#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xdm h LEU 2 N 0.00 0.76 -1.15 0.55 6.46 -1.99 -2.77 115.31 117.16 2xdm h LEU 2 Ca 0.00 -0.46 0.06 0.00 -0.12 0.00 0.00 57.88 57.36 2xdm h LEU 2 Cb 0.00 -0.21 -0.06 0.00 -0.73 0.00 0.00 40.66 39.66 2xdm h LEU 2 CO 0.00 1.07 0.58 0.71 -0.62 0.00 0.00 178.44 180.18 2xdm h THR 3 N 0.47 1.07 0.02 1.05 1.35 -2.00 -2.32 112.91 112.55 2xdm h THR 3 Ca 0.05 -0.35 -0.21 0.00 -0.55 0.00 0.00 66.41 65.35 2xdm h THR 3 Cb 0.84 -0.04 -0.02 0.00 -1.73 0.00 0.00 68.15 67.20 2xdm h THR 3 CO 0.07 0.19 -0.95 -0.08 -0.25 0.00 0.00 175.52 174.49 2xdm h GLU 4 N 1.03 0.13 -0.33 4.72 4.81 -1.99 -2.96 114.58 119.98 2xdm h GLU 4 Ca 0.38 -0.17 -0.07 0.00 -0.13 0.00 0.00 59.36 59.38 2xdm h GLU 4 Cb 0.18 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 2xdm h GLU 4 CO -0.14 0.98 -0.08 1.25 -0.73 0.00 0.00 179.01 180.29 2xdm h LEU 5 N 0.06 0.52 -0.27 1.64 5.85 -1.16 -0.83 115.31 121.12 2xdm h LEU 5 Ca -0.04 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.48 2xdm h LEU 5 Cb 1.63 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.52 2xdm h LEU 5 CO 0.14 0.65 -0.12 0.03 -0.34 0.00 0.00 178.44 178.80 2xdm h ARG 6 N 0.51 0.55 -0.87 1.25 3.08 -1.41 -1.92 114.38 115.57 2xdm h ARG 6 Ca 0.10 -0.24 0.06 0.00 0.07 0.00 0.00 59.98 59.97 2xdm h ARG 6 Cb 0.46 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.43 2xdm h ARG 6 CO 0.02 0.80 0.55 0.93 -1.07 0.00 0.00 179.97 181.19 2xdm h GLU 7 N 0.29 0.98 -0.36 0.04 5.08 -1.33 -0.94 114.58 118.33 2xdm h GLU 7 Ca 0.06 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 2xdm h GLU 7 Cb 0.63 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2xdm h GLU 7 CO 0.04 0.65 -0.24 -0.44 -1.00 0.00 0.00 179.01 178.01 2xdm h ASP 8 N 1.00 0.84 0.13 1.42 3.32 -1.02 -1.76 116.42 120.35 2xdm h ASP 8 Ca 0.37 -0.43 -0.18 0.00 0.02 0.00 0.00 57.03 56.81 2xdm h ASP 8 Cb 0.14 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.46 2xdm h ASP 8 CO -0.16 1.09 -0.68 0.40 -1.72 0.00 0.00 179.24 178.17 2xdm h ILE 9 N 0.59 1.35 -0.33 0.35 2.04 -1.26 -1.68 117.51 118.57 2xdm h ILE 9 Ca 0.07 -2.01 0.07 0.00 1.00 0.00 0.00 64.86 64.00 2xdm h ILE 9 Cb 0.81 1.99 -0.07 0.00 -0.74 0.00 0.00 36.82 38.80 2xdm h ILE 9 CO 0.07 0.61 -0.16 0.44 0.00 0.00 0.00 178.15 179.11 2xdm h ASP 10 N 0.36 -0.53 -0.62 1.72 3.45 -1.09 -0.66 116.42 119.05 2xdm h ASP 10 Ca -0.02 0.13 -0.08 0.00 0.43 0.00 0.00 57.03 57.48 2xdm h ASP 10 Cb 1.25 0.29 -0.02 0.00 -0.56 0.00 0.00 39.33 40.29 2xdm h ASP 10 CO 0.12 -0.19 0.07 0.00 -1.57 0.00 0.00 179.24 177.67 2xdm h ALA 11 N 1.15 0.82 -0.66 3.45 0.00 -1.20 -2.56 119.26 120.26 2xdm h ALA 11 Ca 0.17 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2xdm h ALA 11 Cb 0.36 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2xdm h ALA 11 CO -0.40 0.61 0.41 0.82 0.00 0.00 0.00 179.25 180.69 2xdm h ILE 12 N 0.95 1.19 0.00 0.00 2.04 -1.00 -2.12 117.51 118.57 2xdm h ILE 12 Ca 0.18 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2xdm h ILE 12 Cb 0.48 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2xdm h ILE 12 CO 0.02 0.20 0.00 0.18 0.00 0.00 0.00 178.15 178.54 2xdm n LEU 13 N -4.58 0.00 0.00 1.44 4.77 -0.28 -2.62 117.00 115.73 2xdm n LEU 13 Ca 0.05 0.47 0.05 0.00 -0.03 0.00 0.00 56.01 56.55 2xdm n LEU 13 Cb 0.05 -0.47 0.27 0.00 -2.33 0.00 0.00 43.42 40.94 2xdm n LEU 13 CO 0.36 -0.09 0.67 -0.62 -1.33 0.00 0.00 177.39 176.38 2xdm n GLU 14 N -1.47 0.98 -1.86 3.23 -0.58 -0.80 -4.88 120.64 115.26 2xdm n GLU 14 Ca 0.06 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.39 2xdm n GLU 14 Cb 0.26 -1.15 -0.02 0.00 -0.57 0.00 0.00 31.44 29.97 2xdm n GLU 14 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2xdm s ASP 15 N -1.30 6.47 0.60 1.62 2.15 -1.08 -4.91 116.67 120.22 2xdm s ASP 15 Ca 0.14 2.87 0.28 0.00 0.43 0.00 0.00 52.55 56.27 2xdm s ASP 15 Cb 0.06 -2.64 1.33 0.00 -0.30 0.00 0.00 42.92 41.38 2xdm s ASP 15 CO 0.11 -0.83 1.74 1.55 -0.17 0.00 0.00 175.17 177.57 2xdm h PRO 16 N 4.61 0.00 0.00 4.34 0.13 -1.93 -1.95 132.00 137.20 2xdm h PRO 16 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2xdm h PRO 16 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2xdm h PRO 16 CO 0.76 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.53 2xdm h ALA 17 N 1.20 1.00 -0.53 -0.56 0.00 -1.97 -2.90 119.26 115.50 2xdm h ALA 17 Ca 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2xdm h ALA 17 Cb 1.57 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 2xdm h ALA 17 CO -0.00 0.00 0.03 1.28 0.00 0.00 0.00 179.25 180.56 2xdm n LEU 18 N -3.01 5.24 -4.67 0.00 4.77 -0.73 -4.55 117.00 114.04 2xdm n LEU 18 Ca 0.01 -2.67 -0.42 0.00 -0.03 0.00 0.00 56.01 52.90 2xdm n LEU 18 Cb 0.32 -0.67 -0.03 0.00 -2.33 0.00 0.00 43.42 40.71 2xdm n LEU 18 CO 0.27 0.60 1.44 -0.70 -1.33 0.00 0.00 177.39 177.67 2xdm s GLU 19 N -2.57 4.17 -0.09 3.23 2.56 -1.10 -2.08 118.70 122.81 2xdm s GLU 19 Ca 0.48 2.41 0.00 0.00 0.00 0.00 0.00 54.97 57.86 2xdm s GLU 19 Cb 0.37 -3.88 0.00 0.00 2.00 0.00 0.00 34.13 32.62 2xdm s GLU 19 CO 0.14 -0.85 0.00 0.41 -0.56 0.00 0.00 175.26 174.40 2xdm n GLY 20 N 4.23 0.45 3.88 -1.50 0.00 -1.26 -4.27 105.19 106.72 2xdm n GLY 20 Ca 0.18 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 2xdm n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdm s ALA 21 N -1.84 3.89 -0.17 4.61 0.00 -0.88 -4.35 121.76 123.01 2xdm s ALA 21 Ca 0.00 -0.77 -0.12 0.00 0.00 0.00 0.00 51.96 51.08 2xdm s ALA 21 Cb 0.00 -1.84 -0.05 0.00 0.00 0.00 0.00 23.12 21.23 2xdm s ALA 21 CO 0.00 0.73 0.21 0.08 0.00 0.00 0.00 175.76 176.78 2xdm s VAL 22 N -1.27 5.36 -0.19 0.00 1.01 -0.02 -4.93 120.40 120.36 2xdm s VAL 22 Ca 0.25 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.61 2xdm s VAL 22 Cb -0.12 -3.54 0.05 0.00 0.00 0.00 0.00 36.38 32.76 2xdm s VAL 22 CO 0.16 0.44 -0.06 -0.44 0.00 0.00 0.00 175.10 175.20 2xdm s SER 23 N 0.20 3.24 -0.36 3.32 0.01 -1.26 -1.36 113.70 117.50 2xdm s SER 23 Ca 0.13 -0.86 -0.25 0.00 1.31 0.00 0.00 55.95 56.28 2xdm s SER 23 Cb -0.12 -1.05 0.01 0.00 0.21 0.00 0.00 66.02 65.07 2xdm s SER 23 CO 0.02 -0.19 0.87 -0.83 0.41 0.00 0.00 173.24 173.52 2xdm s GLY 24 N 1.52 1.61 -0.13 3.44 0.00 0.51 -4.54 107.32 109.73 2xdm s GLY 24 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 44.72 44.22 2xdm s GLY 24 CO -0.07 1.91 -0.11 0.14 0.00 0.00 0.00 173.10 174.97 2xdm s VAL 25 N 3.30 1.32 -0.02 1.40 1.01 -0.22 -0.61 120.40 126.58 2xdm s VAL 25 Ca 0.36 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.87 2xdm s VAL 25 Cb -0.13 -1.28 0.01 0.00 0.00 0.00 0.00 36.38 34.99 2xdm s VAL 25 CO 0.17 0.42 -0.05 -0.69 0.00 0.00 0.00 175.10 174.95 2xdm s VAL 26 N 1.55 0.44 -0.04 2.92 1.01 -0.74 -0.27 120.40 125.27 2xdm s VAL 26 Ca 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2xdm s VAL 26 Cb -0.13 -0.42 0.03 0.00 0.00 0.00 0.00 36.38 35.85 2xdm s VAL 26 CO -0.09 0.16 -0.00 -0.69 0.00 0.00 0.00 175.10 174.48 2xdm s VAL 27 N 0.33 0.22 -0.03 2.92 1.01 0.67 -1.45 120.40 124.09 2xdm s VAL 27 Ca -0.04 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.04 2xdm s VAL 27 Cb -0.08 -0.33 0.01 0.00 0.00 0.00 0.00 36.38 35.99 2xdm s VAL 27 CO -0.00 0.17 -0.06 -0.69 0.00 0.00 0.00 175.10 174.52 2xdm s VAL 28 N 1.17 0.57 -0.18 2.92 1.01 -0.47 -0.20 120.40 125.23 2xdm s VAL 28 Ca -0.08 -0.22 -0.29 0.00 0.00 0.00 0.00 61.98 61.39 2xdm s VAL 28 Cb -0.13 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.69 2xdm s VAL 28 CO -0.02 0.20 1.32 -0.62 0.00 0.00 0.00 175.10 175.98 2xdm s ASP 29 N 0.40 6.86 0.12 3.32 3.68 0.34 -0.96 116.67 130.42 2xdm s ASP 29 Ca -0.05 1.67 0.26 0.00 2.13 0.00 0.00 52.55 56.56 2xdm s ASP 29 Cb -0.09 -2.54 0.77 0.00 -1.45 0.00 0.00 42.92 39.61 2xdm s ASP 29 CO 0.00 -0.84 1.67 1.07 0.13 0.00 0.00 175.17 177.20 2xdm n THR 30 N 5.54 0.33 -0.06 1.71 5.66 -0.04 -0.69 114.28 126.73 2xdm n THR 30 Ca 0.14 -0.18 -0.05 0.00 -3.05 0.00 0.00 64.05 60.91 2xdm n THR 30 Cb 0.45 -0.37 -0.05 0.00 -1.55 0.00 0.00 70.33 68.82 2xdm n THR 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2xdm h ALA 31 N 2.69 0.01 0.11 1.79 0.00 -1.91 -3.40 119.26 118.55 2xdm h ALA 31 Ca 0.00 -0.22 -0.27 0.00 0.00 0.00 0.00 54.91 54.42 2xdm h ALA 31 Cb 0.66 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2xdm h ALA 31 CO 0.00 0.04 -1.21 1.79 0.00 0.00 0.00 179.25 179.87 2xdm h THR 32 N -1.00 1.52 0.00 0.00 1.35 -1.94 -3.47 112.91 109.36 2xdm h THR 32 Ca -0.01 -3.09 0.00 0.00 -0.55 0.00 0.00 66.41 62.76 2xdm h THR 32 Cb 0.39 2.93 0.00 0.00 -1.73 0.00 0.00 68.15 69.74 2xdm h THR 32 CO -0.01 0.90 0.00 0.61 -0.25 0.00 0.00 175.52 176.77 2xdm n GLY 33 N 1.50 0.59 3.71 5.82 0.00 0.14 -5.05 105.19 111.90 2xdm n GLY 33 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2xdm n GLY 33 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2xdm s GLU 34 N -0.85 4.18 -0.44 1.61 2.12 -1.19 -4.77 118.70 119.36 2xdm s GLU 34 Ca 0.00 2.45 -0.29 0.00 0.36 0.00 0.00 54.97 57.49 2xdm s GLU 34 Cb 0.00 -3.32 0.03 0.00 0.26 0.00 0.00 34.13 31.10 2xdm s GLU 34 CO 0.00 -0.71 1.13 -2.00 -0.54 0.00 0.00 175.26 173.14 2xdm s GLU 35 N 1.78 3.81 0.04 4.30 2.12 -1.26 -0.50 118.70 128.98 2xdm s GLU 35 Ca 0.74 0.70 0.12 0.00 0.36 0.00 0.00 54.97 56.89 2xdm s GLU 35 Cb -0.45 -3.87 -0.19 0.00 0.26 0.00 0.00 34.13 29.89 2xdm s GLU 35 CO 0.33 -1.27 0.90 -0.07 -0.54 0.00 0.00 175.26 174.61 2xdm h LEU 36 N 10.96 0.00 -7.12 2.70 3.38 -0.94 -3.47 115.31 120.81 2xdm h LEU 36 Ca -0.22 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.68 2xdm h LEU 36 Cb 1.06 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.59 2xdm h LEU 36 CO 1.10 0.88 -0.02 -0.47 0.09 0.00 0.00 178.44 180.02 2xdm s TYR 37 N -2.71 -0.69 -0.16 1.13 6.14 -1.04 -4.84 117.35 115.17 2xdm s TYR 37 Ca -0.02 1.64 -0.09 0.00 0.64 0.00 0.00 57.07 59.24 2xdm s TYR 37 Cb 0.09 0.26 0.06 0.00 0.42 0.00 0.00 41.96 42.78 2xdm s TYR 37 CO 0.82 -0.34 0.39 0.45 0.64 0.00 0.00 175.55 177.51 2xdm s SER 38 N 0.48 -0.48 -0.17 4.32 0.15 -1.25 -0.24 113.70 116.51 2xdm s SER 38 Ca -0.01 0.85 -0.07 0.00 0.70 0.00 0.00 55.95 57.42 2xdm s SER 38 Cb -0.04 0.73 0.08 0.00 -1.71 0.00 0.00 66.02 65.08 2xdm s SER 38 CO -0.02 -0.19 0.37 -0.60 1.20 0.00 0.00 173.24 174.01 2xdm s ARG 39 N 1.40 0.28 -1.65 5.44 3.52 0.62 -4.88 118.95 123.69 2xdm s ARG 39 Ca -0.09 0.92 -0.17 0.00 -0.13 0.00 0.00 55.73 56.26 2xdm s ARG 39 Cb -0.09 0.18 0.13 0.00 -1.56 0.00 0.00 34.95 33.62 2xdm s ARG 39 CO -0.12 -0.25 0.85 -0.25 -0.81 0.00 0.00 175.30 174.72 2xdm n ASP 40 N 5.22 -3.77 0.24 -2.12 8.00 -1.26 -1.06 116.55 121.80 2xdm n ASP 40 Ca -0.10 -0.93 0.08 0.00 0.71 0.00 0.00 54.79 54.55 2xdm n ASP 40 Cb 0.50 -3.14 0.60 0.00 -0.02 0.00 0.00 41.12 39.07 2xdm n ASP 40 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2xdm h GLY 41 N -1.70 0.00 -1.90 0.44 0.00 -1.90 -2.44 103.07 95.57 2xdm h GLY 41 Ca -0.59 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.74 2xdm h GLY 41 CO 0.74 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.89 2xdm n GLY 42 N -0.85 2.33 3.74 4.60 0.00 -1.26 -0.46 105.19 113.29 2xdm n GLY 42 Ca -0.02 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 2xdm n GLY 42 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2xdm s GLU 43 N -1.06 4.60 -0.26 1.61 2.56 -0.92 -4.95 118.70 120.28 2xdm s GLU 43 Ca 0.34 1.75 -0.22 0.00 0.00 0.00 0.00 54.97 56.83 2xdm s GLU 43 Cb 0.18 -3.25 -0.01 0.00 2.00 0.00 0.00 34.13 33.05 2xdm s GLU 43 CO 0.24 0.10 0.73 -0.65 -0.56 0.00 0.00 175.26 175.13 2xdm s GLN 44 N -0.62 4.11 0.05 4.30 -0.21 -1.26 -4.23 119.66 121.81 2xdm s GLN 44 Ca 0.48 0.71 0.02 0.00 0.02 0.00 0.00 55.36 56.59 2xdm s GLN 44 Cb -0.30 -3.66 -0.03 0.00 1.00 0.00 0.00 33.01 30.02 2xdm s GLN 44 CO 0.36 -0.50 -0.07 -0.51 -2.12 0.00 0.00 175.29 172.45 2xdm s LEU 45 N 2.71 2.32 0.18 2.90 1.43 0.52 -4.92 118.68 123.82 2xdm s LEU 45 Ca 0.31 -0.67 -0.31 0.00 -1.03 0.00 0.00 54.13 52.43 2xdm s LEU 45 Cb -0.15 -0.11 -0.10 0.00 0.03 0.00 0.00 46.19 45.86 2xdm s LEU 45 CO 0.09 -0.29 1.49 -0.76 0.23 0.00 0.00 176.35 177.11 2xdm s LEU 46 N -1.96 4.38 0.00 1.79 1.43 -1.26 -0.33 118.68 122.73 2xdm s LEU 46 Ca -0.05 2.58 0.23 0.00 -1.03 0.00 0.00 54.13 55.86 2xdm s LEU 46 Cb -0.06 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.59 2xdm s LEU 46 CO -0.01 -0.75 1.09 -0.81 0.23 0.00 0.00 176.35 176.09 2xdm n PRO 47 N 3.44 0.26 0.00 1.29 -0.04 -1.26 -4.80 135.00 133.89 2xdm n PRO 47 Ca 0.11 -0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2xdm n PRO 47 Cb 0.40 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 2xdm n PRO 47 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2xdm n ALA 48 N -1.20 0.00 1.51 0.55 0.00 -1.26 -1.69 120.51 118.42 2xdm n ALA 48 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.63 2xdm n ALA 48 Cb 0.36 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.55 2xdm n ALA 48 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2xdm n SER 49 N 2.81 0.00 0.24 0.00 7.64 -1.26 -2.53 113.62 120.52 2xdm n SER 49 Ca 0.00 -0.52 0.16 0.00 1.01 0.00 0.00 58.87 59.52 2xdm n SER 49 Cb 0.00 -0.13 0.86 0.00 -1.01 0.00 0.00 64.21 63.93 2xdm n SER 49 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 2xdm h ASN 50 N 0.00 0.00 0.03 6.43 4.21 -1.30 -1.82 115.58 123.13 2xdm h ASN 50 Ca 0.00 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.49 2xdm h ASN 50 Cb 0.11 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.31 2xdm h ASN 50 CO 0.00 0.00 -0.06 -0.03 -1.29 0.00 0.00 177.43 176.05 2xdm h MET 51 N 0.00 0.09 -0.10 0.81 4.05 -1.67 -2.16 114.93 115.95 2xdm h MET 51 Ca 0.00 -0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.44 2xdm h MET 51 Cb 0.01 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 30.79 2xdm h MET 51 CO 0.00 0.16 0.11 0.87 0.23 0.00 0.00 176.91 178.27 2xdm h LYS 52 N 0.09 0.00 -0.62 0.39 1.57 -1.40 -2.42 116.57 114.18 2xdm h LYS 52 Ca 0.02 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 2xdm h LYS 52 Cb 0.16 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.43 2xdm h LYS 52 CO 0.01 0.00 0.35 -0.07 -0.57 0.00 0.00 179.45 179.16 2xdm h LEU 53 N 0.00 0.52 -0.25 2.94 3.38 -1.57 0.78 115.31 121.11 2xdm h LEU 53 Ca 0.05 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.89 2xdm h LEU 53 Cb 0.26 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2xdm h LEU 53 CO -0.00 0.35 -0.43 -0.26 0.09 0.00 0.00 178.44 178.19 2xdm h PHE 54 N 0.66 0.92 0.13 1.13 -1.00 -1.60 -2.78 116.94 114.38 2xdm h PHE 54 Ca 0.27 -0.32 -0.00 0.00 2.81 0.00 0.00 57.97 60.72 2xdm h PHE 54 Cb 0.13 -0.18 -0.00 0.00 3.61 0.00 0.00 35.95 39.51 2xdm h PHE 54 CO -0.08 1.10 -0.07 1.15 -1.61 0.00 0.00 178.31 178.80 2xdm h THR 55 N 0.47 0.85 -0.60 -1.55 2.02 -1.41 -2.13 112.91 110.56 2xdm h THR 55 Ca 0.02 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.25 2xdm h THR 55 Cb 1.03 0.85 -0.05 0.00 -1.74 0.00 0.00 68.15 68.24 2xdm h THR 55 CO 0.10 0.00 0.32 0.00 0.37 0.00 0.00 175.52 176.31 2xdm h ALA 56 N 0.68 0.78 -0.56 6.16 0.00 -0.88 -0.42 119.26 125.03 2xdm h ALA 56 Ca -0.01 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2xdm h ALA 56 Cb 0.15 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2xdm h ALA 56 CO 0.02 -0.01 0.18 0.00 0.00 0.00 0.00 179.25 179.43 2xdm h ALA 57 N 1.32 0.73 -0.20 0.00 0.00 -1.48 -2.07 119.26 117.56 2xdm h ALA 57 Ca 0.27 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 2xdm h ALA 57 Cb 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2xdm h ALA 57 CO -0.17 0.39 -0.45 0.00 0.00 0.00 0.00 179.25 179.02 2xdm h ALA 58 N 1.04 0.86 -0.50 0.00 0.00 -1.07 -1.97 119.26 117.62 2xdm h ALA 58 Ca 0.18 -0.46 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 2xdm h ALA 58 Cb 0.27 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2xdm h ALA 58 CO -0.01 0.65 -0.14 0.00 0.00 0.00 0.00 179.25 179.75 2xdm h ALA 59 N 1.12 0.80 -0.34 0.00 0.00 -0.94 0.10 119.26 120.00 2xdm h ALA 59 Ca 0.03 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 2xdm h ALA 59 Cb 0.94 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2xdm h ALA 59 CO 0.08 0.66 -0.17 -0.07 0.00 0.00 0.00 179.25 179.75 2xdm h LEU 60 N 0.85 0.62 -0.13 0.00 3.38 -1.28 0.22 115.31 118.97 2xdm h LEU 60 Ca 0.13 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 2xdm h LEU 60 Cb 0.70 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 2xdm h LEU 60 CO 0.05 0.81 -0.19 -0.33 0.09 0.00 0.00 178.44 178.87 2xdm h GLU 61 N 0.57 0.35 0.01 1.13 4.39 -1.07 -1.68 114.58 118.27 2xdm h GLU 61 Ca 0.09 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 2xdm h GLU 61 Cb 0.61 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 2xdm h GLU 61 CO 0.04 0.79 -0.01 0.28 -1.16 0.00 0.00 179.01 178.95 2xdm h VAL 62 N -0.06 1.41 0.06 3.13 2.07 -0.77 -3.39 116.25 118.70 2xdm h VAL 62 Ca 0.01 -1.95 -0.32 0.00 0.82 0.00 0.00 66.70 65.27 2xdm h VAL 62 Cb 0.75 2.61 -0.03 0.00 -1.52 0.00 0.00 31.29 33.10 2xdm h VAL 62 CO 0.04 0.46 -1.78 -0.07 0.02 0.00 0.00 177.57 176.24 2xdm h LEU 63 N -0.95 0.20 0.00 2.57 3.38 -0.75 -3.50 115.31 116.26 2xdm h LEU 63 Ca -0.00 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2xdm h LEU 63 Cb 0.76 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2xdm h LEU 63 CO 0.00 1.36 0.00 0.61 0.09 0.00 0.00 178.44 180.51 2xdm n GLY 64 N 1.72 -0.18 0.15 0.83 0.00 -0.63 -4.18 105.19 102.90 2xdm n GLY 64 Ca -0.22 -1.58 0.12 0.00 0.00 0.00 0.00 46.02 44.34 2xdm n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdm h ALA 65 N 0.00 1.00 -0.00 4.61 0.00 -1.88 -2.72 119.26 120.26 2xdm h ALA 65 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2xdm h ALA 65 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2xdm h ALA 65 CO 0.00 0.00 -0.43 -0.40 0.00 0.00 0.00 179.25 178.42 2xdm n ASP 66 N -2.31 0.87 -4.72 0.00 5.68 -1.26 -2.98 116.55 111.83 2xdm n ASP 66 Ca 0.01 -0.67 -0.42 0.00 -0.50 0.00 0.00 54.79 53.21 2xdm n ASP 66 Cb 0.16 0.28 -0.03 0.00 -1.14 0.00 0.00 41.12 40.39 2xdm n ASP 66 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 2xdm s HIS 67 N -2.75 3.36 0.44 2.11 2.46 -1.03 -4.68 115.29 115.20 2xdm s HIS 67 Ca 0.17 1.18 0.04 0.00 0.47 0.00 0.00 55.06 56.92 2xdm s HIS 67 Cb 0.18 -3.53 -0.04 0.00 -0.13 0.00 0.00 32.58 29.06 2xdm s HIS 67 CO 0.63 -1.71 0.03 -1.54 -2.47 0.00 0.00 174.74 169.67 2xdm s SER 68 N 0.95 3.69 0.07 9.88 1.04 -1.26 0.28 113.70 128.34 2xdm s SER 68 Ca 0.60 -1.52 0.08 0.00 0.48 0.00 0.00 55.95 55.58 2xdm s SER 68 Cb -0.33 0.12 -0.03 0.00 0.10 0.00 0.00 66.02 65.88 2xdm s SER 68 CO 0.31 -0.69 -0.21 -0.36 0.98 0.00 0.00 173.24 173.27 2xdm s PHE 69 N -2.90 1.79 0.11 5.02 0.40 -1.26 -4.94 117.98 116.19 2xdm s PHE 69 Ca 0.22 -0.39 0.09 0.00 -0.60 0.00 0.00 56.93 56.25 2xdm s PHE 69 Cb 0.06 -1.03 -0.04 0.00 0.51 0.00 0.00 43.02 42.52 2xdm s PHE 69 CO 0.11 0.14 -0.20 0.20 0.70 0.00 0.00 175.22 176.17 2xdm s GLY 70 N -1.50 1.65 -0.01 4.36 0.00 -1.26 -0.05 107.32 110.52 2xdm s GLY 70 Ca 0.07 -1.37 0.04 0.00 0.00 0.00 0.00 44.72 43.46 2xdm s GLY 70 CO 0.03 -1.34 -0.13 -1.59 0.00 0.00 0.00 173.10 170.06 2xdm s THR 71 N -1.10 1.06 0.09 0.90 2.01 -0.36 -1.28 115.64 116.95 2xdm s THR 71 Ca 0.17 -0.60 -0.05 0.00 0.31 0.00 0.00 61.69 61.52 2xdm s THR 71 Cb -0.10 -0.89 -0.02 0.00 0.01 0.00 0.00 72.50 71.50 2xdm s THR 71 CO 0.09 0.28 0.11 -1.83 -0.69 0.00 0.00 174.62 172.58 2xdm s GLU 72 N -0.36 0.81 -0.08 4.92 -1.05 -0.12 0.03 118.70 122.84 2xdm s GLU 72 Ca 0.05 -1.13 0.04 0.00 -0.15 0.00 0.00 54.97 53.78 2xdm s GLU 72 Cb -0.05 0.29 -0.01 0.00 -0.44 0.00 0.00 34.13 33.91 2xdm s GLU 72 CO -0.00 -0.23 -0.19 0.08 0.95 0.00 0.00 175.26 175.86 2xdm s VAL 73 N -3.91 2.53 -0.04 1.83 1.01 0.13 0.03 120.40 121.99 2xdm s VAL 73 Ca 0.09 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 2xdm s VAL 73 Cb 0.06 -1.99 0.03 0.00 0.00 0.00 0.00 36.38 34.48 2xdm s VAL 73 CO -0.08 0.56 0.03 0.00 0.00 0.00 0.00 175.10 175.61 2xdm s ALA 74 N -0.05 0.28 0.28 5.51 0.00 0.75 -0.53 121.76 128.00 2xdm s ALA 74 Ca -0.05 0.17 0.09 0.00 0.00 0.00 0.00 51.96 52.17 2xdm s ALA 74 Cb -0.14 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 2xdm s ALA 74 CO 0.04 -0.29 0.05 0.00 0.00 0.00 0.00 175.76 175.56 2xdm s ALA 75 N 1.60 3.28 0.35 0.00 0.00 -0.58 -0.99 121.76 125.42 2xdm s ALA 75 Ca -0.02 -1.68 0.05 0.00 0.00 0.00 0.00 51.96 50.32 2xdm s ALA 75 Cb -0.13 -0.81 0.64 0.00 0.00 0.00 0.00 23.12 22.83 2xdm s ALA 75 CO -0.03 0.21 1.89 1.49 0.00 0.00 0.00 175.76 179.31 2xdm h GLU 76 N 1.77 0.47 -3.56 0.00 4.81 -1.86 0.14 114.58 116.34 2xdm h GLU 76 Ca -0.44 -0.10 -0.06 0.00 -0.13 0.00 0.00 59.36 58.62 2xdm h GLU 76 Cb 1.25 -0.07 -0.12 0.00 0.63 0.00 0.00 28.75 30.44 2xdm h GLU 76 CO 0.61 0.51 -0.15 -1.54 -0.73 0.00 0.00 179.01 177.71 2xdm s SER 77 N -6.77 -0.11 0.91 1.04 1.04 -1.26 -4.15 113.70 104.39 2xdm s SER 77 Ca -0.07 -0.58 -0.10 0.00 0.48 0.00 0.00 55.95 55.68 2xdm s SER 77 Cb 0.15 0.48 0.14 0.00 0.10 0.00 0.00 66.02 66.89 2xdm s SER 77 CO 0.76 -0.91 1.14 0.00 0.98 0.00 0.00 173.24 175.21 2xdm n ALA 78 N -0.24 -0.76 -1.64 5.32 0.00 -1.26 -4.85 120.51 117.07 2xdm n ALA 78 Ca -0.11 -0.54 -0.33 0.00 0.00 0.00 0.00 53.44 52.46 2xdm n ALA 78 Cb 0.63 -2.20 0.02 0.00 0.00 0.00 0.00 19.45 17.90 2xdm n ALA 78 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2xdm s PRO 79 N -4.57 3.19 0.00 0.00 0.04 -1.26 -4.89 135.00 127.51 2xdm s PRO 79 Ca 0.68 1.34 0.00 0.00 0.04 0.00 0.00 61.00 63.05 2xdm s PRO 79 Cb -0.24 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.30 2xdm s PRO 79 CO 0.57 -0.93 0.00 0.41 0.04 0.00 0.00 177.00 177.09 2xdm n GLY 80 N -0.60 -1.50 0.19 0.56 0.00 -1.23 -4.74 105.19 97.86 2xdm n GLY 80 Ca 0.10 -1.56 -0.00 0.00 0.00 0.00 0.00 46.02 44.55 2xdm n GLY 80 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2xdm h ARG 81 N 0.00 0.13 0.00 1.61 -0.00 -1.95 -2.66 114.38 111.51 2xdm h ARG 81 Ca 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 59.98 59.92 2xdm h ARG 81 Cb 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.97 2xdm h ARG 81 CO 0.00 0.52 0.00 0.00 -0.00 0.00 0.00 179.97 180.49 2xdm h ARG 82 N 0.11 0.00 -2.20 0.08 2.47 -1.94 -3.47 114.38 109.43 2xdm h ARG 82 Ca 0.01 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.59 2xdm h ARG 82 Cb 0.78 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 29.13 2xdm h ARG 82 CO 0.06 0.00 -0.22 0.41 0.56 0.00 0.00 179.97 180.78 2xdm n GLY 83 N 0.41 0.35 3.32 0.04 0.00 -1.00 -4.76 105.19 103.54 2xdm n GLY 83 Ca 0.02 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 2xdm n GLY 83 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2xdm s GLU 84 N -5.15 3.09 0.36 1.61 2.02 -1.26 -0.51 118.70 118.86 2xdm s GLU 84 Ca 0.15 -0.78 0.08 0.00 0.02 0.00 0.00 54.97 54.44 2xdm s GLU 84 Cb -0.06 -2.44 -0.05 0.00 0.10 0.00 0.00 34.13 31.68 2xdm s GLU 84 CO 0.18 0.26 0.10 0.14 0.02 0.00 0.00 175.26 175.96 2xdm s VAL 85 N 0.19 2.62 0.00 2.63 -7.23 -1.02 -3.52 120.40 114.06 2xdm s VAL 85 Ca -0.11 -1.82 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 2xdm s VAL 85 Cb -0.16 -2.91 0.00 0.00 0.56 0.00 0.00 36.38 33.87 2xdm s VAL 85 CO 0.06 -0.13 0.00 0.00 -0.31 0.00 0.00 175.10 174.72 2xdm n GLN 86 N -1.09 0.00 -3.05 4.82 1.13 -1.26 -1.61 117.38 116.32 2xdm n GLN 86 Ca -0.03 0.00 -0.34 0.00 -1.94 0.00 0.00 57.00 54.69 2xdm n GLN 86 Cb 0.63 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.92 2xdm n GLN 86 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2xdm s ASP 87 N -1.00 6.93 0.07 1.08 1.01 -1.26 -0.41 116.67 123.09 2xdm s ASP 87 Ca 0.00 1.43 0.09 0.00 0.71 0.00 0.00 52.55 54.78 2xdm s ASP 87 Cb 0.00 -2.43 -0.03 0.00 1.01 0.00 0.00 42.92 41.47 2xdm s ASP 87 CO 0.00 -0.15 -0.24 -0.22 0.21 0.00 0.00 175.17 174.77 2xdm s LEU 88 N -2.65 2.22 -0.13 1.23 0.20 -0.54 -4.43 118.68 114.58 2xdm s LEU 88 Ca 0.52 -0.61 0.01 0.00 0.69 0.00 0.00 54.13 54.74 2xdm s LEU 88 Cb -0.13 -1.12 0.02 0.00 -0.43 0.00 0.00 46.19 44.53 2xdm s LEU 88 CO 0.18 0.18 -0.17 -0.31 -0.29 0.00 0.00 176.35 175.95 2xdm s TYR 89 N -0.90 2.27 -0.31 5.38 1.51 -0.16 -0.94 117.35 124.19 2xdm s TYR 89 Ca 0.10 -1.17 -0.22 0.00 -1.01 0.00 0.00 57.07 54.78 2xdm s TYR 89 Cb -0.10 -1.61 -0.00 0.00 -0.11 0.00 0.00 41.96 40.14 2xdm s TYR 89 CO 0.03 -0.59 0.71 -1.17 -1.11 0.00 0.00 175.55 173.42 2xdm s LEU 90 N 1.09 4.12 -0.22 -1.29 2.96 0.52 -0.18 118.68 125.68 2xdm s LEU 90 Ca -0.03 0.53 -0.02 0.00 -0.22 0.00 0.00 54.13 54.39 2xdm s LEU 90 Cb -0.14 -2.95 0.01 0.00 0.50 0.00 0.00 46.19 43.61 2xdm s LEU 90 CO -0.05 -0.56 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.66 2xdm s VAL 91 N 2.80 2.95 -0.09 1.68 1.01 0.11 0.23 120.40 129.08 2xdm s VAL 91 Ca 0.29 -0.78 -0.03 0.00 0.00 0.00 0.00 61.98 61.46 2xdm s VAL 91 Cb -0.14 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 2xdm s VAL 91 CO 0.12 0.36 0.05 -0.83 0.00 0.00 0.00 175.10 174.79 2xdm s GLY 92 N 1.39 1.95 -0.49 4.51 0.00 -0.52 -0.95 107.32 113.21 2xdm s GLY 92 Ca 0.04 -0.77 0.06 0.00 0.00 0.00 0.00 44.72 44.05 2xdm s GLY 92 CO -0.06 -0.53 1.00 0.54 0.00 0.00 0.00 173.10 174.05 2xdm n ARG 93 N 2.02 3.02 -0.81 2.90 1.74 -0.40 -4.52 116.66 120.61 2xdm n ARG 93 Ca -0.19 -4.51 0.00 0.00 -0.77 0.00 0.00 57.85 52.38 2xdm n ARG 93 Cb 0.54 -2.14 0.00 0.00 -1.02 0.00 0.00 32.46 29.84 2xdm n ARG 93 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2xdm n GLY 94 N -0.29 0.54 3.61 -0.13 0.00 -0.88 -4.27 105.19 103.77 2xdm n GLY 94 Ca 0.32 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 2xdm n GLY 94 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2xdm s ASP 95 N -2.44 5.92 0.00 1.61 -1.08 -1.26 -4.87 116.67 114.55 2xdm s ASP 95 Ca 0.00 1.55 0.19 0.00 -0.52 0.00 0.00 52.55 53.77 2xdm s ASP 95 Cb 0.00 -2.52 0.87 0.00 -1.46 0.00 0.00 42.92 39.81 2xdm s ASP 95 CO 0.00 -1.64 1.59 -0.81 0.52 0.00 0.00 175.17 174.83 2xdm n PRO 96 N 8.31 1.39 -0.96 4.34 -0.04 -1.26 -3.94 135.00 142.84 2xdm n PRO 96 Ca 0.23 -0.59 0.04 0.00 -0.04 0.00 0.00 63.50 63.15 2xdm n PRO 96 Cb 0.46 -1.33 0.07 0.00 -0.04 0.00 0.00 33.50 32.66 2xdm n PRO 96 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2xdm n THR 97 N -0.18 0.72 -2.70 0.52 -2.24 -1.26 -4.77 114.28 104.36 2xdm n THR 97 Ca 0.15 -1.49 -0.43 0.00 -2.27 0.00 0.00 64.05 60.01 2xdm n THR 97 Cb 0.20 0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.89 2xdm n THR 97 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2xdm s LEU 98 N -1.07 4.00 0.47 3.22 1.98 -1.25 -4.84 118.68 121.18 2xdm s LEU 98 Ca 0.29 1.05 0.03 0.00 -2.89 0.00 0.00 54.13 52.60 2xdm s LEU 98 Cb 0.30 -3.45 0.01 0.00 0.66 0.00 0.00 46.19 43.72 2xdm s LEU 98 CO -0.10 -0.78 0.66 -0.94 -1.89 0.00 0.00 176.35 173.31 2xdm s SER 99 N 1.55 5.60 0.40 3.68 1.04 -1.26 0.98 113.70 125.69 2xdm s SER 99 Ca 0.42 -0.03 0.07 0.00 0.48 0.00 0.00 55.95 56.89 2xdm s SER 99 Cb -0.13 -1.06 0.84 0.00 0.10 0.00 0.00 66.02 65.76 2xdm s SER 99 CO 0.13 -0.85 2.03 0.00 0.98 0.00 0.00 173.24 175.53 2xdm h ALA 100 N 0.39 1.66 -0.26 5.32 0.00 -1.96 -2.42 119.26 121.98 2xdm h ALA 100 Ca -0.43 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.25 2xdm h ALA 100 Cb 1.28 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 2xdm h ALA 100 CO 0.52 0.29 -0.50 1.49 0.00 0.00 0.00 179.25 181.06 2xdm h GLU 101 N 0.50 0.73 -0.99 0.00 4.81 -1.96 -1.59 114.58 116.08 2xdm h GLU 101 Ca 0.13 -0.43 0.08 0.00 -0.13 0.00 0.00 59.36 59.01 2xdm h GLU 101 Cb 0.02 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.37 2xdm h GLU 101 CO -0.02 1.05 0.64 -0.44 -0.73 0.00 0.00 179.01 179.51 2xdm h ASP 102 N 0.57 0.99 -0.24 1.04 3.45 -1.88 0.18 116.42 120.53 2xdm h ASP 102 Ca 0.02 0.02 -0.13 0.00 0.43 0.00 0.00 57.03 57.38 2xdm h ASP 102 Cb 1.06 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 39.63 2xdm h ASP 102 CO 0.10 0.61 -0.29 -0.07 -1.57 0.00 0.00 179.24 178.02 2xdm h LEU 103 N 1.11 0.77 -0.50 1.55 3.38 -1.18 -2.54 115.31 117.89 2xdm h LEU 103 Ca 0.44 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2xdm h LEU 103 Cb 0.25 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2xdm h LEU 103 CO -0.19 1.01 0.20 -0.78 0.09 0.00 0.00 178.44 178.77 2xdm h ASP 104 N 0.64 0.69 0.02 -0.43 1.82 -0.61 -1.77 116.42 116.78 2xdm h ASP 104 Ca 0.08 -0.17 -0.07 0.00 -0.39 0.00 0.00 57.03 56.48 2xdm h ASP 104 Cb 0.81 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.63 2xdm h ASP 104 CO 0.07 0.67 -0.18 0.00 -1.61 0.00 0.00 179.24 178.19 2xdm h ALA 105 N 1.04 1.36 -0.10 -0.78 0.00 -0.89 -0.69 119.26 119.19 2xdm h ALA 105 Ca 0.17 -0.26 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 2xdm h ALA 105 Cb 0.20 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2xdm h ALA 105 CO -0.01 0.44 -0.67 0.52 0.00 0.00 0.00 179.25 179.52 2xdm h MET 106 N 0.28 0.43 -0.63 0.00 2.86 -1.34 -2.42 114.93 114.10 2xdm h MET 106 Ca 0.05 -0.32 -0.01 0.00 -2.06 0.00 0.00 59.70 57.36 2xdm h MET 106 Cb 0.49 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 2xdm h MET 106 CO 0.03 0.95 0.35 0.00 1.06 0.00 0.00 176.91 179.30 2xdm h ALA 107 N 0.97 1.43 -0.10 6.32 0.00 -0.79 -0.61 119.26 126.47 2xdm h ALA 107 Ca -0.02 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 2xdm h ALA 107 Cb 1.23 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2xdm h ALA 107 CO 0.12 0.47 -0.41 0.00 0.00 0.00 0.00 179.25 179.43 2xdm h ALA 108 N 1.51 1.12 -0.07 0.00 0.00 -0.88 -2.52 119.26 118.42 2xdm h ALA 108 Ca 0.22 -0.41 -0.22 0.00 0.00 0.00 0.00 54.91 54.51 2xdm h ALA 108 Cb 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2xdm h ALA 108 CO -0.04 0.58 -0.83 0.93 0.00 0.00 0.00 179.25 179.89 2xdm h GLU 109 N 0.18 0.56 -0.42 0.00 5.08 -0.92 -0.37 114.58 118.70 2xdm h GLU 109 Ca 0.02 -0.51 0.02 0.00 -1.00 0.00 0.00 59.36 57.89 2xdm h GLU 109 Cb 0.81 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 2xdm h GLU 109 CO 0.06 1.13 0.25 0.28 -1.00 0.00 0.00 179.01 179.74 2xdm h VAL 110 N 0.36 1.05 -0.43 3.13 2.07 -1.01 -1.00 116.25 120.41 2xdm h VAL 110 Ca -0.06 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 2xdm h VAL 110 Cb 1.45 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 2xdm h VAL 110 CO 0.16 0.09 0.19 0.00 0.02 0.00 0.00 177.57 178.02 2xdm h ALA 111 N 1.18 0.56 0.00 1.67 0.00 -1.39 -2.86 119.26 118.42 2xdm h ALA 111 Ca 0.17 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2xdm h ALA 111 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2xdm h ALA 111 CO -0.07 0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.33 2xdm n ALA 112 N -2.30 1.66 1.29 0.00 0.00 -0.15 -1.55 120.51 119.46 2xdm n ALA 112 Ca 0.01 0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.65 2xdm n ALA 112 Cb 0.13 -1.38 0.35 0.00 0.00 0.00 0.00 19.45 18.56 2xdm n ALA 112 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2xdm n SER 113 N -2.19 1.83 0.00 0.00 3.41 -0.40 -4.95 113.62 111.31 2xdm n SER 113 Ca 0.02 -1.52 0.00 0.00 -0.26 0.00 0.00 58.87 57.12 2xdm n SER 113 Cb 0.23 0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 2xdm n SER 113 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2xdm n GLY 114 N 1.27 1.01 3.75 5.00 0.00 -0.59 -4.72 105.19 110.90 2xdm n GLY 114 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 2xdm n GLY 114 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2xdm s VAL 115 N -2.00 4.10 0.00 1.61 1.01 -1.13 -4.20 120.40 119.79 2xdm s VAL 115 Ca 0.00 2.07 0.00 0.00 0.00 0.00 0.00 61.98 64.05 2xdm s VAL 115 Cb 0.00 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 32.06 2xdm s VAL 115 CO 0.00 0.48 0.00 0.54 0.00 0.00 0.00 175.10 176.12 2xdm n ARG 116 N 1.62 2.36 -3.72 2.72 1.74 0.33 -4.44 116.66 117.28 2xdm n ARG 116 Ca -0.02 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.89 2xdm n ARG 116 Cb 0.47 -0.81 -0.17 0.00 -1.02 0.00 0.00 32.46 30.94 2xdm n ARG 116 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2xdm s THR 117 N -1.35 -0.09 -0.49 0.55 2.01 -1.09 -1.09 115.64 114.10 2xdm s THR 117 Ca 0.00 0.32 -0.19 0.00 0.31 0.00 0.00 61.69 62.12 2xdm s THR 117 Cb 0.00 -0.12 0.05 0.00 0.01 0.00 0.00 72.50 72.43 2xdm s THR 117 CO 0.00 0.13 0.62 -0.69 -0.69 0.00 0.00 174.62 173.99 2xdm s VAL 118 N 1.61 4.87 0.16 3.82 1.01 0.14 -2.44 120.40 129.56 2xdm s VAL 118 Ca -0.02 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 61.71 2xdm s VAL 118 Cb -0.12 -4.27 -0.13 0.00 0.00 0.00 0.00 36.38 31.86 2xdm s VAL 118 CO -0.03 -0.74 1.41 0.03 0.00 0.00 0.00 175.10 175.76 2xdm h ARG 119 N 8.96 0.00 0.00 2.72 3.08 -1.30 0.18 114.38 128.01 2xdm h ARG 119 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.78 2xdm h ARG 119 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.15 2xdm h ARG 119 CO 0.94 0.83 0.00 0.41 -1.07 0.00 0.00 179.97 181.08 2xdm n GLY 120 N 0.96 1.77 3.91 0.04 0.00 0.45 -4.20 105.19 108.12 2xdm n GLY 120 Ca -0.00 -1.74 -0.26 0.00 0.00 0.00 0.00 46.02 44.02 2xdm n GLY 120 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2xdm s ASP 121 N -1.00 6.13 -0.25 1.61 -0.00 -1.25 -1.53 116.67 120.38 2xdm s ASP 121 Ca 0.00 0.09 -0.11 0.00 -0.00 0.00 0.00 52.55 52.53 2xdm s ASP 121 Cb 0.00 -1.79 -0.05 0.00 -0.00 0.00 0.00 42.92 41.08 2xdm s ASP 121 CO 0.00 0.05 0.20 -0.22 -0.00 0.00 0.00 175.17 175.20 2xdm s LEU 122 N -3.22 4.09 -0.02 1.23 2.96 0.53 -1.47 118.68 122.78 2xdm s LEU 122 Ca 0.34 0.12 0.04 0.00 -0.22 0.00 0.00 54.13 54.41 2xdm s LEU 122 Cb -0.11 -2.16 -0.03 0.00 0.50 0.00 0.00 46.19 44.39 2xdm s LEU 122 CO 0.27 0.01 -0.13 -0.31 -1.32 0.00 0.00 176.35 174.88 2xdm s TYR 123 N 1.32 2.74 -0.31 5.38 1.51 -0.12 -2.01 117.35 125.86 2xdm s TYR 123 Ca 0.09 -0.13 -0.12 0.00 -1.01 0.00 0.00 57.07 55.90 2xdm s TYR 123 Cb -0.14 -1.60 -0.03 0.00 -0.11 0.00 0.00 41.96 40.08 2xdm s TYR 123 CO 0.07 0.26 0.21 0.00 -1.11 0.00 0.00 175.55 174.97 2xdm s ALA 124 N -0.84 3.47 -0.38 3.71 0.00 0.30 -0.36 121.76 127.66 2xdm s ALA 124 Ca 0.13 -1.28 -0.12 0.00 0.00 0.00 0.00 51.96 50.69 2xdm s ALA 124 Cb -0.11 -2.54 0.02 0.00 0.00 0.00 0.00 23.12 20.49 2xdm s ALA 124 CO 0.03 -0.81 0.23 0.34 0.00 0.00 0.00 175.76 175.55 2xdm s ASP 125 N 1.71 5.85 -0.17 0.00 3.68 0.14 -2.39 116.67 125.49 2xdm s ASP 125 Ca 0.06 -0.93 0.15 0.00 2.13 0.00 0.00 52.55 53.96 2xdm s ASP 125 Cb -0.17 -2.07 0.35 0.00 -1.45 0.00 0.00 42.92 39.59 2xdm s ASP 125 CO 0.10 -0.39 1.18 -0.90 0.13 0.00 0.00 175.17 175.29 2xdm n ASP 126 N 5.05 1.98 0.00 -0.34 3.85 -1.26 -1.44 116.55 124.38 2xdm n ASP 126 Ca -0.12 -3.46 0.10 0.00 -0.71 0.00 0.00 54.79 50.60 2xdm n ASP 126 Cb 0.47 -0.47 0.44 0.00 -1.35 0.00 0.00 41.12 40.20 2xdm n ASP 126 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 2xdm n THR 127 N -1.23 0.58 0.14 2.12 -2.24 -1.26 -2.93 114.28 109.45 2xdm n THR 127 Ca 0.17 0.14 0.09 0.00 -2.27 0.00 0.00 64.05 62.19 2xdm n THR 127 Cb 0.67 -0.80 0.59 0.00 -2.10 0.00 0.00 70.33 68.69 2xdm n THR 127 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 2xdm h TRP 128 N 0.00 0.15 -2.12 4.78 2.91 -1.87 -3.41 115.95 116.39 2xdm h TRP 128 Ca 0.00 0.00 -0.56 0.00 1.13 0.00 0.00 58.89 59.46 2xdm h TRP 128 Cb 0.32 -0.05 -0.10 0.00 -0.51 0.00 0.00 29.16 28.83 2xdm h TRP 128 CO 0.00 0.09 -0.63 -0.06 -1.03 0.00 0.00 178.44 176.80 2xdm s PHE 129 N -5.18 2.65 1.18 2.65 0.08 -1.15 -3.91 117.98 114.29 2xdm s PHE 129 Ca -0.06 -0.28 -0.15 0.00 0.12 0.00 0.00 56.93 56.56 2xdm s PHE 129 Cb 0.18 -1.28 0.28 0.00 -0.57 0.00 0.00 43.02 41.63 2xdm s PHE 129 CO 0.70 0.57 1.03 0.16 -0.10 0.00 0.00 175.22 177.58 2xdm s ASP 130 N -3.69 0.95 -0.35 1.36 1.47 0.12 -4.82 116.67 111.70 2xdm s ASP 130 Ca 0.33 1.23 0.09 0.00 1.18 0.00 0.00 52.55 55.37 2xdm s ASP 130 Cb -0.05 -1.89 0.71 0.00 -0.34 0.00 0.00 42.92 41.35 2xdm s ASP 130 CO 0.20 -4.18 1.81 -1.54 0.68 0.00 0.00 175.17 172.14 2xdm n SER 131 N -4.87 4.40 -4.55 2.11 3.41 -1.26 -4.81 113.62 108.05 2xdm n SER 131 Ca 0.05 -3.35 -0.41 0.00 -0.26 0.00 0.00 58.87 54.90 2xdm n SER 131 Cb 0.56 -0.76 -0.03 0.00 -0.26 0.00 0.00 64.21 63.73 2xdm n SER 131 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2xdm s GLU 132 N -3.09 3.25 0.14 4.33 2.12 -1.26 -4.87 118.70 119.32 2xdm s GLU 132 Ca 0.55 -0.18 -0.07 0.00 0.36 0.00 0.00 54.97 55.63 2xdm s GLU 132 Cb 0.45 -4.15 -0.05 0.00 0.26 0.00 0.00 34.13 30.64 2xdm s GLU 132 CO 0.12 -2.04 1.37 0.00 -0.54 0.00 0.00 175.26 174.17 2xdm h ARG 133 N 9.91 0.58 -4.99 4.30 2.47 -1.88 -3.43 114.38 121.33 2xdm h ARG 133 Ca -0.27 -0.48 -0.33 0.00 -1.26 0.00 0.00 59.98 57.64 2xdm h ARG 133 Cb 1.05 0.10 -0.18 0.00 -1.65 0.00 0.00 29.97 29.29 2xdm h ARG 133 CO 1.26 1.11 -0.74 -0.51 0.56 0.00 0.00 179.97 181.65 2xdm s LEU 134 N -8.15 2.39 0.53 3.04 1.43 -1.26 -0.98 118.68 115.69 2xdm s LEU 134 Ca -0.08 -0.78 -0.19 0.00 -1.03 0.00 0.00 54.13 52.05 2xdm s LEU 134 Cb 0.10 -0.32 -0.06 0.00 0.03 0.00 0.00 46.19 45.93 2xdm s LEU 134 CO 0.87 -0.24 1.10 -0.69 0.23 0.00 0.00 176.35 177.62 2xdm s VAL 135 N -2.27 3.36 0.15 -1.59 1.01 -1.26 -4.97 120.40 114.82 2xdm s VAL 135 Ca 0.04 0.83 -0.31 0.00 0.00 0.00 0.00 61.98 62.55 2xdm s VAL 135 Cb -0.04 -3.33 -0.06 0.00 0.00 0.00 0.00 36.38 32.94 2xdm s VAL 135 CO 0.00 -0.20 1.55 -2.24 0.00 0.00 0.00 175.10 174.21 2xdm h ASP 136 N 1.24 -1.94 -0.60 3.32 3.04 -2.01 -3.09 116.42 116.39 2xdm h ASP 136 Ca -0.50 0.28 0.00 0.00 -3.24 0.00 0.00 57.03 53.58 2xdm h ASP 136 Cb 1.25 0.84 0.00 0.00 -1.04 0.00 0.00 39.33 40.37 2xdm h ASP 136 CO 0.57 -0.32 0.00 -0.90 -2.04 0.00 0.00 179.24 176.55 2xdm n ASP 137 N -5.33 3.74 -4.77 4.15 3.85 -1.26 -4.90 116.55 112.03 2xdm n ASP 137 Ca -0.00 -2.18 -0.36 0.00 -0.71 0.00 0.00 54.79 51.54 2xdm n ASP 137 Cb 0.31 -0.47 0.00 0.00 -1.35 0.00 0.00 41.12 39.61 2xdm n ASP 137 CO 0.00 0.00 0.00 0.26 -1.01 0.00 0.00 177.20 176.45 2xdm s TRP 138 N -1.46 2.70 -0.27 2.11 0.52 -1.17 -4.72 118.94 116.65 2xdm s TRP 138 Ca 0.43 1.54 -0.22 0.00 0.02 0.00 0.00 56.10 57.86 2xdm s TRP 138 Cb 0.25 -3.34 -0.01 0.00 -1.15 0.00 0.00 33.47 29.22 2xdm s TRP 138 CO 0.25 -1.63 0.72 -1.58 0.02 0.00 0.00 176.95 174.74 2xdm s TRP 139 N -1.68 3.27 0.41 -1.98 0.52 -1.26 -4.95 118.94 113.27 2xdm s TRP 139 Ca 0.70 0.89 0.21 0.00 0.02 0.00 0.00 56.10 57.92 2xdm s TRP 139 Cb -0.26 -3.00 1.18 0.00 -1.15 0.00 0.00 33.47 30.24 2xdm s TRP 139 CO 0.30 -0.41 1.75 -1.35 0.02 0.00 0.00 176.95 177.26 2xdm h PRO 140 N 7.90 0.31 0.00 4.98 0.11 -1.97 0.08 132.00 143.42 2xdm h PRO 140 Ca -0.25 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.81 2xdm h PRO 140 Cb 1.11 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 2xdm h PRO 140 CO 0.83 0.21 -0.15 1.05 -0.21 0.00 0.00 178.00 179.72 2xdm h GLU 141 N 0.32 0.00 0.00 1.05 9.09 -2.01 -2.15 114.58 120.89 2xdm h GLU 141 Ca 0.63 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.04 2xdm h GLU 141 Cb 1.71 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.81 2xdm h GLU 141 CO -0.30 0.15 0.00 -0.25 0.05 0.00 0.00 179.01 178.66 2xdm n ASP 142 N -3.63 0.56 0.14 3.06 8.00 0.01 -4.45 116.55 120.24 2xdm n ASP 142 Ca -0.01 0.57 0.11 0.00 0.71 0.00 0.00 54.79 56.17 2xdm n ASP 142 Cb 0.28 -0.72 0.62 0.00 -0.02 0.00 0.00 41.12 41.28 2xdm n ASP 142 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2xdm h GLU 143 N 0.00 0.09 0.00 -1.24 5.08 -1.44 -1.49 114.58 115.57 2xdm h GLU 143 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2xdm h GLU 143 Cb 0.57 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2xdm h GLU 143 CO 0.00 0.06 0.00 -2.30 -1.00 0.00 0.00 179.01 175.77 2xdm n PRO 144 N -4.49 0.04 -3.60 2.33 -0.02 -1.26 -4.63 135.00 123.37 2xdm n PRO 144 Ca 0.02 0.27 -0.37 0.00 -2.02 0.00 0.00 63.50 61.41 2xdm n PRO 144 Cb 0.24 -1.57 -0.06 0.00 -0.02 0.00 0.00 33.50 32.09 2xdm n PRO 144 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2xdm s TYR 145 N -3.06 3.66 0.35 6.00 1.51 -0.56 -1.54 117.35 123.70 2xdm s TYR 145 Ca 0.07 0.84 0.13 0.00 -1.01 0.00 0.00 57.07 57.10 2xdm s TYR 145 Cb 0.10 -2.18 0.97 0.00 -0.11 0.00 0.00 41.96 40.74 2xdm s TYR 145 CO 0.30 0.62 1.75 0.00 -1.11 0.00 0.00 175.55 177.11 2xdm h ALA 146 N 4.39 1.98 0.00 3.71 0.00 -1.88 0.26 119.26 127.73 2xdm h ALA 146 Ca -0.51 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2xdm h ALA 146 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2xdm h ALA 146 CO 0.63 -0.42 0.00 0.10 0.00 0.00 0.00 179.25 179.56 2xdm h TYR 147 N 0.51 0.00 -0.37 0.00 -0.00 -1.94 -2.46 116.97 112.72 2xdm h TYR 147 Ca 0.62 0.00 -0.10 0.00 0.00 0.00 0.00 58.73 59.25 2xdm h TYR 147 Cb 1.33 0.00 -0.06 0.00 0.00 0.00 0.00 36.73 38.00 2xdm h TYR 147 CO -0.00 0.00 0.03 0.45 -0.00 0.00 0.00 178.16 178.64 2xdm n SER 148 N -2.31 3.59 -4.68 0.10 2.88 0.91 -4.65 113.62 109.46 2xdm n SER 148 Ca 0.01 -3.29 -0.42 0.00 -1.33 0.00 0.00 58.87 53.84 2xdm n SER 148 Cb 0.19 -0.61 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 2xdm n SER 148 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2xdm n ALA 149 N -0.67 1.03 -1.68 -1.46 0.00 -0.93 -4.79 120.51 112.01 2xdm n ALA 149 Ca 0.29 0.32 -0.40 0.00 0.00 0.00 0.00 53.44 53.65 2xdm n ALA 149 Cb 1.02 -2.22 0.03 0.00 0.00 0.00 0.00 19.45 18.29 2xdm n ALA 149 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2xdm n GLN 150 N 0.36 1.59 -3.81 0.00 6.02 -1.26 -4.88 117.38 115.40 2xdm n GLN 150 Ca 0.06 0.58 -0.35 0.00 -0.01 0.00 0.00 57.00 57.28 2xdm n GLN 150 Cb 0.37 -2.34 -0.09 0.00 1.02 0.00 0.00 30.24 29.20 2xdm n GLN 150 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2xdm s ILE 151 N -1.29 5.15 0.07 5.09 -1.09 -0.15 -4.81 121.20 124.16 2xdm s ILE 151 Ca 0.67 0.10 -0.07 0.00 -2.23 0.00 0.00 60.65 59.11 2xdm s ILE 151 Cb -0.47 -3.35 -0.01 0.00 -1.58 0.00 0.00 42.46 37.05 2xdm s ILE 151 CO 0.53 0.42 0.15 -0.55 -1.23 0.00 0.00 174.94 174.27 2xdm s SER 152 N 0.58 0.17 0.33 3.58 0.15 -1.26 -4.42 113.70 112.82 2xdm s SER 152 Ca 0.06 -0.65 0.14 0.00 0.70 0.00 0.00 55.95 56.21 2xdm s SER 152 Cb -0.12 0.30 0.53 0.00 -1.71 0.00 0.00 66.02 65.02 2xdm s SER 152 CO 0.00 -0.67 1.68 0.00 1.20 0.00 0.00 173.24 175.46 2xdm h ALA 153 N 2.99 1.02 -3.71 5.45 0.00 -1.88 -3.41 119.26 119.72 2xdm h ALA 153 Ca -0.34 -0.45 -0.66 0.00 0.00 0.00 0.00 54.91 53.47 2xdm h ALA 153 Cb 1.19 -0.08 -0.39 0.00 0.00 0.00 0.00 17.79 18.51 2xdm h ALA 153 CO 0.56 0.61 -0.73 -1.17 0.00 0.00 0.00 179.25 178.52 2xdm s LEU 154 N -7.41 4.59 0.01 0.00 0.20 -1.26 -2.06 118.68 112.74 2xdm s LEU 154 Ca -0.01 -2.05 0.00 0.00 0.69 0.00 0.00 54.13 52.77 2xdm s LEU 154 Cb 0.12 -1.62 -0.01 0.00 -0.43 0.00 0.00 46.19 44.25 2xdm s LEU 154 CO 0.73 -0.35 -0.01 0.28 -0.29 0.00 0.00 176.35 176.70 2xdm s THR 155 N 0.93 0.07 -0.24 3.68 -1.32 -1.26 -2.28 115.64 115.22 2xdm s THR 155 Ca 0.08 -0.33 -0.18 0.00 -1.21 0.00 0.00 61.69 60.05 2xdm s THR 155 Cb -0.19 -0.12 -0.03 0.00 -1.51 0.00 0.00 72.50 70.65 2xdm s THR 155 CO -0.08 -0.16 0.52 -0.69 -2.21 0.00 0.00 174.62 172.00 2xdm s VAL 156 N -0.51 5.08 -0.16 5.08 1.01 -1.26 -4.49 120.40 125.15 2xdm s VAL 156 Ca -0.05 0.91 -0.25 0.00 0.00 0.00 0.00 61.98 62.58 2xdm s VAL 156 Cb -0.04 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 2xdm s VAL 156 CO -0.00 0.11 0.83 0.00 0.00 0.00 0.00 175.10 176.03 2xdm s ALA 157 N 2.13 3.49 0.02 5.51 0.00 0.27 -2.27 121.76 130.91 2xdm s ALA 157 Ca 0.22 0.06 -0.20 0.00 0.00 0.00 0.00 51.96 52.04 2xdm s ALA 157 Cb -0.16 -3.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 2xdm s ALA 157 CO 0.09 -0.60 0.59 -1.58 0.00 0.00 0.00 175.76 174.26 2xdm s HIS 158 N 2.02 3.72 0.13 0.00 2.46 0.93 -4.35 115.29 120.19 2xdm s HIS 158 Ca 0.39 1.22 0.00 0.00 0.47 0.00 0.00 55.06 57.14 2xdm s HIS 158 Cb -0.17 -2.58 0.00 0.00 -0.13 0.00 0.00 32.58 29.70 2xdm s HIS 158 CO 0.13 0.42 0.00 0.41 -2.47 0.00 0.00 174.74 173.23 2xdm n GLY 159 N 2.25 -1.64 0.03 1.59 0.00 -1.26 -1.48 105.19 104.67 2xdm n GLY 159 Ca -0.08 -1.19 0.14 0.00 0.00 0.00 0.00 46.02 44.89 2xdm n GLY 159 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2xdm n GLU 160 N -2.49 0.08 0.15 1.61 0.28 -1.26 -2.35 120.64 116.66 2xdm n GLU 160 Ca 0.00 0.06 0.12 0.00 -0.16 0.00 0.00 57.16 57.19 2xdm n GLU 160 Cb 0.26 -1.59 0.10 0.00 1.43 0.00 0.00 31.44 31.64 2xdm n GLU 160 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2xdm h ARG 161 N 0.00 0.00 -4.10 3.44 3.08 -1.98 -3.48 114.38 111.34 2xdm h ARG 161 Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.86 2xdm h ARG 161 Cb 0.56 0.00 0.10 0.00 0.08 0.00 0.00 29.97 30.71 2xdm h ARG 161 CO 0.00 0.00 -0.44 1.19 -1.07 0.00 0.00 179.97 179.65 2xdm n PHE 162 N -2.81 -1.26 -2.47 3.04 0.99 -0.99 -4.75 117.46 109.20 2xdm n PHE 162 Ca 0.02 0.53 -0.43 0.00 -0.00 0.00 0.00 57.45 57.57 2xdm n PHE 162 Cb 0.53 -3.74 -0.02 0.00 -1.00 0.00 0.00 39.48 35.25 2xdm n PHE 162 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2xdm s ASP 163 N -3.74 6.51 0.40 4.37 1.01 -0.55 -4.66 116.67 120.00 2xdm s ASP 163 Ca 0.02 0.70 -0.13 0.00 0.71 0.00 0.00 52.55 53.84 2xdm s ASP 163 Cb -0.00 -2.54 -0.07 0.00 1.01 0.00 0.00 42.92 41.31 2xdm s ASP 163 CO 0.42 -1.32 0.80 0.42 0.21 0.00 0.00 175.17 175.70 2xdm s THR 164 N 4.88 4.71 -1.39 -1.27 -4.23 -1.26 -0.05 115.64 117.02 2xdm s THR 164 Ca 0.55 0.81 0.00 0.00 -1.18 0.00 0.00 61.69 61.87 2xdm s THR 164 Cb -0.11 -3.70 0.00 0.00 1.34 0.00 0.00 72.50 70.04 2xdm s THR 164 CO 0.31 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.54 2xdm n GLY 165 N -1.09 0.18 3.38 3.99 0.00 -0.96 -4.80 105.19 105.89 2xdm n GLY 165 Ca 0.03 -0.25 -0.19 0.00 0.00 0.00 0.00 46.02 45.61 2xdm n GLY 165 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2xdm s VAL 166 N -2.72 0.79 0.07 1.61 -7.23 -1.26 -2.35 120.40 109.31 2xdm s VAL 166 Ca 0.00 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.22 2xdm s VAL 166 Cb 0.00 -2.68 -0.03 0.00 0.56 0.00 0.00 36.38 34.23 2xdm s VAL 166 CO 0.00 0.00 -0.13 0.28 -0.31 0.00 0.00 175.10 174.94 2xdm s THR 167 N -3.54 1.04 -0.36 5.32 -1.32 0.49 -4.84 115.64 112.43 2xdm s THR 167 Ca 0.37 -1.32 -0.18 0.00 -1.21 0.00 0.00 61.69 59.34 2xdm s THR 167 Cb 0.08 -1.06 -0.00 0.00 -1.51 0.00 0.00 72.50 70.01 2xdm s THR 167 CO 0.15 -0.28 0.53 -0.70 -2.21 0.00 0.00 174.62 172.10 2xdm s GLU 168 N -1.85 3.60 -0.19 7.08 2.12 -1.26 -1.35 118.70 126.85 2xdm s GLU 168 Ca -0.02 -0.16 -0.18 0.00 0.36 0.00 0.00 54.97 54.96 2xdm s GLU 168 Cb -0.09 -3.82 -0.03 0.00 0.26 0.00 0.00 34.13 30.45 2xdm s GLU 168 CO 0.02 -0.67 0.51 0.08 -0.54 0.00 0.00 175.26 174.66 2xdm s VAL 169 N 2.43 5.11 -0.17 3.70 1.01 0.68 -2.78 120.40 130.39 2xdm s VAL 169 Ca 0.19 0.95 -0.01 0.00 0.00 0.00 0.00 61.98 63.12 2xdm s VAL 169 Cb -0.15 -3.84 -0.00 0.00 0.00 0.00 0.00 36.38 32.39 2xdm s VAL 169 CO 0.14 0.19 -0.13 -0.44 0.00 0.00 0.00 175.10 174.85 2xdm s SER 170 N 1.11 3.79 -0.19 3.32 0.01 0.01 -0.86 113.70 120.89 2xdm s SER 170 Ca 0.24 -0.45 -0.03 0.00 1.31 0.00 0.00 55.95 57.02 2xdm s SER 170 Cb -0.15 -1.60 -0.01 0.00 0.21 0.00 0.00 66.02 64.47 2xdm s SER 170 CO 0.10 0.07 -0.05 -0.69 0.41 0.00 0.00 173.24 173.08 2xdm s VAL 171 N 0.90 3.48 -0.06 3.43 1.01 0.91 -0.53 120.40 129.54 2xdm s VAL 171 Ca -0.03 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.51 2xdm s VAL 171 Cb -0.15 -2.55 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 2xdm s VAL 171 CO -0.01 0.45 -0.19 -0.89 0.00 0.00 0.00 175.10 174.46 2xdm s THR 172 N 1.02 2.61 0.62 3.92 2.01 -0.13 -0.56 115.64 125.13 2xdm s THR 172 Ca 0.00 -0.87 -0.14 0.00 0.31 0.00 0.00 61.69 61.00 2xdm s THR 172 Cb -0.15 -2.00 -0.03 0.00 0.01 0.00 0.00 72.50 70.33 2xdm s THR 172 CO 0.00 0.57 1.04 -2.16 -0.69 0.00 0.00 174.62 173.39 2xdm s PRO 173 N -0.36 3.31 0.00 4.92 0.04 -1.26 -1.18 135.00 140.47 2xdm s PRO 173 Ca 0.03 1.03 0.00 0.00 0.04 0.00 0.00 61.00 62.10 2xdm s PRO 173 Cb -0.12 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2xdm s PRO 173 CO 0.02 -0.80 0.00 0.00 0.04 0.00 0.00 177.00 176.26 2xdm n ALA 174 N -2.41 0.00 -1.78 8.56 0.00 -1.26 -4.82 120.51 118.80 2xdm n ALA 174 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.15 2xdm n ALA 174 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.96 2xdm n ALA 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2xdm s ALA 175 N -2.03 3.00 0.07 0.00 0.00 -1.26 -4.77 121.76 116.77 2xdm s ALA 175 Ca 0.00 0.80 -0.36 0.00 0.00 0.00 0.00 51.96 52.40 2xdm s ALA 175 Cb 0.00 -3.32 -0.15 0.00 0.00 0.00 0.00 23.12 19.65 2xdm s ALA 175 CO 0.00 -0.43 1.53 -1.91 0.00 0.00 0.00 175.76 174.94 2xdm n GLU 176 N -0.38 1.67 0.00 0.00 2.13 -1.26 -1.31 120.64 121.49 2xdm n GLU 176 Ca 0.07 0.60 0.00 0.00 0.66 0.00 0.00 57.16 58.49 2xdm n GLU 176 Cb 0.49 -2.32 0.00 0.00 0.27 0.00 0.00 31.44 29.88 2xdm n GLU 176 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2xdm n GLY 177 N 3.22 1.92 3.90 8.31 0.00 -0.38 -5.01 105.19 117.14 2xdm n GLY 177 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2xdm n GLY 177 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2xdm s GLU 178 N -0.98 3.66 0.53 1.61 2.02 -0.43 -4.78 118.70 120.33 2xdm s GLU 178 Ca 0.00 -0.00 -0.22 0.00 0.02 0.00 0.00 54.97 54.77 2xdm s GLU 178 Cb 0.00 -2.75 -0.06 0.00 0.10 0.00 0.00 34.13 31.42 2xdm s GLU 178 CO 0.00 0.37 1.36 -2.30 0.02 0.00 0.00 175.26 174.70 2xdm n PRO 179 N -0.28 1.75 -1.90 0.39 -0.02 -1.26 -0.57 135.00 133.11 2xdm n PRO 179 Ca -0.02 0.64 -0.35 0.00 -2.02 0.00 0.00 63.50 61.75 2xdm n PRO 179 Cb 0.53 -2.57 0.04 0.00 -0.02 0.00 0.00 33.50 31.48 2xdm n PRO 179 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2xdm s ALA 180 N -1.28 2.47 -0.19 3.55 0.00 -0.80 -4.57 121.76 120.95 2xdm s ALA 180 Ca 0.70 0.91 -0.21 0.00 0.00 0.00 0.00 51.96 53.37 2xdm s ALA 180 Cb -0.42 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.24 2xdm s ALA 180 CO 0.50 -1.26 0.62 0.34 0.00 0.00 0.00 175.76 175.96 2xdm s ASP 181 N -1.81 6.68 -0.19 0.00 -1.08 -0.32 -4.93 116.67 115.03 2xdm s ASP 181 Ca 0.75 0.83 -0.05 0.00 -0.52 0.00 0.00 52.55 53.56 2xdm s ASP 181 Cb -0.28 -2.34 -0.03 0.00 -1.46 0.00 0.00 42.92 38.80 2xdm s ASP 181 CO 0.36 -0.26 0.01 -0.69 0.52 0.00 0.00 175.17 175.11 2xdm s VAL 182 N 1.83 4.17 -0.25 1.11 1.01 -1.26 -0.96 120.40 126.06 2xdm s VAL 182 Ca 0.29 -0.25 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 2xdm s VAL 182 Cb -0.16 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.36 2xdm s VAL 182 CO 0.10 0.45 -0.04 -0.62 0.00 0.00 0.00 175.10 175.00 2xdm s ASP 183 N 0.68 4.40 0.00 3.32 3.68 0.31 -4.99 116.67 124.07 2xdm s ASP 183 Ca 0.00 -0.72 0.31 0.00 2.13 0.00 0.00 52.55 54.27 2xdm s ASP 183 Cb -0.14 -1.71 1.61 0.00 -1.45 0.00 0.00 42.92 41.23 2xdm s ASP 183 CO 0.02 -0.11 2.07 0.18 0.13 0.00 0.00 175.17 177.46 2xdm n LEU 184 N 4.73 0.41 0.00 -1.34 4.77 -1.26 -0.81 117.00 123.51 2xdm n LEU 184 Ca -0.17 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 2xdm n LEU 184 Cb 0.48 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2xdm n LEU 184 CO 0.28 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 2xdm n GLY 185 N 1.09 1.94 0.49 -0.72 0.00 -1.12 -3.07 105.19 103.79 2xdm n GLY 185 Ca 0.21 -0.52 0.31 0.00 0.00 0.00 0.00 46.02 46.02 2xdm n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdm h ALA 186 N -0.89 2.84 -0.01 4.61 0.00 -1.93 0.36 119.26 124.24 2xdm h ALA 186 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2xdm h ALA 186 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2xdm h ALA 186 CO 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 179.25 178.08 2xdm n ALA 187 N -2.68 2.65 -1.66 0.00 0.00 -1.18 -4.83 120.51 112.80 2xdm n ALA 187 Ca 0.24 -0.18 -0.52 0.00 0.00 0.00 0.00 53.44 52.98 2xdm n ALA 187 Cb 1.09 -1.40 -0.06 0.00 0.00 0.00 0.00 19.45 19.08 2xdm n ALA 187 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2xdm n GLU 188 N -0.83 1.53 -1.10 0.00 -0.58 0.11 -0.55 120.64 119.22 2xdm n GLU 188 Ca 0.19 0.56 -0.04 0.00 -0.42 0.00 0.00 57.16 57.45 2xdm n GLU 188 Cb 0.11 -2.27 -0.02 0.00 -0.57 0.00 0.00 31.44 28.69 2xdm n GLU 188 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2xdm n GLY 189 N 3.59 0.61 1.33 0.62 0.00 -1.26 -4.79 105.19 105.29 2xdm n GLY 189 Ca 0.22 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2xdm n GLY 189 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2xdm n TYR 190 N -2.69 -0.74 -2.68 1.61 9.36 0.29 -5.05 117.16 117.25 2xdm n TYR 190 Ca -0.04 0.13 -0.33 0.00 3.32 0.00 0.00 57.90 60.99 2xdm n TYR 190 Cb 0.22 0.18 -0.06 0.00 -0.63 0.00 0.00 39.34 39.05 2xdm n TYR 190 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2xdm s ALA 191 N -2.00 3.07 0.30 2.98 0.00 0.15 -5.05 121.76 121.21 2xdm s ALA 191 Ca 0.00 0.29 -0.10 0.00 0.00 0.00 0.00 51.96 52.15 2xdm s ALA 191 Cb 0.00 -3.11 -0.07 0.00 0.00 0.00 0.00 23.12 19.94 2xdm s ALA 191 CO 0.00 0.00 0.64 -1.21 0.00 0.00 0.00 175.76 175.19 2xdm s GLU 192 N -3.51 3.81 -0.17 0.00 2.02 -0.28 -4.79 118.70 115.78 2xdm s GLU 192 Ca 0.60 0.35 -0.04 0.00 0.02 0.00 0.00 54.97 55.90 2xdm s GLU 192 Cb -0.09 -2.55 -0.03 0.00 0.10 0.00 0.00 34.13 31.56 2xdm s GLU 192 CO 0.20 0.19 -0.02 -1.17 0.02 0.00 0.00 175.26 174.49 2xdm s LEU 193 N -3.21 3.34 -0.46 1.80 2.96 -1.26 -0.18 118.68 121.66 2xdm s LEU 193 Ca 0.49 -0.11 0.03 0.00 -0.22 0.00 0.00 54.13 54.32 2xdm s LEU 193 Cb -0.11 -1.82 0.12 0.00 0.50 0.00 0.00 46.19 44.89 2xdm s LEU 193 CO 0.24 0.15 0.21 -0.62 -1.32 0.00 0.00 176.35 175.01 2xdm s ASP 194 N 0.48 4.20 -0.50 3.68 2.15 -0.38 -4.95 116.67 121.36 2xdm s ASP 194 Ca -0.02 -2.70 -0.16 0.00 0.43 0.00 0.00 52.55 50.09 2xdm s ASP 194 Cb -0.14 -1.44 0.08 0.00 -0.30 0.00 0.00 42.92 41.12 2xdm s ASP 194 CO 0.02 -0.27 0.47 0.21 -0.17 0.00 0.00 175.17 175.43 2xdm s ASN 195 N 0.17 6.17 0.00 -0.34 2.47 -1.26 -0.81 114.94 121.34 2xdm s ASN 195 Ca 0.16 -1.33 0.16 0.00 0.42 0.00 0.00 52.86 52.27 2xdm s ASN 195 Cb -0.24 -2.21 0.04 0.00 -1.45 0.00 0.00 41.25 37.39 2xdm s ASN 195 CO -0.03 -0.75 0.91 0.54 -3.72 0.00 0.00 177.10 174.06 2xdm n ARG 196 N 5.45 1.56 -2.22 0.43 5.12 -0.07 -5.00 116.66 121.94 2xdm n ARG 196 Ca -0.11 -1.05 -0.41 0.00 -1.93 0.00 0.00 57.85 54.34 2xdm n ARG 196 Cb 0.43 -1.29 -0.03 0.00 -1.16 0.00 0.00 32.46 30.42 2xdm n ARG 196 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2xdm s ALA 197 N -1.71 3.52 0.32 7.54 0.00 -0.86 -4.59 121.76 125.99 2xdm s ALA 197 Ca 0.15 1.11 0.07 0.00 0.00 0.00 0.00 51.96 53.30 2xdm s ALA 197 Cb 0.13 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 2xdm s ALA 197 CO 0.33 -0.54 0.26 0.54 0.00 0.00 0.00 175.76 176.35 2xdm s VAL 198 N 0.05 3.65 -0.24 0.00 0.11 -0.48 -1.91 120.40 121.59 2xdm s VAL 198 Ca 0.56 -1.41 -0.14 0.00 -2.93 0.00 0.00 61.98 58.07 2xdm s VAL 198 Cb -0.37 -3.20 -0.04 0.00 -1.53 0.00 0.00 36.38 31.24 2xdm s VAL 198 CO 0.39 -0.21 0.32 -0.89 -3.33 0.00 0.00 175.10 171.38 2xdm s THR 199 N -2.28 5.24 0.69 5.04 2.01 0.26 -1.63 115.64 124.96 2xdm s THR 199 Ca 0.39 0.50 -0.07 0.00 0.31 0.00 0.00 61.69 62.82 2xdm s THR 199 Cb -0.06 -3.65 0.05 0.00 0.01 0.00 0.00 72.50 68.85 2xdm s THR 199 CO 0.26 0.24 1.00 -0.83 -0.69 0.00 0.00 174.62 174.61 2xdm s GLY 200 N 1.30 1.67 0.65 4.40 0.00 0.42 -1.25 107.32 114.51 2xdm s GLY 200 Ca 0.14 -0.86 -0.17 0.00 0.00 0.00 0.00 44.72 43.82 2xdm s GLY 200 CO 0.08 -0.48 0.79 0.00 0.00 0.00 0.00 173.10 173.50 2xdm n ALA 201 N -2.88 -0.52 -1.70 3.20 0.00 -1.26 -1.18 120.51 116.17 2xdm n ALA 201 Ca 0.07 -0.10 -0.43 0.00 0.00 0.00 0.00 53.44 52.98 2xdm n ALA 201 Cb 0.60 -2.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.03 2xdm n ALA 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2xdm n ALA 202 N -2.07 1.51 -0.91 0.00 0.00 -1.26 -2.06 120.51 115.72 2xdm n ALA 202 Ca 0.13 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.95 2xdm n ALA 202 Cb 0.49 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2xdm n ALA 202 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2xdm n GLY 203 N 1.63 0.40 3.79 0.00 0.00 -1.26 -4.94 105.19 104.82 2xdm n GLY 203 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2xdm n GLY 203 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2xdm s SER 204 N -2.24 2.88 0.13 1.61 1.04 -0.87 -5.02 113.70 111.23 2xdm s SER 204 Ca 0.00 0.68 -0.29 0.00 0.48 0.00 0.00 55.95 56.82 2xdm s SER 204 Cb 0.00 -1.02 -0.07 0.00 0.10 0.00 0.00 66.02 65.03 2xdm s SER 204 CO 0.00 -2.91 0.90 0.00 0.98 0.00 0.00 173.24 172.21 2xdm s ALA 205 N -3.41 3.31 -0.27 5.32 0.00 -1.26 -4.73 121.76 120.72 2xdm s ALA 205 Ca 0.68 0.51 -0.24 0.00 0.00 0.00 0.00 51.96 52.91 2xdm s ALA 205 Cb -0.10 -3.18 -0.00 0.00 0.00 0.00 0.00 23.12 19.84 2xdm s ALA 205 CO 0.54 0.07 0.82 1.21 0.00 0.00 0.00 175.76 178.40 2xdm s ASN 206 N -0.38 6.78 -0.08 0.00 3.84 -1.26 -4.67 114.94 119.16 2xdm s ASN 206 Ca 0.43 0.92 0.12 0.00 0.21 0.00 0.00 52.86 54.53 2xdm s ASN 206 Cb -0.23 -2.43 0.18 0.00 -0.55 0.00 0.00 41.25 38.21 2xdm s ASN 206 CO 0.29 -0.56 1.09 0.35 -2.79 0.00 0.00 177.10 175.47 2xdm n THR 207 N 5.37 1.17 -2.08 -5.21 -2.24 -0.48 -5.00 114.28 105.81 2xdm n THR 207 Ca 0.05 -1.40 -0.41 0.00 -2.27 0.00 0.00 64.05 60.02 2xdm n THR 207 Cb 0.48 0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.74 2xdm n THR 207 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2xdm s LEU 208 N -1.77 4.40 -0.06 3.22 2.96 -1.10 -4.20 118.68 122.12 2xdm s LEU 208 Ca 0.19 2.58 0.02 0.00 -0.22 0.00 0.00 54.13 56.70 2xdm s LEU 208 Cb 0.17 -3.62 0.02 0.00 0.50 0.00 0.00 46.19 43.26 2xdm s LEU 208 CO 0.02 -0.64 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.62 2xdm s VAL 209 N 0.03 0.92 -0.23 1.68 1.01 -0.28 -4.99 120.40 118.55 2xdm s VAL 209 Ca 0.58 -0.34 -0.02 0.00 0.00 0.00 0.00 61.98 62.20 2xdm s VAL 209 Cb -0.40 -0.88 0.01 0.00 0.00 0.00 0.00 36.38 35.11 2xdm s VAL 209 CO 0.42 0.31 -0.07 -0.63 0.00 0.00 0.00 175.10 175.13 2xdm s ILE 210 N 0.87 3.03 0.19 2.22 1.01 -1.26 -1.17 121.20 126.08 2xdm s ILE 210 Ca -0.11 -0.76 0.09 0.00 0.00 0.00 0.00 60.65 59.87 2xdm s ILE 210 Cb -0.15 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.84 2xdm s ILE 210 CO 0.01 0.34 -0.18 -0.62 0.00 0.00 0.00 174.94 174.49 2xdm s ASP 211 N 1.40 2.84 -0.30 3.58 2.15 0.03 -4.99 116.67 121.39 2xdm s ASP 211 Ca 0.04 -0.92 0.03 0.00 0.43 0.00 0.00 52.55 52.13 2xdm s ASP 211 Cb -0.15 -0.18 0.08 0.00 -0.30 0.00 0.00 42.92 42.37 2xdm s ASP 211 CO -0.05 -0.04 -0.03 -0.60 -0.17 0.00 0.00 175.17 174.28 2xdm s ARG 212 N -3.06 1.88 0.54 4.34 3.52 -1.26 -0.32 118.95 124.60 2xdm s ARG 212 Ca 0.19 -1.60 -0.21 0.00 -0.13 0.00 0.00 55.73 53.98 2xdm s ARG 212 Cb -0.05 -3.05 -0.05 0.00 -1.56 0.00 0.00 34.95 30.24 2xdm s ARG 212 CO 0.08 -0.75 1.30 -2.14 -0.81 0.00 0.00 175.30 172.98 2xdm s PRO 213 N 1.01 3.20 0.33 5.12 0.02 -1.25 -4.57 135.00 138.86 2xdm s PRO 213 Ca 0.01 2.09 -0.29 0.00 0.02 0.00 0.00 61.00 62.82 2xdm s PRO 213 Cb -0.20 -2.22 -0.11 0.00 0.02 0.00 0.00 34.50 31.99 2xdm s PRO 213 CO -0.06 -1.10 1.56 0.54 -0.33 0.00 0.00 177.00 177.60 2xdm s VAL 214 N -1.39 2.02 -1.20 3.83 0.11 -1.26 -2.44 120.40 120.08 2xdm s VAL 214 Ca 0.71 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.78 2xdm s VAL 214 Cb -0.37 -3.01 0.00 0.00 -1.53 0.00 0.00 36.38 31.47 2xdm s VAL 214 CO 0.43 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.81 2xdm n GLY 215 N 1.38 0.86 3.30 6.54 0.00 -1.26 -5.01 105.19 110.99 2xdm n GLY 215 Ca 0.05 -0.44 -0.16 0.00 0.00 0.00 0.00 46.02 45.47 2xdm n GLY 215 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2xdm s THR 216 N -2.49 1.08 -0.53 2.61 -4.23 -1.02 -5.05 115.64 106.00 2xdm s THR 216 Ca 0.00 -2.05 0.03 0.00 -1.18 0.00 0.00 61.69 58.50 2xdm s THR 216 Cb 0.00 -2.17 0.41 0.00 1.34 0.00 0.00 72.50 72.08 2xdm s THR 216 CO 0.00 -0.47 1.37 -3.20 -0.54 0.00 0.00 174.62 171.78 2xdm n ASN 217 N -0.34 5.53 -4.23 3.99 5.15 -1.26 -4.66 115.26 119.43 2xdm n ASN 217 Ca -0.07 -3.75 -0.32 0.00 -0.60 0.00 0.00 54.58 49.84 2xdm n ASN 217 Cb 0.63 -0.61 -0.17 0.00 -0.53 0.00 0.00 39.78 39.09 2xdm n ASN 217 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2xdm s THR 218 N -5.31 2.12 -0.43 -0.44 2.01 -1.26 -1.13 115.64 111.21 2xdm s THR 218 Ca 0.50 -1.00 -0.20 0.00 0.31 0.00 0.00 61.69 61.30 2xdm s THR 218 Cb 0.41 -1.80 0.02 0.00 0.01 0.00 0.00 72.50 71.14 2xdm s THR 218 CO -0.21 0.56 0.59 -0.63 -0.69 0.00 0.00 174.62 174.24 2xdm s ILE 219 N 0.28 4.89 -0.29 1.82 -1.09 0.74 -3.85 121.20 123.71 2xdm s ILE 219 Ca -0.17 0.05 -0.11 0.00 -2.23 0.00 0.00 60.65 58.20 2xdm s ILE 219 Cb -0.17 -4.15 -0.03 0.00 -1.58 0.00 0.00 42.46 36.52 2xdm s ILE 219 CO 0.08 -0.53 0.17 0.00 -1.23 0.00 0.00 174.94 173.44 2xdm s ALA 220 N 2.65 3.42 -0.25 9.38 0.00 0.56 -1.25 121.76 136.27 2xdm s ALA 220 Ca 0.20 -1.20 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 2xdm s ALA 220 Cb -0.15 -2.43 0.02 0.00 0.00 0.00 0.00 23.12 20.57 2xdm s ALA 220 CO 0.17 -0.67 -0.05 0.08 0.00 0.00 0.00 175.76 175.29 2xdm s VAL 221 N 1.71 2.97 0.42 0.00 1.01 0.01 -0.79 120.40 125.72 2xdm s VAL 221 Ca 0.06 -0.99 0.07 0.00 0.00 0.00 0.00 61.98 61.12 2xdm s VAL 221 Cb -0.16 -2.51 -0.06 0.00 0.00 0.00 0.00 36.38 33.65 2xdm s VAL 221 CO 0.09 0.19 0.09 0.42 0.00 0.00 0.00 175.10 175.89 2xdm s THR 222 N 1.34 2.10 0.00 3.92 -4.23 -0.32 -0.90 115.64 117.55 2xdm s THR 222 Ca 0.00 -1.85 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 2xdm s THR 222 Cb -0.17 -2.95 0.00 0.00 1.34 0.00 0.00 72.50 70.72 2xdm s THR 222 CO -0.04 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 2xdm n GLY 223 N -1.11 -1.80 3.46 3.99 0.00 -1.26 -1.13 105.19 107.34 2xdm n GLY 223 Ca -0.04 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 2xdm n GLY 223 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2xdm s SER 224 N -3.96 4.07 -0.23 1.61 0.01 -1.26 -1.38 113.70 112.56 2xdm s SER 224 Ca 0.00 -0.21 -0.02 0.00 1.31 0.00 0.00 55.95 57.02 2xdm s SER 224 Cb 0.00 -1.06 0.01 0.00 0.21 0.00 0.00 66.02 65.19 2xdm s SER 224 CO 0.00 0.30 -0.07 -0.22 0.41 0.00 0.00 173.24 173.66 2xdm s LEU 225 N -0.47 2.95 0.44 2.44 2.96 -0.65 -1.39 118.68 124.96 2xdm s LEU 225 Ca 0.06 -0.67 -0.24 0.00 -0.22 0.00 0.00 54.13 53.06 2xdm s LEU 225 Cb -0.12 -1.67 -0.10 0.00 0.50 0.00 0.00 46.19 44.81 2xdm s LEU 225 CO 0.02 -0.07 1.06 -2.65 -1.32 0.00 0.00 176.35 173.38 2xdm n PRO 226 N 4.71 1.42 0.26 0.98 -0.02 -1.26 -0.44 135.00 140.65 2xdm n PRO 226 Ca -0.18 0.51 0.10 0.00 -2.02 0.00 0.00 63.50 61.92 2xdm n PRO 226 Cb 0.49 -2.13 0.69 0.00 -0.02 0.00 0.00 33.50 32.53 2xdm n PRO 226 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2xdm h ALA 227 N 1.53 1.57 -0.02 3.55 0.00 -1.19 -2.11 119.26 122.59 2xdm h ALA 227 Ca -0.46 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2xdm h ALA 227 Cb 1.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2xdm h ALA 227 CO 0.57 0.12 -0.13 -0.40 0.00 0.00 0.00 179.25 179.40 2xdm n ASP 228 N -4.04 1.74 -4.79 0.00 5.75 -1.26 -4.83 116.55 109.12 2xdm n ASP 228 Ca -0.02 -1.44 -0.33 0.00 -0.01 0.00 0.00 54.79 52.98 2xdm n ASP 228 Cb 0.18 0.10 0.01 0.00 -1.03 0.00 0.00 41.12 40.38 2xdm n ASP 228 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2xdm s ALA 229 N -2.20 2.68 0.48 2.12 0.00 -0.80 -5.03 121.76 119.02 2xdm s ALA 229 Ca 0.30 0.55 -0.21 0.00 0.00 0.00 0.00 51.96 52.60 2xdm s ALA 229 Cb 0.20 -3.28 -0.07 0.00 0.00 0.00 0.00 23.12 19.96 2xdm s ALA 229 CO 0.41 -0.85 1.11 0.00 0.00 0.00 0.00 175.76 176.43 2xdm s ALA 230 N -2.21 2.88 0.30 0.00 0.00 -1.26 -4.73 121.76 116.73 2xdm s ALA 230 Ca 0.67 0.80 -0.28 0.00 0.00 0.00 0.00 51.96 53.15 2xdm s ALA 230 Cb -0.19 -3.33 -0.13 0.00 0.00 0.00 0.00 23.12 19.46 2xdm s ALA 230 CO 0.33 -0.56 1.12 -2.30 0.00 0.00 0.00 175.76 174.35 2xdm n PRO 231 N -0.79 1.63 -3.27 0.00 -0.02 -1.26 -4.90 135.00 126.38 2xdm n PRO 231 Ca 0.09 0.57 -0.40 0.00 -2.02 0.00 0.00 63.50 61.74 2xdm n PRO 231 Cb 0.50 -2.02 -0.08 0.00 -0.02 0.00 0.00 33.50 31.88 2xdm n PRO 231 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2xdm s VAL 232 N -1.03 5.08 -0.10 -1.45 1.01 0.28 -4.93 120.40 119.26 2xdm s VAL 232 Ca 0.58 0.68 0.01 0.00 0.00 0.00 0.00 61.98 63.25 2xdm s VAL 232 Cb -0.66 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 31.87 2xdm s VAL 232 CO 0.60 0.03 -0.11 0.42 0.00 0.00 0.00 175.10 176.04 2xdm s THR 233 N 2.28 3.28 -0.05 3.92 -4.23 -1.26 -0.06 115.64 119.52 2xdm s THR 233 Ca 0.19 -0.61 -0.03 0.00 -1.18 0.00 0.00 61.69 60.06 2xdm s THR 233 Cb -0.16 -2.36 0.02 0.00 1.34 0.00 0.00 72.50 71.35 2xdm s THR 233 CO 0.10 0.55 0.13 0.00 -0.54 0.00 0.00 174.62 174.86 2xdm s ALA 234 N -0.13 -0.27 -0.24 3.99 0.00 -0.04 -4.98 121.76 120.08 2xdm s ALA 234 Ca -0.00 0.48 -0.25 0.00 0.00 0.00 0.00 51.96 52.18 2xdm s ALA 234 Cb -0.13 -0.30 -0.00 0.00 0.00 0.00 0.00 23.12 22.68 2xdm s ALA 234 CO 0.03 -0.10 0.86 -0.51 0.00 0.00 0.00 175.76 176.05 2xdm s LEU 235 N 0.55 4.08 0.06 0.00 1.43 -1.26 -0.23 118.68 123.31 2xdm s LEU 235 Ca -0.04 1.09 0.09 0.00 -1.03 0.00 0.00 54.13 54.24 2xdm s LEU 235 Cb -0.06 -3.24 -0.03 0.00 0.03 0.00 0.00 46.19 42.89 2xdm s LEU 235 CO -0.02 -0.54 -0.25 -0.13 0.23 0.00 0.00 176.35 175.63 2xdm s ARG 236 N 2.90 1.66 0.58 1.70 1.81 -0.45 -4.13 118.95 123.01 2xdm s ARG 236 Ca 0.36 -1.11 -0.12 0.00 -1.72 0.00 0.00 55.73 53.14 2xdm s ARG 236 Cb -0.15 -1.87 -0.05 0.00 -0.45 0.00 0.00 34.95 32.43 2xdm s ARG 236 CO 0.07 0.48 1.00 0.95 -0.68 0.00 0.00 175.30 177.12 2xdm s THR 237 N -0.84 4.67 0.22 0.02 -4.23 -0.59 -0.38 115.64 114.51 2xdm s THR 237 Ca 0.11 0.93 0.09 0.00 -1.18 0.00 0.00 61.69 61.64 2xdm s THR 237 Cb -0.10 -3.83 -0.04 0.00 1.34 0.00 0.00 72.50 69.87 2xdm s THR 237 CO 0.03 -1.00 -0.01 0.68 -0.54 0.00 0.00 174.62 173.78 2xdm s VAL 238 N -2.99 3.53 0.21 2.29 -7.23 -0.99 -4.83 120.40 110.39 2xdm s VAL 238 Ca 0.56 -1.69 -0.30 0.00 -1.81 0.00 0.00 61.98 58.73 2xdm s VAL 238 Cb -0.11 -2.83 -0.08 0.00 0.56 0.00 0.00 36.38 33.92 2xdm s VAL 238 CO 0.47 -0.24 1.15 -0.62 -0.31 0.00 0.00 175.10 175.54 2xdm s ASP 239 N -3.30 7.18 -0.70 4.85 2.15 -1.26 -4.42 116.67 121.16 2xdm s ASP 239 Ca 0.29 2.21 -0.02 0.00 0.43 0.00 0.00 52.55 55.46 2xdm s ASP 239 Cb -0.08 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 39.93 2xdm s ASP 239 CO 0.19 -0.27 0.69 -0.62 -0.17 0.00 0.00 175.17 174.98 2xdm n GLU 240 N 2.10 -1.46 -0.35 4.34 -0.58 -1.26 -4.74 120.64 118.69 2xdm n GLU 240 Ca 0.02 1.57 0.24 0.00 -0.42 0.00 0.00 57.16 58.58 2xdm n GLU 240 Cb 0.45 -5.69 0.51 0.00 -0.57 0.00 0.00 31.44 26.14 2xdm n GLU 240 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 2xdm h PRO 241 N 0.65 0.35 -0.50 3.49 0.11 -1.85 -0.61 132.00 133.64 2xdm h PRO 241 Ca -0.01 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 2xdm h PRO 241 Cb 1.01 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 2xdm h PRO 241 CO 0.29 0.23 -0.00 0.00 -0.21 0.00 0.00 178.00 178.31 2xdm h ALA 242 N 1.66 1.06 -0.58 -0.75 0.00 -1.79 -1.14 119.26 117.72 2xdm h ALA 242 Ca 0.65 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 55.22 2xdm h ALA 242 Cb 1.66 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 2xdm h ALA 242 CO -0.38 0.59 0.07 0.00 0.00 0.00 0.00 179.25 179.53 2xdm h ALA 243 N 1.22 1.03 -0.33 0.00 0.00 -1.42 0.16 119.26 119.92 2xdm h ALA 243 Ca 0.15 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 2xdm h ALA 243 Cb 0.47 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2xdm h ALA 243 CO 0.02 0.62 -0.01 1.25 0.00 0.00 0.00 179.25 181.13 2xdm h LEU 244 N 0.89 0.58 -0.49 0.00 5.85 -1.30 -0.47 115.31 120.37 2xdm h LEU 244 Ca 0.18 -0.31 0.09 0.00 0.84 0.00 0.00 57.88 58.68 2xdm h LEU 244 Cb 0.43 -0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.22 2xdm h LEU 244 CO 0.01 0.75 0.03 0.00 -0.34 0.00 0.00 178.44 178.89 2xdm h ALA 245 N 0.85 0.49 -0.72 1.25 0.00 -0.87 0.24 119.26 120.49 2xdm h ALA 245 Ca 0.09 0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.16 2xdm h ALA 245 Cb 0.46 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2xdm h ALA 245 CO 0.02 -0.37 0.46 0.78 0.00 0.00 0.00 179.25 180.14 2xdm h GLY 246 N 0.14 1.03 0.97 0.00 0.00 -0.59 0.26 103.07 104.89 2xdm h GLY 246 Ca 0.25 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2xdm h GLY 246 CO -0.39 0.31 0.01 0.84 0.00 0.00 0.00 176.54 177.32 2xdm h HIS 247 N 0.91 0.03 -0.14 5.60 6.17 -0.26 -1.31 115.15 126.15 2xdm h HIS 247 Ca 0.28 0.00 -0.09 0.00 0.71 0.00 0.00 60.37 61.27 2xdm h HIS 247 Cb -0.02 -0.01 -0.01 0.00 2.52 0.00 0.00 27.41 29.89 2xdm h HIS 247 CO -0.03 0.05 -0.32 -0.07 0.71 0.00 0.00 177.93 178.26 2xdm h LEU 248 N 0.01 0.27 -0.65 0.26 3.38 -0.32 -2.63 115.31 115.62 2xdm h LEU 248 Ca 0.01 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 2xdm h LEU 248 Cb 0.02 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2xdm h LEU 248 CO -0.00 0.58 0.01 0.15 0.09 0.00 0.00 178.44 179.27 2xdm h PHE 249 N 0.23 1.14 -0.31 1.13 3.57 -0.78 0.19 116.94 122.12 2xdm h PHE 249 Ca 0.03 -0.19 0.06 0.00 3.53 0.00 0.00 57.97 61.40 2xdm h PHE 249 Cb 0.69 -0.30 -0.06 0.00 2.79 0.00 0.00 35.95 39.07 2xdm h PHE 249 CO 0.01 1.01 -0.07 1.49 -2.23 0.00 0.00 178.31 178.52 2xdm h GLU 250 N 0.96 0.01 -0.59 1.11 4.57 -0.88 0.33 114.58 120.09 2xdm h GLU 250 Ca 0.17 -0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.27 2xdm h GLU 250 Cb 0.55 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 2xdm h GLU 250 CO 0.03 0.01 0.07 0.93 -1.18 0.00 0.00 179.01 178.86 2xdm h GLU 251 N 0.01 1.00 -0.40 1.92 5.08 -1.42 -1.11 114.58 119.67 2xdm h GLU 251 Ca 0.15 -0.28 0.03 0.00 -1.00 0.00 0.00 59.36 58.26 2xdm h GLU 251 Cb 0.23 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.33 2xdm h GLU 251 CO -0.32 0.96 0.19 0.00 -1.00 0.00 0.00 179.01 178.84 2xdm h ALA 252 N 1.00 0.49 0.10 3.43 0.00 -0.44 0.17 119.26 124.01 2xdm h ALA 252 Ca 0.18 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2xdm h ALA 252 Cb 0.46 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2xdm h ALA 252 CO 0.02 -0.18 -0.06 -0.07 0.00 0.00 0.00 179.25 178.95 2xdm h LEU 253 N 0.38 -0.15 -0.73 0.00 3.38 -0.08 -1.57 115.31 116.53 2xdm h LEU 253 Ca 0.17 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 2xdm h LEU 253 Cb 0.10 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2xdm h LEU 253 CO -0.14 -0.10 0.38 -0.08 0.09 0.00 0.00 178.44 178.60 2xdm h GLU 254 N -0.15 1.03 -0.22 1.13 4.57 -1.03 -0.35 114.58 119.55 2xdm h GLU 254 Ca -0.01 -0.13 0.01 0.00 -1.18 0.00 0.00 59.36 58.05 2xdm h GLU 254 Cb 0.13 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.51 2xdm h GLU 254 CO 0.01 0.78 0.15 1.03 -1.18 0.00 0.00 179.01 179.80 2xdm h SER 255 N 1.01 0.21 -0.39 1.04 0.87 -0.53 -1.51 113.55 114.25 2xdm h SER 255 Ca 0.25 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 2xdm h SER 255 Cb 0.07 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 2xdm h SER 255 CO -0.04 0.15 0.00 0.59 -0.53 0.00 0.00 176.83 177.00 2xdm n ASN 256 N -4.50 4.16 -0.97 6.23 3.02 -0.28 -4.92 115.26 117.99 2xdm n ASN 256 Ca 0.01 -2.61 -0.08 0.00 -0.03 0.00 0.00 54.58 51.87 2xdm n ASN 256 Cb 0.12 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.67 2xdm n ASN 256 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2xdm n GLY 257 N 0.45 0.10 3.22 7.41 0.00 -0.57 -4.84 105.19 110.97 2xdm n GLY 257 Ca 0.19 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 2xdm n GLY 257 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2xdm s VAL 258 N -2.48 3.08 -0.24 1.61 1.01 -0.39 -4.79 120.40 118.19 2xdm s VAL 258 Ca 0.03 -1.04 -0.28 0.00 0.00 0.00 0.00 61.98 60.69 2xdm s VAL 258 Cb -0.01 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.77 2xdm s VAL 258 CO 0.04 0.12 1.02 -0.89 0.00 0.00 0.00 175.10 175.38 2xdm s THR 259 N 1.34 4.68 -0.32 3.92 2.01 -0.25 -2.96 115.64 124.05 2xdm s THR 259 Ca -0.00 1.92 -0.12 0.00 0.31 0.00 0.00 61.69 63.80 2xdm s THR 259 Cb -0.17 -4.30 -0.02 0.00 0.01 0.00 0.00 72.50 68.02 2xdm s THR 259 CO -0.03 -0.21 0.21 -0.69 -0.69 0.00 0.00 174.62 173.22 2xdm s VAL 260 N 3.22 5.16 -0.30 3.82 1.01 -1.26 0.26 120.40 132.31 2xdm s VAL 260 Ca 0.43 -0.18 0.22 0.00 0.00 0.00 0.00 61.98 62.45 2xdm s VAL 260 Cb -0.15 -3.61 -0.13 0.00 0.00 0.00 0.00 36.38 32.49 2xdm s VAL 260 CO 0.08 0.05 0.88 0.29 0.00 0.00 0.00 175.10 176.40 2xdm n LYS 261 N 5.07 0.52 0.00 2.72 4.76 0.62 -4.96 118.16 126.89 2xdm n LYS 261 Ca -0.13 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.30 2xdm n LYS 261 Cb 0.50 -1.67 0.00 0.00 -1.84 0.00 0.00 35.03 32.02 2xdm n LYS 261 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2xdm n GLY 262 N 1.26 2.91 3.99 0.72 0.00 -0.58 -4.98 105.19 108.52 2xdm n GLY 262 Ca -0.01 -1.88 -0.19 0.00 0.00 0.00 0.00 46.02 43.95 2xdm n GLY 262 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2xdm s ASP 263 N -0.38 5.50 -0.11 1.61 1.01 -1.26 -4.82 116.67 118.21 2xdm s ASP 263 Ca 0.00 -0.26 0.02 0.00 0.71 0.00 0.00 52.55 53.03 2xdm s ASP 263 Cb 0.00 -0.74 -0.01 0.00 1.01 0.00 0.00 42.92 43.18 2xdm s ASP 263 CO 0.00 -0.92 -0.20 -0.69 0.21 0.00 0.00 175.17 173.57 2xdm s VAL 264 N -2.52 2.46 0.09 -1.27 1.01 -1.26 -0.35 120.40 118.56 2xdm s VAL 264 Ca 0.56 -0.88 -0.08 0.00 0.00 0.00 0.00 61.98 61.58 2xdm s VAL 264 Cb -0.10 -1.98 0.03 0.00 0.00 0.00 0.00 36.38 34.33 2xdm s VAL 264 CO 0.35 0.55 0.39 0.61 0.00 0.00 0.00 175.10 177.00 2xdm n GLY 265 N 3.49 1.13 3.83 4.51 0.00 -0.85 -5.01 105.19 112.28 2xdm n GLY 265 Ca -0.19 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.46 2xdm n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2xdm s LEU 266 N 0.00 4.19 0.00 0.99 1.43 -1.26 -0.54 118.68 123.50 2xdm s LEU 266 Ca 0.09 1.41 0.00 0.00 -1.03 0.00 0.00 54.13 54.60 2xdm s LEU 266 Cb -0.01 -3.90 0.00 0.00 0.03 0.00 0.00 46.19 42.31 2xdm s LEU 266 CO 0.03 -0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.11 2xdm n GLY 267 N 0.15 2.07 3.90 -3.19 0.00 -1.01 -4.81 105.19 102.31 2xdm n GLY 267 Ca 0.01 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2xdm n GLY 267 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2xdm s GLY 268 N 0.00 2.05 -0.09 -0.02 0.00 -1.26 -3.29 107.32 104.70 2xdm s GLY 268 Ca 0.00 -0.60 -0.37 0.00 0.00 0.00 0.00 44.72 43.75 2xdm s GLY 268 CO 0.00 -0.52 1.68 -0.62 0.00 0.00 0.00 173.10 173.65 2xdm n VAL 269 N -0.34 0.29 0.01 1.40 0.31 -1.26 -4.86 118.33 113.89 2xdm n VAL 269 Ca -0.03 -0.05 0.22 0.00 -0.01 0.00 0.00 64.34 64.48 2xdm n VAL 269 Cb 0.53 -1.38 0.66 0.00 -0.91 0.00 0.00 33.84 32.74 2xdm n VAL 269 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2xdm h PRO 270 N 7.11 0.00 0.00 5.55 0.11 -1.96 -3.45 132.00 139.36 2xdm h PRO 270 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2xdm h PRO 270 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2xdm h PRO 270 CO 0.91 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.70 2xdm n ALA 271 N -2.30 0.00 -0.36 -0.75 0.00 -1.26 -4.48 120.51 111.36 2xdm n ALA 271 Ca 0.12 0.00 0.37 0.00 0.00 0.00 0.00 53.44 53.92 2xdm n ALA 271 Cb 0.87 0.00 0.76 0.00 0.00 0.00 0.00 19.45 21.08 2xdm n ALA 271 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2xdm h ASP 272 N 0.00 0.00 -2.67 0.00 3.58 -2.01 -3.41 116.42 111.91 2xdm h ASP 272 Ca 0.00 0.00 -0.55 0.00 0.42 0.00 0.00 57.03 56.90 2xdm h ASP 272 Cb 0.00 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.01 2xdm h ASP 272 CO 0.00 0.00 1.23 0.26 -2.88 0.00 0.00 179.24 177.85 2xdm s TRP 273 N -4.94 1.96 0.08 0.28 0.52 -1.26 -4.90 118.94 110.68 2xdm s TRP 273 Ca -0.05 0.65 -0.30 0.00 0.02 0.00 0.00 56.10 56.42 2xdm s TRP 273 Cb 0.23 -4.19 -0.14 0.00 -1.15 0.00 0.00 33.47 28.22 2xdm s TRP 273 CO 0.81 -2.48 1.47 0.37 0.02 0.00 0.00 176.95 177.15 2xdm h GLN 274 N 12.64 -0.75 -2.45 4.98 5.75 -1.91 -3.39 115.11 129.97 2xdm h GLN 274 Ca -0.30 0.05 -0.46 0.00 -0.15 0.00 0.00 58.65 57.79 2xdm h GLN 274 Cb 1.14 0.17 -0.37 0.00 1.07 0.00 0.00 27.48 29.50 2xdm h GLN 274 CO 1.10 -0.50 -0.74 -0.51 -2.65 0.00 0.00 178.83 175.53 2xdm s ASP 275 N -4.15 2.58 0.22 -0.69 1.01 -1.26 -5.12 116.67 109.26 2xdm s ASP 275 Ca -0.15 -1.39 -0.31 0.00 0.71 0.00 0.00 52.55 51.42 2xdm s ASP 275 Cb 0.04 -0.00 -0.11 0.00 1.01 0.00 0.00 42.92 43.86 2xdm s ASP 275 CO 0.51 -0.37 1.59 0.00 0.21 0.00 0.00 175.17 177.11 2xdm s ALA 276 N 1.85 3.78 -0.30 5.23 0.00 -1.26 -4.78 121.76 126.27 2xdm s ALA 276 Ca 0.12 1.46 -0.28 0.00 0.00 0.00 0.00 51.96 53.27 2xdm s ALA 276 Cb -0.17 -3.63 0.01 0.00 0.00 0.00 0.00 23.12 19.33 2xdm s ALA 276 CO -0.23 -0.86 1.02 -2.00 0.00 0.00 0.00 175.76 173.70 2xdm s GLU 277 N 0.43 4.09 -0.36 0.00 2.56 0.47 -4.93 118.70 120.97 2xdm s GLU 277 Ca 0.67 1.06 -0.24 0.00 0.00 0.00 0.00 54.97 56.46 2xdm s GLU 277 Cb -0.46 -3.71 0.01 0.00 2.00 0.00 0.00 34.13 31.97 2xdm s GLU 277 CO 0.38 -0.81 0.85 0.08 -0.56 0.00 0.00 175.26 175.20 2xdm s VAL 278 N 3.44 4.68 -0.26 3.70 1.01 -1.26 -1.52 120.40 130.18 2xdm s VAL 278 Ca 0.43 1.06 0.22 0.00 0.00 0.00 0.00 61.98 63.69 2xdm s VAL 278 Cb -0.13 -4.25 -0.28 0.00 0.00 0.00 0.00 36.38 31.72 2xdm s VAL 278 CO 0.13 -0.45 0.64 0.18 0.00 0.00 0.00 175.10 175.59 2xdm n LEU 279 N 6.54 0.28 -3.53 3.92 4.77 0.31 -4.94 117.00 124.36 2xdm n LEU 279 Ca 0.05 -0.07 -0.17 0.00 -0.03 0.00 0.00 56.01 55.79 2xdm n LEU 279 Cb 0.48 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.50 2xdm n LEU 279 CO 0.55 0.03 0.48 0.00 -1.33 0.00 0.00 177.39 177.12 2xdm s ALA 280 N -3.39 -1.79 0.15 -1.18 0.00 -1.22 -3.85 121.76 110.48 2xdm s ALA 280 Ca -0.04 1.35 -0.08 0.00 0.00 0.00 0.00 51.96 53.19 2xdm s ALA 280 Cb 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 2xdm s ALA 280 CO 0.89 -0.36 0.25 0.16 0.00 0.00 0.00 175.76 176.70 2xdm s ASP 281 N -1.18 0.07 -0.07 0.00 -4.77 -1.26 0.20 116.67 109.65 2xdm s ASP 281 Ca -0.10 -0.85 -0.10 0.00 -3.30 0.00 0.00 52.55 48.21 2xdm s ASP 281 Cb -0.00 0.41 0.02 0.00 -1.09 0.00 0.00 42.92 42.26 2xdm s ASP 281 CO 0.09 -0.85 0.25 -2.28 0.70 0.00 0.00 175.17 173.08 2xdm s HIS 282 N -3.95 -0.23 -0.11 2.11 2.46 0.10 -4.88 115.29 110.79 2xdm s HIS 282 Ca 0.15 0.52 0.03 0.00 0.47 0.00 0.00 55.06 56.24 2xdm s HIS 282 Cb 0.04 0.08 0.00 0.00 -0.13 0.00 0.00 32.58 32.57 2xdm s HIS 282 CO -0.02 -0.19 -0.23 0.99 -2.47 0.00 0.00 174.74 172.82 2xdm s THR 283 N -0.28 2.14 1.15 0.89 2.01 -1.26 -1.22 115.64 119.07 2xdm s THR 283 Ca -0.04 -0.98 -0.14 0.00 0.31 0.00 0.00 61.69 60.84 2xdm s THR 283 Cb -0.03 -1.83 0.27 0.00 0.01 0.00 0.00 72.50 70.92 2xdm s THR 283 CO 0.01 0.55 1.04 -0.94 -0.69 0.00 0.00 174.62 174.60 2xdm s SER 284 N 0.44 1.17 1.12 3.53 1.04 0.93 -4.95 113.70 116.98 2xdm s SER 284 Ca -0.16 1.26 -0.16 0.00 0.48 0.00 0.00 55.95 57.37 2xdm s SER 284 Cb -0.17 -1.96 0.25 0.00 0.10 0.00 0.00 66.02 64.24 2xdm s SER 284 CO 0.06 -4.05 1.10 0.00 0.98 0.00 0.00 173.24 171.34 2xdm s ALA 285 N -2.63 0.70 0.54 5.32 0.00 -1.26 -4.53 121.76 119.90 2xdm s ALA 285 Ca 0.68 -0.70 -0.08 0.00 0.00 0.00 0.00 51.96 51.86 2xdm s ALA 285 Cb -0.21 -2.98 -0.03 0.00 0.00 0.00 0.00 23.12 19.89 2xdm s ALA 285 CO 0.62 -3.31 0.89 -1.21 0.00 0.00 0.00 175.76 172.75 2xdm s GLU 286 N -5.21 3.51 0.25 0.00 2.02 -1.26 -4.43 118.70 113.57 2xdm s GLU 286 Ca 0.69 0.39 -0.03 0.00 0.02 0.00 0.00 54.97 56.04 2xdm s GLU 286 Cb -0.14 -2.25 0.48 0.00 0.10 0.00 0.00 34.13 32.32 2xdm s GLU 286 CO 0.57 -0.39 1.73 1.25 0.02 0.00 0.00 175.26 178.44 2xdm h LEU 287 N -0.02 0.32 -0.96 1.80 5.85 -0.25 -1.38 115.31 120.67 2xdm h LEU 287 Ca -0.46 0.11 0.16 0.00 0.84 0.00 0.00 57.88 58.53 2xdm h LEU 287 Cb 1.20 0.08 -0.10 0.00 0.37 0.00 0.00 40.66 42.21 2xdm h LEU 287 CO 0.62 0.12 0.56 0.77 -0.34 0.00 0.00 178.44 180.17 2xdm h SER 288 N 0.47 0.74 -0.15 1.25 4.64 -1.83 0.23 113.55 118.91 2xdm h SER 288 Ca 0.43 0.08 -0.15 0.00 -0.47 0.00 0.00 61.79 61.68 2xdm h SER 288 Cb 0.64 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2xdm h SER 288 CO -0.40 0.31 -0.50 -0.08 -0.87 0.00 0.00 176.83 175.30 2xdm h GLU 289 N 0.78 0.60 0.00 4.77 4.81 -1.60 -3.26 114.58 120.67 2xdm h GLU 289 Ca 0.52 -0.44 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2xdm h GLU 289 Cb 0.72 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.17 2xdm h GLU 289 CO -0.35 1.07 -0.12 0.82 -0.73 0.00 0.00 179.01 179.70 2xdm h ILE 290 N 0.25 0.82 0.00 2.32 2.04 -0.28 -2.49 117.51 120.16 2xdm h ILE 290 Ca -0.02 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 2xdm h ILE 290 Cb 1.12 1.27 -0.00 0.00 -0.74 0.00 0.00 36.82 38.47 2xdm h ILE 290 CO 0.11 0.12 -0.04 -0.07 0.00 0.00 0.00 178.15 178.26 2xdm h LEU 291 N 0.00 0.00 0.38 1.44 3.38 -0.65 -2.92 115.31 116.94 2xdm h LEU 291 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2xdm h LEU 291 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2xdm h LEU 291 CO 0.02 0.04 -0.18 0.58 0.09 0.00 0.00 178.44 178.99 2xdm h VAL 292 N 0.00 0.00 -0.88 1.22 2.07 -1.60 -0.11 116.25 116.95 2xdm h VAL 292 Ca -0.00 -0.30 0.05 0.00 0.82 0.00 0.00 66.70 67.28 2xdm h VAL 292 Cb 0.14 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.85 2xdm h VAL 292 CO 0.01 0.00 0.57 1.55 0.02 0.00 0.00 177.57 179.72 2xdm h PRO 293 N -0.81 1.00 0.10 1.57 0.13 -1.74 0.07 132.00 132.32 2xdm h PRO 293 Ca -0.05 -0.06 0.02 0.00 -0.87 0.00 0.00 66.00 65.04 2xdm h PRO 293 Cb 0.39 -0.23 -0.05 0.00 0.13 0.00 0.00 31.00 31.25 2xdm h PRO 293 CO 0.09 0.66 -0.45 0.35 -0.23 0.00 0.00 178.00 178.42 2xdm h PHE 294 N 1.03 -1.28 0.20 1.56 -0.00 -1.53 -2.99 116.94 113.93 2xdm h PHE 294 Ca 0.37 0.03 -0.35 0.00 -0.00 0.00 0.00 57.97 58.03 2xdm h PHE 294 Cb 0.13 0.55 0.02 0.00 -0.00 0.00 0.00 35.95 36.65 2xdm h PHE 294 CO -0.00 -0.54 -1.67 0.52 -0.00 0.00 0.00 178.31 176.62 2xdm h MET 295 N -0.67 0.43 -0.96 1.11 2.86 -0.73 0.17 114.93 117.14 2xdm h MET 295 Ca 0.02 -0.73 0.08 0.00 -2.06 0.00 0.00 59.70 57.00 2xdm h MET 295 Cb 0.70 0.27 -0.07 0.00 0.06 0.00 0.00 31.60 32.57 2xdm h MET 295 CO -0.27 1.34 0.61 0.87 1.06 0.00 0.00 176.91 180.53 2xdm h LYS 296 N 0.12 1.05 -0.01 1.72 1.79 -0.69 -2.97 116.57 117.58 2xdm h LYS 296 Ca -0.31 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.09 2xdm h LYS 296 Cb 2.12 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 32.53 2xdm h LYS 296 CO 0.21 0.69 -0.12 1.19 -1.08 0.00 0.00 179.45 180.33 2xdm n PHE 297 N -4.56 0.00 -2.73 -1.35 3.72 -1.13 -1.00 117.46 110.41 2xdm n PHE 297 Ca 0.15 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.45 2xdm n PHE 297 Cb 0.22 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.81 2xdm n PHE 297 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2xdm n SER 298 N 0.23 -3.67 -4.62 4.37 2.88 -0.26 -4.92 113.62 107.63 2xdm n SER 298 Ca 0.06 -0.42 -0.43 0.00 -1.33 0.00 0.00 58.87 56.75 2xdm n SER 298 Cb 0.28 -3.44 -0.02 0.00 -0.75 0.00 0.00 64.21 60.28 2xdm n SER 298 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2xdm s ASN 299 N -3.51 6.41 0.07 -3.46 3.04 0.45 -4.92 114.94 113.02 2xdm s ASN 299 Ca 0.16 1.21 -0.21 0.00 0.04 0.00 0.00 52.86 54.06 2xdm s ASN 299 Cb -0.02 -2.54 -0.11 0.00 -1.54 0.00 0.00 41.25 37.04 2xdm s ASN 299 CO 0.46 -1.30 1.56 0.78 -3.04 0.00 0.00 177.10 175.56 2xdm h ASN 300 N 10.47 0.24 -0.67 -4.21 2.35 -1.90 -2.90 115.58 118.97 2xdm h ASN 300 Ca -0.29 -0.23 0.03 0.00 -0.55 0.00 0.00 56.30 55.25 2xdm h ASN 300 Cb 1.12 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 39.39 2xdm h ASN 300 CO 1.04 0.41 0.42 1.23 -1.65 0.00 0.00 177.43 178.88 2xdm h GLY 301 N 0.06 0.96 0.49 2.83 0.00 -1.87 -2.27 103.07 103.26 2xdm h GLY 301 Ca 0.05 -0.32 0.06 0.00 0.00 0.00 0.00 47.33 47.12 2xdm h GLY 301 CO 0.00 0.27 0.01 0.45 0.00 0.00 0.00 176.54 177.27 2xdm h HIS 302 N 0.82 -0.00 -0.35 5.60 3.86 -1.90 -1.06 115.15 122.12 2xdm h HIS 302 Ca 0.27 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.55 2xdm h HIS 302 Cb 0.01 0.05 -0.04 0.00 1.06 0.00 0.00 27.41 28.48 2xdm h HIS 302 CO -0.04 -0.05 0.09 0.00 0.86 0.00 0.00 177.93 178.78 2xdm h ALA 303 N 1.28 0.39 -0.06 2.45 0.00 -1.23 0.75 119.26 122.84 2xdm h ALA 303 Ca 0.16 0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.97 2xdm h ALA 303 Cb 0.21 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2xdm h ALA 303 CO -0.26 -0.32 -0.66 0.93 0.00 0.00 0.00 179.25 178.94 2xdm h GLU 304 N 0.21 0.25 -0.74 0.00 4.39 -1.29 -1.80 114.58 115.59 2xdm h GLU 304 Ca 0.17 -0.19 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 2xdm h GLU 304 Cb 0.18 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.83 2xdm h GLU 304 CO -0.21 0.82 0.35 0.52 -1.16 0.00 0.00 179.01 179.33 2xdm h MET 305 N 0.17 1.07 -0.50 2.33 2.86 -0.87 -2.39 114.93 117.59 2xdm h MET 305 Ca -0.01 -0.15 -0.09 0.00 -2.06 0.00 0.00 59.70 57.38 2xdm h MET 305 Cb 1.19 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.64 2xdm h MET 305 CO 0.10 0.83 -0.05 -0.07 1.06 0.00 0.00 176.91 178.78 2xdm h LEU 306 N 1.06 0.91 -0.20 1.22 3.38 -0.36 0.05 115.31 121.35 2xdm h LEU 306 Ca 0.26 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.94 2xdm h LEU 306 Cb 0.12 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 2xdm h LEU 306 CO -0.03 1.02 -0.09 0.58 0.09 0.00 0.00 178.44 180.01 2xdm h VAL 307 N 0.77 0.70 -0.43 1.22 2.07 -1.34 0.12 116.25 119.36 2xdm h VAL 307 Ca 0.14 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.56 2xdm h VAL 307 Cb 0.59 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 2xdm h VAL 307 CO 0.04 0.00 -0.12 0.11 0.02 0.00 0.00 177.57 177.61 2xdm h LYS 308 N -0.07 0.77 -0.42 1.57 1.57 -1.24 -0.74 116.57 118.01 2xdm h LYS 308 Ca 0.11 -0.26 0.02 0.00 -1.87 0.00 0.00 60.65 58.64 2xdm h LYS 308 Cb 0.23 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 2xdm h LYS 308 CO -0.25 0.86 0.28 0.77 -0.57 0.00 0.00 179.45 180.54 2xdm h SER 309 N 0.70 0.44 -0.31 0.86 0.02 -0.77 -0.31 113.55 114.18 2xdm h SER 309 Ca 0.12 -0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.95 2xdm h SER 309 Cb 0.60 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2xdm h SER 309 CO 0.04 0.32 -0.24 0.40 -1.14 0.00 0.00 176.83 176.20 2xdm h ILE 310 N 0.52 1.30 -0.61 3.27 2.04 -0.10 -2.05 117.51 121.88 2xdm h ILE 310 Ca 0.16 -1.39 0.04 0.00 1.00 0.00 0.00 64.86 64.67 2xdm h ILE 310 Cb 0.01 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 2xdm h ILE 310 CO -0.04 0.45 0.36 1.23 0.00 0.00 0.00 178.15 180.15 2xdm h GLY 311 N 0.46 0.87 1.03 5.37 0.00 -0.74 0.84 103.07 110.90 2xdm h GLY 311 Ca 0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 2xdm h GLY 311 CO 0.06 0.20 0.39 1.46 0.00 0.00 0.00 176.54 178.65 2xdm h GLN 312 N 0.69 1.14 -0.07 4.80 1.08 -0.69 -1.37 115.11 120.70 2xdm h GLN 312 Ca 0.26 -0.16 -0.08 0.00 -1.45 0.00 0.00 58.65 57.21 2xdm h GLN 312 Cb 0.08 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.30 2xdm h GLN 312 CO -0.13 0.88 -0.28 1.49 -0.95 0.00 0.00 178.83 179.84 2xdm h GLU 313 N 1.13 0.30 0.00 1.46 4.57 -0.78 0.12 114.58 121.37 2xdm h GLU 313 Ca 0.28 -0.24 -0.05 0.00 -1.18 0.00 0.00 59.36 58.17 2xdm h GLU 313 Cb 0.11 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.74 2xdm h GLU 313 CO -0.04 0.88 -0.22 1.79 -1.18 0.00 0.00 179.01 180.24 2xdm h THR 314 N -0.20 0.42 0.00 0.32 1.35 -0.91 -3.40 112.91 110.49 2xdm h THR 314 Ca -0.02 -1.40 0.00 0.00 -0.55 0.00 0.00 66.41 64.44 2xdm h THR 314 Cb 0.92 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 2xdm h THR 314 CO 0.06 0.22 0.00 0.00 -0.25 0.00 0.00 175.52 175.55 2xdm n ALA 315 N -2.17 0.00 -2.31 6.62 0.00 -0.58 -5.03 120.51 117.04 2xdm n ALA 315 Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.31 2xdm n ALA 315 Cb 0.56 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.00 2xdm n ALA 315 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2xdm n GLY 316 N 0.00 -0.23 2.65 0.00 0.00 0.41 -4.93 105.19 103.10 2xdm n GLY 316 Ca 0.00 -0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 2xdm n GLY 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdm s ALA 317 N -2.74 0.83 -1.28 4.61 0.00 -0.83 -4.84 121.76 117.51 2xdm s ALA 317 Ca 0.01 -0.85 -0.17 0.00 0.00 0.00 0.00 51.96 50.96 2xdm s ALA 317 Cb -0.01 -1.26 0.10 0.00 0.00 0.00 0.00 23.12 21.95 2xdm s ALA 317 CO 0.02 -1.38 1.66 0.41 0.00 0.00 0.00 175.76 176.47 2xdm n GLY 318 N 5.13 2.85 3.27 0.00 0.00 -1.25 -2.39 105.19 112.81 2xdm n GLY 318 Ca -0.07 -1.64 -0.14 0.00 0.00 0.00 0.00 46.02 44.18 2xdm n GLY 318 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2xdm s THR 319 N 3.41 0.03 0.16 2.61 2.01 -1.26 0.11 115.64 122.72 2xdm s THR 319 Ca 0.51 -0.27 -0.10 0.00 0.31 0.00 0.00 61.69 62.13 2xdm s THR 319 Cb 0.02 -0.61 0.00 0.00 0.01 0.00 0.00 72.50 71.92 2xdm s THR 319 CO 0.05 -0.15 1.55 -0.50 -0.69 0.00 0.00 174.62 174.88 2xdm h TRP 320 N 4.41 1.14 -0.13 4.92 6.55 -1.91 -0.46 115.95 130.46 2xdm h TRP 320 Ca -0.28 -0.28 0.01 0.00 0.95 0.00 0.00 58.89 59.29 2xdm h TRP 320 Cb 1.18 -0.26 -0.02 0.00 -0.86 0.00 0.00 29.16 29.20 2xdm h TRP 320 CO 0.47 1.11 0.03 -0.44 -1.05 0.00 0.00 178.44 178.56 2xdm h ASP 321 N 0.85 0.02 -0.07 -3.49 3.45 -1.97 -0.54 116.42 114.67 2xdm h ASP 321 Ca 0.11 0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.55 2xdm h ASP 321 Cb 0.81 0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 39.60 2xdm h ASP 321 CO 0.07 0.03 -0.09 0.00 -1.57 0.00 0.00 179.24 177.69 2xdm h ALA 322 N 1.09 0.11 -0.06 3.45 0.00 -1.85 -3.10 119.26 118.91 2xdm h ALA 322 Ca 0.06 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 2xdm h ALA 322 Cb 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2xdm h ALA 322 CO -0.07 -0.06 -0.37 0.78 0.00 0.00 0.00 179.25 179.53 2xdm h GLY 323 N -0.25 0.12 1.31 0.00 0.00 -1.05 -2.27 103.07 100.93 2xdm h GLY 323 Ca 0.01 -0.11 -0.22 0.00 0.00 0.00 0.00 47.33 47.01 2xdm h GLY 323 CO 0.02 0.10 -0.82 1.41 0.00 0.00 0.00 176.54 177.25 2xdm h LEU 324 N 0.10 0.80 -0.54 3.11 4.07 -1.16 -1.17 115.31 120.52 2xdm h LEU 324 Ca 0.01 -0.55 0.00 0.00 0.08 0.00 0.00 57.88 57.42 2xdm h LEU 324 Cb 0.71 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 42.19 2xdm h LEU 324 CO 0.05 1.34 0.34 0.58 -1.08 0.00 0.00 178.44 179.68 2xdm h VAL 325 N 0.43 1.15 -0.82 1.22 2.07 -1.45 -2.13 116.25 116.71 2xdm h VAL 325 Ca -0.06 -0.29 0.08 0.00 0.82 0.00 0.00 66.70 67.24 2xdm h VAL 325 Cb 1.45 0.38 -0.07 0.00 -1.52 0.00 0.00 31.29 31.53 2xdm h VAL 325 CO 0.16 0.14 0.49 1.23 0.02 0.00 0.00 177.57 179.61 2xdm h GLY 326 N 0.72 1.26 0.55 2.17 0.00 -1.26 0.16 103.07 106.67 2xdm h GLY 326 Ca 0.19 -0.34 0.01 0.00 0.00 0.00 0.00 47.33 47.19 2xdm h GLY 326 CO -0.04 0.19 -0.33 -2.08 0.00 0.00 0.00 176.54 174.29 2xdm h VAL 327 N 0.86 0.31 -0.16 4.60 2.07 -0.99 -1.09 116.25 121.86 2xdm h VAL 327 Ca 0.38 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.94 2xdm h VAL 327 Cb 0.26 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.29 2xdm h VAL 327 CO -0.21 0.00 -0.16 -0.08 0.02 0.00 0.00 177.57 177.15 2xdm h GLU 328 N -0.63 -0.17 -0.86 1.57 4.22 -0.68 -1.16 114.58 116.87 2xdm h GLU 328 Ca 0.00 0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.44 2xdm h GLU 328 Cb 0.61 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 2xdm h GLU 328 CO -0.12 -0.12 0.48 0.93 -2.18 0.00 0.00 179.01 178.01 2xdm h GLU 329 N -0.18 1.19 -0.59 1.92 4.39 -0.70 -0.22 114.58 120.39 2xdm h GLU 329 Ca 0.10 -0.13 -0.06 0.00 0.34 0.00 0.00 59.36 59.62 2xdm h GLU 329 Cb 0.33 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 2xdm h GLU 329 CO -0.26 0.86 0.14 0.00 -1.16 0.00 0.00 179.01 178.58 2xdm h ALA 330 N 1.33 0.78 -0.56 3.43 0.00 -0.78 0.61 119.26 124.07 2xdm h ALA 330 Ca 0.30 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2xdm h ALA 330 Cb 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2xdm h ALA 330 CO -0.05 0.50 0.09 -0.07 0.00 0.00 0.00 179.25 179.71 2xdm h LEU 331 N 0.86 0.90 -0.18 0.00 3.38 -0.78 -0.79 115.31 118.69 2xdm h LEU 331 Ca 0.19 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.90 2xdm h LEU 331 Cb 0.36 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2xdm h LEU 331 CO 0.00 0.93 0.09 0.28 0.09 0.00 0.00 178.44 179.84 2xdm h SER 332 N 0.83 0.14 0.14 -0.43 0.02 -0.85 -1.07 113.55 112.34 2xdm h SER 332 Ca 0.17 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 2xdm h SER 332 Cb 0.42 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.94 2xdm h SER 332 CO 0.01 0.11 -0.05 1.23 -1.14 0.00 0.00 176.83 176.99 2xdm h GLY 333 N 0.20 0.00 2.00 -3.77 0.00 -0.67 -0.02 103.07 100.80 2xdm h GLY 333 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2xdm h GLY 333 CO -0.05 0.00 0.00 -2.00 0.00 0.00 0.00 176.54 174.49 2xdm h LEU 334 N 0.00 0.00 0.00 3.11 5.85 -0.54 -3.47 115.31 120.26 2xdm h LEU 334 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2xdm h LEU 334 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 2xdm h LEU 334 CO 0.01 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.72 2xdm n GLY 335 N 0.85 1.10 3.79 3.75 0.00 -0.02 -4.94 105.19 109.71 2xdm n GLY 335 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2xdm n GLY 335 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2xdm s VAL 336 N -2.00 4.86 -0.54 1.61 1.01 -0.46 -5.01 120.40 119.87 2xdm s VAL 336 Ca 0.00 1.19 -0.25 0.00 0.00 0.00 0.00 61.98 62.92 2xdm s VAL 336 Cb 0.00 -3.90 0.04 0.00 0.00 0.00 0.00 36.38 32.52 2xdm s VAL 336 CO 0.00 0.48 0.98 -0.62 0.00 0.00 0.00 175.10 175.95 2xdm s ASP 337 N -0.60 6.39 -0.00 3.32 2.15 -1.26 -4.14 116.67 122.52 2xdm s ASP 337 Ca 0.29 -0.19 0.15 0.00 0.43 0.00 0.00 52.55 53.23 2xdm s ASP 337 Cb -0.18 -2.46 0.44 0.00 -0.30 0.00 0.00 42.92 40.41 2xdm s ASP 337 CO 0.17 -1.24 1.36 0.35 -0.17 0.00 0.00 175.17 175.64 2xdm n THR 338 N 6.32 0.70 -0.15 1.71 -2.24 -1.26 -4.48 114.28 114.88 2xdm n THR 338 Ca 0.04 -0.67 -0.03 0.00 -2.27 0.00 0.00 64.05 61.12 2xdm n THR 338 Cb 0.48 0.31 0.06 0.00 -2.10 0.00 0.00 70.33 69.07 2xdm n THR 338 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2xdm h ALA 339 N 3.89 0.52 0.00 6.98 0.00 -2.03 -2.17 119.26 126.45 2xdm h ALA 339 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2xdm h ALA 339 Cb 0.69 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2xdm h ALA 339 CO 0.01 -0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.36 2xdm n GLY 340 N -1.28 -1.35 3.74 0.00 0.00 -1.26 -4.86 105.19 100.19 2xdm n GLY 340 Ca 0.05 -0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 2xdm n GLY 340 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2xdm s LEU 341 N -2.75 4.48 -0.22 0.99 1.43 -0.82 -4.38 118.68 117.41 2xdm s LEU 341 Ca 0.22 1.59 0.01 0.00 -1.03 0.00 0.00 54.13 54.92 2xdm s LEU 341 Cb 0.19 -3.37 0.05 0.00 0.03 0.00 0.00 46.19 43.10 2xdm s LEU 341 CO 0.48 0.01 -0.09 -0.69 0.23 0.00 0.00 176.35 176.28 2xdm s VAL 342 N -0.14 1.71 -0.35 -1.59 1.01 -0.28 -4.95 120.40 115.81 2xdm s VAL 342 Ca 0.41 -1.18 -0.16 0.00 0.00 0.00 0.00 61.98 61.06 2xdm s VAL 342 Cb -0.22 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.31 2xdm s VAL 342 CO 0.26 0.06 0.38 -0.76 0.00 0.00 0.00 175.10 175.04 2xdm s LEU 343 N 1.34 4.47 -0.01 3.92 1.43 -1.26 -1.63 118.68 126.94 2xdm s LEU 343 Ca -0.04 -0.26 0.05 0.00 -1.03 0.00 0.00 54.13 52.86 2xdm s LEU 343 Cb -0.18 -2.36 -0.08 0.00 0.03 0.00 0.00 46.19 43.60 2xdm s LEU 343 CO -0.07 -0.37 0.12 -3.20 0.23 0.00 0.00 176.35 173.06 2xdm n ASN 344 N 5.43 3.71 -2.97 2.29 5.15 -1.26 -5.00 115.26 122.61 2xdm n ASN 344 Ca -0.09 -0.02 -0.09 0.00 -0.60 0.00 0.00 54.58 53.79 2xdm n ASN 344 Cb 0.49 1.23 0.02 0.00 -0.53 0.00 0.00 39.78 40.99 2xdm n ASN 344 CO 0.00 0.00 0.00 1.51 1.40 0.00 0.00 177.26 180.17 2xdm s ASP 345 N -2.58 0.05 0.02 1.20 1.47 -1.26 -4.98 116.67 110.59 2xdm s ASP 345 Ca -0.02 -1.15 0.19 0.00 1.18 0.00 0.00 52.55 52.75 2xdm s ASP 345 Cb 0.03 0.84 -0.18 0.00 -0.34 0.00 0.00 42.92 43.28 2xdm s ASP 345 CO 0.22 -1.66 0.66 0.61 0.68 0.00 0.00 175.17 175.68 2xdm n GLY 346 N -0.53 -1.16 0.11 2.12 0.00 -1.26 -4.55 105.19 99.91 2xdm n GLY 346 Ca -0.08 -0.25 -0.17 0.00 0.00 0.00 0.00 46.02 45.52 2xdm n GLY 346 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2xdm h SER 347 N 0.00 0.34 0.00 1.61 4.64 -1.84 -3.29 113.55 115.00 2xdm h SER 347 Ca -0.17 -0.55 0.00 0.00 -0.47 0.00 0.00 61.79 60.60 2xdm h SER 347 Cb 1.49 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 2xdm h SER 347 CO 0.03 1.47 0.00 0.61 -0.87 0.00 0.00 176.83 178.07 2xdm n GLY 348 N 1.72 0.63 0.35 -0.77 0.00 -1.26 -4.08 105.19 101.78 2xdm n GLY 348 Ca -0.20 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.86 2xdm n GLY 348 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2xdm h LEU 349 N 0.00 0.78 -9.64 0.99 6.46 -1.94 -3.37 115.31 108.59 2xdm h LEU 349 Ca 0.00 -0.01 -0.52 0.00 -0.12 0.00 0.00 57.88 57.23 2xdm h LEU 349 Cb 0.00 -0.18 0.02 0.00 -0.73 0.00 0.00 40.66 39.78 2xdm h LEU 349 CO 0.00 0.53 0.61 -0.55 -0.62 0.00 0.00 178.44 178.42 2xdm s SER 350 N -6.23 6.98 -0.01 1.25 0.15 -1.26 -4.89 113.70 109.68 2xdm s SER 350 Ca -0.11 2.30 0.04 0.00 0.70 0.00 0.00 55.95 58.89 2xdm s SER 350 Cb 0.19 -2.60 0.15 0.00 -1.71 0.00 0.00 66.02 62.05 2xdm s SER 350 CO 0.78 -0.48 1.03 0.54 1.20 0.00 0.00 173.24 176.31 2xdm n ARG 351 N 2.81 1.51 0.00 5.44 1.74 -1.26 -3.23 116.66 123.66 2xdm n ARG 351 Ca 0.06 -0.61 0.12 0.00 -0.77 0.00 0.00 57.85 56.65 2xdm n ARG 351 Cb 0.44 -1.27 0.13 0.00 -1.02 0.00 0.00 32.46 30.73 2xdm n ARG 351 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2xdm n GLY 352 N 0.59 0.46 3.79 -0.13 0.00 -1.26 -4.95 105.19 103.68 2xdm n GLY 352 Ca 0.06 -0.63 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 2xdm n GLY 352 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2xdm s ASN 353 N -2.20 7.25 -0.03 1.61 0.01 -1.20 -4.53 114.94 115.85 2xdm s ASN 353 Ca 0.26 1.48 0.04 0.00 -0.71 0.00 0.00 52.86 53.92 2xdm s ASN 353 Cb 0.19 -2.44 -0.00 0.00 0.41 0.00 0.00 41.25 39.41 2xdm s ASN 353 CO 0.41 0.21 -0.14 -0.76 -1.51 0.00 0.00 177.10 175.32 2xdm s LEU 354 N -1.01 1.89 0.45 0.60 1.43 -0.65 -4.18 118.68 117.21 2xdm s LEU 354 Ca 0.33 -0.28 0.03 0.00 -1.03 0.00 0.00 54.13 53.18 2xdm s LEU 354 Cb -0.21 -0.79 -0.03 0.00 0.03 0.00 0.00 46.19 45.19 2xdm s LEU 354 CO 0.23 0.13 0.04 0.68 0.23 0.00 0.00 176.35 177.66 2xdm s VAL 355 N 0.03 1.17 0.08 -1.59 -7.23 0.55 -1.12 120.40 112.30 2xdm s VAL 355 Ca -0.02 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.22 2xdm s VAL 355 Cb -0.09 -2.41 -0.03 0.00 0.56 0.00 0.00 36.38 34.40 2xdm s VAL 355 CO 0.01 0.00 -0.18 0.42 -0.31 0.00 0.00 175.10 175.04 2xdm s THR 356 N -2.97 1.44 0.56 5.32 -4.23 -1.26 -0.35 115.64 114.15 2xdm s THR 356 Ca 0.18 -1.40 0.27 0.00 -1.18 0.00 0.00 61.69 59.55 2xdm s THR 356 Cb 0.04 -1.33 0.33 0.00 1.34 0.00 0.00 72.50 72.88 2xdm s THR 356 CO 0.09 -0.11 2.22 0.00 -0.54 0.00 0.00 174.62 176.29 2xdm h ALA 357 N 4.24 1.60 -0.28 3.99 0.00 -1.73 -1.45 119.26 125.64 2xdm h ALA 357 Ca -0.43 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.38 2xdm h ALA 357 Cb 1.18 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2xdm h ALA 357 CO 0.40 0.01 -0.16 -0.44 0.00 0.00 0.00 179.25 179.06 2xdm h ASP 358 N 0.00 0.62 -0.54 0.00 3.32 -1.11 -2.83 116.42 115.89 2xdm h ASP 358 Ca -0.00 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.63 2xdm h ASP 358 Cb 0.03 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 2xdm h ASP 358 CO 0.00 0.91 0.35 0.74 -1.72 0.00 0.00 179.24 179.52 2xdm h THR 359 N 0.33 1.15 0.05 0.35 2.02 -1.53 -0.70 112.91 114.58 2xdm h THR 359 Ca 0.06 -0.29 0.01 0.00 0.77 0.00 0.00 66.41 66.96 2xdm h THR 359 Cb 0.69 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 2xdm h THR 359 CO 0.05 0.14 -0.10 0.58 0.37 0.00 0.00 175.52 176.56 2xdm h VAL 360 N 0.73 0.75 -0.52 3.16 2.07 -1.33 -1.41 116.25 119.70 2xdm h VAL 360 Ca 0.20 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.72 2xdm h VAL 360 Cb -0.06 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 2xdm h VAL 360 CO -0.04 0.00 0.34 0.58 0.02 0.00 0.00 177.57 178.47 2xdm h VAL 361 N -0.20 1.13 -0.47 2.57 2.07 -1.45 -0.44 116.25 119.46 2xdm h VAL 361 Ca 0.02 -0.24 0.07 0.00 0.82 0.00 0.00 66.70 67.38 2xdm h VAL 361 Cb 0.22 0.37 -0.09 0.00 -1.52 0.00 0.00 31.29 30.26 2xdm h VAL 361 CO -0.07 0.13 -0.45 -0.78 0.02 0.00 0.00 177.57 176.42 2xdm h ASP 362 N 0.70 -1.52 -0.87 0.57 -0.00 -0.76 0.48 116.42 115.02 2xdm h ASP 362 Ca 0.19 0.23 0.09 0.00 -0.00 0.00 0.00 57.03 57.54 2xdm h ASP 362 Cb -0.07 0.66 -0.07 0.00 -0.00 0.00 0.00 39.33 39.85 2xdm h ASP 362 CO -0.05 -0.36 0.52 0.25 -0.00 0.00 0.00 179.24 179.60 2xdm h LEU 363 N -0.30 0.77 -0.77 2.28 5.85 -0.89 -0.81 115.31 121.43 2xdm h LEU 363 Ca 0.14 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.84 2xdm h LEU 363 Cb 0.58 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 2xdm h LEU 363 CO -0.62 0.45 0.17 -0.07 -0.34 0.00 0.00 178.44 178.03 2xdm h LEU 364 N 0.88 1.03 -0.19 2.25 3.38 0.34 0.33 115.31 123.33 2xdm h LEU 364 Ca 0.41 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 2xdm h LEU 364 Cb 0.33 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2xdm h LEU 364 CO -0.23 0.99 0.05 1.23 0.09 0.00 0.00 178.44 180.57 2xdm h GLY 365 N 1.08 0.33 1.59 0.83 0.00 -0.57 -2.78 103.07 103.54 2xdm h GLY 365 Ca 0.22 -0.20 -0.08 0.00 0.00 0.00 0.00 47.33 47.27 2xdm h GLY 365 CO 0.00 0.19 -0.15 1.46 0.00 0.00 0.00 176.54 178.04 2xdm h GLN 366 N 0.12 0.49 0.00 4.80 1.08 -0.73 -2.61 115.11 118.26 2xdm h GLN 366 Ca 0.06 -0.15 -0.10 0.00 -1.45 0.00 0.00 58.65 57.01 2xdm h GLN 366 Cb 0.26 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 2xdm h GLN 366 CO 0.00 0.63 -0.47 0.00 -0.95 0.00 0.00 178.83 178.04 2xdm h ALA 367 N 1.39 1.13 0.00 3.87 0.00 -0.39 -3.01 119.26 122.25 2xdm h ALA 367 Ca 0.08 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 2xdm h ALA 367 Cb 0.53 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2xdm h ALA 367 CO 0.03 0.59 -0.09 0.78 0.00 0.00 0.00 179.25 180.56 2xdm h GLY 368 N 1.59 0.00 -0.35 0.00 0.00 -1.17 -3.01 103.07 100.14 2xdm h GLY 368 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2xdm h GLY 368 CO 0.06 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.46 2xdm n SER 369 N -3.36 1.89 -4.72 0.19 3.41 -1.22 -4.82 113.62 105.00 2xdm n SER 369 Ca -0.01 -1.66 -0.35 0.00 -0.26 0.00 0.00 58.87 56.59 2xdm n SER 369 Cb 0.27 -0.04 0.09 0.00 -0.26 0.00 0.00 64.21 64.27 2xdm n SER 369 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2xdm s ALA 370 N -0.72 2.19 0.57 7.33 0.00 -1.14 -4.91 121.76 125.09 2xdm s ALA 370 Ca 0.06 1.03 0.27 0.00 0.00 0.00 0.00 51.96 53.31 2xdm s ALA 370 Cb 0.03 -3.51 1.59 0.00 0.00 0.00 0.00 23.12 21.23 2xdm s ALA 370 CO 0.05 -1.81 2.11 -1.35 0.00 0.00 0.00 175.76 174.75 2xdm h PRO 371 N -0.00 0.00 -0.61 0.00 0.11 -1.94 -2.49 132.00 127.07 2xdm h PRO 371 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2xdm h PRO 371 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2xdm h PRO 371 CO 0.51 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.63 2xdm n TRP 372 N -3.97 0.89 -0.41 0.65 4.27 -1.26 -4.63 117.44 112.97 2xdm n TRP 372 Ca 0.02 -0.42 0.37 0.00 -3.89 0.00 0.00 57.50 53.58 2xdm n TRP 372 Cb 0.31 -0.04 0.71 0.00 -1.36 0.00 0.00 31.31 30.94 2xdm n TRP 372 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2xdm h ALA 373 N 4.07 3.07 0.22 -1.67 0.00 -1.60 -1.65 119.26 121.71 2xdm h ALA 373 Ca 0.00 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.55 2xdm h ALA 373 Cb 0.89 0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.81 2xdm h ALA 373 CO 0.03 -1.51 -1.63 1.96 0.00 0.00 0.00 179.25 178.11 2xdm h GLN 374 N 0.07 0.47 -0.37 0.00 1.08 -1.87 -1.95 115.11 112.55 2xdm h GLN 374 Ca 0.68 -0.80 -0.04 0.00 -1.45 0.00 0.00 58.65 57.03 2xdm h GLN 374 Cb 2.48 0.30 -0.01 0.00 -0.05 0.00 0.00 27.48 30.19 2xdm h GLN 374 CO -0.11 1.38 0.06 0.00 -0.95 0.00 0.00 178.83 179.21 2xdm h THR 375 N 0.13 1.24 -0.26 -0.54 1.03 -1.69 -1.05 112.91 111.77 2xdm h THR 375 Ca -0.30 -0.86 0.06 0.00 -0.01 0.00 0.00 66.41 65.30 2xdm h THR 375 Cb 2.14 1.09 -0.07 0.00 -1.07 0.00 0.00 68.15 70.24 2xdm h THR 375 CO 0.23 0.29 -0.21 -0.25 -0.01 0.00 0.00 175.52 175.56 2xdm h TRP 376 N 0.45 -0.55 -0.69 0.00 2.91 -1.49 -2.90 115.95 113.68 2xdm h TRP 376 Ca 0.11 0.04 -0.03 0.00 1.13 0.00 0.00 58.89 60.13 2xdm h TRP 376 Cb 0.37 0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 29.27 2xdm h TRP 376 CO 0.03 -0.29 0.30 1.03 -1.03 0.00 0.00 178.44 178.48 2xdm h SER 377 N -0.20 0.94 0.60 2.65 0.87 -1.22 -2.77 113.55 114.42 2xdm h SER 377 Ca 0.14 -0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 2xdm h SER 377 Cb 0.42 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.14 2xdm h SER 377 CO -0.38 0.84 -0.05 0.00 -0.53 0.00 0.00 176.83 176.70 2xdm h ALA 378 N 1.14 1.07 0.00 6.23 0.00 -1.08 -3.04 119.26 123.58 2xdm h ALA 378 Ca 0.23 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 2xdm h ALA 378 Cb 0.18 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2xdm h ALA 378 CO -0.02 0.07 -0.42 0.66 0.00 0.00 0.00 179.25 179.54 2xdm h SER 379 N 0.00 0.00 -3.91 0.00 4.64 -1.28 -3.47 113.55 109.52 2xdm h SER 379 Ca -0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 2xdm h SER 379 Cb 0.37 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.51 2xdm h SER 379 CO 0.01 0.42 0.52 -0.76 -0.87 0.00 0.00 176.83 176.14 2xdm s LEU 380 N -6.55 4.28 0.33 5.97 1.43 -1.15 -2.52 118.68 120.46 2xdm s LEU 380 Ca 0.03 2.37 -0.27 0.00 -1.03 0.00 0.00 54.13 55.23 2xdm s LEU 380 Cb 0.08 -3.92 -0.13 0.00 0.03 0.00 0.00 46.19 42.25 2xdm s LEU 380 CO 0.72 -0.57 1.06 -2.65 0.23 0.00 0.00 176.35 175.14 2xdm n PRO 381 N 0.33 1.52 -3.79 1.29 -0.02 -1.24 -4.75 135.00 128.33 2xdm n PRO 381 Ca 0.03 0.53 -0.36 0.00 -2.02 0.00 0.00 63.50 61.68 2xdm n PRO 381 Cb 0.46 -1.99 -0.13 0.00 -0.02 0.00 0.00 33.50 31.82 2xdm n PRO 381 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2xdm s VAL 382 N -1.12 4.07 -0.16 -1.45 1.01 -0.92 -1.74 120.40 120.09 2xdm s VAL 382 Ca 0.59 -0.28 -0.41 0.00 0.00 0.00 0.00 61.98 61.87 2xdm s VAL 382 Cb -0.64 -2.91 -0.18 0.00 0.00 0.00 0.00 36.38 32.65 2xdm s VAL 382 CO 0.60 0.34 1.39 0.00 0.00 0.00 0.00 175.10 177.43 2xdm n ALA 383 N 4.89 -1.81 -1.01 5.51 0.00 -0.25 -2.47 120.51 125.37 2xdm n ALA 383 Ca -0.17 0.52 -0.00 0.00 0.00 0.00 0.00 53.44 53.79 2xdm n ALA 383 Cb 0.51 -1.96 -0.00 0.00 0.00 0.00 0.00 19.45 18.00 2xdm n ALA 383 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2xdm n GLY 384 N 2.87 0.31 3.64 0.00 0.00 0.13 -1.09 105.19 111.05 2xdm n GLY 384 Ca 0.24 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2xdm n GLY 384 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2xdm s GLU 385 N -0.93 4.12 0.24 1.61 0.41 -1.03 -4.77 118.70 118.34 2xdm s GLU 385 Ca 0.00 1.00 -0.07 0.00 -0.41 0.00 0.00 54.97 55.49 2xdm s GLU 385 Cb 0.00 -3.69 0.42 0.00 -1.78 0.00 0.00 34.13 29.08 2xdm s GLU 385 CO 0.00 -0.70 1.64 0.77 -0.49 0.00 0.00 175.26 176.48 2xdm h SER 386 N 7.85 -0.35 -2.51 -0.19 0.02 -1.92 -3.18 113.55 113.26 2xdm h SER 386 Ca -0.22 0.19 -0.56 0.00 -0.84 0.00 0.00 61.79 60.37 2xdm h SER 386 Cb 1.08 0.34 -0.01 0.00 0.14 0.00 0.00 62.40 63.95 2xdm h SER 386 CO 0.95 -0.18 1.21 -0.62 -1.14 0.00 0.00 176.83 177.06 2xdm s ASP 387 N -5.19 6.26 0.30 3.07 -1.08 -1.26 -4.86 116.67 113.90 2xdm s ASP 387 Ca -0.13 1.99 0.02 0.00 -0.52 0.00 0.00 52.55 53.90 2xdm s ASP 387 Cb 0.22 -2.53 0.57 0.00 -1.46 0.00 0.00 42.92 39.73 2xdm s ASP 387 CO 0.75 -1.30 1.89 -0.65 0.52 0.00 0.00 175.17 176.38 2xdm h PRO 388 N 11.36 0.95 0.00 4.34 0.11 -1.93 0.51 132.00 147.34 2xdm h PRO 388 Ca -0.39 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2xdm h PRO 388 Cb 1.19 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.09 2xdm h PRO 388 CO 0.97 0.63 0.00 1.19 -0.21 0.00 0.00 178.00 180.58 2xdm n PHE 389 N -4.53 0.00 -0.02 0.65 3.01 -1.26 -0.47 117.46 114.84 2xdm n PHE 389 Ca 0.15 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.58 2xdm n PHE 389 Cb 0.27 -0.20 -0.01 0.00 -0.01 0.00 0.00 39.48 39.53 2xdm n PHE 389 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 2xdm n VAL 390 N -1.20 0.92 -0.10 -4.37 0.31 0.11 -4.76 118.33 109.25 2xdm n VAL 390 Ca 0.11 0.27 -0.04 0.00 -0.01 0.00 0.00 64.34 64.67 2xdm n VAL 390 Cb 0.13 -1.77 0.17 0.00 -0.91 0.00 0.00 33.84 31.46 2xdm n VAL 390 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2xdm h GLY 391 N -0.38 0.82 0.00 2.92 0.00 -0.19 -2.44 103.07 103.81 2xdm h GLY 391 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 47.33 46.79 2xdm h GLY 391 CO 0.00 0.50 0.00 0.61 0.00 0.00 0.00 176.54 177.65 2xdm n GLY 392 N -0.66 3.10 0.00 4.60 0.00 0.38 -1.65 105.19 110.96 2xdm n GLY 392 Ca 0.02 -0.27 0.07 0.00 0.00 0.00 0.00 46.02 45.84 2xdm n GLY 392 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2xdm n THR 393 N 0.00 0.33 -0.38 2.61 -2.24 -0.17 -2.29 114.28 112.14 2xdm n THR 393 Ca 0.00 0.08 0.06 0.00 -2.27 0.00 0.00 64.05 61.93 2xdm n THR 393 Cb 0.00 -0.84 0.18 0.00 -2.10 0.00 0.00 70.33 67.57 2xdm n THR 393 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2xdm n LEU 394 N -1.16 3.18 0.09 3.22 4.77 -0.66 -4.73 117.00 121.73 2xdm n LEU 394 Ca 0.09 -2.25 0.03 0.00 -0.03 0.00 0.00 56.01 53.84 2xdm n LEU 394 Cb 0.09 -0.31 0.40 0.00 -2.33 0.00 0.00 43.42 41.27 2xdm n LEU 394 CO 0.10 0.72 0.96 0.00 -1.33 0.00 0.00 177.39 177.83 2xdm h ALA 395 N 1.99 1.56 -0.30 -1.18 0.00 -1.36 0.49 119.26 120.45 2xdm h ALA 395 Ca 0.00 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 2xdm h ALA 395 Cb 0.91 -0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.51 2xdm h ALA 395 CO 0.06 0.32 -0.15 0.09 0.00 0.00 0.00 179.25 179.57 2xdm n ASN 396 N -4.33 2.34 -4.11 0.00 3.02 -1.26 -3.94 115.26 106.99 2xdm n ASN 396 Ca -0.00 -3.81 -0.25 0.00 -0.03 0.00 0.00 54.58 50.49 2xdm n ASN 396 Cb 0.21 -0.62 -0.16 0.00 -0.61 0.00 0.00 39.78 38.60 2xdm n ASN 396 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2xdm s ARG 397 N -3.26 1.57 -0.66 3.52 0.52 -1.02 -4.85 118.95 114.77 2xdm s ARG 397 Ca 0.44 -0.54 0.00 0.00 -0.52 0.00 0.00 55.73 55.11 2xdm s ARG 397 Cb 0.40 -1.39 0.00 0.00 0.52 0.00 0.00 34.95 34.48 2xdm s ARG 397 CO -0.01 0.22 0.00 -1.33 0.02 0.00 0.00 175.30 174.20 2xdm n MET 398 N 3.15 -0.65 -1.91 3.54 2.81 -1.26 -1.13 117.12 121.67 2xdm n MET 398 Ca -0.18 0.64 -0.41 0.00 -1.81 0.00 0.00 57.70 55.94 2xdm n MET 398 Cb 0.53 -4.43 -0.02 0.00 -0.71 0.00 0.00 33.22 28.59 2xdm n MET 398 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2xdm s ARG 399 N -2.21 4.20 -1.08 0.03 0.52 -1.26 -2.66 118.95 116.49 2xdm s ARG 399 Ca 0.00 2.43 0.00 0.00 -0.52 0.00 0.00 55.73 57.64 2xdm s ARG 399 Cb 0.00 -3.06 0.00 0.00 0.52 0.00 0.00 34.95 32.41 2xdm s ARG 399 CO 0.00 -0.50 0.00 0.41 0.02 0.00 0.00 175.30 175.23 2xdm n GLY 400 N 1.90 0.49 3.60 -3.53 0.00 -1.26 -5.01 105.19 101.38 2xdm n GLY 400 Ca 0.06 -0.45 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 2xdm n GLY 400 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2xdm s THR 401 N -2.51 1.70 -0.35 2.61 -4.23 -1.09 -4.76 115.64 107.02 2xdm s THR 401 Ca 0.00 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.74 2xdm s THR 401 Cb 0.00 -2.83 0.24 0.00 1.34 0.00 0.00 72.50 71.24 2xdm s THR 401 CO 0.00 0.00 1.69 0.00 -0.54 0.00 0.00 174.62 175.77 2xdm n ALA 402 N -0.95 1.39 0.09 3.99 0.00 -1.26 -2.06 120.51 121.70 2xdm n ALA 402 Ca -0.06 0.14 -0.03 0.00 0.00 0.00 0.00 53.44 53.48 2xdm n ALA 402 Cb 0.67 -1.36 -0.06 0.00 0.00 0.00 0.00 19.45 18.70 2xdm n ALA 402 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2xdm h ALA 403 N 2.14 0.48 -2.16 0.00 0.00 -1.82 -3.41 119.26 114.49 2xdm h ALA 403 Ca 0.00 -0.74 -0.59 0.00 0.00 0.00 0.00 54.91 53.58 2xdm h ALA 403 Cb 0.21 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 17.90 2xdm h ALA 403 CO 0.00 1.01 1.04 -1.91 0.00 0.00 0.00 179.25 179.39 2xdm n GLU 404 N -3.31 2.29 -0.21 0.00 2.13 -0.87 -1.49 120.64 119.18 2xdm n GLU 404 Ca 0.01 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.66 2xdm n GLU 404 Cb 0.86 -2.68 0.00 0.00 0.27 0.00 0.00 31.44 29.89 2xdm n GLU 404 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2xdm n GLY 405 N 4.16 2.11 0.73 8.31 0.00 -0.25 -4.83 105.19 115.43 2xdm n GLY 405 Ca 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.15 2xdm n GLY 405 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2xdm n VAL 406 N -2.00 0.73 -2.23 1.61 0.31 -0.55 -4.96 118.33 111.24 2xdm n VAL 406 Ca 0.00 0.01 -0.43 0.00 -0.01 0.00 0.00 64.34 63.91 2xdm n VAL 406 Cb 0.00 -1.68 -0.02 0.00 -0.91 0.00 0.00 33.84 31.22 2xdm n VAL 406 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2xdm s VAL 407 N -2.20 3.91 -0.26 2.52 1.01 -0.90 -4.52 120.40 119.96 2xdm s VAL 407 Ca -0.11 1.06 -0.09 0.00 0.00 0.00 0.00 61.98 62.84 2xdm s VAL 407 Cb 0.04 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 2xdm s VAL 407 CO 0.15 -0.25 0.11 -1.61 0.00 0.00 0.00 175.10 173.50 2xdm s GLU 408 N 4.18 3.74 -0.18 2.72 2.02 -1.00 -1.09 118.70 129.08 2xdm s GLU 408 Ca 0.65 -0.43 -0.19 0.00 0.02 0.00 0.00 54.97 55.01 2xdm s GLU 408 Cb -0.24 -3.45 0.05 0.00 0.10 0.00 0.00 34.13 30.59 2xdm s GLU 408 CO 0.24 -0.20 0.53 0.00 0.02 0.00 0.00 175.26 175.86 2xdm s ALA 409 N 1.66 -1.33 -0.06 5.21 0.00 -0.71 0.19 121.76 126.72 2xdm s ALA 409 Ca 0.07 1.44 -0.16 0.00 0.00 0.00 0.00 51.96 53.30 2xdm s ALA 409 Cb -0.15 -0.78 -0.05 0.00 0.00 0.00 0.00 23.12 22.14 2xdm s ALA 409 CO 0.06 -0.26 0.43 0.21 0.00 0.00 0.00 175.76 176.20 2xdm s LYS 410 N 0.11 4.14 0.50 0.00 2.47 0.18 -3.73 119.74 123.41 2xdm s LYS 410 Ca -0.01 0.41 0.04 0.00 -1.56 0.00 0.00 55.97 54.84 2xdm s LYS 410 Cb -0.04 -3.33 0.09 0.00 -1.46 0.00 0.00 37.83 33.09 2xdm s LYS 410 CO 0.01 0.42 0.68 0.25 0.16 0.00 0.00 175.35 176.88 2xdm n THR 411 N 2.77 0.00 0.00 3.43 -2.24 -1.26 -1.48 114.28 115.49 2xdm n THR 411 Ca -0.11 -1.33 0.00 0.00 -2.27 0.00 0.00 64.05 60.34 2xdm n THR 411 Cb 0.52 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 2xdm n THR 411 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2xdm n GLY 412 N -0.60 -0.33 3.22 3.38 0.00 -1.05 -3.25 105.19 106.56 2xdm n GLY 412 Ca 0.13 0.73 -0.31 0.00 0.00 0.00 0.00 46.02 46.57 2xdm n GLY 412 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2xdm s THR 413 N 0.00 1.93 0.39 2.61 2.01 -1.26 -1.48 115.64 119.85 2xdm s THR 413 Ca 0.00 -0.97 0.05 0.00 0.31 0.00 0.00 61.69 61.08 2xdm s THR 413 Cb 0.00 -1.66 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 2xdm s THR 413 CO 0.00 0.54 0.20 -0.04 -0.69 0.00 0.00 174.62 174.63 2xdm s MET 414 N 0.12 1.90 0.01 4.92 -1.94 0.32 -4.87 119.30 119.76 2xdm s MET 414 Ca -0.11 -2.15 -0.34 0.00 -1.71 0.00 0.00 55.69 51.39 2xdm s MET 414 Cb -0.15 -0.21 -0.12 0.00 2.01 0.00 0.00 34.83 36.35 2xdm s MET 414 CO 0.06 -0.58 1.78 0.43 -0.01 0.00 0.00 175.02 176.70 2xdm n SER 415 N -1.50 3.38 0.00 3.03 7.64 -1.26 -2.16 113.62 122.75 2xdm n SER 415 Ca -0.01 1.01 0.00 0.00 1.01 0.00 0.00 58.87 60.88 2xdm n SER 415 Cb 0.64 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 2xdm n SER 415 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2xdm n GLY 416 N 4.07 0.38 2.76 0.23 0.00 -1.26 -4.98 105.19 106.39 2xdm n GLY 416 Ca 0.20 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 2xdm n GLY 416 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2xdm s VAL 417 N -1.93 -0.08 0.01 1.61 1.01 -0.92 -0.41 120.40 119.69 2xdm s VAL 417 Ca 0.00 0.28 -0.06 0.00 0.00 0.00 0.00 61.98 62.19 2xdm s VAL 417 Cb 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 36.38 36.25 2xdm s VAL 417 CO 0.00 0.11 0.12 -0.55 0.00 0.00 0.00 175.10 174.78 2xdm s SER 418 N 1.42 0.06 -0.05 3.32 0.15 0.12 -0.52 113.70 118.21 2xdm s SER 418 Ca -0.05 -0.27 -0.18 0.00 0.70 0.00 0.00 55.95 56.15 2xdm s SER 418 Cb -0.13 0.19 0.04 0.00 -1.71 0.00 0.00 66.02 64.42 2xdm s SER 418 CO -0.03 -0.38 0.41 0.00 1.20 0.00 0.00 173.24 174.44 2xdm s ALA 419 N -1.50 -1.05 -0.06 5.45 0.00 -0.55 0.63 121.76 124.68 2xdm s ALA 419 Ca -0.14 0.70 -0.03 0.00 0.00 0.00 0.00 51.96 52.50 2xdm s ALA 419 Cb -0.07 -0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.00 2xdm s ALA 419 CO 0.01 -0.27 0.10 -1.17 0.00 0.00 0.00 175.76 174.43 2xdm s LEU 420 N -1.02 0.05 -0.04 0.00 2.96 -0.33 -2.52 118.68 117.78 2xdm s LEU 420 Ca -0.11 0.18 -0.03 0.00 -0.22 0.00 0.00 54.13 53.96 2xdm s LEU 420 Cb -0.04 0.04 0.02 0.00 0.50 0.00 0.00 46.19 46.71 2xdm s LEU 420 CO 0.05 -0.25 0.10 -0.44 -1.32 0.00 0.00 176.35 174.49 2xdm s SER 421 N 2.22 -0.09 0.00 3.68 0.01 -0.55 -0.65 113.70 118.32 2xdm s SER 421 Ca 0.04 0.21 0.00 0.00 1.31 0.00 0.00 55.95 57.51 2xdm s SER 421 Cb -0.12 0.18 0.00 0.00 0.21 0.00 0.00 66.02 66.29 2xdm s SER 421 CO -0.04 -0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.16 2xdm n GLY 422 N 3.28 -0.79 3.35 3.44 0.00 -0.63 0.49 105.19 114.34 2xdm n GLY 422 Ca -0.15 -0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 2xdm n GLY 422 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2xdm s TYR 423 N -4.00 2.31 -0.33 1.61 2.02 0.13 -1.07 117.35 118.02 2xdm s TYR 423 Ca 0.00 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.32 2xdm s TYR 423 Cb 0.00 -1.35 0.10 0.00 -0.40 0.00 0.00 41.96 40.31 2xdm s TYR 423 CO 0.00 0.18 0.07 0.08 -1.57 0.00 0.00 175.55 174.31 2xdm s VAL 424 N -0.87 1.68 0.66 0.71 1.01 0.51 -2.39 120.40 121.71 2xdm s VAL 424 Ca 0.12 -1.95 -0.11 0.00 0.00 0.00 0.00 61.98 60.04 2xdm s VAL 424 Cb -0.10 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 2xdm s VAL 424 CO 0.03 -0.64 1.05 -2.84 0.00 0.00 0.00 175.10 172.71 2xdm s PRO 425 N 1.20 3.24 0.00 2.72 0.02 -1.26 0.76 135.00 141.68 2xdm s PRO 425 Ca 0.11 0.72 0.00 0.00 0.02 0.00 0.00 61.00 61.84 2xdm s PRO 425 Cb -0.18 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.29 2xdm s PRO 425 CO -0.15 -0.82 0.00 0.41 -0.33 0.00 0.00 177.00 176.10 2xdm n GLY 426 N -2.63 1.26 0.43 0.52 0.00 -1.22 -4.91 105.19 98.63 2xdm n GLY 426 Ca 0.07 -0.99 0.29 0.00 0.00 0.00 0.00 46.02 45.38 2xdm n GLY 426 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2xdm h PRO 427 N 0.00 0.24 -2.98 1.61 0.11 -1.76 -2.76 132.00 126.47 2xdm h PRO 427 Ca 0.00 -0.01 -0.77 0.00 0.11 0.00 0.00 66.00 65.33 2xdm h PRO 427 Cb 0.00 -0.05 -0.31 0.00 0.11 0.00 0.00 31.00 30.75 2xdm h PRO 427 CO 0.00 0.16 0.44 0.39 -0.21 0.00 0.00 178.00 178.78 2xdm n GLU 428 N -4.69 3.84 -1.42 1.05 -0.58 -0.80 -5.03 120.64 113.01 2xdm n GLU 428 Ca 0.31 -4.55 0.07 0.00 -0.42 0.00 0.00 57.16 52.57 2xdm n GLU 428 Cb 1.13 -2.47 -0.04 0.00 -0.57 0.00 0.00 31.44 29.49 2xdm n GLU 428 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2xdm n GLY 429 N 1.60 -3.73 3.71 0.62 0.00 -1.04 -4.61 105.19 101.75 2xdm n GLY 429 Ca 0.26 -0.96 -0.38 0.00 0.00 0.00 0.00 46.02 44.93 2xdm n GLY 429 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2xdm s GLU 430 N -4.88 4.30 0.07 1.61 2.12 -1.26 -3.45 118.70 117.22 2xdm s GLU 430 Ca 0.00 0.43 0.03 0.00 0.36 0.00 0.00 54.97 55.79 2xdm s GLU 430 Cb 0.00 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.89 2xdm s GLU 430 CO 0.00 0.09 0.06 -0.51 -0.54 0.00 0.00 175.26 174.36 2xdm s LEU 431 N 0.85 3.72 -0.07 2.70 1.02 0.23 -0.86 118.68 126.26 2xdm s LEU 431 Ca 0.25 -0.03 0.02 0.00 0.02 0.00 0.00 54.13 54.39 2xdm s LEU 431 Cb -0.15 -2.37 -0.02 0.00 0.02 0.00 0.00 46.19 43.66 2xdm s LEU 431 CO 0.10 0.19 -0.12 0.00 0.02 0.00 0.00 176.35 176.54 2xdm s ALA 432 N -1.33 2.74 0.04 4.21 0.00 -0.13 -0.36 121.76 126.93 2xdm s ALA 432 Ca 0.27 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.31 2xdm s ALA 432 Cb -0.12 -1.08 -0.03 0.00 0.00 0.00 0.00 23.12 21.89 2xdm s ALA 432 CO 0.20 0.50 -0.07 -0.59 0.00 0.00 0.00 175.76 175.79 2xdm s PHE 433 N -0.53 0.64 -0.05 0.00 -0.12 -0.23 -1.37 117.98 116.32 2xdm s PHE 433 Ca 0.07 -0.55 0.01 0.00 -0.05 0.00 0.00 56.93 56.42 2xdm s PHE 433 Cb -0.12 -0.39 0.02 0.00 -0.63 0.00 0.00 43.02 41.90 2xdm s PHE 433 CO 0.02 -0.11 -0.06 0.45 -0.05 0.00 0.00 175.22 175.47 2xdm s SER 434 N -1.71 1.19 -0.23 1.98 0.15 -0.52 -1.60 113.70 112.96 2xdm s SER 434 Ca -0.09 -0.17 0.02 0.00 0.70 0.00 0.00 55.95 56.41 2xdm s SER 434 Cb -0.08 -0.54 0.05 0.00 -1.71 0.00 0.00 66.02 63.73 2xdm s SER 434 CO -0.00 -0.04 -0.10 -0.63 1.20 0.00 0.00 173.24 173.66 2xdm s ILE 435 N 0.93 1.86 -0.19 6.45 1.01 0.17 -1.80 121.20 129.64 2xdm s ILE 435 Ca -0.11 -1.31 0.01 0.00 0.00 0.00 0.00 60.65 59.25 2xdm s ILE 435 Cb -0.14 -1.97 0.04 0.00 0.01 0.00 0.00 42.46 40.39 2xdm s ILE 435 CO 0.00 0.06 -0.13 -0.69 0.00 0.00 0.00 174.94 174.18 2xdm s VAL 436 N 1.27 1.71 -0.14 2.92 1.01 0.22 -1.19 120.40 126.20 2xdm s VAL 436 Ca -0.05 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 2xdm s VAL 436 Cb -0.18 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 2xdm s VAL 436 CO -0.07 0.28 -0.10 0.20 0.00 0.00 0.00 175.10 175.41 2xdm s ASN 437 N 1.39 4.23 0.01 3.32 0.01 0.21 -0.36 114.94 123.74 2xdm s ASN 437 Ca 0.01 -0.27 0.01 0.00 -0.71 0.00 0.00 52.86 51.90 2xdm s ASN 437 Cb -0.15 -1.66 -0.01 0.00 0.41 0.00 0.00 41.25 39.84 2xdm s ASN 437 CO -0.09 0.17 -0.05 0.20 -1.51 0.00 0.00 177.10 175.82 2xdm s ASN 438 N 0.35 0.51 0.00 -1.22 0.02 -0.46 -0.70 114.94 113.44 2xdm s ASN 438 Ca -0.09 -0.25 0.00 0.00 -1.02 0.00 0.00 52.86 51.50 2xdm s ASN 438 Cb -0.15 -0.01 0.00 0.00 0.02 0.00 0.00 41.25 41.11 2xdm s ASN 438 CO 0.05 -0.06 0.00 0.61 0.02 0.00 0.00 177.10 177.72 2xdm n GLY 439 N 2.42 1.40 3.68 0.66 0.00 0.45 -0.84 105.19 112.96 2xdm n GLY 439 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 2xdm n GLY 439 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2xdm s HIS 440 N -3.06 1.82 -0.43 1.61 -3.43 -1.26 -4.13 115.29 106.41 2xdm s HIS 440 Ca 0.00 1.68 0.03 0.00 -0.80 0.00 0.00 55.06 55.97 2xdm s HIS 440 Cb 0.00 -3.26 0.03 0.00 -1.43 0.00 0.00 32.58 27.92 2xdm s HIS 440 CO 0.00 -2.68 0.59 0.45 -2.00 0.00 0.00 174.74 171.11 2xdm n SER 441 N -4.13 1.25 0.00 7.38 2.88 -1.26 -4.52 113.62 115.22 2xdm n SER 441 Ca 0.10 -1.13 0.00 0.00 -1.33 0.00 0.00 58.87 56.52 2xdm n SER 441 Cb 0.53 0.03 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 2xdm n SER 441 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2xdm n GLY 442 N 0.23 4.83 3.52 0.46 0.00 -1.26 -5.07 105.19 107.90 2xdm n GLY 442 Ca 0.02 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.66 2xdm n GLY 442 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2xdm n PRO 443 N 0.00 0.90 -1.68 1.61 -0.04 -1.26 -4.78 135.00 129.75 2xdm n PRO 443 Ca 0.00 0.32 -0.44 0.00 -0.04 0.00 0.00 63.50 63.34 2xdm n PRO 443 Cb 0.00 -1.68 -0.02 0.00 -0.04 0.00 0.00 33.50 31.76 2xdm n PRO 443 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2xdm n ALA 444 N -0.45 1.22 -0.74 0.55 0.00 -1.26 -4.83 120.51 114.99 2xdm n ALA 444 Ca 0.11 0.40 -0.21 0.00 0.00 0.00 0.00 53.44 53.74 2xdm n ALA 444 Cb 0.36 -2.28 -0.02 0.00 0.00 0.00 0.00 19.45 17.51 2xdm n ALA 444 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2xdm n PRO 445 N 1.83 2.06 0.08 0.00 -0.04 -1.26 -4.58 135.00 133.09 2xdm n PRO 445 Ca 0.10 -1.40 -0.07 0.00 -0.04 0.00 0.00 63.50 62.09 2xdm n PRO 445 Cb 0.32 -2.40 0.05 0.00 -0.04 0.00 0.00 33.50 31.43 2xdm n PRO 445 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2xdm h LEU 446 N 7.99 0.28 -0.46 1.53 3.38 -1.99 -2.52 115.31 123.51 2xdm h LEU 446 Ca 0.47 -0.19 -0.13 0.00 0.09 0.00 0.00 57.88 58.12 2xdm h LEU 446 Cb 0.23 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2xdm h LEU 446 CO 1.36 0.93 -0.23 0.00 0.09 0.00 0.00 178.44 180.59 2xdm h ALA 447 N 1.06 0.65 -0.52 1.53 0.00 -1.99 0.50 119.26 120.49 2xdm h ALA 447 Ca -0.03 -0.40 0.02 0.00 0.00 0.00 0.00 54.91 54.50 2xdm h ALA 447 Cb 1.33 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 2xdm h ALA 447 CO 0.12 0.65 0.32 0.28 0.00 0.00 0.00 179.25 180.62 2xdm h VAL 448 N 0.82 1.08 -0.23 0.00 2.07 -1.91 0.30 116.25 118.38 2xdm h VAL 448 Ca 0.10 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 2xdm h VAL 448 Cb 0.81 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2xdm h VAL 448 CO 0.07 0.12 0.09 1.56 0.02 0.00 0.00 177.57 179.42 2xdm h GLN 449 N 0.64 0.35 0.01 1.57 4.20 -1.28 -1.65 115.11 118.94 2xdm h GLN 449 Ca 0.20 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.87 2xdm h GLN 449 Cb -0.01 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.68 2xdm h GLN 449 CO -0.08 0.41 -0.20 -0.44 -0.67 0.00 0.00 178.83 177.85 2xdm h ASP 450 N 0.22 -0.59 -0.68 1.46 3.45 -0.69 -1.17 116.42 118.41 2xdm h ASP 450 Ca 0.08 0.08 0.15 0.00 0.43 0.00 0.00 57.03 57.77 2xdm h ASP 450 Cb 0.20 0.25 -0.12 0.00 -0.56 0.00 0.00 39.33 39.09 2xdm h ASP 450 CO -0.01 -0.27 -0.05 0.00 -1.57 0.00 0.00 179.24 177.34 2xdm h ALA 451 N 0.56 0.62 0.48 3.45 0.00 -0.19 0.44 119.26 124.61 2xdm h ALA 451 Ca 0.06 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2xdm h ALA 451 Cb 0.40 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2xdm h ALA 451 CO -0.18 -0.42 -0.23 0.82 0.00 0.00 0.00 179.25 179.24 2xdm h ILE 452 N 0.07 0.50 -0.81 0.00 2.04 -1.09 -1.11 117.51 117.10 2xdm h ILE 452 Ca 0.36 -0.27 0.15 0.00 1.00 0.00 0.00 64.86 66.09 2xdm h ILE 452 Cb 0.59 0.61 -0.09 0.00 -0.74 0.00 0.00 36.82 37.19 2xdm h ILE 452 CO -0.63 0.04 0.38 0.00 0.00 0.00 0.00 178.15 177.95 2xdm h ALA 453 N -0.37 1.20 -0.01 1.87 0.00 -0.64 -0.40 119.26 120.91 2xdm h ALA 453 Ca -0.07 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2xdm h ALA 453 Cb 0.56 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2xdm h ALA 453 CO 0.11 -0.14 0.01 0.28 0.00 0.00 0.00 179.25 179.50 2xdm h VAL 454 N 0.55 1.05 -0.76 0.00 2.07 -0.09 -1.23 116.25 117.84 2xdm h VAL 454 Ca 0.45 -0.15 0.05 0.00 0.82 0.00 0.00 66.70 67.87 2xdm h VAL 454 Cb 0.65 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 31.50 2xdm h VAL 454 CO -0.38 0.04 0.47 0.03 0.02 0.00 0.00 177.57 177.74 2xdm h ARG 455 N -0.04 0.85 -0.47 1.57 2.47 -0.45 -1.12 114.38 117.19 2xdm h ARG 455 Ca 0.00 -0.05 -0.05 0.00 -1.26 0.00 0.00 59.98 58.62 2xdm h ARG 455 Cb 0.06 -0.19 -0.02 0.00 -1.65 0.00 0.00 29.97 28.17 2xdm h ARG 455 CO -0.00 0.56 0.08 -0.07 0.56 0.00 0.00 179.97 181.10 2xdm h LEU 456 N 0.88 0.75 -0.50 3.04 3.38 -0.95 0.80 115.31 122.71 2xdm h LEU 456 Ca 0.32 -0.26 0.08 0.00 0.09 0.00 0.00 57.88 58.11 2xdm h LEU 456 Cb 0.10 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.59 2xdm h LEU 456 CO -0.15 0.81 0.14 0.00 0.09 0.00 0.00 178.44 179.34 2xdm h ALA 457 N 0.96 0.59 -0.66 1.53 0.00 -0.86 0.32 119.26 121.13 2xdm h ALA 457 Ca 0.14 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.17 2xdm h ALA 457 Cb 0.38 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 2xdm h ALA 457 CO 0.01 -0.26 0.40 0.93 0.00 0.00 0.00 179.25 180.33 2xdm h GLU 458 N 0.30 0.74 -0.70 0.00 5.08 -0.87 -0.20 114.58 118.94 2xdm h GLU 458 Ca 0.24 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.51 2xdm h GLU 458 Cb 0.29 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2xdm h GLU 458 CO -0.28 0.49 0.23 -0.92 -1.00 0.00 0.00 179.01 177.54 2xdm h TYR 459 N 0.76 1.09 0.00 4.33 3.20 -0.15 -1.17 116.97 125.04 2xdm h TYR 459 Ca 0.27 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 62.05 2xdm h TYR 459 Cb 0.07 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.02 2xdm h TYR 459 CO -0.06 0.86 0.00 0.00 -1.64 0.00 0.00 178.16 177.32 2xdm n ALA 460 N -2.45 2.06 -0.16 1.82 0.00 0.11 -4.78 120.51 117.10 2xdm n ALA 460 Ca 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2xdm n ALA 460 Cb 0.21 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.38 2xdm n ALA 460 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2xdm n GLY 461 N 0.14 1.08 3.95 0.00 0.00 -0.44 -1.90 105.19 108.02 2xdm n GLY 461 Ca 0.11 -0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 2xdm n GLY 461 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2xdm s HIS 462 N -2.00 3.47 0.06 1.61 3.76 -0.12 -4.77 115.29 117.30 2xdm s HIS 462 Ca 0.00 0.15 0.04 0.00 -0.15 0.00 0.00 55.06 55.10 2xdm s HIS 462 Cb 0.00 -1.71 -0.03 0.00 1.11 0.00 0.00 32.58 31.95 2xdm s HIS 462 CO 0.00 0.33 -0.11 -0.65 -0.85 0.00 0.00 174.74 173.46 2xdm s GLN 463 N -3.98 0.69 0.22 1.40 1.11 -1.26 -4.13 119.66 113.71 2xdm s GLN 463 Ca 0.36 -0.87 -0.32 0.00 0.01 0.00 0.00 55.36 54.55 2xdm s GLN 463 Cb -0.09 -0.59 -0.12 0.00 -1.01 0.00 0.00 33.01 31.19 2xdm s GLN 463 CO 0.31 0.13 1.70 0.00 0.01 0.00 0.00 175.29 177.43 2xdm s ALA 464 N -1.32 3.90 0.28 6.09 0.00 -1.26 -4.47 121.76 124.98 2xdm s ALA 464 Ca -0.05 1.58 -0.30 0.00 0.00 0.00 0.00 51.96 53.19 2xdm s ALA 464 Cb -0.10 -3.69 -0.11 0.00 0.00 0.00 0.00 23.12 19.23 2xdm s ALA 464 CO 0.01 -0.93 1.52 -1.25 0.00 0.00 0.00 175.76 175.12 2xdm s PRO 465 N 0.86 4.19 0.00 0.00 0.04 -1.26 -4.91 135.00 133.91 2xdm s PRO 465 Ca 0.73 2.46 0.00 0.00 0.04 0.00 0.00 61.00 64.22 2xdm s PRO 465 Cb -0.49 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 30.99 2xdm s PRO 465 CO 0.35 -0.54 0.40 0.39 0.04 0.00 0.00 177.00 177.65