0.27 0.00 -0.03 0.00 0.00 56.01 55.62 1t03 n LEU 429 Cb 0.54 -1.25 -0.02 0.00 -2.33 0.00 0.00 43.42 40.35 1t03 n LEU 429 CO -0.08 -3.08 0.16 -1.61 -1.33 0.00 0.00 177.39 171.45 1t03 s GLU 430 N -4.24 3.56 -0.05 3.23 0.41 0.20 -4.96 118.70 116.85 1t03 s GLU 430 Ca 0.66 -0.17 0.06 0.00 -0.41 0.00 0.00 54.97 55.11 1t03 s GLU 430 Cb -0.23 -2.69 -0.24 0.00 -1.78 0.00 0.00 34.13 29.20 1t03 s GLU 430 CO 0.64 0.22 0.64 0.87 -0.49 0.00 0.00 175.26 177.14 1t03 h LYS 431 N 1.42 0.09 -6.46 1.61 1.57 -1.95 -3.45 116.57 109.40 1t03 h LYS 431 Ca -0.48 -0.15 -0.63 0.00 -1.87 0.00 0.00 60.65 57.52 1t03 h LYS 431 Cb 1.20 0.05 -0.24 0.00 0.08 0.00 0.00 32.23 33.32 1t03 h LYS 431 CO 0.65 0.74 -0.86 -1.21 -0.57 0.00 0.00 179.45 178.20 1t03 s GLU 432 N -2.60 1.45 0.26 3.15 0.41 -1.26 -5.10 118.70 115.02 1t03 s GLU 432 Ca -0.09 -1.12 -0.31 0.00 -0.41 0.00 0.00 54.97 53.04 1t03 s GLU 432 Cb 0.08 -1.69 -0.13 0.00 -1.78 0.00 0.00 34.13 30.60 1t03 s GLU 432 CO 0.81 0.42 1.42 -0.35 -0.49 0.00 0.00 175.26 177.08 1t03 n PRO 433 N 1.47 2.16 -3.07 0.39 -0.04 -1.26 -4.94 135.00 129.71 1t03 n PRO 433 Ca -0.18 0.77 -0.31 0.00 -0.04 0.00 0.00 63.50 63.74 1t03 n PRO 433 Cb 0.53 -2.44 -0.05 0.00 -0.04 0.00 0.00 33.50 31.51 1t03 n PRO 433 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1t03 s ILE 434 N -0.20 4.77 -0.15 0.52 1.10 -1.26 -5.07 121.20 120.91 1t03 s ILE 434 Ca 0.65 0.71 -0.03 0.00 -0.51 0.00 0.00 60.65 61.47 1t03 s ILE 434 Cb -0.61 -3.66 -0.03 0.00 0.15 0.00 0.00 42.46 38.31 1t03 s ILE 434 CO 0.51 -0.31 -0.05 -0.69 -2.11 0.00 0.00 174.94 172.30 1t03 s VAL 435 N -2.12 3.83 0.00 4.00 1.01 -1.26 -4.45 120.40 121.41 1t03 s VAL 435 Ca 0.52 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1t03 s VAL 435 Cb -0.10 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.61 1t03 s VAL 435 CO 0.24 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.46 1t03 n GLY 436 N 3.41 1.70 3.15 4.51 0.00 -1.26 -5.11 105.19 111.58 1t03 n GLY 436 Ca -0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 1t03 n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t03 s ALA 437 N -2.00 -0.66 0.38 4.61 0.00 -1.26 -4.91 121.76 117.92 1t03 s ALA 437 Ca 0.00 0.77 -0.27 0.00 0.00 0.00 0.00 51.96 52.45 1t03 s ALA 437 Cb 0.00 -0.45 -0.10 0.00 0.00 0.00 0.00 23.12 22.57 1t03 s ALA 437 CO 0.00 -0.13 1.40 -1.21 0.00 0.00 0.00 175.76 175.82 1t03 s GLU 438 N 0.20 4.08 -1.10 0.00 2.02 -1.26 -4.63 118.70 118.01 1t03 s GLU 438 Ca -0.00 2.39 -0.07 0.00 0.02 0.00 0.00 54.97 57.30 1t03 s GLU 438 Cb -0.02 -2.91 0.29 0.00 0.10 0.00 0.00 34.13 31.59 1t03 s GLU 438 CO -0.00 -0.48 1.26 0.25 0.02 0.00 0.00 175.26 176.31 1t03 n THR 439 N 0.39 4.87 -1.56 3.63 -2.24 -1.26 -2.02 114.28 116.08 1t03 n THR 439 Ca 0.02 -5.61 -0.43 0.00 -2.27 0.00 0.00 64.05 55.76 1t03 n THR 439 Cb 0.41 -2.37 0.00 0.00 -2.10 0.00 0.00 70.33 66.27 1t03 n THR 439 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1t03 n PHE 440 N 2.10 0.74 -3.89 4.78 3.72 -0.73 -4.23 117.46 119.94 1t03 n PHE 440 Ca 0.25 0.63 -0.30 0.00 -0.05 0.00 0.00 57.45 57.97 1t03 n PHE 440 Cb 0.37 -2.17 -0.13 0.00 -0.94 0.00 0.00 39.48 36.61 1t03 n PHE 440 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1t03 s TYR 441 N -1.25 3.37 0.83 1.38 1.51 -1.26 -1.93 117.35 120.01 1t03 s TYR 441 Ca 0.62 -3.18 -0.12 0.00 -1.01 0.00 0.00 57.07 53.38 1t03 s TYR 441 Cb -0.63 -2.85 0.09 0.00 -0.11 0.00 0.00 41.96 38.47 1t03 s TYR 441 CO 0.58 -0.69 1.13 0.14 -1.11 0.00 0.00 175.55 175.60 1t03 s VAL 442 N -0.71 2.53 0.00 0.71 -7.23 -0.72 -3.29 120.40 111.70 1t03 s VAL 442 Ca 0.20 0.17 0.00 0.00 -1.81 0.00 0.00 61.98 60.54 1t03 s VAL 442 Cb -0.17 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 33.77 1t03 s VAL 442 CO -0.06 -0.23 0.00 -0.67 -0.31 0.00 0.00 175.10 173.83 1t03 n ASP 443 N -3.48 0.00 0.00 4.85 2.03 -1.23 -4.51 116.55 114.21 1t03 n ASP 443 Ca 0.07 -0.91 0.00 0.00 0.52 0.00 0.00 54.79 54.47 1t03 n ASP 443 Cb 0.58 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.98 1t03 n ASP 443 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1t03 n GLY 444 N 0.00 1.62 2.61 0.27 0.00 -1.26 -3.21 105.19 105.21 1t03 n GLY 444 Ca 0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 46.02 44.98 1t03 n GLY 444 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t03 n ALA 445 N -0.72 -1.71 -3.62 4.61 0.00 -0.73 -4.52 120.51 113.81 1t03 n ALA 445 Ca 0.00 -0.73 -0.01 0.00 0.00 0.00 0.00 53.44 52.70 1t03 n ALA 445 Cb 0.00 0.45 -0.01 0.00 0.00 0.00 0.00 19.45 19.89 1t03 n ALA 445 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1t03 s ALA 446 N -1.71 -2.14 -0.16 0.00 0.00 -1.26 -3.37 121.76 113.13 1t03 s ALA 446 Ca 0.15 0.95 0.02 0.00 0.00 0.00 0.00 51.96 53.07 1t03 s ALA 446 Cb -0.02 0.23 0.01 0.00 0.00 0.00 0.00 23.12 23.34 1t03 s ALA 446 CO 0.05 -0.90 -0.20 1.21 0.00 0.00 0.00 175.76 175.92 1t03 s ASN 447 N -2.71 3.22 0.33 0.00 2.47 -0.43 -4.77 114.94 113.05 1t03 s ASN 447 Ca 0.12 -0.59 0.02 0.00 0.42 0.00 0.00 52.86 52.83 1t03 s ASN 447 Cb 0.02 -1.48 0.59 0.00 -1.45 0.00 0.00 41.25 38.93 1t03 s ASN 447 CO -0.04 0.05 1.95 0.03 -3.72 0.00 0.00 177.10 175.38 1t03 h ARG 448 N 7.53 0.92 0.00 0.43 3.08 -1.93 0.57 114.38 124.98 1t03 h ARG 448 Ca -0.37 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1t03 h ARG 448 Cb 1.17 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 31.02 1t03 h ARG 448 CO 0.58 0.61 0.00 0.93 -1.07 0.00 0.00 179.97 181.02 1t03 h GLU 449 N 0.94 0.00 0.00 0.04 5.08 -1.95 -3.31 114.58 115.39 1t03 h GLU 449 Ca 0.32 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.61 1t03 h GLU 449 Cb 0.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1t03 h GLU 449 CO -0.10 0.00 -1.38 0.25 -1.00 0.00 0.00 179.01 176.78 1t03 n THR 450 N -2.75 0.29 -0.97 1.13 -2.24 -0.56 -5.00 114.28 104.17 1t03 n THR 450 Ca 0.02 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1t03 n THR 450 Cb 0.32 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 1t03 n THR 450 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1t03 n LYS 451 N -2.07 -0.19 -4.46 -0.78 2.85 0.19 -4.84 118.16 108.86 1t03 n LYS 451 Ca -0.07 0.05 -0.24 0.00 -1.05 0.00 0.00 58.31 57.00 1t03 n LYS 451 Cb 0.53 -3.12 -0.10 0.00 -0.65 0.00 0.00 35.03 31.69 1t03 n LYS 451 CO 0.00 0.00 0.00 -0.48 -0.05 0.00 0.00 177.40 176.87 1t03 s LEU 452 N 0.00 2.65 0.00 -5.58 0.05 -1.25 0.24 118.68 114.79 1t03 s LEU 452 Ca 0.00 -1.00 0.00 0.00 0.05 0.00 0.00 54.13 53.18 1t03 s LEU 452 Cb 0.00 -1.15 0.00 0.00 -2.05 0.00 0.00 46.19 42.99 1t03 s LEU 452 CO 0.00 0.03 0.00 0.61 -0.55 0.00 0.00 176.35 176.44 1t03 n GLY 453 N -0.65 0.50 3.75 -3.48 0.00 -0.69 -1.31 105.19 103.32 1t03 n GLY 453 Ca -0.05 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 1t03 n GLY 453 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t03 s LYS 454 N -2.00 2.16 -0.30 1.61 1.02 -1.22 0.17 119.74 121.19 1t03 s LYS 454 Ca 0.00 -2.22 -0.15 0.00 0.02 0.00 0.00 55.97 53.62 1t03 s LYS 454 Cb 0.00 -1.70 0.17 0.00 -0.52 0.00 0.00 37.83 35.78 1t03 s LYS 454 CO 0.00 -0.31 1.03 0.00 -0.92 0.00 0.00 175.35 175.15 1t03 s ALA 455 N -2.79 -2.81 0.18 5.17 0.00 -1.01 -1.78 121.76 118.73 1t03 s ALA 455 Ca 0.20 2.00 -0.23 0.00 0.00 0.00 0.00 51.96 53.92 1t03 s ALA 455 Cb 0.03 -2.10 0.07 0.00 0.00 0.00 0.00 23.12 21.11 1t03 s ALA 455 CO 0.11 -0.98 0.98 0.20 0.00 0.00 0.00 175.76 176.07 1t03 s GLY 456 N 2.42 -0.08 0.16 0.00 0.00 -1.20 -3.69 107.32 104.93 1t03 s GLY 456 Ca -0.02 -0.08 0.01 0.00 0.00 0.00 0.00 44.72 44.63 1t03 s GLY 456 CO -0.17 0.74 0.22 1.58 0.00 0.00 0.00 173.10 175.47 1t03 n TYR 457 N -0.55 -3.05 -2.74 1.90 4.11 -1.24 -3.56 117.16 112.03 1t03 n TYR 457 Ca -0.05 -0.48 -0.06 0.00 -0.00 0.00 0.00 57.90 57.31 1t03 n TYR 457 Cb 0.60 -0.16 0.03 0.00 -0.00 0.00 0.00 39.34 39.82 1t03 n TYR 457 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.86 177.14 1t03 n VAL 458 N -1.53 0.00 -0.80 -3.48 0.31 -1.21 -3.75 118.33 107.88 1t03 n VAL 458 Ca 0.04 -1.10 -0.35 0.00 -0.01 0.00 0.00 64.34 62.92 1t03 n VAL 458 Cb 0.15 1.18 0.11 0.00 -0.91 0.00 0.00 33.84 34.37 1t03 n VAL 458 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1t03 n THR 459 N 2.25 0.00 0.23 2.52 5.66 -1.09 -4.03 114.28 119.82 1t03 n THR 459 Ca 0.12 -0.17 0.12 0.00 -3.05 0.00 0.00 64.05 61.07 1t03 n THR 459 Cb 0.61 -0.35 0.29 0.00 -1.55 0.00 0.00 70.33 69.33 1t03 n THR 459 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1t03 h ASN 460 N -1.65 0.00 1.77 1.09 -1.07 -1.91 -3.11 115.58 110.70 1t03 h ASN 460 Ca -0.47 0.00 -0.04 0.00 0.07 0.00 0.00 56.30 55.86 1t03 h ASN 460 Cb 1.36 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.60 1t03 h ASN 460 CO 0.31 0.06 -0.19 0.11 0.07 0.00 0.00 177.43 177.78 1t03 h LYS 461 N 0.00 0.00 0.00 4.14 1.57 -1.95 -3.48 116.57 116.85 1t03 h LYS 461 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1t03 h LYS 461 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1t03 h LYS 461 CO 0.01 0.19 0.00 0.41 -0.57 0.00 0.00 179.45 179.49 1t03 n GLY 462 N 1.11 0.97 3.17 3.86 0.00 -1.17 -5.12 105.19 108.01 1t03 n GLY 462 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1t03 n GLY 462 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1t03 n ARG 463 N 0.00 0.02 -1.30 1.61 0.63 -1.26 -4.71 116.66 111.65 1t03 n ARG 463 Ca 0.00 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 1t03 n ARG 463 Cb 0.00 -1.11 0.00 0.00 0.45 0.00 0.00 32.46 31.80 1t03 n ARG 463 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 1t03 n GLN 464 N 1.61 0.00 0.00 -0.14 -0.06 -1.26 -2.67 117.38 114.86 1t03 n GLN 464 Ca 0.04 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.04 1t03 n GLN 464 Cb 0.51 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.69 1t03 n GLN 464 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 1t03 n LYS 465 N 0.00 0.00 -2.68 3.69 3.00 -1.25 -4.87 118.16 116.05 1t03 n LYS 465 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.26 1t03 n LYS 465 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 35.03 35.08 1t03 n LYS 465 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1t03 n VAL 466 N -0.90 0.00 -1.56 3.15 0.31 -1.26 -3.72 118.33 114.35 1t03 n VAL 466 Ca 0.00 -1.01 -0.45 0.00 -0.01 0.00 0.00 64.34 62.86 1t03 n VAL 466 Cb 0.00 0.84 -0.02 0.00 -0.91 0.00 0.00 33.84 33.75 1t03 n VAL 466 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1t03 n VAL 467 N -0.39 1.92 -3.20 2.52 0.24 -1.24 -4.54 118.33 113.63 1t03 n VAL 467 Ca -0.14 -0.48 -0.31 0.00 -2.04 0.00 0.00 64.34 61.37 1t03 n VAL 467 Cb 0.73 -0.82 -0.04 0.00 -1.47 0.00 0.00 33.84 32.24 1t03 n VAL 467 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1t03 s PRO 468 N -1.38 3.78 0.02 7.34 0.04 -1.26 -2.39 135.00 141.14 1t03 s PRO 468 Ca 0.61 0.31 0.04 0.00 0.04 0.00 0.00 61.00 61.99 1t03 s PRO 468 Cb -0.75 -2.54 -0.01 0.00 0.04 0.00 0.00 34.50 31.23 1t03 s PRO 468 CO 0.59 0.17 -0.11 -0.51 0.04 0.00 0.00 177.00 177.17 1t03 s LEU 469 N -3.32 2.11 -0.06 -3.56 1.02 0.13 -4.97 118.68 110.02 1t03 s LEU 469 Ca 0.48 -0.33 0.06 0.00 0.02 0.00 0.00 54.13 54.36 1t03 s LEU 469 Cb -0.11 -0.50 -0.01 0.00 0.02 0.00 0.00 46.19 45.60 1t03 s LEU 469 CO 0.26 0.05 -0.24 0.42 0.02 0.00 0.00 176.35 176.85 1t03 s THR 470 N -0.61 1.98 -0.37 5.49 -4.23 -1.26 -1.70 115.64 114.95 1t03 s THR 470 Ca 0.01 -1.02 -0.12 0.00 -1.18 0.00 0.00 61.69 59.38 1t03 s THR 470 Cb -0.06 -1.68 0.02 0.00 1.34 0.00 0.00 72.50 72.11 1t03 s THR 470 CO 0.00 0.55 0.38 -3.20 -0.54 0.00 0.00 174.62 171.81 1t03 n ASN 471 N 3.04 -7.64 -3.60 3.99 5.15 0.67 -4.97 115.26 111.90 1t03 n ASN 471 Ca -0.18 0.74 -0.04 0.00 -0.60 0.00 0.00 54.58 54.50 1t03 n ASN 471 Cb 0.52 -4.73 -0.02 0.00 -0.53 0.00 0.00 39.78 35.02 1t03 n ASN 471 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1t03 s THR 472 N -2.07 0.00 -0.01 -0.44 -4.23 -0.81 -5.02 115.64 103.05 1t03 s THR 472 Ca 0.17 -0.17 0.01 0.00 -1.18 0.00 0.00 61.69 60.52 1t03 s THR 472 Cb -0.04 -1.39 0.00 0.00 1.34 0.00 0.00 72.50 72.42 1t03 s THR 472 CO 0.74 0.00 -0.04 -0.89 -0.54 0.00 0.00 174.62 173.89 1t03 s THR 473 N -2.79 0.34 0.00 3.99 2.01 -1.26 -4.52 115.64 113.41 1t03 s THR 473 Ca 0.10 -0.14 0.00 0.00 0.31 0.00 0.00 61.69 61.95 1t03 s THR 473 Cb 0.00 -0.32 0.00 0.00 0.01 0.00 0.00 72.50 72.19 1t03 s THR 473 CO -0.05 0.12 0.00 0.59 -0.69 0.00 0.00 174.62 174.59 1t03 n ASN 474 N 3.25 0.00 -0.34 3.53 4.13 -1.26 0.56 115.26 125.13 1t03 n ASN 474 Ca -0.16 0.00 0.21 0.00 1.68 0.00 0.00 54.58 56.31 1t03 n ASN 474 Cb 0.56 0.00 0.43 0.00 -1.54 0.00 0.00 39.78 39.24 1t03 n ASN 474 CO 0.00 0.00 0.00 1.56 0.28 0.00 0.00 177.26 179.10 1t03 h GLN 475 N 0.00 0.44 0.62 3.52 7.50 -1.96 0.75 115.11 125.98 1t03 h GLN 475 Ca 0.00 -0.03 -0.03 0.00 0.50 0.00 0.00 58.65 59.09 1t03 h GLN 475 Cb 0.00 -0.10 0.01 0.00 0.05 0.00 0.00 27.48 27.44 1t03 h GLN 475 CO 0.00 0.29 -0.30 0.87 -1.50 0.00 0.00 178.83 178.19 1t03 h LYS 476 N 0.46 -0.80 0.14 1.46 1.79 1.45 -2.59 116.57 118.47 1t03 h LYS 476 Ca 0.69 0.05 0.02 0.00 -2.18 0.00 0.00 60.65 59.23 1t03 h LYS 476 Cb 1.45 0.18 -0.03 0.00 -1.58 0.00 0.00 32.23 32.25 1t03 h LYS 476 CO -0.53 -0.54 -0.28 1.79 -1.08 0.00 0.00 179.45 178.81 1t03 h THR 477 N -1.01 0.39 0.00 -0.16 1.35 -0.95 0.57 112.91 113.10 1t03 h THR 477 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 1t03 h THR 477 Cb 0.64 0.39 0.00 0.00 -1.73 0.00 0.00 68.15 67.45 1t03 h THR 477 CO 0.14 0.00 0.13 -0.08 -0.25 0.00 0.00 175.52 175.46 1t03 h GLU 478 N -0.51 0.00 0.13 4.72 4.57 0.29 1.73 114.58 125.51 1t03 h GLU 478 Ca 0.03 0.00 -0.31 0.00 -1.18 0.00 0.00 59.36 57.89 1t03 h GLU 478 Cb 0.53 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.11 1t03 h GLU 478 CO -0.15 0.00 -1.56 1.25 -1.18 0.00 0.00 179.01 177.37 1t03 h LEU 479 N 0.00 0.43 -0.09 1.64 5.85 -0.59 -3.34 115.31 119.22 1t03 h LEU 479 Ca 0.00 -0.60 0.01 0.00 0.84 0.00 0.00 57.88 58.13 1t03 h LEU 479 Cb 0.26 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1t03 h LEU 479 CO 0.00 1.50 0.04 -0.61 -0.34 0.00 0.00 178.44 179.02 1t03 h GLN 480 N 0.07 0.08 -0.31 1.25 5.75 0.77 -3.07 115.11 119.66 1t03 h GLN 480 Ca -0.26 -0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.27 1t03 h GLN 480 Cb 2.03 -0.02 -0.06 0.00 1.07 0.00 0.00 27.48 30.50 1t03 h GLN 480 CO 0.17 0.05 -0.39 0.00 -2.65 0.00 0.00 178.83 176.01 1t03 h ALA 481 N 1.05 -0.62 0.00 3.38 0.00 -0.87 0.91 119.26 123.11 1t03 h ALA 481 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1t03 h ALA 481 Cb 0.01 1.02 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1t03 h ALA 481 CO -0.03 -0.82 0.66 0.82 0.00 0.00 0.00 179.25 179.89 1t03 h ILE 482 N -0.26 0.00 0.01 0.00 2.04 -1.65 0.26 117.51 117.91 1t03 h ILE 482 Ca 0.05 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.87 1t03 h ILE 482 Cb 0.41 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1t03 h ILE 482 CO -0.43 0.00 -0.19 0.22 0.00 0.00 0.00 178.15 177.75 1t03 h TYR 483 N 0.00 0.17 0.00 1.37 3.20 0.89 -3.28 116.97 119.33 1t03 h TYR 483 Ca 0.00 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 61.77 1t03 h TYR 483 Cb 1.32 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.57 1t03 h TYR 483 CO 0.00 0.94 0.00 1.28 -1.64 0.00 0.00 178.16 178.74 1t03 n LEU 484 N -4.55 0.00 0.15 2.82 4.77 0.92 -0.81 117.00 120.31 1t03 n LEU 484 Ca -0.10 0.95 0.00 0.00 -0.03 0.00 0.00 56.01 56.83 1t03 n LEU 484 Cb 0.49 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1t03 n LEU 484 CO 0.38 -0.45 0.71 0.00 -1.33 0.00 0.00 177.39 176.69 1t03 n ALA 485 N -2.31 0.00 -1.17 -1.18 0.00 -1.15 0.24 120.51 114.93 1t03 n ALA 485 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1t03 n ALA 485 Cb 0.00 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.70 1t03 n ALA 485 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1t03 n LEU 486 N -1.66 4.80 0.04 0.00 4.77 0.01 -4.19 117.00 120.77 1t03 n LEU 486 Ca 0.00 -3.36 0.00 0.00 -0.03 0.00 0.00 56.01 52.62 1t03 n LEU 486 Cb 0.71 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1t03 n LEU 486 CO 0.00 0.92 -0.02 0.00 -1.33 0.00 0.00 177.39 176.96 1t03 n GLN 487 N -0.65 0.00 -1.91 3.23 6.02 0.65 -4.81 117.38 119.91 1t03 n GLN 487 Ca 0.34 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.92 1t03 n GLN 487 Cb 1.14 -0.03 -0.01 0.00 1.02 0.00 0.00 30.24 32.36 1t03 n GLN 487 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1t03 n ASP 488 N -2.79 6.55 -3.62 1.08 8.00 -0.27 -4.83 116.55 120.67 1t03 n ASP 488 Ca 0.00 -2.96 -0.01 0.00 0.71 0.00 0.00 54.79 52.53 1t03 n ASP 488 Cb 0.02 -1.49 -0.01 0.00 -0.02 0.00 0.00 41.12 39.62 1t03 n ASP 488 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1t03 s SER 489 N 1.39 -0.09 0.00 -2.24 0.15 -1.26 -4.68 113.70 106.97 1t03 s SER 489 Ca 0.52 -0.12 0.00 0.00 0.70 0.00 0.00 55.95 57.05 1t03 s SER 489 Cb 0.15 0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.64 1t03 s SER 489 CO -0.06 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.67 1t03 n GLY 490 N -0.38 -0.76 0.66 9.45 0.00 -1.26 -4.92 105.19 107.98 1t03 n GLY 490 Ca -0.06 -1.48 0.09 0.00 0.00 0.00 0.00 46.02 44.57 1t03 n GLY 490 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1t03 n LEU 491 N 0.00 1.95 -3.79 0.99 7.94 -1.26 -4.79 117.00 118.04 1t03 n LEU 491 Ca 0.00 -0.87 -0.13 0.00 -1.11 0.00 0.00 56.01 53.91 1t03 n LEU 491 Cb 0.00 -0.16 -0.10 0.00 0.53 0.00 0.00 43.42 43.69 1t03 n LEU 491 CO 0.00 0.43 -0.06 -1.61 -1.11 0.00 0.00 177.39 175.05 1t03 s GLU 492 N -1.68 0.45 -0.25 1.96 2.02 -1.26 -2.07 118.70 117.88 1t03 s GLU 492 Ca 0.31 0.07 -0.34 0.00 0.02 0.00 0.00 54.97 55.03 1t03 s GLU 492 Cb 0.17 0.21 0.16 0.00 0.10 0.00 0.00 34.13 34.76 1t03 s GLU 492 CO 0.24 -0.09 1.30 0.54 0.02 0.00 0.00 175.26 177.27 1t03 s VAL 493 N -0.56 0.00 0.12 2.63 0.11 -0.96 -4.59 120.40 117.15 1t03 s VAL 493 Ca -0.07 0.00 0.08 0.00 -2.93 0.00 0.00 61.98 59.06 1t03 s VAL 493 Cb -0.04 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.77 1t03 s VAL 493 CO 0.02 0.00 -0.12 0.20 -3.33 0.00 0.00 175.10 171.87 1t03 s ASN 494 N -1.73 4.26 0.05 3.54 0.02 -0.86 -3.04 114.94 117.19 1t03 s ASN 494 Ca 0.09 -0.46 -0.00 0.00 -1.02 0.00 0.00 52.86 51.48 1t03 s ASN 494 Cb -0.01 -0.75 -0.03 0.00 0.02 0.00 0.00 41.25 40.47 1t03 s ASN 494 CO -0.05 0.16 -0.04 -0.63 0.02 0.00 0.00 177.10 176.57 1t03 s ILE 495 N -1.28 0.28 -0.13 0.60 1.01 -0.37 -1.78 121.20 119.54 1t03 s ILE 495 Ca 0.21 -1.53 -0.05 0.00 0.00 0.00 0.00 60.65 59.28 1t03 s ILE 495 Cb -0.11 -1.14 0.06 0.00 0.01 0.00 0.00 42.46 41.29 1t03 s ILE 495 CO 0.13 -0.80 0.25 -0.69 0.00 0.00 0.00 174.94 173.83 1t03 s VAL 496 N -3.03 -0.40 0.37 2.92 1.01 -0.81 -1.63 120.40 118.82 1t03 s VAL 496 Ca 0.00 0.28 0.08 0.00 0.00 0.00 0.00 61.98 62.35 1t03 s VAL 496 Cb 0.01 -0.43 -0.07 0.00 0.00 0.00 0.00 36.38 35.89 1t03 s VAL 496 CO -0.06 0.12 -0.04 0.42 0.00 0.00 0.00 175.10 175.54 1t03 s THR 497 N 2.41 2.05 -0.84 3.92 -4.23 -1.07 -1.75 115.64 116.13 1t03 s THR 497 Ca 0.01 -2.10 0.07 0.00 -1.18 0.00 0.00 61.69 58.50 1t03 s THR 497 Cb -0.12 -2.81 0.09 0.00 1.34 0.00 0.00 72.50 71.00 1t03 s THR 497 CO -0.08 -0.11 0.82 -0.90 -0.54 0.00 0.00 174.62 173.81 1t03 n ASP 498 N -0.86 1.82 -4.44 3.99 5.75 -1.26 -1.68 116.55 119.87 1t03 n ASP 498 Ca -0.05 -1.45 -0.38 0.00 -0.01 0.00 0.00 54.79 52.90 1t03 n ASP 498 Cb 0.65 -0.03 -0.12 0.00 -1.03 0.00 0.00 41.12 40.59 1t03 n ASP 498 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1t03 s SER 499 N -0.69 5.46 0.14 -1.12 1.04 -1.26 -4.50 113.70 112.77 1t03 s SER 499 Ca 0.10 -0.47 -0.13 0.00 0.48 0.00 0.00 55.95 55.93 1t03 s SER 499 Cb 0.06 -1.98 -0.00 0.00 0.10 0.00 0.00 66.02 64.20 1t03 s SER 499 CO 0.09 -0.16 1.56 1.56 0.98 0.00 0.00 173.24 177.27 1t03 h GLN 500 N 8.32 0.85 -0.30 4.02 7.50 -1.97 -1.01 115.11 132.52 1t03 h GLN 500 Ca -0.33 -0.31 0.03 0.00 0.50 0.00 0.00 58.65 58.53 1t03 h GLN 500 Cb 1.15 -0.06 -0.04 0.00 0.05 0.00 0.00 27.48 28.59 1t03 h GLN 500 CO 0.61 0.94 -0.18 -0.92 -1.50 0.00 0.00 178.83 177.78 1t03 h TYR 501 N 0.69 -0.58 -0.37 2.96 3.20 -1.99 1.47 116.97 122.35 1t03 h TYR 501 Ca 0.12 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 1t03 h TYR 501 Cb 0.61 0.29 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 1t03 h TYR 501 CO 0.05 -0.11 0.18 0.00 -1.64 0.00 0.00 178.16 176.64 1t03 h ALA 502 N -0.55 0.47 -0.09 1.82 0.00 -1.90 -1.85 119.26 117.15 1t03 h ALA 502 Ca 0.05 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1t03 h ALA 502 Cb 0.13 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 1t03 h ALA 502 CO -0.28 0.02 -0.47 1.25 0.00 0.00 0.00 179.25 179.78 1t03 h LEU 503 N 0.46 -1.47 0.25 0.00 5.85 0.30 -2.16 115.31 118.53 1t03 h LEU 503 Ca 0.13 0.17 0.00 0.00 0.84 0.00 0.00 57.88 59.02 1t03 h LEU 503 Cb 0.10 0.57 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 1t03 h LEU 503 CO -0.02 -0.42 -0.47 1.23 -0.34 0.00 0.00 178.44 178.43 1t03 h GLY 504 N -0.52 -1.19 -0.68 3.75 0.00 0.20 -1.27 103.07 103.37 1t03 h GLY 504 Ca 0.02 0.61 0.22 0.00 0.00 0.00 0.00 47.33 48.18 1t03 h GLY 504 CO -0.36 -0.32 0.13 1.39 0.00 0.00 0.00 176.54 177.38 1t03 n ILE 505 N -5.16 -0.29 0.01 2.60 5.41 -0.70 -0.57 119.36 120.67 1t03 n ILE 505 Ca -0.09 1.46 -0.11 0.00 1.00 0.00 0.00 62.75 65.00 1t03 n ILE 505 Cb 0.39 -2.20 -0.09 0.00 -0.71 0.00 0.00 39.64 37.02 1t03 n ILE 505 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1t03 h ILE 506 N 0.00 1.12 -0.96 1.39 1.08 -0.67 -3.31 117.51 116.16 1t03 h ILE 506 Ca 0.47 -1.37 0.25 0.00 -0.39 0.00 0.00 64.86 63.82 1t03 h ILE 506 Cb 1.08 1.92 -0.13 0.00 -3.07 0.00 0.00 36.82 36.62 1t03 h ILE 506 CO -0.60 0.30 0.51 1.56 -0.69 0.00 0.00 178.15 179.23 1t03 h GLN 507 N -0.81 0.45 0.00 2.37 4.20 0.27 0.20 115.11 121.79 1t03 h GLN 507 Ca -0.01 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1t03 h GLN 507 Cb 0.59 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1t03 h GLN 507 CO 0.02 0.30 0.03 0.00 -0.67 0.00 0.00 178.83 178.51 1t03 n ALA 508 N -2.39 0.87 -3.65 3.87 0.00 -0.90 -4.73 120.51 113.57 1t03 n ALA 508 Ca 0.26 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.46 1t03 n ALA 508 Cb 0.74 -0.61 0.06 0.00 0.00 0.00 0.00 19.45 19.64 1t03 n ALA 508 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1t03 n GLN 509 N -0.89 -6.84 -1.62 0.00 1.13 0.71 -4.90 117.38 104.97 1t03 n GLN 509 Ca 0.00 0.76 -0.43 0.00 -1.94 0.00 0.00 57.00 55.39 1t03 n GLN 509 Cb 0.03 -5.72 -0.01 0.00 0.11 0.00 0.00 30.24 24.66 1t03 n GLN 509 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 1t03 n PRO 510 N -4.70 1.55 0.00 -1.09 -0.04 -1.25 -4.77 135.00 124.70 1t03 n PRO 510 Ca -0.07 0.55 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 1t03 n PRO 510 Cb 0.58 -2.02 0.00 0.00 -0.04 0.00 0.00 33.50 32.03 1t03 n PRO 510 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1t03 n ASP 511 N 0.92 1.24 0.00 3.54 3.85 -0.37 -4.94 116.55 120.80 1t03 n ASP 511 Ca 0.08 -1.62 0.00 0.00 -0.71 0.00 0.00 54.79 52.54 1t03 n ASP 511 Cb 0.35 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.12 1t03 n ASP 511 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.20 177.36 1t03 n LYS 512 N -0.31 0.00 -2.48 0.11 3.00 -0.83 -4.90 118.16 112.75 1t03 n LYS 512 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.25 1t03 n LYS 512 Cb 0.34 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.37 1t03 n LYS 512 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1t03 n SER 513 N 0.00 -0.75 -0.03 3.14 2.88 -1.26 -1.60 113.62 116.00 1t03 n SER 513 Ca 0.00 -1.79 -0.21 0.00 -1.33 0.00 0.00 58.87 55.54 1t03 n SER 513 Cb 0.00 1.33 -0.13 0.00 -0.75 0.00 0.00 64.21 64.66 1t03 n SER 513 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1t03 n GLU 514 N -0.25 0.73 -3.11 -1.46 4.07 -1.23 -4.91 120.64 114.47 1t03 n GLU 514 Ca -0.01 0.25 -0.36 0.00 -0.06 0.00 0.00 57.16 56.97 1t03 n GLU 514 Cb 0.26 -1.66 -0.06 0.00 -0.06 0.00 0.00 31.44 29.92 1t03 n GLU 514 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1t03 s SER 515 N -6.92 7.07 0.04 4.31 0.15 -1.26 -5.00 113.70 112.08 1t03 s SER 515 Ca -0.26 1.41 -0.20 0.00 0.70 0.00 0.00 55.95 57.60 1t03 s SER 515 Cb 0.07 -2.41 -0.15 0.00 -1.71 0.00 0.00 66.02 61.81 1t03 s SER 515 CO 0.72 0.06 1.30 -0.33 1.20 0.00 0.00 173.24 176.19 1t03 h GLU 516 N 3.53 0.41 -0.96 5.44 4.39 -1.97 -2.14 114.58 123.28 1t03 h GLU 516 Ca -0.48 -0.25 0.12 0.00 0.34 0.00 0.00 59.36 59.08 1t03 h GLU 516 Cb 1.19 0.03 -0.14 0.00 -0.10 0.00 0.00 28.75 29.74 1t03 h GLU 516 CO 0.65 0.85 -0.47 -0.11 -1.16 0.00 0.00 179.01 178.77 1t03 n LEU 517 N -4.45 -0.81 0.18 1.33 7.94 -1.26 0.21 117.00 120.14 1t03 n LEU 517 Ca -0.07 1.69 0.05 0.00 -1.11 0.00 0.00 56.01 56.57 1t03 n LEU 517 Cb 0.44 -0.31 0.33 0.00 0.53 0.00 0.00 43.42 44.41 1t03 n LEU 517 CO 0.41 -1.45 0.67 0.58 -1.11 0.00 0.00 177.39 176.49 1t03 h VAL 518 N 0.00 0.98 -0.04 1.96 2.07 -1.98 0.39 116.25 119.64 1t03 h VAL 518 Ca 0.25 -1.55 -0.12 0.00 0.82 0.00 0.00 66.70 66.10 1t03 h VAL 518 Cb 0.49 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 1t03 h VAL 518 CO -0.93 0.39 -0.53 -1.13 0.02 0.00 0.00 177.57 175.39 1t03 h ASN 519 N 0.00 0.11 0.10 0.57 -0.73 0.23 -0.17 115.58 115.68 1t03 h ASN 519 Ca -0.00 -0.06 -0.18 0.00 1.87 0.00 0.00 56.30 57.93 1t03 h ASN 519 Cb 0.89 -0.03 0.02 0.00 0.27 0.00 0.00 38.32 39.47 1t03 h ASN 519 CO 0.05 0.62 -0.78 1.56 -0.37 0.00 0.00 177.43 178.52 1t03 h GLN 520 N 0.08 0.35 -0.03 6.67 4.20 0.34 -1.62 115.11 125.10 1t03 h GLN 520 Ca -0.00 -0.51 0.01 0.00 0.06 0.00 0.00 58.65 58.21 1t03 h GLN 520 Cb 0.97 0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.92 1t03 h GLN 520 CO 0.07 1.21 0.06 0.82 -0.67 0.00 0.00 178.83 180.32 1t03 h ILE 521 N -0.26 0.25 -0.02 2.54 2.04 -0.07 0.49 117.51 122.48 1t03 h ILE 521 Ca -0.13 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 1t03 h ILE 521 Cb 1.56 0.95 0.01 0.00 -0.74 0.00 0.00 36.82 38.59 1t03 h ILE 521 CO 0.15 0.00 -0.29 0.40 0.00 0.00 0.00 178.15 178.41 1t03 h ILE 522 N 0.00 1.49 -0.51 -0.67 2.04 -0.87 -3.02 117.51 115.98 1t03 h ILE 522 Ca 0.01 -1.86 0.05 0.00 1.00 0.00 0.00 64.86 64.07 1t03 h ILE 522 Cb 0.13 2.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.77 1t03 h ILE 522 CO -0.00 0.52 0.34 -0.08 0.00 0.00 0.00 178.15 178.93 1t03 h GLU 523 N -0.36 0.48 0.23 2.37 4.57 0.89 -1.79 114.58 120.97 1t03 h GLU 523 Ca -0.03 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1t03 h GLU 523 Cb 1.00 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.49 1t03 h GLU 523 CO 0.06 0.31 -0.11 1.96 -1.18 0.00 0.00 179.01 180.05 1t03 h GLN 524 N 0.49 -0.30 -0.83 1.92 7.50 -1.12 -2.11 115.11 120.66 1t03 h GLN 524 Ca 0.21 0.02 0.17 0.00 0.50 0.00 0.00 58.65 59.55 1t03 h GLN 524 Cb 0.23 0.07 -0.10 0.00 0.05 0.00 0.00 27.48 27.73 1t03 h GLN 524 CO -0.06 0.05 0.36 -0.07 -1.50 0.00 0.00 178.83 177.62 1t03 h LEU 525 N -0.70 0.36 -0.89 1.46 4.07 -1.28 0.23 115.31 118.55 1t03 h LEU 525 Ca -0.03 0.12 -0.12 0.00 0.08 0.00 0.00 57.88 57.93 1t03 h LEU 525 Cb 0.48 0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.29 1t03 h LEU 525 CO 0.05 0.10 -0.49 -0.29 -1.08 0.00 0.00 178.44 176.74 1t03 h ILE 526 N 0.48 1.35 0.40 1.22 2.10 -1.34 -3.28 117.51 118.44 1t03 h ILE 526 Ca 0.47 -1.70 -0.02 0.00 1.08 0.00 0.00 64.86 64.69 1t03 h ILE 526 Cb 0.76 1.84 0.00 0.00 -1.09 0.00 0.00 36.82 38.34 1t03 h ILE 526 CO -0.43 0.50 -0.19 0.50 -1.08 0.00 0.00 178.15 177.44 1t03 h LYS 527 N 0.13 -0.52 0.00 2.19 3.64 0.09 -3.46 116.57 118.64 1t03 h LYS 527 Ca 0.00 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1t03 h LYS 527 Cb 0.91 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1t03 h LYS 527 CO 0.07 -0.21 0.00 1.63 -2.27 0.00 0.00 179.45 178.67 1t03 n LYS 528 N -5.18 -0.01 -0.03 1.90 5.02 -0.24 -5.00 118.16 114.61 1t03 n LYS 528 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 1t03 n LYS 528 Cb 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.30 1t03 n LYS 528 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1t03 n GLU 529 N -0.91 0.00 0.00 1.97 2.13 -0.88 -5.03 120.64 117.93 1t03 n GLU 529 Ca 0.00 -0.43 0.00 0.00 0.66 0.00 0.00 57.16 57.39 1t03 n GLU 529 Cb 0.00 -0.40 0.00 0.00 0.27 0.00 0.00 31.44 31.31 1t03 n GLU 529 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1t03 n LYS 530 N 0.00 0.00 -4.41 5.31 5.02 -0.92 -4.94 118.16 118.23 1t03 n LYS 530 Ca 0.00 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.08 1t03 n LYS 530 Cb 0.51 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.42 1t03 n LYS 530 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1t03 s VAL 531 N 0.00 1.72 -0.29 -0.18 1.01 -1.26 -2.27 120.40 119.14 1t03 s VAL 531 Ca 0.00 -2.17 -0.16 0.00 0.00 0.00 0.00 61.98 59.66 1t03 s VAL 531 Cb 0.00 -2.33 0.12 0.00 0.00 0.00 0.00 36.38 34.17 1t03 s VAL 531 CO 0.00 -0.39 0.86 -0.47 0.00 0.00 0.00 175.10 175.11 1t03 s TYR 532 N -2.97 -0.78 0.12 5.22 5.04 -1.17 -0.63 117.35 122.18 1t03 s TYR 532 Ca 0.28 1.54 0.10 0.00 -2.44 0.00 0.00 57.07 56.55 1t03 s TYR 532 Cb 0.02 0.47 -0.04 0.00 0.35 0.00 0.00 41.96 42.76 1t03 s TYR 532 CO 0.11 -0.39 -0.24 -0.51 -1.34 0.00 0.00 175.55 173.18 1t03 s LEU 533 N 1.55 2.32 0.27 6.97 1.02 -1.26 -1.24 118.68 128.32 1t03 s LEU 533 Ca -0.09 -0.74 0.02 0.00 0.02 0.00 0.00 54.13 53.34 1t03 s LEU 533 Cb -0.05 -1.06 -0.05 0.00 0.02 0.00 0.00 46.19 45.06 1t03 s LEU 533 CO -0.17 0.12 0.11 0.00 0.02 0.00 0.00 176.35 176.42 1t03 s ALA 534 N -1.18 1.79 0.16 4.21 0.00 -0.65 -4.94 121.76 121.14 1t03 s ALA 534 Ca 0.11 -1.83 0.08 0.00 0.00 0.00 0.00 51.96 50.31 1t03 s ALA 534 Cb -0.10 1.06 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 1t03 s ALA 534 CO 0.06 -0.47 -0.16 -0.46 0.00 0.00 0.00 175.76 174.73 1t03 s TRP 535 N -3.72 1.67 -0.17 0.00 -0.00 -1.26 -2.60 118.94 112.85 1t03 s TRP 535 Ca 0.37 -0.51 -0.16 0.00 -0.00 0.00 0.00 56.10 55.80 1t03 s TRP 535 Cb 0.07 -0.84 0.05 0.00 -0.00 0.00 0.00 33.47 32.75 1t03 s TRP 535 CO 0.14 0.27 0.47 0.08 -0.00 0.00 0.00 176.95 177.91 1t03 s VAL 536 N -2.20 0.00 -0.59 5.86 1.01 -0.68 -4.94 120.40 118.86 1t03 s VAL 536 Ca 0.14 -0.01 -0.26 0.00 0.00 0.00 0.00 61.98 61.86 1t03 s VAL 536 Cb -0.05 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.63 1t03 s VAL 536 CO 0.05 -0.00 2.16 -2.84 0.00 0.00 0.00 175.10 174.47 1t03 s PRO 537 N 0.22 2.30 0.83 2.72 0.02 -1.26 -4.09 135.00 135.74 1t03 s PRO 537 Ca -0.00 0.91 -0.13 0.00 0.02 0.00 0.00 61.00 61.80 1t03 s PRO 537 Cb -0.03 -4.55 0.07 0.00 0.02 0.00 0.00 34.50 30.01 1t03 s PRO 537 CO 0.01 -3.16 1.04 0.00 -0.33 0.00 0.00 177.00 174.55 1t03 n ALA 538 N 14.76 -0.57 -1.48 -1.55 0.00 -1.26 -2.71 120.51 127.69 1t03 n ALA 538 Ca 0.31 -0.38 -0.13 0.00 0.00 0.00 0.00 53.44 53.24 1t03 n ALA 538 Cb 0.52 -2.15 -0.05 0.00 0.00 0.00 0.00 19.45 17.78 1t03 n ALA 538 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1t03 n HIS 539 N -3.36 -0.08 0.03 0.00 8.25 -1.26 -4.84 115.22 113.96 1t03 n HIS 539 Ca 0.12 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.63 1t03 n HIS 539 Cb 0.51 -2.39 -0.08 0.00 1.12 0.00 0.00 29.99 29.15 1t03 n HIS 539 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1t03 n LYS 540 N -2.58 0.56 -0.33 -0.41 5.02 -1.10 -5.01 118.16 114.30 1t03 n LYS 540 Ca -0.13 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.07 1t03 n LYS 540 Cb 0.44 -1.22 0.00 0.00 -0.02 0.00 0.00 35.03 34.23 1t03 n LYS 540 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1t03 n GLY 541 N 1.87 0.82 3.70 0.72 0.00 -1.26 -5.05 105.19 105.99 1t03 n GLY 541 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1t03 n GLY 541 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1t03 n ILE 542 N -2.31 3.74 0.00 -0.61 -0.00 -1.26 -4.81 119.36 114.11 1t03 n ILE 542 Ca 0.00 -0.39 0.00 0.00 -0.00 0.00 0.00 62.75 62.36 1t03 n ILE 542 Cb 0.00 -1.34 0.00 0.00 -0.00 0.00 0.00 39.64 38.30 1t03 n ILE 542 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1t03 n GLY 543 N 0.84 0.00 0.70 7.39 0.00 -1.26 -2.16 105.19 110.70 1t03 n GLY 543 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1t03 n GLY 543 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t03 n GLY 544 N 0.00 0.10 0.07 -0.02 0.00 -1.26 -3.30 105.19 100.77 1t03 n GLY 544 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1t03 n GLY 544 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1t03 h ASN 545 N 1.31 0.00 -0.94 1.61 -0.00 -1.78 -3.38 115.58 112.40 1t03 h ASN 545 Ca 0.00 -0.00 0.25 0.00 -0.00 0.00 0.00 56.30 56.55 1t03 h ASN 545 Cb 0.04 0.00 -0.18 0.00 -0.00 0.00 0.00 38.32 38.19 1t03 h ASN 545 CO 0.00 0.69 -0.01 -0.62 -0.00 0.00 0.00 177.43 177.50 1t03 n GLU 546 N -4.66 -0.08 0.00 6.67 1.02 -1.21 -0.97 120.64 121.42 1t03 n GLU 546 Ca -0.05 1.41 0.00 0.00 -0.02 0.00 0.00 57.16 58.50 1t03 n GLU 546 Cb 0.20 -2.23 0.00 0.00 -0.02 0.00 0.00 31.44 29.39 1t03 n GLU 546 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1t03 n GLN 547 N -5.40 0.00 -0.33 3.49 3.00 -1.26 -0.93 117.38 115.94 1t03 n GLN 547 Ca 0.21 0.23 0.25 0.00 -0.01 0.00 0.00 57.00 57.68 1t03 n GLN 547 Cb 0.70 -0.81 0.54 0.00 0.00 0.00 0.00 30.24 30.66 1t03 n GLN 547 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.06 176.67 1t03 h VAL 548 N 0.00 0.49 0.28 5.09 -1.51 -1.57 -0.90 116.25 118.13 1t03 h VAL 548 Ca 0.00 -0.12 -0.00 0.00 -1.23 0.00 0.00 66.70 65.35 1t03 h VAL 548 Cb 0.00 0.12 -0.03 0.00 -2.13 0.00 0.00 31.29 29.25 1t03 h VAL 548 CO 0.00 0.06 -0.46 -0.78 -1.23 0.00 0.00 177.57 175.17 1t03 h ASP 549 N 0.34 -1.31 -0.53 4.19 3.58 -0.48 0.00 116.42 122.22 1t03 h ASP 549 Ca 0.61 0.12 0.02 0.00 0.42 0.00 0.00 57.03 58.20 1t03 h ASP 549 Cb 1.64 0.46 -0.03 0.00 1.72 0.00 0.00 39.33 43.11 1t03 h ASP 549 CO -0.28 -0.54 0.33 0.50 -2.88 0.00 0.00 179.24 176.36 1t03 h LYS 550 N -0.78 0.63 0.00 0.28 1.63 -0.16 0.46 116.57 118.63 1t03 h LYS 550 Ca -0.03 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1t03 h LYS 550 Cb 0.72 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.21 1t03 h LYS 550 CO -0.15 0.42 0.27 1.25 -3.45 0.00 0.00 179.45 177.79 1t03 h LEU 551 N 0.65 0.00 -0.84 5.20 5.85 -0.69 -0.28 115.31 125.21 1t03 h LEU 551 Ca 0.21 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1t03 h LEU 551 Cb -0.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.02 1t03 h LEU 551 CO -0.08 0.00 0.00 0.52 -0.34 0.00 0.00 178.44 178.54 1t03 n VAL 552 N -2.91 0.00 0.89 1.05 0.31 -0.06 -4.68 118.33 112.93 1t03 n VAL 552 Ca -0.02 -0.49 -0.01 0.00 -0.01 0.00 0.00 64.34 63.82 1t03 n VAL 552 Cb 0.32 1.02 0.01 0.00 -0.91 0.00 0.00 33.84 34.29 1t03 n VAL 552 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1t03 n SER 553 N -0.14 2.26 -4.50 4.52 7.64 0.14 -4.67 113.62 118.88 1t03 n SER 553 Ca 0.00 -2.07 -0.42 0.00 1.01 0.00 0.00 58.87 57.39 1t03 n SER 553 Cb 0.01 -0.51 -0.03 0.00 -1.01 0.00 0.00 64.21 62.66 1t03 n SER 553 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1t03 s ALA 554 N -0.58 3.04 0.00 -0.43 0.00 -1.26 -3.92 121.76 118.61 1t03 s ALA 554 Ca 0.03 -2.38 0.00 0.00 0.00 0.00 0.00 51.96 49.61 1t03 s ALA 554 Cb 0.02 -4.23 0.00 0.00 0.00 0.00 0.00 23.12 18.91 1t03 s ALA 554 CO 0.01 -3.23 0.00 0.41 0.00 0.00 0.00 175.76 172.94 1t03 n GLY 555 N 6.02 0.76 0.06 0.00 0.00 -1.26 -4.89 105.19 105.87 1t03 n GLY 555 Ca 0.23 -0.66 0.04 0.00 0.00 0.00 0.00 46.02 45.63 1t03 n GLY 555 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1t03 n ILE 556 N 0.00 1.17 -3.57 -0.61 3.06 -1.25 -4.73 119.36 113.43 1t03 n ILE 556 Ca 0.00 -1.30 -0.05 0.00 -2.50 0.00 0.00 62.75 58.89 1t03 n ILE 556 Cb 0.00 0.28 -0.02 0.00 0.54 0.00 0.00 39.64 40.44 1t03 n ILE 556 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 1t03 s ARG 557 N -1.52 0.52 0.00 9.51 0.52 -1.26 -5.12 118.95 121.60 1t03 s ARG 557 Ca 0.11 -0.20 0.00 0.00 -0.52 0.00 0.00 55.73 55.12 1t03 s ARG 557 Cb 0.10 0.23 0.00 0.00 0.52 0.00 0.00 34.95 35.80 1t03 s ARG 557 CO 0.01 -0.23 0.00 0.36 0.02 0.00 0.00 175.30 175.46