#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 -0.56 -1.31 6.15 6.46 -1.99 0.15 115.31 124.21 2xdm h LEU 2 Ca 0.00 0.17 -0.05 0.00 -0.12 0.00 0.00 57.88 57.88 2xdm h LEU 2 Cb 0.00 0.36 -0.01 0.00 -0.73 0.00 0.00 40.66 40.28 2xdm h LEU 2 CO 0.00 -0.20 -0.09 0.71 -0.62 0.00 0.00 178.44 178.25 2xdm h THR 3 N -0.01 1.19 -0.21 1.05 1.35 -2.00 -2.19 112.91 112.09 2xdm h THR 3 Ca 0.27 -0.81 -0.19 0.00 -0.55 0.00 0.00 66.41 65.13 2xdm h THR 3 Cb 0.43 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 2xdm h THR 3 CO -0.59 0.26 -0.63 -0.08 -0.25 0.00 0.00 175.52 174.23 2xdm h GLU 4 N 0.34 0.73 -0.63 4.72 4.81 -1.75 -2.89 114.58 119.91 2xdm h GLU 4 Ca 0.07 -0.51 0.04 0.00 -0.13 0.00 0.00 59.36 58.83 2xdm h GLU 4 Cb 0.37 0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.79 2xdm h GLU 4 CO 0.02 1.13 0.37 1.25 -0.73 0.00 0.00 179.01 181.05 2xdm h LEU 5 N 0.54 0.57 -0.29 1.64 5.85 -0.32 -2.34 115.31 120.96 2xdm h LEU 5 Ca -0.01 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2xdm h LEU 5 Cb 1.22 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 2xdm h LEU 5 CO 0.13 0.39 0.09 0.03 -0.34 0.00 0.00 178.44 178.73 2xdm h ARG 6 N 0.70 0.45 -0.63 1.25 3.08 -1.40 -2.00 114.38 115.83 2xdm h ARG 6 Ca 0.27 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 2xdm h ARG 6 Cb 0.09 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 2xdm h ARG 6 CO -0.14 0.51 0.33 1.05 -1.07 0.00 0.00 179.97 180.65 2xdm h GLU 7 N 0.30 0.88 -0.57 0.04 4.11 -1.41 -0.23 114.58 117.70 2xdm h GLU 7 Ca 0.09 -0.11 -0.01 0.00 0.07 0.00 0.00 59.36 59.40 2xdm h GLU 7 Cb 0.25 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 2xdm h GLU 7 CO -0.00 0.68 0.33 -0.44 0.07 0.00 0.00 179.01 179.65 2xdm h ASP 8 N 0.85 0.70 -0.33 3.06 3.32 -1.32 -1.17 116.42 121.53 2xdm h ASP 8 Ca 0.22 -0.08 -0.15 0.00 0.02 0.00 0.00 57.03 57.04 2xdm h ASP 8 Cb 0.07 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 2xdm h ASP 8 CO -0.03 0.58 -0.34 0.40 -1.72 0.00 0.00 179.24 178.13 2xdm h ILE 9 N 0.77 1.28 -0.93 0.35 2.04 -1.21 -2.11 117.51 117.69 2xdm h ILE 9 Ca 0.20 -1.50 0.10 0.00 1.00 0.00 0.00 64.86 64.66 2xdm h ILE 9 Cb 0.02 1.34 -0.07 0.00 -0.74 0.00 0.00 36.82 37.37 2xdm h ILE 9 CO -0.03 0.50 0.59 0.44 0.00 0.00 0.00 178.15 179.65 2xdm h ASP 10 N 0.72 0.84 1.15 1.72 3.45 -0.74 -1.37 116.42 122.20 2xdm h ASP 10 Ca 0.07 0.03 -0.17 0.00 0.43 0.00 0.00 57.03 57.39 2xdm h ASP 10 Cb 0.90 -0.15 -0.03 0.00 -0.56 0.00 0.00 39.33 39.50 2xdm h ASP 10 CO 0.08 0.49 -0.86 0.00 -1.57 0.00 0.00 179.24 177.38 2xdm h ALA 11 N 1.54 0.50 -0.28 3.45 0.00 -1.07 -2.62 119.26 120.78 2xdm h ALA 11 Ca 0.43 -0.76 -0.12 0.00 0.00 0.00 0.00 54.91 54.46 2xdm h ALA 11 Cb 0.42 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2xdm h ALA 11 CO -0.20 1.02 -0.29 0.82 0.00 0.00 0.00 179.25 180.60 2xdm h ILE 12 N 0.00 1.30 0.00 0.00 2.04 -1.03 -3.09 117.51 116.74 2xdm h ILE 12 Ca -0.03 -1.46 -0.02 0.00 1.00 0.00 0.00 64.86 64.35 2xdm h ILE 12 Cb 1.63 1.61 -0.00 0.00 -0.74 0.00 0.00 36.82 39.31 2xdm h ILE 12 CO 0.10 0.47 -0.09 -0.07 0.00 0.00 0.00 178.15 178.56 2xdm h LEU 13 N 0.43 0.00 -5.41 1.44 3.38 -1.19 -2.98 115.31 110.99 2xdm h LEU 13 Ca 0.04 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.35 2xdm h LEU 13 Cb 0.86 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.62 2xdm h LEU 13 CO 0.07 0.09 3.50 -0.62 0.09 0.00 0.00 178.44 181.57 2xdm n GLU 14 N -3.53 3.25 -4.46 1.13 -0.58 -1.00 -4.84 120.64 110.62 2xdm n GLU 14 Ca -0.02 -2.27 -0.34 0.00 -0.42 0.00 0.00 57.16 54.11 2xdm n GLU 14 Cb 0.22 -2.94 -0.10 0.00 -0.57 0.00 0.00 31.44 28.04 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 2.68 4.97 0.28 1.62 2.15 -1.13 -4.99 116.67 122.25 2xdm s ASP 15 Ca 0.60 0.05 -0.01 0.00 0.43 0.00 0.00 52.55 53.62 2xdm s ASP 15 Cb 0.16 -1.32 0.64 0.00 -0.30 0.00 0.00 42.92 42.10 2xdm s ASP 15 CO -0.06 0.35 1.61 1.55 -0.17 0.00 0.00 175.17 178.46 2xdm h PRO 16 N 5.04 0.09 0.00 4.34 0.13 -1.92 -1.35 132.00 138.34 2xdm h PRO 16 Ca -0.50 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2xdm h PRO 16 Cb 1.18 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2xdm h PRO 16 CO 0.54 0.06 0.00 0.00 -0.23 0.00 0.00 178.00 178.37 2xdm n ALA 17 N -2.95 1.42 0.02 -0.56 0.00 -1.26 -1.75 120.51 115.43 2xdm n ALA 17 Ca 0.19 -0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.65 2xdm n ALA 17 Cb 0.64 -1.12 0.09 0.00 0.00 0.00 0.00 19.45 19.07 2xdm n ALA 17 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2xdm n LEU 18 N -1.39 2.38 -4.70 0.00 4.32 -0.51 -4.67 117.00 112.43 2xdm n LEU 18 Ca 0.03 -1.69 -0.42 0.00 -0.02 0.00 0.00 56.01 53.91 2xdm n LEU 18 Cb 0.07 -0.12 -0.03 0.00 -1.62 0.00 0.00 43.42 41.72 2xdm n LEU 18 CO 0.06 0.57 1.35 -1.61 -1.22 0.00 0.00 177.39 176.54 2xdm s GLU 19 N -0.90 4.18 0.00 3.23 0.41 -0.71 -1.61 118.70 123.29 2xdm s GLU 19 Ca 0.15 2.44 0.00 0.00 -0.41 0.00 0.00 54.97 57.15 2xdm s GLU 19 Cb 0.08 -3.44 0.00 0.00 -1.78 0.00 0.00 34.13 28.99 2xdm s GLU 19 CO 0.11 -0.74 0.00 0.41 -0.49 0.00 0.00 175.26 174.55 2xdm n GLY 20 N 4.01 0.72 4.00 -1.39 0.00 -1.26 -4.64 105.19 106.62 2xdm n GLY 20 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.00 4.03 -0.09 4.61 0.00 -0.63 -4.75 121.76 121.93 2xdm s ALA 21 Ca 0.00 -1.67 0.04 0.00 0.00 0.00 0.00 51.96 50.32 2xdm s ALA 21 Cb 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 21.23 2xdm s ALA 21 CO 0.00 -1.01 -0.22 0.08 0.00 0.00 0.00 175.76 174.61 2xdm s VAL 22 N -2.86 1.90 -0.18 0.00 1.01 0.15 -4.96 120.40 115.46 2xdm s VAL 22 Ca 0.62 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 61.66 2xdm s VAL 22 Cb -0.07 -1.65 0.05 0.00 0.00 0.00 0.00 36.38 34.70 2xdm s VAL 22 CO 0.40 0.52 -0.05 -0.44 0.00 0.00 0.00 175.10 175.54 2xdm s SER 23 N 0.37 3.02 -0.26 3.32 0.01 -1.26 -0.91 113.70 117.99 2xdm s SER 23 Ca -0.17 -0.76 -0.29 0.00 1.31 0.00 0.00 55.95 56.04 2xdm s SER 23 Cb -0.17 -0.96 0.01 0.00 0.21 0.00 0.00 66.02 65.11 2xdm s SER 23 CO 0.08 -0.19 1.04 -0.83 0.41 0.00 0.00 173.24 173.74 2xdm s GLY 24 N 1.60 1.65 -0.14 3.44 0.00 -0.51 -4.59 107.32 108.77 2xdm s GLY 24 Ca -0.00 0.07 -0.02 0.00 0.00 0.00 0.00 44.72 44.77 2xdm s GLY 24 CO -0.08 2.19 0.02 0.14 0.00 0.00 0.00 173.10 175.37 2xdm s VAL 25 N 3.33 0.48 -0.06 1.40 1.01 -0.13 -0.95 120.40 125.49 2xdm s VAL 25 Ca 0.44 -0.29 0.03 0.00 0.00 0.00 0.00 61.98 62.16 2xdm s VAL 25 Cb -0.14 -0.84 0.01 0.00 0.00 0.00 0.00 36.38 35.41 2xdm s VAL 25 CO 0.09 -0.01 -0.12 -0.69 0.00 0.00 0.00 175.10 174.37 2xdm s VAL 26 N 1.90 1.11 -0.09 2.92 1.01 -0.81 -0.47 120.40 125.97 2xdm s VAL 26 Ca 0.02 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.54 2xdm s VAL 26 Cb -0.15 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.23 2xdm s VAL 26 CO -0.07 0.34 -0.21 -0.69 0.00 0.00 0.00 175.10 174.48 2xdm s VAL 27 N 0.51 1.81 -0.02 2.92 1.01 0.11 -1.79 120.40 124.95 2xdm s VAL 27 Ca -0.11 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.02 2xdm s VAL 27 Cb -0.14 -1.58 -0.00 0.00 0.00 0.00 0.00 36.38 34.65 2xdm s VAL 27 CO 0.03 0.50 -0.09 -0.69 0.00 0.00 0.00 175.10 174.85 2xdm s VAL 28 N 0.47 0.76 -0.22 2.92 1.01 0.38 -1.45 120.40 124.27 2xdm s VAL 28 Ca -0.17 -0.38 -0.27 0.00 0.00 0.00 0.00 61.98 61.17 2xdm s VAL 28 Cb -0.17 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.55 2xdm s VAL 28 CO 0.07 0.23 0.93 -0.62 0.00 0.00 0.00 175.10 175.70 2xdm s ASP 29 N -0.02 6.98 0.19 3.32 2.15 0.55 -0.40 116.67 129.45 2xdm s ASP 29 Ca 0.00 1.22 0.01 0.00 0.43 0.00 0.00 52.55 54.22 2xdm s ASP 29 Cb -0.06 -2.49 0.10 0.00 -0.30 0.00 0.00 42.92 40.17 2xdm s ASP 29 CO 0.00 -0.56 1.46 0.74 -0.17 0.00 0.00 175.17 176.63 2xdm h THR 30 N 5.39 1.41 0.00 1.71 2.02 -1.62 0.05 112.91 121.88 2xdm h THR 30 Ca -0.22 -2.21 0.00 0.00 0.77 0.00 0.00 66.41 64.74 2xdm h THR 30 Cb 1.09 2.17 0.00 0.00 -1.74 0.00 0.00 68.15 69.67 2xdm h THR 30 CO 0.91 0.66 0.00 0.00 0.37 0.00 0.00 175.52 177.46 2xdm n ALA 31 N -2.49 -0.26 -0.11 6.16 0.00 -1.26 -4.21 120.51 118.35 2xdm n ALA 31 Ca -0.04 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.29 2xdm n ALA 31 Cb 0.70 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.12 2xdm n ALA 31 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2xdm h THR 32 N 0.00 1.28 0.00 0.00 1.35 -1.96 -3.47 112.91 110.11 2xdm h THR 32 Ca 0.00 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 2xdm h THR 32 Cb 0.00 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 2xdm h THR 32 CO 0.00 0.36 0.00 0.61 -0.25 0.00 0.00 175.52 176.24 2xdm n GLY 33 N -0.18 0.69 3.77 5.82 0.00 0.00 -5.08 105.19 110.20 2xdm n GLY 33 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.57 3.82 -0.92 1.61 2.12 -1.23 -4.66 118.70 118.87 2xdm s GLU 34 Ca 0.00 2.22 -0.10 0.00 0.36 0.00 0.00 54.97 57.45 2xdm s GLU 34 Cb 0.00 -2.68 0.24 0.00 0.26 0.00 0.00 34.13 31.95 2xdm s GLU 34 CO 0.00 -0.64 0.87 -2.00 -0.54 0.00 0.00 175.26 172.95 2xdm s GLU 35 N -2.36 3.72 0.13 4.30 2.12 -1.26 -0.33 118.70 125.01 2xdm s GLU 35 Ca 0.59 -2.82 -0.19 0.00 0.36 0.00 0.00 54.97 52.92 2xdm s GLU 35 Cb -0.39 -4.38 -0.05 0.00 0.26 0.00 0.00 34.13 29.57 2xdm s GLU 35 CO 0.50 -1.26 1.77 -0.07 -0.54 0.00 0.00 175.26 175.66 2xdm h LEU 36 N 7.16 0.19 -7.87 2.70 3.38 -1.62 -3.43 115.31 115.83 2xdm h LEU 36 Ca 0.13 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.79 2xdm h LEU 36 Cb 0.95 -0.04 -0.29 0.00 0.09 0.00 0.00 40.66 41.38 2xdm h LEU 36 CO 0.85 0.15 -0.75 -0.47 0.09 0.00 0.00 178.44 178.31 2xdm s TYR 37 N -6.17 0.42 -0.20 1.13 6.14 -1.14 -4.81 117.35 112.71 2xdm s TYR 37 Ca -0.13 -0.08 -0.04 0.00 0.64 0.00 0.00 57.07 57.46 2xdm s TYR 37 Cb 0.09 -0.28 0.10 0.00 0.42 0.00 0.00 41.96 42.29 2xdm s TYR 37 CO 0.69 -0.02 0.34 0.45 0.64 0.00 0.00 175.55 177.65 2xdm s SER 38 N -0.04 0.34 -0.08 4.32 0.15 -1.25 0.07 113.70 117.21 2xdm s SER 38 Ca 0.01 0.41 0.01 0.00 0.70 0.00 0.00 55.95 57.08 2xdm s SER 38 Cb -0.03 0.96 0.02 0.00 -1.71 0.00 0.00 66.02 65.26 2xdm s SER 38 CO -0.00 -0.28 -0.10 -0.60 1.20 0.00 0.00 173.24 173.47 2xdm s ARG 39 N 2.50 1.51 -1.61 5.44 3.52 0.38 -4.83 118.95 125.86 2xdm s ARG 39 Ca 0.06 -0.32 -0.16 0.00 -0.13 0.00 0.00 55.73 55.18 2xdm s ARG 39 Cb -0.14 -1.37 0.12 0.00 -1.56 0.00 0.00 34.95 32.00 2xdm s ARG 39 CO -0.13 -0.07 0.90 -0.25 -0.81 0.00 0.00 175.30 174.94 2xdm n ASP 40 N 4.18 -4.20 0.29 -2.12 8.00 -1.26 -0.96 116.55 120.48 2xdm n ASP 40 Ca -0.20 -0.87 0.18 0.00 0.71 0.00 0.00 54.79 54.60 2xdm n ASP 40 Cb 0.51 -3.38 0.88 0.00 -0.02 0.00 0.00 41.12 39.10 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 -1.81 0.00 -1.45 0.44 0.00 -1.88 -2.59 103.07 95.78 2xdm h GLY 41 Ca -0.58 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.75 2xdm h GLY 41 CO 0.72 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.87 2xdm n GLY 42 N -0.56 0.38 3.71 4.60 0.00 -1.26 -0.69 105.19 111.36 2xdm n GLY 42 Ca -0.01 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.51 4.36 -0.27 1.61 2.56 -0.98 -4.93 118.70 119.53 2xdm s GLU 43 Ca 0.21 1.91 -0.28 0.00 0.00 0.00 0.00 54.97 56.80 2xdm s GLU 43 Cb 0.15 -3.38 0.01 0.00 2.00 0.00 0.00 34.13 32.91 2xdm s GLU 43 CO 0.23 -0.40 1.03 -0.65 -0.56 0.00 0.00 175.26 174.90 2xdm s GLN 44 N 1.46 4.15 0.09 4.30 -0.21 -1.26 -4.36 119.66 123.83 2xdm s GLN 44 Ca 0.62 1.16 0.05 0.00 0.02 0.00 0.00 55.36 57.21 2xdm s GLN 44 Cb -0.32 -3.69 -0.03 0.00 1.00 0.00 0.00 33.01 29.97 2xdm s GLN 44 CO 0.28 -0.75 -0.13 -0.51 -2.12 0.00 0.00 175.29 172.07 2xdm s LEU 45 N 3.36 2.34 0.14 2.90 1.43 0.15 -4.94 118.68 124.07 2xdm s LEU 45 Ca 0.43 -0.71 -0.31 0.00 -1.03 0.00 0.00 54.13 52.51 2xdm s LEU 45 Cb -0.14 -0.46 -0.10 0.00 0.03 0.00 0.00 46.19 45.52 2xdm s LEU 45 CO 0.11 -0.14 1.64 -0.76 0.23 0.00 0.00 176.35 177.43 2xdm s LEU 46 N -2.10 4.37 0.15 1.79 1.02 -1.26 -0.45 118.68 122.20 2xdm s LEU 46 Ca 0.02 2.63 0.24 0.00 0.02 0.00 0.00 54.13 57.04 2xdm s LEU 46 Cb -0.07 -3.58 0.31 0.00 0.02 0.00 0.00 46.19 42.86 2xdm s LEU 46 CO 0.02 -0.88 1.30 1.55 0.02 0.00 0.00 176.35 178.36 2xdm h PRO 47 N 7.46 0.00 0.00 1.29 0.13 -1.90 -3.45 132.00 135.52 2xdm h PRO 47 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2xdm h PRO 47 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2xdm h PRO 47 CO 0.93 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.70 2xdm n ALA 48 N -1.89 0.00 1.29 -0.56 0.00 -1.26 -2.03 120.51 116.06 2xdm n ALA 48 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.57 2xdm n ALA 48 Cb 0.46 0.00 0.61 0.00 0.00 0.00 0.00 19.45 20.52 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 0.43 0.00 0.22 0.00 7.64 -1.26 -1.60 113.62 119.05 2xdm n SER 49 Ca 0.00 -0.62 0.16 0.00 1.01 0.00 0.00 58.87 59.41 2xdm n SER 49 Cb 0.00 -0.01 0.74 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 -0.02 6.43 4.21 -1.49 -1.71 115.58 123.00 2xdm h ASN 50 Ca 0.00 0.00 0.01 0.00 1.21 0.00 0.00 56.30 57.52 2xdm h ASN 50 Cb 0.01 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.21 2xdm h ASN 50 CO 0.00 0.00 0.02 -0.03 -1.29 0.00 0.00 177.43 176.13 2xdm h MET 51 N 0.00 0.00 0.00 0.81 4.05 -1.48 -2.50 114.93 115.81 2xdm h MET 51 Ca 0.00 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 2xdm h MET 51 Cb 0.21 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.00 2xdm h MET 51 CO 0.00 0.00 -0.06 0.87 0.23 0.00 0.00 176.91 177.95 2xdm h LYS 52 N 0.00 0.00 -0.34 0.39 1.57 -1.41 -1.96 116.57 114.82 2xdm h LYS 52 Ca 0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2xdm h LYS 52 Cb 0.04 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 2xdm h LYS 52 CO -0.00 0.06 0.16 -0.07 -0.57 0.00 0.00 179.45 179.03 2xdm h LEU 53 N 0.00 0.44 -0.16 2.94 3.38 -1.62 0.18 115.31 120.46 2xdm h LEU 53 Ca -0.00 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 2xdm h LEU 53 Cb 0.23 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2xdm h LEU 53 CO 0.01 0.44 0.00 -0.26 0.09 0.00 0.00 178.44 178.72 2xdm h PHE 54 N 0.41 0.30 0.20 1.13 -1.00 -1.52 -1.62 116.94 114.83 2xdm h PHE 54 Ca 0.12 -0.05 0.01 0.00 2.81 0.00 0.00 57.97 60.86 2xdm h PHE 54 Cb 0.12 -0.08 -0.04 0.00 3.61 0.00 0.00 35.95 39.56 2xdm h PHE 54 CO -0.02 0.49 -0.44 1.15 -1.61 0.00 0.00 178.31 177.88 2xdm h THR 55 N 0.03 0.13 -0.50 -1.55 2.02 -1.39 -1.28 112.91 110.37 2xdm h THR 55 Ca 0.05 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.33 2xdm h THR 55 Cb 0.36 0.13 -0.10 0.00 -1.74 0.00 0.00 68.15 66.80 2xdm h THR 55 CO 0.01 0.00 -0.13 0.00 0.37 0.00 0.00 175.52 175.77 2xdm h ALA 56 N -0.33 0.33 -0.98 6.16 0.00 -0.97 -0.76 119.26 122.71 2xdm h ALA 56 Ca 0.00 0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.17 2xdm h ALA 56 Cb 0.72 0.38 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 2xdm h ALA 56 CO -0.21 -0.44 0.64 0.00 0.00 0.00 0.00 179.25 179.24 2xdm h ALA 57 N 1.50 1.42 0.00 0.00 0.00 -0.94 -2.05 119.26 119.19 2xdm h ALA 57 Ca 0.24 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 2xdm h ALA 57 Cb 0.37 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2xdm h ALA 57 CO -0.52 0.45 -0.56 0.00 0.00 0.00 0.00 179.25 178.61 2xdm h ALA 58 N 1.46 0.70 0.00 0.00 0.00 -0.51 -2.59 119.26 118.32 2xdm h ALA 58 Ca 0.42 -0.51 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 2xdm h ALA 58 Cb 0.14 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2xdm h ALA 58 CO -0.16 0.70 -0.88 0.00 0.00 0.00 0.00 179.25 178.92 2xdm h ALA 59 N 1.44 0.50 0.13 0.00 0.00 -0.50 0.74 119.26 121.57 2xdm h ALA 59 Ca -0.01 -0.80 -0.29 0.00 0.00 0.00 0.00 54.91 53.82 2xdm h ALA 59 Cb 1.34 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 19.01 2xdm h ALA 59 CO 0.07 1.10 -1.24 -0.07 0.00 0.00 0.00 179.25 179.12 2xdm h LEU 60 N 0.00 0.71 -0.15 0.00 3.38 -1.43 0.15 115.31 117.98 2xdm h LEU 60 Ca -0.01 -0.68 -0.03 0.00 0.09 0.00 0.00 57.88 57.25 2xdm h LEU 60 Cb 1.60 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.12 2xdm h LEU 60 CO 0.11 1.50 -0.03 -0.08 0.09 0.00 0.00 178.44 180.03 2xdm h GLU 61 N 0.20 0.28 0.01 1.13 4.57 -1.47 -1.56 114.58 117.74 2xdm h GLU 61 Ca -0.17 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 57.88 2xdm h GLU 61 Cb 1.92 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 30.49 2xdm h GLU 61 CO 0.22 0.56 -0.09 0.28 -1.18 0.00 0.00 179.01 178.81 2xdm h VAL 62 N -0.02 1.70 0.00 0.32 2.07 -0.94 -3.39 116.25 115.98 2xdm h VAL 62 Ca 0.04 -2.17 -0.29 0.00 0.82 0.00 0.00 66.70 65.10 2xdm h VAL 62 Cb 0.46 3.16 -0.05 0.00 -1.52 0.00 0.00 31.29 33.34 2xdm h VAL 62 CO 0.01 0.57 -1.89 0.18 0.02 0.00 0.00 177.57 176.47 2xdm n LEU 63 N -4.59 0.57 0.00 2.57 4.77 0.52 -5.06 117.00 115.77 2xdm n LEU 63 Ca -0.10 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 2xdm n LEU 63 Cb 0.48 0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 2xdm n LEU 63 CO 0.36 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 2xdm n GLY 64 N 1.58 0.08 0.28 -0.72 0.00 -0.59 -4.14 105.19 101.69 2xdm n GLY 64 Ca -0.20 -1.55 0.19 0.00 0.00 0.00 0.00 46.02 44.46 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 -0.02 4.61 0.00 -1.88 -2.61 119.26 120.36 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 -0.08 -0.40 0.00 0.00 0.00 179.25 178.77 2xdm n ASP 66 N -2.91 2.08 -4.77 0.00 5.68 -1.26 -2.20 116.55 113.18 2xdm n ASP 66 Ca -0.01 -1.63 -0.41 0.00 -0.50 0.00 0.00 54.79 52.24 2xdm n ASP 66 Cb 0.16 0.06 -0.02 0.00 -1.14 0.00 0.00 41.12 40.18 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 -2.10 3.06 0.14 2.11 2.46 -0.98 -4.66 115.29 115.31 2xdm s HIS 67 Ca 0.31 1.38 0.05 0.00 0.47 0.00 0.00 55.06 57.26 2xdm s HIS 67 Cb 0.20 -3.69 -0.04 0.00 -0.13 0.00 0.00 32.58 28.92 2xdm s HIS 67 CO 0.37 -1.91 -0.10 -1.54 -2.47 0.00 0.00 174.74 169.08 2xdm s SER 68 N -0.39 1.78 -0.04 9.88 1.04 -1.26 0.47 113.70 125.19 2xdm s SER 68 Ca 0.50 -0.98 0.07 0.00 0.48 0.00 0.00 55.95 56.02 2xdm s SER 68 Cb -0.40 -0.01 -0.02 0.00 0.10 0.00 0.00 66.02 65.69 2xdm s SER 68 CO 0.52 -0.31 -0.23 -0.36 0.98 0.00 0.00 173.24 173.83 2xdm s PHE 69 N -3.14 2.44 0.12 5.02 0.40 -1.26 -4.93 117.98 116.62 2xdm s PHE 69 Ca 0.15 -0.45 0.05 0.00 -0.60 0.00 0.00 56.93 56.08 2xdm s PHE 69 Cb 0.01 -1.55 -0.04 0.00 0.51 0.00 0.00 43.02 41.95 2xdm s PHE 69 CO 0.01 -0.04 0.02 0.20 0.70 0.00 0.00 175.22 176.11 2xdm s GLY 70 N -0.51 1.85 0.04 4.36 0.00 -1.26 -1.18 107.32 110.61 2xdm s GLY 70 Ca 0.07 -1.19 0.04 0.00 0.00 0.00 0.00 44.72 43.64 2xdm s GLY 70 CO 0.00 -1.18 -0.12 -1.59 0.00 0.00 0.00 173.10 170.21 2xdm s THR 71 N -1.48 0.95 0.02 0.90 2.01 -0.86 -1.82 115.64 115.36 2xdm s THR 71 Ca 0.27 -1.01 -0.01 0.00 0.31 0.00 0.00 61.69 61.25 2xdm s THR 71 Cb -0.11 -0.89 -0.02 0.00 0.01 0.00 0.00 72.50 71.49 2xdm s THR 71 CO 0.19 -0.10 -0.01 -1.61 -0.69 0.00 0.00 174.62 172.40 2xdm s GLU 72 N -1.25 0.29 -0.24 4.92 2.02 0.19 -0.49 118.70 124.14 2xdm s GLU 72 Ca -0.01 -0.52 -0.02 0.00 0.02 0.00 0.00 54.97 54.44 2xdm s GLU 72 Cb -0.08 0.11 0.02 0.00 0.10 0.00 0.00 34.13 34.28 2xdm s GLU 72 CO 0.01 -0.05 -0.07 0.08 0.02 0.00 0.00 175.26 175.25 2xdm s VAL 73 N -1.29 2.83 -0.07 2.63 1.01 0.20 -0.08 120.40 125.63 2xdm s VAL 73 Ca -0.14 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 60.90 2xdm s VAL 73 Cb -0.09 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 2xdm s VAL 73 CO -0.01 0.25 -0.13 0.00 0.00 0.00 0.00 175.10 175.22 2xdm s ALA 74 N 1.33 2.70 0.31 5.51 0.00 -0.10 0.30 121.76 131.81 2xdm s ALA 74 Ca 0.01 -0.95 0.05 0.00 0.00 0.00 0.00 51.96 51.07 2xdm s ALA 74 Cb -0.16 -1.05 -0.06 0.00 0.00 0.00 0.00 23.12 21.84 2xdm s ALA 74 CO -0.05 0.50 0.01 0.00 0.00 0.00 0.00 175.76 176.21 2xdm s ALA 75 N -0.52 2.38 0.13 0.00 0.00 0.70 -1.40 121.76 123.06 2xdm s ALA 75 Ca 0.07 -2.00 0.00 0.00 0.00 0.00 0.00 51.96 50.03 2xdm s ALA 75 Cb -0.12 0.43 -0.11 0.00 0.00 0.00 0.00 23.12 23.32 2xdm s ALA 75 CO 0.02 -0.20 1.30 1.49 0.00 0.00 0.00 175.76 178.37 2xdm h GLU 76 N 2.17 0.23 -4.53 0.00 4.81 -1.85 0.56 114.58 115.99 2xdm h GLU 76 Ca -0.41 -0.30 -0.22 0.00 -0.13 0.00 0.00 59.36 58.31 2xdm h GLU 76 Cb 1.24 0.09 -0.15 0.00 0.63 0.00 0.00 28.75 30.56 2xdm h GLU 76 CO 0.69 1.05 -0.64 -1.12 -0.73 0.00 0.00 179.01 178.26 2xdm s SER 77 N -6.99 0.38 0.82 1.04 0.01 -1.26 -4.19 113.70 103.52 2xdm s SER 77 Ca -0.03 -1.27 -0.13 0.00 1.31 0.00 0.00 55.95 55.83 2xdm s SER 77 Cb 0.09 0.30 0.08 0.00 0.21 0.00 0.00 66.02 66.70 2xdm s SER 77 CO 0.85 -0.75 1.13 0.00 0.41 0.00 0.00 173.24 174.88 2xdm n ALA 78 N -0.17 -0.28 -1.62 1.44 0.00 -1.26 -4.71 120.51 113.91 2xdm n ALA 78 Ca -0.03 -0.36 -0.45 0.00 0.00 0.00 0.00 53.44 52.60 2xdm n ALA 78 Cb 0.64 -2.20 -0.02 0.00 0.00 0.00 0.00 19.45 17.87 2xdm n ALA 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2xdm n PRO 79 N -3.15 1.54 0.00 0.00 -0.04 -1.26 -4.96 135.00 127.13 2xdm n PRO 79 Ca 0.13 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 64.13 2xdm n PRO 79 Cb 0.51 -2.01 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 2xdm n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2xdm n GLY 80 N 1.40 -1.71 0.20 0.55 0.00 -0.63 -4.84 105.19 100.15 2xdm n GLY 80 Ca 0.10 -1.48 0.04 0.00 0.00 0.00 0.00 46.02 44.68 2xdm n GLY 80 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2xdm h ARG 81 N 0.00 0.00 -0.49 1.61 3.08 -1.94 -2.87 114.38 113.77 2xdm h ARG 81 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2xdm h ARG 81 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2xdm h ARG 81 CO 0.00 0.33 0.00 0.54 -1.07 0.00 0.00 179.97 179.77 2xdm n ARG 82 N -4.02 4.19 -1.85 0.04 1.74 -1.26 -4.91 116.66 110.59 2xdm n ARG 82 Ca -0.02 -3.03 -0.10 0.00 -0.77 0.00 0.00 57.85 53.94 2xdm n ARG 82 Cb 0.38 -2.09 -0.02 0.00 -1.02 0.00 0.00 32.46 29.71 2xdm n ARG 82 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2xdm n GLY 83 N 0.35 0.39 3.56 -0.13 0.00 -1.08 -4.72 105.19 103.56 2xdm n GLY 83 Ca 0.26 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 2xdm n GLY 83 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2xdm s GLU 84 N -3.87 3.07 0.34 1.61 1.03 -1.26 0.84 118.70 120.47 2xdm s GLU 84 Ca 0.00 -0.53 0.09 0.00 0.03 0.00 0.00 54.97 54.56 2xdm s GLU 84 Cb 0.00 -2.71 -0.06 0.00 -0.80 0.00 0.00 34.13 30.57 2xdm s GLU 84 CO 0.00 0.52 -0.03 0.14 -1.33 0.00 0.00 175.26 174.56 2xdm s VAL 85 N -0.42 2.49 0.00 1.83 -7.23 -0.72 -1.60 120.40 114.75 2xdm s VAL 85 Ca 0.06 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 2xdm s VAL 85 Cb -0.12 -2.74 0.00 0.00 0.56 0.00 0.00 36.38 34.08 2xdm s VAL 85 CO 0.02 -0.20 0.00 1.67 -0.31 0.00 0.00 175.10 176.28 2xdm n GLN 86 N -0.89 0.00 -2.89 4.82 -0.06 -1.26 -0.67 117.38 116.42 2xdm n GLN 86 Ca -0.04 0.00 -0.27 0.00 -2.00 0.00 0.00 57.00 54.69 2xdm n GLN 86 Cb 0.63 0.00 -0.01 0.00 -4.06 0.00 0.00 30.24 26.80 2xdm n GLN 86 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2xdm s ASP 87 N -1.00 6.31 0.01 1.69 1.01 -1.26 -0.53 116.67 122.90 2xdm s ASP 87 Ca 0.00 0.82 0.02 0.00 0.71 0.00 0.00 52.55 54.10 2xdm s ASP 87 Cb 0.00 -2.20 -0.01 0.00 1.01 0.00 0.00 42.92 41.72 2xdm s ASP 87 CO 0.00 -0.46 -0.06 -0.22 0.21 0.00 0.00 175.17 174.65 2xdm s LEU 88 N -4.44 2.07 -0.15 1.23 0.20 -0.51 -4.60 118.68 112.48 2xdm s LEU 88 Ca 0.46 -0.19 0.01 0.00 0.69 0.00 0.00 54.13 55.09 2xdm s LEU 88 Cb -0.10 -0.23 0.02 0.00 -0.43 0.00 0.00 46.19 45.45 2xdm s LEU 88 CO 0.40 -0.00 -0.15 -0.31 -0.29 0.00 0.00 176.35 176.00 2xdm s TYR 89 N -0.41 2.21 -0.35 5.38 1.51 -0.49 -0.92 117.35 124.27 2xdm s TYR 89 Ca -0.01 -1.22 -0.19 0.00 -1.01 0.00 0.00 57.07 54.65 2xdm s TYR 89 Cb -0.04 -1.60 -0.00 0.00 -0.11 0.00 0.00 41.96 40.21 2xdm s TYR 89 CO -0.00 -0.65 0.55 -1.17 -1.11 0.00 0.00 175.55 173.17 2xdm s LEU 90 N 1.38 4.33 -0.29 -1.29 2.96 0.29 -0.92 118.68 125.14 2xdm s LEU 90 Ca 0.03 0.01 -0.03 0.00 -0.22 0.00 0.00 54.13 53.92 2xdm s LEU 90 Cb -0.13 -2.64 0.04 0.00 0.50 0.00 0.00 46.19 43.95 2xdm s LEU 90 CO -0.09 -0.52 0.00 -0.69 -1.32 0.00 0.00 176.35 173.73 2xdm s VAL 91 N 2.49 3.17 -0.14 1.68 1.01 0.88 0.13 120.40 129.62 2xdm s VAL 91 Ca 0.20 -1.15 -0.11 0.00 0.00 0.00 0.00 61.98 60.93 2xdm s VAL 91 Cb -0.15 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.46 2xdm s VAL 91 CO 0.14 0.01 0.20 -0.83 0.00 0.00 0.00 175.10 174.62 2xdm s GLY 92 N 1.33 2.17 -0.46 4.51 0.00 -0.80 -0.64 107.32 113.42 2xdm s GLY 92 Ca -0.02 -0.56 0.05 0.00 0.00 0.00 0.00 44.72 44.18 2xdm s GLY 92 CO -0.01 0.05 1.21 0.54 0.00 0.00 0.00 173.10 174.89 2xdm n ARG 93 N 2.87 3.38 -0.42 2.90 1.74 -0.75 -4.39 116.66 121.99 2xdm n ARG 93 Ca -0.16 -4.36 0.00 0.00 -0.77 0.00 0.00 57.85 52.56 2xdm n ARG 93 Cb 0.53 -2.26 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 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 -0.52 0.75 3.60 -0.13 0.00 -0.21 -4.41 105.19 104.27 2xdm n GLY 94 Ca 0.41 -0.38 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.35 5.97 0.00 1.61 2.15 -1.26 -4.86 116.67 117.93 2xdm s ASP 95 Ca 0.00 1.30 0.06 0.00 0.43 0.00 0.00 52.55 54.33 2xdm s ASP 95 Cb 0.00 -2.53 0.26 0.00 -0.30 0.00 0.00 42.92 40.35 2xdm s ASP 95 CO 0.00 -1.65 1.18 -0.81 -0.17 0.00 0.00 175.17 173.72 2xdm n PRO 96 N 8.35 1.16 -1.50 4.34 -0.04 -1.26 -3.83 135.00 142.22 2xdm n PRO 96 Ca 0.22 -0.25 0.04 0.00 -0.04 0.00 0.00 63.50 63.46 2xdm n PRO 96 Cb 0.47 -1.11 0.05 0.00 -0.04 0.00 0.00 33.50 32.87 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 -0.34 0.43 -2.87 0.52 -2.24 -1.26 -4.77 114.28 103.74 2xdm n THR 97 Ca 0.05 -1.49 -0.42 0.00 -2.27 0.00 0.00 64.05 59.91 2xdm n THR 97 Cb 0.07 0.83 -0.04 0.00 -2.10 0.00 0.00 70.33 69.09 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 -0.78 4.06 0.39 3.22 0.20 -1.25 -4.85 118.68 119.67 2xdm s LEU 98 Ca 0.34 0.84 0.06 0.00 0.69 0.00 0.00 54.13 56.06 2xdm s LEU 98 Cb 0.38 -3.20 -0.00 0.00 -0.43 0.00 0.00 46.19 42.94 2xdm s LEU 98 CO -0.14 -0.64 0.55 -0.94 -0.29 0.00 0.00 176.35 174.88 2xdm s SER 99 N 1.55 5.82 0.45 3.68 1.04 -1.26 0.75 113.70 125.72 2xdm s SER 99 Ca 0.36 -0.17 0.11 0.00 0.48 0.00 0.00 55.95 56.73 2xdm s SER 99 Cb -0.14 -1.10 1.00 0.00 0.10 0.00 0.00 66.02 65.87 2xdm s SER 99 CO 0.12 -0.61 2.07 0.00 0.98 0.00 0.00 173.24 175.80 2xdm h ALA 100 N 0.70 1.78 -0.53 5.32 0.00 -1.96 -2.12 119.26 122.44 2xdm h ALA 100 Ca -0.44 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 2xdm h ALA 100 Cb 1.26 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 2xdm h ALA 100 CO 0.51 0.19 0.21 0.93 0.00 0.00 0.00 179.25 181.09 2xdm h GLU 101 N 0.29 0.77 -0.28 0.00 5.08 -1.96 -0.89 114.58 117.58 2xdm h GLU 101 Ca 0.08 -0.11 -0.17 0.00 -1.00 0.00 0.00 59.36 58.15 2xdm h GLU 101 Cb 0.04 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 2xdm h GLU 101 CO -0.01 0.63 -0.50 -0.44 -1.00 0.00 0.00 179.01 177.69 2xdm h ASP 102 N 0.76 0.86 -0.78 1.42 3.32 -1.79 -1.88 116.42 118.33 2xdm h ASP 102 Ca 0.18 -0.44 0.00 0.00 0.02 0.00 0.00 57.03 56.79 2xdm h ASP 102 Cb 0.15 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.42 2xdm h ASP 102 CO -0.02 1.21 0.50 -0.07 -1.72 0.00 0.00 179.24 179.14 2xdm h LEU 103 N 0.62 0.92 -0.40 1.55 3.38 -1.13 -2.09 115.31 118.15 2xdm h LEU 103 Ca 0.02 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2xdm h LEU 103 Cb 1.08 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 2xdm h LEU 103 CO 0.11 0.69 0.11 -0.78 0.09 0.00 0.00 178.44 178.66 2xdm h ASP 104 N 1.07 0.60 -0.85 -0.43 1.82 -0.94 -0.55 116.42 117.15 2xdm h ASP 104 Ca 0.28 -0.22 -0.03 0.00 -0.39 0.00 0.00 57.03 56.67 2xdm h ASP 104 Cb -0.08 -0.16 -0.04 0.00 0.68 0.00 0.00 39.33 39.73 2xdm h ASP 104 CO -0.06 0.67 0.41 0.00 -1.61 0.00 0.00 179.24 178.65 2xdm h ALA 105 N 0.96 1.13 -0.19 -0.78 0.00 -1.28 0.26 119.26 119.36 2xdm h ALA 105 Ca 0.13 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 2xdm h ALA 105 Cb 0.29 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2xdm h ALA 105 CO -0.00 0.66 -0.51 0.52 0.00 0.00 0.00 179.25 179.92 2xdm h MET 106 N 1.21 0.52 -0.79 0.00 2.86 -1.25 -0.97 114.93 116.52 2xdm h MET 106 Ca 0.29 -0.31 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 2xdm h MET 106 Cb 0.11 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 2xdm h MET 106 CO -0.04 0.91 0.36 0.00 1.06 0.00 0.00 176.91 179.20 2xdm h ALA 107 N 1.04 1.02 -0.52 6.32 0.00 -0.75 -2.13 119.26 124.23 2xdm h ALA 107 Ca 0.02 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2xdm h ALA 107 Cb 1.03 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2xdm h ALA 107 CO 0.09 0.60 0.16 0.00 0.00 0.00 0.00 179.25 180.10 2xdm h ALA 108 N 1.19 1.30 -0.14 0.00 0.00 -0.72 -2.84 119.26 118.06 2xdm h ALA 108 Ca 0.27 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2xdm h ALA 108 Cb 0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2xdm h ALA 108 CO -0.03 0.50 -0.33 0.93 0.00 0.00 0.00 179.25 180.32 2xdm h GLU 109 N 0.76 0.27 -0.25 0.00 5.08 -0.77 -2.35 114.58 117.32 2xdm h GLU 109 Ca 0.17 -0.11 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 2xdm h GLU 109 Cb 0.23 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 2xdm h GLU 109 CO -0.01 0.57 -0.20 0.28 -1.00 0.00 0.00 179.01 178.66 2xdm h VAL 110 N 0.24 1.31 -0.59 3.13 2.07 -1.25 -2.19 116.25 118.97 2xdm h VAL 110 Ca 0.03 -1.34 -0.02 0.00 0.82 0.00 0.00 66.70 66.19 2xdm h VAL 110 Cb 0.70 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 32.08 2xdm h VAL 110 CO 0.05 0.42 0.29 0.00 0.02 0.00 0.00 177.57 178.35 2xdm h ALA 111 N 0.69 1.41 -0.00 1.67 0.00 -1.35 -1.57 119.26 120.11 2xdm h ALA 111 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2xdm h ALA 111 Cb 0.74 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2xdm h ALA 111 CO 0.05 0.47 -0.14 0.00 0.00 0.00 0.00 179.25 179.63 2xdm n ALA 112 N -2.45 2.74 0.48 0.00 0.00 -0.90 -2.76 120.51 117.62 2xdm n ALA 112 Ca 0.05 -0.21 0.13 0.00 0.00 0.00 0.00 53.44 53.41 2xdm n ALA 112 Cb 0.12 -1.36 0.44 0.00 0.00 0.00 0.00 19.45 18.65 2xdm n ALA 112 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2xdm h SER 113 N 0.17 0.00 0.00 0.00 0.02 -0.62 -3.47 113.55 109.65 2xdm h SER 113 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2xdm h SER 113 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 2xdm h SER 113 CO 0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 2xdm n GLY 114 N 0.73 0.96 3.68 -3.77 0.00 -1.11 -4.79 105.19 100.89 2xdm n GLY 114 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 4.88 -0.05 1.61 1.01 -1.09 -4.36 120.40 120.41 2xdm s VAL 115 Ca 0.00 1.75 0.04 0.00 0.00 0.00 0.00 61.98 63.77 2xdm s VAL 115 Cb 0.00 -4.19 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 2xdm s VAL 115 CO 0.00 0.06 0.01 -1.14 0.00 0.00 0.00 175.10 174.03 2xdm n ARG 116 N 4.87 3.02 -3.97 2.72 0.63 0.25 -4.29 116.66 119.88 2xdm n ARG 116 Ca 0.05 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.82 2xdm n ARG 116 Cb 0.49 -1.12 -0.15 0.00 0.45 0.00 0.00 32.46 32.13 2xdm n ARG 116 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2xdm s THR 117 N -2.11 0.21 -0.42 5.15 2.01 -0.62 -1.35 115.64 118.50 2xdm s THR 117 Ca -0.03 0.00 -0.13 0.00 0.31 0.00 0.00 61.69 61.84 2xdm s THR 117 Cb 0.01 -0.25 0.05 0.00 0.01 0.00 0.00 72.50 72.32 2xdm s THR 117 CO 0.18 0.12 0.30 -0.69 -0.69 0.00 0.00 174.62 173.84 2xdm s VAL 118 N 0.60 4.87 -0.02 3.82 1.01 0.17 -1.75 120.40 129.09 2xdm s VAL 118 Ca -0.06 -1.00 0.12 0.00 0.00 0.00 0.00 61.98 61.04 2xdm s VAL 118 Cb -0.09 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 2xdm s VAL 118 CO -0.01 -0.42 1.39 0.03 0.00 0.00 0.00 175.10 176.08 2xdm h ARG 119 N 8.58 0.00 0.00 2.72 3.08 -0.81 0.17 114.38 128.11 2xdm h ARG 119 Ca -0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.79 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 0.77 0.71 0.00 0.41 -1.07 0.00 0.00 179.97 180.79 2xdm n GLY 120 N 1.23 1.95 3.92 0.04 0.00 0.31 -4.22 105.19 108.42 2xdm n GLY 120 Ca 0.01 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.49 6.31 -0.28 1.61 1.01 -1.26 -1.12 116.67 122.46 2xdm s ASP 121 Ca 0.00 0.22 -0.11 0.00 0.71 0.00 0.00 52.55 53.37 2xdm s ASP 121 Cb 0.00 -1.92 -0.05 0.00 1.01 0.00 0.00 42.92 41.96 2xdm s ASP 121 CO 0.00 0.12 0.19 -0.22 0.21 0.00 0.00 175.17 175.47 2xdm s LEU 122 N -2.79 4.02 -0.09 1.23 2.96 0.08 -1.43 118.68 122.67 2xdm s LEU 122 Ca 0.35 -0.00 -0.00 0.00 -0.22 0.00 0.00 54.13 54.25 2xdm s LEU 122 Cb -0.12 -2.12 -0.03 0.00 0.50 0.00 0.00 46.19 44.42 2xdm s LEU 122 CO 0.28 -0.04 -0.07 -0.31 -1.32 0.00 0.00 176.35 174.88 2xdm s TYR 123 N 1.71 2.93 -0.41 5.38 2.02 -0.10 -1.45 117.35 127.43 2xdm s TYR 123 Ca 0.07 -0.14 -0.17 0.00 -0.37 0.00 0.00 57.07 56.45 2xdm s TYR 123 Cb -0.16 -1.78 0.02 0.00 -0.40 0.00 0.00 41.96 39.64 2xdm s TYR 123 CO 0.10 0.17 0.45 0.00 -1.57 0.00 0.00 175.55 174.71 2xdm s ALA 124 N -0.40 3.43 -0.46 3.71 0.00 0.12 -0.55 121.76 127.61 2xdm s ALA 124 Ca 0.06 -1.44 -0.18 0.00 0.00 0.00 0.00 51.96 50.40 2xdm s ALA 124 Cb -0.12 -3.06 0.04 0.00 0.00 0.00 0.00 23.12 19.98 2xdm s ALA 124 CO 0.02 -1.55 0.50 0.34 0.00 0.00 0.00 175.76 175.08 2xdm s ASP 125 N 1.82 6.20 -0.26 0.00 -1.08 0.12 -2.05 116.67 121.43 2xdm s ASP 125 Ca 0.13 -0.84 0.09 0.00 -0.52 0.00 0.00 52.55 51.41 2xdm s ASP 125 Cb -0.17 -2.24 0.46 0.00 -1.46 0.00 0.00 42.92 39.51 2xdm s ASP 125 CO 0.14 -0.70 1.32 -0.90 0.52 0.00 0.00 175.17 175.54 2xdm n ASP 126 N 5.76 2.51 0.00 -0.34 3.85 -1.26 -1.90 116.55 125.17 2xdm n ASP 126 Ca -0.08 -3.85 0.11 0.00 -0.71 0.00 0.00 54.79 50.27 2xdm n ASP 126 Cb 0.46 -0.55 0.52 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 -1.06 0.36 -0.24 2.12 -2.24 -1.26 -3.14 114.28 108.82 2xdm n THR 127 Ca 0.28 0.09 0.12 0.00 -2.27 0.00 0.00 64.05 62.28 2xdm n THR 127 Cb 0.84 -0.69 0.40 0.00 -2.10 0.00 0.00 70.33 68.78 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 0.74 -1.66 4.78 2.91 -1.88 -3.41 115.95 117.44 2xdm h TRP 128 Ca 0.00 0.02 -0.53 0.00 1.13 0.00 0.00 58.89 59.51 2xdm h TRP 128 Cb 0.36 -0.23 -0.06 0.00 -0.51 0.00 0.00 29.16 28.71 2xdm h TRP 128 CO 0.00 0.28 -0.46 -0.06 -1.03 0.00 0.00 178.44 177.17 2xdm s PHE 129 N -5.62 2.70 0.91 2.65 2.99 -1.19 -3.94 117.98 116.48 2xdm s PHE 129 Ca -0.09 -0.48 -0.14 0.00 0.00 0.00 0.00 56.93 56.22 2xdm s PHE 129 Cb 0.22 -1.94 0.15 0.00 0.00 0.00 0.00 43.02 41.44 2xdm s PHE 129 CO 0.78 0.12 1.22 0.16 -0.00 0.00 0.00 175.22 177.50 2xdm s ASP 130 N -3.98 3.54 -0.18 1.36 -4.77 -0.56 -4.87 116.67 107.22 2xdm s ASP 130 Ca 0.43 0.62 0.11 0.00 -3.30 0.00 0.00 52.55 50.40 2xdm s ASP 130 Cb -0.01 -0.94 0.63 0.00 -1.09 0.00 0.00 42.92 41.51 2xdm s ASP 130 CO 0.25 -2.50 1.46 -1.54 0.70 0.00 0.00 175.17 173.54 2xdm n SER 131 N -3.68 4.60 -4.58 2.11 3.41 -1.26 -4.81 113.62 109.42 2xdm n SER 131 Ca 0.11 -2.69 -0.43 0.00 -0.26 0.00 0.00 58.87 55.60 2xdm n SER 131 Cb 0.60 -0.64 -0.03 0.00 -0.26 0.00 0.00 64.21 63.89 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 -2.32 3.59 0.08 4.33 2.12 -1.26 -4.89 118.70 120.35 2xdm s GLU 132 Ca 0.42 0.33 -0.02 0.00 0.36 0.00 0.00 54.97 56.05 2xdm s GLU 132 Cb 0.32 -3.96 -0.27 0.00 0.26 0.00 0.00 34.13 30.48 2xdm s GLU 132 CO 0.13 -1.45 1.15 0.00 -0.54 0.00 0.00 175.26 174.55 2xdm h ARG 133 N 9.30 0.22 -4.62 4.30 2.47 -1.87 -3.43 114.38 120.75 2xdm h ARG 133 Ca -0.24 -0.38 -0.25 0.00 -1.26 0.00 0.00 59.98 57.85 2xdm h ARG 133 Cb 1.06 0.14 -0.18 0.00 -1.65 0.00 0.00 29.97 29.34 2xdm h ARG 133 CO 1.12 1.17 -0.72 -0.51 0.56 0.00 0.00 179.97 181.60 2xdm s LEU 134 N -7.06 2.37 0.13 3.04 1.43 -1.26 -0.68 118.68 116.65 2xdm s LEU 134 Ca -0.03 -0.76 -0.30 0.00 -1.03 0.00 0.00 54.13 52.01 2xdm s LEU 134 Cb 0.08 -0.13 -0.06 0.00 0.03 0.00 0.00 46.19 46.10 2xdm s LEU 134 CO 0.87 -0.32 1.09 -0.69 0.23 0.00 0.00 176.35 177.53 2xdm s VAL 135 N -2.39 4.08 0.24 -1.59 1.01 -1.26 -4.96 120.40 115.53 2xdm s VAL 135 Ca 0.00 1.69 -0.11 0.00 0.00 0.00 0.00 61.98 63.55 2xdm s VAL 135 Cb -0.03 -4.08 0.32 0.00 0.00 0.00 0.00 36.38 32.59 2xdm s VAL 135 CO -0.02 0.24 1.60 0.44 0.00 0.00 0.00 175.10 177.36 2xdm h ASP 136 N 5.70 -0.70 -0.01 3.32 3.32 -2.00 -0.27 116.42 125.77 2xdm h ASP 136 Ca -0.43 0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.85 2xdm h ASP 136 Cb 1.21 0.47 0.00 0.00 0.22 0.00 0.00 39.33 41.24 2xdm h ASP 136 CO 0.74 -0.25 0.00 -0.90 -1.72 0.00 0.00 179.24 177.11 2xdm n ASP 137 N -5.50 0.13 -4.74 6.45 3.85 -1.26 -4.84 116.55 110.64 2xdm n ASP 137 Ca 0.11 -1.37 -0.33 0.00 -0.71 0.00 0.00 54.79 52.49 2xdm n ASP 137 Cb 0.40 -0.01 0.09 0.00 -1.35 0.00 0.00 41.12 40.25 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 -1.99 2.25 -0.16 2.11 0.51 -0.11 -4.64 118.94 116.91 2xdm s TRP 138 Ca 0.32 1.61 -0.23 0.00 -2.12 0.00 0.00 56.10 55.67 2xdm s TRP 138 Cb 0.15 -3.29 -0.02 0.00 -0.81 0.00 0.00 33.47 29.49 2xdm s TRP 138 CO 0.25 -2.22 0.72 -1.58 -0.51 0.00 0.00 176.95 173.61 2xdm s TRP 139 N -2.32 3.43 0.66 -1.98 0.51 -1.26 -4.93 118.94 113.05 2xdm s TRP 139 Ca 0.69 1.11 0.36 0.00 -2.12 0.00 0.00 56.10 56.15 2xdm s TRP 139 Cb -0.24 -2.88 1.98 0.00 -0.81 0.00 0.00 33.47 31.52 2xdm s TRP 139 CO 0.47 -0.15 2.13 -1.35 -0.51 0.00 0.00 176.95 177.54 2xdm h PRO 140 N 7.29 0.00 0.00 4.98 0.11 -1.94 -2.04 132.00 140.40 2xdm h PRO 140 Ca -0.32 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.62 2xdm h PRO 140 Cb 1.15 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2xdm h PRO 140 CO 0.80 0.00 -0.79 0.93 -0.21 0.00 0.00 178.00 178.73 2xdm h GLU 141 N 0.00 0.00 0.00 1.05 3.07 -2.00 -2.96 114.58 113.73 2xdm h GLU 141 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2xdm h GLU 141 Cb 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 2xdm h GLU 141 CO -0.00 0.79 0.00 -0.25 -1.40 0.00 0.00 179.01 178.15 2xdm n ASP 142 N -3.57 0.57 0.08 1.42 8.00 -0.77 -4.42 116.55 117.86 2xdm n ASP 142 Ca -0.01 0.58 0.15 0.00 0.71 0.00 0.00 54.79 56.22 2xdm n ASP 142 Cb 0.77 -0.72 0.65 0.00 -0.02 0.00 0.00 41.12 41.79 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 0.05 0.00 -1.24 5.08 -1.59 -1.26 114.58 115.62 2xdm h GLU 143 Ca 0.00 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2xdm h GLU 143 Cb 0.56 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2xdm h GLU 143 CO 0.00 0.03 -0.18 -1.35 -1.00 0.00 0.00 179.01 176.51 2xdm h PRO 144 N 0.05 0.00 -6.84 2.33 0.11 -1.83 -3.42 132.00 122.40 2xdm h PRO 144 Ca 0.17 0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.80 2xdm h PRO 144 Cb 0.61 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.71 2xdm h PRO 144 CO -0.01 0.18 0.16 0.71 -0.21 0.00 0.00 178.00 178.83 2xdm s TYR 145 N -4.13 3.39 0.46 0.65 1.51 -0.48 -0.76 117.35 118.01 2xdm s TYR 145 Ca -0.02 1.24 0.22 0.00 -1.01 0.00 0.00 57.07 57.50 2xdm s TYR 145 Cb 0.13 -2.57 1.34 0.00 -0.11 0.00 0.00 41.96 40.75 2xdm s TYR 145 CO 0.62 -0.02 2.08 0.00 -1.11 0.00 0.00 175.55 177.12 2xdm h ALA 146 N 1.85 1.52 0.00 3.71 0.00 -1.86 -1.36 119.26 123.11 2xdm h ALA 146 Ca -0.48 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2xdm h ALA 146 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2xdm h ALA 146 CO 0.64 0.15 0.00 2.48 0.00 0.00 0.00 179.25 182.52 2xdm n TYR 147 N -3.98 0.00 -1.24 0.00 0.18 -1.26 -2.46 117.16 108.40 2xdm n TYR 147 Ca -0.02 0.00 0.09 0.00 1.88 0.00 0.00 57.90 59.84 2xdm n TYR 147 Cb 0.20 -0.48 0.16 0.00 -0.38 0.00 0.00 39.34 38.84 2xdm n TYR 147 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2xdm n SER 148 N -1.48 2.15 -4.49 9.48 2.88 -0.52 -4.67 113.62 116.96 2xdm n SER 148 Ca 0.06 -3.33 -0.40 0.00 -1.33 0.00 0.00 58.87 53.86 2xdm n SER 148 Cb 0.25 -0.46 0.02 0.00 -0.75 0.00 0.00 64.21 63.26 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 -1.34 -1.01 -1.73 -1.46 0.00 -1.03 -4.76 120.51 109.19 2xdm n ALA 149 Ca 0.17 0.12 -0.34 0.00 0.00 0.00 0.00 53.44 53.39 2xdm n ALA 149 Cb 0.66 -1.86 -0.00 0.00 0.00 0.00 0.00 19.45 18.24 2xdm n ALA 149 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2xdm s GLN 150 N -1.85 3.44 -0.28 0.00 -0.21 -1.26 -4.89 119.66 114.61 2xdm s GLN 150 Ca 0.65 1.41 -0.14 0.00 0.02 0.00 0.00 55.36 57.30 2xdm s GLN 150 Cb -0.54 -2.04 -0.04 0.00 1.00 0.00 0.00 33.01 31.39 2xdm s GLN 150 CO 0.56 -0.74 0.32 0.42 -2.12 0.00 0.00 175.29 173.74 2xdm s ILE 151 N -2.05 5.21 0.06 1.08 -1.09 0.14 -4.82 121.20 119.72 2xdm s ILE 151 Ca 0.68 0.41 0.02 0.00 -2.23 0.00 0.00 60.65 59.53 2xdm s ILE 151 Cb -0.19 -3.67 -0.03 0.00 -1.58 0.00 0.00 42.46 36.99 2xdm s ILE 151 CO 0.28 0.15 -0.08 -0.55 -1.23 0.00 0.00 174.94 173.52 2xdm s SER 152 N 1.68 0.95 0.45 3.58 0.15 -1.26 -4.43 113.70 114.82 2xdm s SER 152 Ca 0.13 -0.65 0.29 0.00 0.70 0.00 0.00 55.95 56.41 2xdm s SER 152 Cb -0.16 0.05 1.04 0.00 -1.71 0.00 0.00 66.02 65.24 2xdm s SER 152 CO 0.10 -0.26 1.84 0.00 1.20 0.00 0.00 173.24 176.13 2xdm h ALA 153 N 4.15 1.00 -3.53 5.45 0.00 -1.88 -3.40 119.26 121.05 2xdm h ALA 153 Ca -0.36 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 53.88 2xdm h ALA 153 Cb 1.19 0.00 -0.38 0.00 0.00 0.00 0.00 17.79 18.61 2xdm h ALA 153 CO 0.46 0.00 -0.67 -1.17 0.00 0.00 0.00 179.25 177.86 2xdm s LEU 154 N -5.76 4.73 0.01 0.00 0.20 -1.26 -1.04 118.68 115.55 2xdm s LEU 154 Ca 0.04 -1.99 -0.02 0.00 0.69 0.00 0.00 54.13 52.85 2xdm s LEU 154 Cb 0.08 -1.69 -0.01 0.00 -0.43 0.00 0.00 46.19 44.15 2xdm s LEU 154 CO 0.55 -0.40 0.03 0.28 -0.29 0.00 0.00 176.35 176.51 2xdm s THR 155 N 1.02 0.07 -0.23 3.68 -1.32 -1.26 -2.30 115.64 115.30 2xdm s THR 155 Ca 0.07 -0.58 -0.17 0.00 -1.21 0.00 0.00 61.69 59.80 2xdm s THR 155 Cb -0.20 -0.24 -0.03 0.00 -1.51 0.00 0.00 72.50 70.52 2xdm s THR 155 CO -0.06 -0.32 0.45 -0.69 -2.21 0.00 0.00 174.62 171.79 2xdm s VAL 156 N -0.98 5.14 -0.17 5.08 1.01 -1.26 -4.44 120.40 124.77 2xdm s VAL 156 Ca -0.11 0.79 -0.19 0.00 0.00 0.00 0.00 61.98 62.47 2xdm s VAL 156 Cb -0.07 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2xdm s VAL 156 CO -0.00 0.18 0.53 0.00 0.00 0.00 0.00 175.10 175.81 2xdm s ALA 157 N 1.76 3.52 -0.08 5.51 0.00 0.23 -2.06 121.76 130.63 2xdm s ALA 157 Ca 0.20 -0.31 -0.17 0.00 0.00 0.00 0.00 51.96 51.69 2xdm s ALA 157 Cb -0.15 -2.80 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 2xdm s ALA 157 CO 0.09 -0.33 0.44 -1.58 0.00 0.00 0.00 175.76 174.37 2xdm s HIS 158 N 1.38 3.59 0.04 0.00 2.46 0.57 -4.32 115.29 119.01 2xdm s HIS 158 Ca 0.26 0.90 0.00 0.00 0.47 0.00 0.00 55.06 56.69 2xdm s HIS 158 Cb -0.15 -2.44 0.00 0.00 -0.13 0.00 0.00 32.58 29.85 2xdm s HIS 158 CO 0.10 0.35 0.00 0.41 -2.47 0.00 0.00 174.74 173.13 2xdm n GLY 159 N 2.76 -2.08 0.03 1.59 0.00 -1.26 -1.86 105.19 104.36 2xdm n GLY 159 Ca -0.10 -1.42 0.13 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.08 0.08 0.03 1.61 0.28 -1.26 -2.87 120.64 117.43 2xdm n GLU 160 Ca 0.00 0.05 0.13 0.00 -0.16 0.00 0.00 57.16 57.18 2xdm n GLU 160 Cb 0.07 -1.58 0.44 0.00 1.43 0.00 0.00 31.44 31.80 2xdm n GLU 160 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2xdm n ARG 161 N -1.71 0.10 -3.33 3.44 1.74 -1.26 -4.96 116.66 110.69 2xdm n ARG 161 Ca 0.06 0.06 -0.16 0.00 -0.77 0.00 0.00 57.85 57.04 2xdm n ARG 161 Cb 0.37 -1.60 0.07 0.00 -1.02 0.00 0.00 32.46 30.29 2xdm n ARG 161 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2xdm n PHE 162 N -1.76 -2.35 -2.76 -1.55 3.01 -1.07 -4.82 117.46 106.16 2xdm n PHE 162 Ca 0.06 0.87 -0.43 0.00 1.01 0.00 0.00 57.45 58.97 2xdm n PHE 162 Cb 0.37 -4.42 -0.03 0.00 -0.01 0.00 0.00 39.48 35.39 2xdm n PHE 162 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2xdm s ASP 163 N -3.72 6.87 0.22 4.37 1.01 -0.78 -4.67 116.67 119.97 2xdm s ASP 163 Ca 0.30 0.99 -0.12 0.00 0.71 0.00 0.00 52.55 54.43 2xdm s ASP 163 Cb -0.04 -2.49 -0.07 0.00 1.01 0.00 0.00 42.92 41.32 2xdm s ASP 163 CO 0.74 -0.73 0.57 0.42 0.21 0.00 0.00 175.17 176.38 2xdm s THR 164 N 3.30 4.88 -1.20 -1.27 -4.23 -1.26 -0.31 115.64 115.54 2xdm s THR 164 Ca 0.40 0.63 0.00 0.00 -1.18 0.00 0.00 61.69 61.54 2xdm s THR 164 Cb -0.13 -3.65 0.00 0.00 1.34 0.00 0.00 72.50 70.05 2xdm s THR 164 CO 0.12 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 2xdm n GLY 165 N 0.11 0.44 3.60 3.99 0.00 -0.88 -4.77 105.19 107.68 2xdm n GLY 165 Ca -0.01 -0.38 -0.26 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.58 2.23 0.08 1.61 -7.23 -1.26 -3.00 120.40 110.26 2xdm s VAL 166 Ca 0.00 -2.05 0.06 0.00 -1.81 0.00 0.00 61.98 58.19 2xdm s VAL 166 Cb 0.00 -2.83 -0.03 0.00 0.56 0.00 0.00 36.38 34.08 2xdm s VAL 166 CO 0.00 -0.11 -0.17 0.28 -0.31 0.00 0.00 175.10 174.79 2xdm s THR 167 N -2.63 1.38 -0.49 5.32 -1.32 0.44 -4.88 115.64 113.46 2xdm s THR 167 Ca 0.35 -1.40 -0.21 0.00 -1.21 0.00 0.00 61.69 59.21 2xdm s THR 167 Cb 0.05 -1.28 0.04 0.00 -1.51 0.00 0.00 72.50 69.79 2xdm s THR 167 CO 0.18 -0.14 0.74 -0.70 -2.21 0.00 0.00 174.62 172.49 2xdm s GLU 168 N -1.78 3.26 0.01 7.08 2.12 -1.26 -1.22 118.70 126.91 2xdm s GLU 168 Ca 0.02 -0.47 -0.21 0.00 0.36 0.00 0.00 54.97 54.67 2xdm s GLU 168 Cb -0.10 -4.02 -0.05 0.00 0.26 0.00 0.00 34.13 30.21 2xdm s GLU 168 CO 0.03 -1.22 0.62 0.08 -0.54 0.00 0.00 175.26 174.22 2xdm s VAL 169 N 3.13 4.87 -0.04 3.70 1.01 0.39 -2.68 120.40 130.78 2xdm s VAL 169 Ca 0.23 1.30 0.02 0.00 0.00 0.00 0.00 61.98 63.53 2xdm s VAL 169 Cb -0.15 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.29 2xdm s VAL 169 CO 0.17 0.42 -0.06 -0.94 0.00 0.00 0.00 175.10 174.69 2xdm s SER 170 N -0.25 1.05 -0.16 3.32 1.04 -0.52 -0.73 113.70 117.45 2xdm s SER 170 Ca 0.32 -0.16 0.02 0.00 0.48 0.00 0.00 55.95 56.61 2xdm s SER 170 Cb -0.19 -0.45 0.02 0.00 0.10 0.00 0.00 66.02 65.50 2xdm s SER 170 CO 0.18 -0.01 -0.20 -0.69 0.98 0.00 0.00 173.24 173.49 2xdm s VAL 171 N 0.68 2.03 0.11 5.02 1.01 0.14 -1.88 120.40 127.51 2xdm s VAL 171 Ca -0.10 -0.93 0.10 0.00 0.00 0.00 0.00 61.98 61.04 2xdm s VAL 171 Cb -0.13 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 2xdm s VAL 171 CO 0.01 0.54 -0.22 0.42 0.00 0.00 0.00 175.10 175.84 2xdm s THR 172 N 1.11 2.56 0.30 3.92 -4.23 -0.59 -0.73 115.64 117.98 2xdm s THR 172 Ca 0.00 -1.58 -0.29 0.00 -1.18 0.00 0.00 61.69 58.64 2xdm s THR 172 Cb -0.14 -2.15 -0.10 0.00 1.34 0.00 0.00 72.50 71.46 2xdm s THR 172 CO -0.08 0.13 1.22 -2.16 -0.54 0.00 0.00 174.62 173.18 2xdm s PRO 173 N -2.02 4.48 0.00 3.99 0.04 -1.26 -1.51 135.00 138.72 2xdm s PRO 173 Ca 0.16 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.24 2xdm s PRO 173 Cb -0.10 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.31 2xdm s PRO 173 CO 0.08 -0.02 0.00 0.00 0.04 0.00 0.00 177.00 177.09 2xdm n ALA 174 N 1.04 0.00 -1.90 8.56 0.00 -1.26 -4.81 120.51 122.14 2xdm n ALA 174 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2xdm n ALA 174 Cb 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.82 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 -2.93 3.25 -0.01 0.00 0.00 -1.26 -4.87 121.76 115.94 2xdm s ALA 175 Ca 0.00 0.37 -0.38 0.00 0.00 0.00 0.00 51.96 51.96 2xdm s ALA 175 Cb 0.00 -3.05 -0.16 0.00 0.00 0.00 0.00 23.12 19.91 2xdm s ALA 175 CO 0.00 0.22 1.45 -1.91 0.00 0.00 0.00 175.76 175.52 2xdm n GLU 176 N 0.39 1.14 -0.10 0.00 2.13 -1.26 -1.34 120.64 121.60 2xdm n GLU 176 Ca 0.01 0.41 0.00 0.00 0.66 0.00 0.00 57.16 58.25 2xdm n GLU 176 Cb 0.51 -2.06 0.00 0.00 0.27 0.00 0.00 31.44 30.16 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 2.96 1.52 3.87 8.31 0.00 0.13 -4.98 105.19 117.00 2xdm n GLY 177 Ca 0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.44 3.11 0.41 1.61 2.02 -0.45 -4.78 118.70 120.18 2xdm s GLU 178 Ca 0.00 -0.86 -0.25 0.00 0.02 0.00 0.00 54.97 53.87 2xdm s GLU 178 Cb 0.00 -2.72 -0.11 0.00 0.10 0.00 0.00 34.13 31.41 2xdm s GLU 178 CO 0.00 0.45 1.14 -2.30 0.02 0.00 0.00 175.26 174.57 2xdm n PRO 179 N -0.87 1.63 -2.19 0.39 -0.02 -1.26 -0.00 135.00 132.68 2xdm n PRO 179 Ca -0.08 0.58 -0.33 0.00 -2.02 0.00 0.00 63.50 61.65 2xdm n PRO 179 Cb 0.56 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 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 -1.22 2.74 -0.02 3.55 0.00 -1.13 -4.41 121.76 121.28 2xdm s ALA 180 Ca 0.62 0.55 -0.26 0.00 0.00 0.00 0.00 51.96 52.86 2xdm s ALA 180 Cb -0.55 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.26 2xdm s ALA 180 CO 0.58 -0.71 0.80 -0.51 0.00 0.00 0.00 175.76 175.91 2xdm s ASP 181 N -2.36 7.16 -0.13 0.00 1.01 -0.57 -4.94 116.67 116.85 2xdm s ASP 181 Ca 0.67 1.40 0.02 0.00 0.71 0.00 0.00 52.55 55.34 2xdm s ASP 181 Cb -0.18 -2.47 0.01 0.00 1.01 0.00 0.00 42.92 41.29 2xdm s ASP 181 CO 0.31 -0.12 -0.17 -0.69 0.21 0.00 0.00 175.17 174.71 2xdm s VAL 182 N 0.62 1.70 -0.15 -1.27 1.01 -1.26 -1.55 120.40 119.50 2xdm s VAL 182 Ca 0.42 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 2xdm s VAL 182 Cb -0.19 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 2xdm s VAL 182 CO 0.22 0.48 -0.04 -0.62 0.00 0.00 0.00 175.10 175.15 2xdm s ASP 183 N 1.04 4.82 0.00 3.32 -1.08 -0.79 -5.01 116.67 118.98 2xdm s ASP 183 Ca -0.04 -0.10 0.28 0.00 -0.52 0.00 0.00 52.55 52.17 2xdm s ASP 183 Cb -0.15 -1.74 1.14 0.00 -1.46 0.00 0.00 42.92 40.72 2xdm s ASP 183 CO -0.04 0.19 1.80 0.18 0.52 0.00 0.00 175.17 177.82 2xdm n LEU 184 N 3.38 0.90 0.00 -1.34 4.77 -1.26 -1.44 117.00 122.01 2xdm n LEU 184 Ca -0.17 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 2xdm n LEU 184 Cb 0.53 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2xdm n LEU 184 CO 0.32 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 2xdm n GLY 185 N 1.22 1.38 0.36 -0.72 0.00 -1.09 -3.37 105.19 102.97 2xdm n GLY 185 Ca 0.17 -0.67 0.11 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.37 1.65 0.00 4.61 0.00 -1.94 -0.99 119.26 122.21 2xdm h ALA 186 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2xdm h ALA 186 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2xdm h ALA 186 CO 0.00 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.28 2xdm n ALA 187 N -2.35 2.16 -1.68 0.00 0.00 -1.22 -4.77 120.51 112.66 2xdm n ALA 187 Ca 0.21 -0.07 -0.45 0.00 0.00 0.00 0.00 53.44 53.14 2xdm n ALA 187 Cb 0.50 -1.18 -0.04 0.00 0.00 0.00 0.00 19.45 18.73 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 -0.80 2.48 -0.96 0.00 -0.58 -0.38 -0.63 120.64 119.77 2xdm n GLU 188 Ca 0.08 0.91 0.00 0.00 -0.42 0.00 0.00 57.16 57.73 2xdm n GLU 188 Cb 0.04 -2.77 0.00 0.00 -0.57 0.00 0.00 31.44 28.14 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 4.15 0.57 0.81 0.62 0.00 -1.26 -4.81 105.19 105.27 2xdm n GLY 189 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.49 0.00 -1.93 1.61 9.36 0.20 -5.06 117.16 118.85 2xdm n TYR 190 Ca 0.00 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 60.92 2xdm n TYR 190 Cb 0.05 -0.14 0.02 0.00 -0.63 0.00 0.00 39.34 38.64 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 -2.20 3.04 0.22 2.98 0.00 -0.13 -5.07 121.76 120.60 2xdm s ALA 191 Ca -0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 51.96 51.63 2xdm s ALA 191 Cb 0.01 -3.02 -0.05 0.00 0.00 0.00 0.00 23.12 20.07 2xdm s ALA 191 CO 0.11 -0.86 0.44 -1.21 0.00 0.00 0.00 175.76 174.24 2xdm s GLU 192 N -5.23 3.58 -0.16 0.00 2.02 -0.10 -4.84 118.70 113.97 2xdm s GLU 192 Ca 0.56 -0.18 -0.04 0.00 0.02 0.00 0.00 54.97 55.34 2xdm s GLU 192 Cb -0.11 -2.78 -0.02 0.00 0.10 0.00 0.00 34.13 31.32 2xdm s GLU 192 CO 0.52 0.36 -0.04 -1.17 0.02 0.00 0.00 175.26 174.95 2xdm s LEU 193 N -3.24 3.19 -0.48 1.80 2.96 -1.26 -0.69 118.68 120.95 2xdm s LEU 193 Ca 0.41 -0.17 0.03 0.00 -0.22 0.00 0.00 54.13 54.18 2xdm s LEU 193 Cb -0.11 -1.77 0.13 0.00 0.50 0.00 0.00 46.19 44.94 2xdm s LEU 193 CO 0.28 0.15 0.23 -0.62 -1.32 0.00 0.00 176.35 175.07 2xdm s ASP 194 N 0.48 4.18 -0.53 3.68 3.68 0.89 -4.96 116.67 124.10 2xdm s ASP 194 Ca -0.04 -2.79 -0.16 0.00 2.13 0.00 0.00 52.55 51.69 2xdm s ASP 194 Cb -0.14 -1.46 0.11 0.00 -1.45 0.00 0.00 42.92 39.98 2xdm s ASP 194 CO 0.03 -0.26 0.49 0.21 0.13 0.00 0.00 175.17 175.77 2xdm s ASN 195 N 0.05 6.18 -0.18 -0.34 2.47 -1.26 -0.44 114.94 121.41 2xdm s ASN 195 Ca 0.16 -1.66 0.15 0.00 0.42 0.00 0.00 52.86 51.94 2xdm s ASN 195 Cb -0.25 -2.21 0.38 0.00 -1.45 0.00 0.00 41.25 37.73 2xdm s ASN 195 CO -0.01 -0.82 1.24 0.54 -3.72 0.00 0.00 177.10 174.32 2xdm n ARG 196 N 5.30 1.64 -3.68 0.43 1.74 0.29 -4.97 116.66 117.41 2xdm n ARG 196 Ca -0.13 -2.90 -0.31 0.00 -0.77 0.00 0.00 57.85 53.74 2xdm n ARG 196 Cb 0.41 -1.61 -0.04 0.00 -1.02 0.00 0.00 32.46 30.19 2xdm n ARG 196 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2xdm s ALA 197 N -3.02 3.81 0.16 7.54 0.00 -0.82 -4.46 121.76 124.96 2xdm s ALA 197 Ca 0.36 -0.63 0.05 0.00 0.00 0.00 0.00 51.96 51.75 2xdm s ALA 197 Cb 0.33 -2.09 -0.04 0.00 0.00 0.00 0.00 23.12 21.32 2xdm s ALA 197 CO 0.00 0.62 0.09 0.14 0.00 0.00 0.00 175.76 176.62 2xdm s VAL 198 N -1.71 4.28 -0.18 0.00 -7.23 -0.90 -2.82 120.40 111.85 2xdm s VAL 198 Ca 0.40 -1.14 -0.25 0.00 -1.81 0.00 0.00 61.98 59.18 2xdm s VAL 198 Cb -0.12 -3.16 -0.01 0.00 0.56 0.00 0.00 36.38 33.64 2xdm s VAL 198 CO 0.26 -0.08 0.84 -0.89 -0.31 0.00 0.00 175.10 174.92 2xdm s THR 199 N -1.71 4.87 0.51 5.32 2.01 1.00 -0.77 115.64 126.87 2xdm s THR 199 Ca 0.30 1.65 0.03 0.00 0.31 0.00 0.00 61.69 63.98 2xdm s THR 199 Cb -0.10 -4.14 0.03 0.00 0.01 0.00 0.00 72.50 68.29 2xdm s THR 199 CO 0.22 0.01 0.72 -0.83 -0.69 0.00 0.00 174.62 174.05 2xdm s GLY 200 N 1.17 1.86 0.62 4.40 0.00 0.66 0.18 107.32 116.21 2xdm s GLY 200 Ca 0.38 -1.45 -0.18 0.00 0.00 0.00 0.00 44.72 43.47 2xdm s GLY 200 CO 0.12 -1.19 0.77 0.00 0.00 0.00 0.00 173.10 172.80 2xdm n ALA 201 N -2.20 -0.46 -1.72 3.20 0.00 -1.26 -0.81 120.51 117.26 2xdm n ALA 201 Ca 0.08 -0.05 -0.41 0.00 0.00 0.00 0.00 53.44 53.07 2xdm n ALA 201 Cb 0.60 -1.99 0.01 0.00 0.00 0.00 0.00 19.45 18.06 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 -1.87 1.61 -1.01 0.00 0.00 -1.26 -2.41 120.51 115.57 2xdm n ALA 202 Ca 0.13 0.29 -0.00 0.00 0.00 0.00 0.00 53.44 53.85 2xdm n ALA 202 Cb 0.48 -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 0.70 0.43 4.00 0.00 0.00 -1.26 -4.92 105.19 104.14 2xdm n GLY 203 Ca 0.05 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.07 5.52 0.17 1.61 1.04 -1.01 -5.07 113.70 113.89 2xdm s SER 204 Ca 0.00 -0.51 -0.31 0.00 0.48 0.00 0.00 55.95 55.61 2xdm s SER 204 Cb 0.00 -0.53 -0.09 0.00 0.10 0.00 0.00 66.02 65.51 2xdm s SER 204 CO 0.00 -0.82 1.41 0.00 0.98 0.00 0.00 173.24 174.81 2xdm s ALA 205 N -2.40 3.61 -0.58 5.32 0.00 -1.26 -4.67 121.76 121.78 2xdm s ALA 205 Ca 0.55 1.20 -0.27 0.00 0.00 0.00 0.00 51.96 53.43 2xdm s ALA 205 Cb -0.09 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.50 2xdm s ALA 205 CO 0.33 -0.65 1.53 1.21 0.00 0.00 0.00 175.76 178.19 2xdm s ASN 206 N 0.77 5.91 -0.10 0.00 3.84 -1.26 -4.63 114.94 119.47 2xdm s ASN 206 Ca 0.62 0.28 0.14 0.00 0.21 0.00 0.00 52.86 54.11 2xdm s ASN 206 Cb -0.39 -2.54 0.43 0.00 -0.55 0.00 0.00 41.25 38.20 2xdm s ASN 206 CO 0.35 -1.89 1.35 0.35 -2.79 0.00 0.00 177.10 174.48 2xdm n THR 207 N 6.92 1.74 -1.87 -5.21 -2.24 -0.25 -4.97 114.28 108.40 2xdm n THR 207 Ca 0.14 -1.50 -0.41 0.00 -2.27 0.00 0.00 64.05 60.02 2xdm n THR 207 Cb 0.50 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 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 -2.04 4.27 -0.05 3.22 2.96 -1.00 -4.01 118.68 122.03 2xdm s LEU 208 Ca 0.34 2.93 0.01 0.00 -0.22 0.00 0.00 54.13 57.19 2xdm s LEU 208 Cb 0.25 -3.75 0.02 0.00 0.50 0.00 0.00 46.19 43.21 2xdm s LEU 208 CO 0.12 -0.90 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.51 2xdm s VAL 209 N -1.16 0.58 -0.25 1.68 1.01 0.54 -4.94 120.40 117.86 2xdm s VAL 209 Ca 0.55 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.37 2xdm s VAL 209 Cb -0.44 -0.61 0.01 0.00 0.00 0.00 0.00 36.38 35.34 2xdm s VAL 209 CO 0.59 0.24 -0.03 -0.63 0.00 0.00 0.00 175.10 175.27 2xdm s ILE 210 N 1.03 3.22 0.25 2.22 1.01 -1.26 -1.15 121.20 126.52 2xdm s ILE 210 Ca -0.09 -0.78 0.09 0.00 0.00 0.00 0.00 60.65 59.86 2xdm s ILE 210 Cb -0.14 -2.58 -0.05 0.00 0.01 0.00 0.00 42.46 39.70 2xdm s ILE 210 CO -0.00 0.26 -0.15 -0.62 0.00 0.00 0.00 174.94 174.43 2xdm s ASP 211 N 1.41 3.00 -0.31 3.58 2.15 0.39 -4.99 116.67 121.90 2xdm s ASP 211 Ca 0.03 -1.06 0.01 0.00 0.43 0.00 0.00 52.55 51.96 2xdm s ASP 211 Cb -0.16 -0.21 0.10 0.00 -0.30 0.00 0.00 42.92 42.35 2xdm s ASP 211 CO -0.03 -0.13 0.07 -0.60 -0.17 0.00 0.00 175.17 174.31 2xdm s ARG 212 N -3.61 1.05 0.35 4.34 3.52 -1.26 -0.50 118.95 122.84 2xdm s ARG 212 Ca 0.27 -1.35 -0.26 0.00 -0.13 0.00 0.00 55.73 54.25 2xdm s ARG 212 Cb -0.01 -2.48 -0.13 0.00 -1.56 0.00 0.00 34.95 30.78 2xdm s ARG 212 CO 0.11 -0.94 0.96 -2.30 -0.81 0.00 0.00 175.30 172.32 2xdm n PRO 213 N 4.62 1.27 -1.66 5.12 -0.02 -1.25 -4.67 135.00 138.41 2xdm n PRO 213 Ca -0.01 0.45 -0.45 0.00 -2.02 0.00 0.00 63.50 61.47 2xdm n PRO 213 Cb 0.42 -1.88 -0.02 0.00 -0.02 0.00 0.00 33.50 32.00 2xdm n PRO 213 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2xdm n VAL 214 N -0.16 1.20 -0.96 -1.45 3.14 -1.26 -2.09 118.33 116.74 2xdm n VAL 214 Ca 0.10 -0.30 0.00 0.00 -2.96 0.00 0.00 64.34 61.18 2xdm n VAL 214 Cb 0.35 -1.37 0.00 0.00 -1.06 0.00 0.00 33.84 31.76 2xdm n VAL 214 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2xdm n GLY 215 N 1.84 0.59 3.75 7.55 0.00 -1.26 -5.01 105.19 112.65 2xdm n GLY 215 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.54 2.54 -0.53 2.61 -4.23 -0.89 -5.04 115.64 107.57 2xdm s THR 216 Ca 0.00 -1.65 0.03 0.00 -1.18 0.00 0.00 61.69 58.89 2xdm s THR 216 Cb 0.00 -2.99 0.42 0.00 1.34 0.00 0.00 72.50 71.27 2xdm s THR 216 CO 0.00 -0.05 1.45 -3.20 -0.54 0.00 0.00 174.62 172.27 2xdm n ASN 217 N -1.25 5.75 -4.05 3.99 5.15 -1.26 -4.64 115.26 118.96 2xdm n ASN 217 Ca -0.01 -3.76 -0.31 0.00 -0.60 0.00 0.00 54.58 49.90 2xdm n ASN 217 Cb 0.63 -0.64 -0.16 0.00 -0.53 0.00 0.00 39.78 39.08 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 -5.15 1.69 -0.28 -0.44 2.01 -1.26 -0.92 115.64 111.29 2xdm s THR 218 Ca 0.51 -0.71 -0.29 0.00 0.31 0.00 0.00 61.69 61.52 2xdm s THR 218 Cb 0.42 -1.56 0.01 0.00 0.01 0.00 0.00 72.50 71.38 2xdm s THR 218 CO -0.17 0.48 1.11 -0.63 -0.69 0.00 0.00 174.62 174.71 2xdm s ILE 219 N 1.41 4.50 -0.18 1.82 -1.09 0.13 -3.82 121.20 123.96 2xdm s ILE 219 Ca 0.04 1.76 -0.05 0.00 -2.23 0.00 0.00 60.65 60.17 2xdm s ILE 219 Cb -0.13 -4.32 -0.03 0.00 -1.58 0.00 0.00 42.46 36.40 2xdm s ILE 219 CO -0.11 -0.36 -0.00 0.00 -1.23 0.00 0.00 174.94 173.24 2xdm s ALA 220 N 3.58 3.08 -0.21 9.38 0.00 0.35 -0.08 121.76 137.86 2xdm s ALA 220 Ca 0.47 -0.89 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 2xdm s ALA 220 Cb -0.14 -1.72 0.02 0.00 0.00 0.00 0.00 23.12 21.27 2xdm s ALA 220 CO 0.13 0.03 -0.13 0.08 0.00 0.00 0.00 175.76 175.87 2xdm s VAL 221 N 0.68 2.55 0.40 0.00 1.01 0.41 -0.46 120.40 124.99 2xdm s VAL 221 Ca -0.00 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.10 2xdm s VAL 221 Cb -0.14 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 2xdm s VAL 221 CO 0.02 0.40 0.08 0.42 0.00 0.00 0.00 175.10 176.02 2xdm s THR 222 N 1.33 0.92 0.00 3.92 -4.23 -0.30 -0.55 115.64 116.72 2xdm s THR 222 Ca 0.03 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.54 2xdm s THR 222 Cb -0.15 -2.47 0.00 0.00 1.34 0.00 0.00 72.50 71.22 2xdm s THR 222 CO -0.08 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 2xdm n GLY 223 N -0.91 -2.13 3.43 3.99 0.00 -1.26 -0.34 105.19 107.97 2xdm n GLY 223 Ca -0.07 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 44.08 2xdm n GLY 223 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2xdm s SER 224 N -3.65 3.80 -0.15 1.61 0.15 -1.26 -2.11 113.70 112.09 2xdm s SER 224 Ca 0.00 -0.27 0.01 0.00 0.70 0.00 0.00 55.95 56.39 2xdm s SER 224 Cb 0.00 -0.79 0.02 0.00 -1.71 0.00 0.00 66.02 63.54 2xdm s SER 224 CO 0.00 0.33 -0.17 -0.22 1.20 0.00 0.00 173.24 174.38 2xdm s LEU 225 N -0.63 1.87 0.61 3.45 2.96 0.05 -1.09 118.68 125.91 2xdm s LEU 225 Ca 0.09 -0.54 -0.18 0.00 -0.22 0.00 0.00 54.13 53.28 2xdm s LEU 225 Cb -0.11 -1.29 -0.03 0.00 0.50 0.00 0.00 46.19 45.26 2xdm s LEU 225 CO 0.01 -0.01 1.17 -2.84 -1.32 0.00 0.00 176.35 173.35 2xdm s PRO 226 N 1.29 2.93 0.42 0.98 0.02 -1.26 -0.24 135.00 139.13 2xdm s PRO 226 Ca 0.02 1.68 0.13 0.00 0.02 0.00 0.00 61.00 62.86 2xdm s PRO 226 Cb -0.13 -1.94 0.89 0.00 0.02 0.00 0.00 34.50 33.34 2xdm s PRO 226 CO -0.09 -1.21 1.94 0.00 -0.33 0.00 0.00 177.00 177.31 2xdm h ALA 227 N 0.65 1.59 -0.43 -1.55 0.00 -1.03 -2.35 119.26 116.14 2xdm h ALA 227 Ca -0.49 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.16 2xdm h ALA 227 Cb 1.28 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 2xdm h ALA 227 CO 0.55 0.31 0.06 -0.40 0.00 0.00 0.00 179.25 179.76 2xdm n ASP 228 N -4.26 4.20 -4.85 0.00 5.75 -1.26 -4.83 116.55 111.29 2xdm n ASP 228 Ca -0.02 -2.70 -0.34 0.00 -0.01 0.00 0.00 54.79 51.72 2xdm n ASP 228 Cb 0.29 -0.64 -0.06 0.00 -1.03 0.00 0.00 41.12 39.68 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 -2.23 3.55 0.57 2.12 0.00 -0.89 -4.98 121.76 119.91 2xdm s ALA 229 Ca 0.38 -0.14 -0.19 0.00 0.00 0.00 0.00 51.96 52.01 2xdm s ALA 229 Cb 0.29 -2.53 -0.05 0.00 0.00 0.00 0.00 23.12 20.84 2xdm s ALA 229 CO 0.11 0.46 1.14 0.00 0.00 0.00 0.00 175.76 177.46 2xdm s ALA 230 N -1.60 2.64 0.48 0.00 0.00 -1.26 -4.70 121.76 117.31 2xdm s ALA 230 Ca 0.42 0.82 -0.23 0.00 0.00 0.00 0.00 51.96 52.97 2xdm s ALA 230 Cb -0.14 -3.37 -0.08 0.00 0.00 0.00 0.00 23.12 19.53 2xdm s ALA 230 CO 0.20 -0.91 1.12 -2.30 0.00 0.00 0.00 175.76 173.87 2xdm n PRO 231 N -1.51 1.46 -3.04 0.00 -0.02 -1.26 -4.91 135.00 125.73 2xdm n PRO 231 Ca 0.12 0.53 -0.40 0.00 -2.02 0.00 0.00 63.50 61.73 2xdm n PRO 231 Cb 0.51 -2.24 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 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 -1.31 4.88 -0.21 -1.45 1.01 0.09 -4.93 120.40 118.48 2xdm s VAL 232 Ca 0.66 1.50 0.01 0.00 0.00 0.00 0.00 61.98 64.16 2xdm s VAL 232 Cb -0.49 -4.06 0.05 0.00 0.00 0.00 0.00 36.38 31.88 2xdm s VAL 232 CO 0.54 0.33 -0.07 -0.89 0.00 0.00 0.00 175.10 175.01 2xdm s THR 233 N 0.24 1.52 -0.04 3.92 2.01 -1.26 -0.69 115.64 121.34 2xdm s THR 233 Ca 0.37 -1.06 0.01 0.00 0.31 0.00 0.00 61.69 61.33 2xdm s THR 233 Cb -0.19 -1.70 0.02 0.00 0.01 0.00 0.00 72.50 70.64 2xdm s THR 233 CO 0.20 0.04 -0.05 0.00 -0.69 0.00 0.00 174.62 174.12 2xdm s ALA 234 N 1.43 0.68 -0.11 7.40 0.00 0.09 -5.00 121.76 126.25 2xdm s ALA 234 Ca -0.03 -0.12 -0.27 0.00 0.00 0.00 0.00 51.96 51.54 2xdm s ALA 234 Cb -0.17 -0.36 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 2xdm s ALA 234 CO -0.07 0.04 0.90 -0.51 0.00 0.00 0.00 175.76 176.11 2xdm s LEU 235 N 0.65 4.25 0.16 0.00 1.43 -1.26 -0.46 118.68 123.45 2xdm s LEU 235 Ca -0.09 1.37 0.08 0.00 -1.03 0.00 0.00 54.13 54.46 2xdm s LEU 235 Cb -0.12 -3.37 -0.04 0.00 0.03 0.00 0.00 46.19 42.68 2xdm s LEU 235 CO 0.00 -0.36 -0.17 -0.13 0.23 0.00 0.00 176.35 175.92 2xdm s ARG 236 N 1.76 1.25 0.47 1.70 1.81 -0.36 -4.37 118.95 121.21 2xdm s ARG 236 Ca 0.44 -1.41 -0.13 0.00 -1.72 0.00 0.00 55.73 52.91 2xdm s ARG 236 Cb -0.18 -1.25 -0.07 0.00 -0.45 0.00 0.00 34.95 33.01 2xdm s ARG 236 CO 0.17 0.25 0.87 0.95 -0.68 0.00 0.00 175.30 176.86 2xdm s THR 237 N -2.18 4.69 0.27 0.02 -4.23 0.06 -0.42 115.64 113.86 2xdm s THR 237 Ca 0.16 0.85 0.10 0.00 -1.18 0.00 0.00 61.69 61.61 2xdm s THR 237 Cb -0.05 -3.75 -0.04 0.00 1.34 0.00 0.00 72.50 70.00 2xdm s THR 237 CO 0.06 -0.65 -0.06 0.68 -0.54 0.00 0.00 174.62 174.11 2xdm s VAL 238 N -2.55 3.18 0.18 2.29 -7.23 -1.16 -4.83 120.40 110.29 2xdm s VAL 238 Ca 0.54 -2.05 -0.23 0.00 -1.81 0.00 0.00 61.98 58.43 2xdm s VAL 238 Cb -0.10 -2.69 -0.08 0.00 0.56 0.00 0.00 36.38 34.06 2xdm s VAL 238 CO 0.34 -0.38 0.76 -0.62 -0.31 0.00 0.00 175.10 174.89 2xdm s ASP 239 N -3.62 7.28 -0.50 4.85 2.15 -1.26 -4.46 116.67 121.11 2xdm s ASP 239 Ca 0.31 1.57 -0.18 0.00 0.43 0.00 0.00 52.55 54.68 2xdm s ASP 239 Cb -0.06 -2.47 0.02 0.00 -0.30 0.00 0.00 42.92 40.11 2xdm s ASP 239 CO 0.19 0.15 0.63 -0.62 -0.17 0.00 0.00 175.17 175.35 2xdm n GLU 240 N 1.31 -2.11 -0.35 4.34 -0.58 -1.26 -4.75 120.64 117.24 2xdm n GLU 240 Ca -0.05 1.85 0.14 0.00 -0.42 0.00 0.00 57.16 58.68 2xdm n GLU 240 Cb 0.50 -4.85 0.34 0.00 -0.57 0.00 0.00 31.44 26.86 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 1.70 0.68 -0.55 3.49 0.11 -1.86 -2.16 132.00 133.42 2xdm h PRO 241 Ca -0.14 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.82 2xdm h PRO 241 Cb 1.10 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 2xdm h PRO 241 CO 0.23 0.45 -0.09 0.00 -0.21 0.00 0.00 178.00 178.38 2xdm h ALA 242 N 1.68 0.78 -0.38 -0.75 0.00 -1.81 -1.56 119.26 117.22 2xdm h ALA 242 Ca 0.60 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 2xdm h ALA 242 Cb 1.01 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2xdm h ALA 242 CO -0.41 0.67 0.07 0.00 0.00 0.00 0.00 179.25 179.57 2xdm h ALA 243 N 0.96 1.41 -0.54 0.00 0.00 -1.70 -0.31 119.26 119.08 2xdm h ALA 243 Ca 0.15 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2xdm h ALA 243 Cb 0.66 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2xdm h ALA 243 CO 0.05 0.42 -0.02 1.25 0.00 0.00 0.00 179.25 180.94 2xdm h LEU 244 N 0.55 0.92 -1.13 0.00 5.85 -1.09 0.00 115.31 120.41 2xdm h LEU 244 Ca 0.12 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 2xdm h LEU 244 Cb 0.25 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2xdm h LEU 244 CO 0.00 0.99 0.42 0.00 -0.34 0.00 0.00 178.44 179.51 2xdm h ALA 245 N 1.10 1.34 0.14 1.25 0.00 -0.73 0.19 119.26 122.55 2xdm h ALA 245 Ca 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2xdm h ALA 245 Cb 0.54 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2xdm h ALA 245 CO 0.03 0.55 -0.07 0.78 0.00 0.00 0.00 179.25 180.54 2xdm h GLY 246 N 1.07 -0.20 0.10 0.00 0.00 -0.64 0.24 103.07 103.64 2xdm h GLY 246 Ca 0.27 0.07 0.13 0.00 0.00 0.00 0.00 47.33 47.80 2xdm h GLY 246 CO -0.05 -0.07 0.18 0.84 0.00 0.00 0.00 176.54 177.44 2xdm h HIS 247 N -0.45 0.29 -0.47 5.60 6.17 -0.75 0.81 115.15 126.36 2xdm h HIS 247 Ca -0.02 0.04 -0.10 0.00 0.71 0.00 0.00 60.37 61.00 2xdm h HIS 247 Cb 0.36 -0.02 -0.01 0.00 2.52 0.00 0.00 27.41 30.25 2xdm h HIS 247 CO 0.01 -0.03 -0.10 -0.07 0.71 0.00 0.00 177.93 178.45 2xdm h LEU 248 N 0.30 0.89 -0.85 0.26 3.38 -0.51 -2.87 115.31 115.92 2xdm h LEU 248 Ca 0.36 -0.36 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 2xdm h LEU 248 Cb 0.57 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2xdm h LEU 248 CO -0.44 1.04 -0.45 0.15 0.09 0.00 0.00 178.44 178.84 2xdm h PHE 249 N 0.73 0.34 -0.27 1.13 3.57 0.10 -1.84 116.94 120.70 2xdm h PHE 249 Ca 0.12 -0.10 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 2xdm h PHE 249 Cb 0.64 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 2xdm h PHE 249 CO 0.05 0.69 0.14 1.49 -2.23 0.00 0.00 178.31 178.44 2xdm h GLU 250 N 0.23 0.38 -0.89 1.11 4.81 -0.85 0.09 114.58 119.46 2xdm h GLU 250 Ca 0.02 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 2xdm h GLU 250 Cb 0.89 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.15 2xdm h GLU 250 CO 0.07 0.35 0.58 0.93 -0.73 0.00 0.00 179.01 180.22 2xdm h GLU 251 N 0.32 1.09 -0.20 1.92 5.08 -1.29 -1.87 114.58 119.62 2xdm h GLU 251 Ca 0.09 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 2xdm h GLU 251 Cb 0.09 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 2xdm h GLU 251 CO -0.01 0.72 -0.01 0.00 -1.00 0.00 0.00 179.01 178.71 2xdm h ALA 252 N 1.48 0.28 -0.29 3.43 0.00 -0.98 -2.49 119.26 120.68 2xdm h ALA 252 Ca 0.35 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 55.11 2xdm h ALA 252 Cb -0.01 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.63 2xdm h ALA 252 CO -0.10 0.01 -0.28 -0.07 0.00 0.00 0.00 179.25 178.81 2xdm h LEU 253 N 0.12 -0.90 -1.98 0.00 3.38 -0.67 -1.54 115.31 113.73 2xdm h LEU 253 Ca 0.06 0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.21 2xdm h LEU 253 Cb 0.42 0.42 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 2xdm h LEU 253 CO 0.01 -0.30 0.08 -0.33 0.09 0.00 0.00 178.44 177.99 2xdm h GLU 254 N -0.26 0.03 0.00 1.13 4.39 -1.09 -0.27 114.58 118.51 2xdm h GLU 254 Ca 0.15 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.85 2xdm h GLU 254 Cb 0.50 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 2xdm h GLU 254 CO -0.44 0.02 -0.01 0.77 -1.16 0.00 0.00 179.01 178.19 2xdm h SER 255 N 0.03 0.00 -0.46 1.42 0.02 -0.87 -3.10 113.55 110.59 2xdm h SER 255 Ca 0.05 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2xdm h SER 255 Cb 0.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.71 2xdm h SER 255 CO -0.00 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.28 2xdm n ASN 256 N -2.89 4.97 0.00 3.07 3.02 -0.30 -4.96 115.26 118.17 2xdm n ASN 256 Ca 0.04 -2.92 0.00 0.00 -0.03 0.00 0.00 54.58 51.68 2xdm n ASN 256 Cb 0.51 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 39.05 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 0.24 0.75 3.59 7.41 0.00 -0.97 -4.80 105.19 111.41 2xdm n GLY 257 Ca 0.25 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.66 5.20 0.17 1.61 1.01 -0.27 -4.84 120.40 120.62 2xdm s VAL 258 Ca 0.00 0.39 -0.19 0.00 0.00 0.00 0.00 61.98 62.19 2xdm s VAL 258 Cb 0.00 -3.69 -0.08 0.00 0.00 0.00 0.00 36.38 32.62 2xdm s VAL 258 CO 0.00 0.13 0.66 -0.89 0.00 0.00 0.00 175.10 174.99 2xdm s THR 259 N 2.00 4.66 -0.26 3.92 2.01 -0.46 -2.60 115.64 124.91 2xdm s THR 259 Ca 0.13 1.19 0.01 0.00 0.31 0.00 0.00 61.69 63.33 2xdm s THR 259 Cb -0.16 -3.86 0.07 0.00 0.01 0.00 0.00 72.50 68.56 2xdm s THR 259 CO 0.10 0.31 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.62 2xdm s VAL 260 N -1.40 1.69 0.10 3.82 1.01 -1.26 0.44 120.40 124.81 2xdm s VAL 260 Ca 0.38 -1.48 -0.03 0.00 0.00 0.00 0.00 61.98 60.86 2xdm s VAL 260 Cb -0.17 -2.00 -0.23 0.00 0.00 0.00 0.00 36.38 33.97 2xdm s VAL 260 CO 0.21 -0.21 1.22 0.11 0.00 0.00 0.00 175.10 176.43 2xdm h LYS 261 N 7.88 0.27 0.00 2.72 1.79 -0.85 -3.47 116.57 124.92 2xdm h LYS 261 Ca -0.16 -0.39 0.00 0.00 -2.18 0.00 0.00 60.65 57.92 2xdm h LYS 261 Cb 1.05 0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 2xdm h LYS 261 CO 0.44 1.14 0.00 0.41 -1.08 0.00 0.00 179.45 180.36 2xdm n GLY 262 N 1.28 0.85 3.84 3.86 0.00 -0.27 -5.00 105.19 109.75 2xdm n GLY 262 Ca -0.07 -1.75 -0.27 0.00 0.00 0.00 0.00 46.02 43.93 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 -1.00 5.76 -0.21 1.61 1.01 -1.26 -4.82 116.67 117.75 2xdm s ASP 263 Ca 0.00 -0.02 -0.08 0.00 0.71 0.00 0.00 52.55 53.15 2xdm s ASP 263 Cb 0.00 -1.58 -0.04 0.00 1.01 0.00 0.00 42.92 42.30 2xdm s ASP 263 CO 0.00 0.08 0.09 -0.69 0.21 0.00 0.00 175.17 174.87 2xdm s VAL 264 N -1.69 4.90 0.00 -1.27 1.01 -1.26 -0.74 120.40 121.35 2xdm s VAL 264 Ca 0.32 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.31 2xdm s VAL 264 Cb -0.11 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.03 2xdm s VAL 264 CO 0.25 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.36 2xdm n GLY 265 N 3.98 2.06 3.75 4.51 0.00 -0.53 -4.99 105.19 113.97 2xdm n GLY 265 Ca -0.16 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.54 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 4.25 0.00 0.99 1.43 -1.26 0.12 118.68 124.21 2xdm s LEU 266 Ca 0.00 0.42 -0.29 0.00 -1.03 0.00 0.00 54.13 53.24 2xdm s LEU 266 Cb 0.00 -2.26 0.08 0.00 0.03 0.00 0.00 46.19 44.04 2xdm s LEU 266 CO 0.00 0.16 0.70 -0.83 0.23 0.00 0.00 176.35 176.62 2xdm s GLY 267 N 0.24 -0.55 -0.01 -3.19 0.00 -0.87 -4.83 107.32 98.11 2xdm s GLY 267 Ca 0.14 1.14 -0.09 0.00 0.00 0.00 0.00 44.72 45.90 2xdm s GLY 267 CO 0.02 0.70 0.30 -0.32 0.00 0.00 0.00 173.10 173.81 2xdm s GLY 268 N -1.70 2.30 -0.39 0.20 0.00 -1.26 -3.04 107.32 103.44 2xdm s GLY 268 Ca -0.06 -0.47 -0.44 0.00 0.00 0.00 0.00 44.72 43.76 2xdm s GLY 268 CO 0.02 -0.22 1.63 -0.62 0.00 0.00 0.00 173.10 173.91 2xdm n VAL 269 N 1.43 0.12 -0.55 1.40 0.31 -1.26 -4.80 118.33 114.97 2xdm n VAL 269 Ca -0.13 -0.02 0.44 0.00 -0.01 0.00 0.00 64.34 64.62 2xdm n VAL 269 Cb 0.53 -0.76 0.73 0.00 -0.91 0.00 0.00 33.84 33.42 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 5.77 0.01 0.00 5.55 0.11 -1.95 -3.47 132.00 138.02 2xdm h PRO 270 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2xdm h PRO 270 Cb 1.35 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.46 2xdm h PRO 270 CO 0.96 0.01 0.00 0.00 -0.21 0.00 0.00 178.00 178.75 2xdm n ALA 271 N -2.66 0.00 1.61 -0.75 0.00 -1.26 -4.64 120.51 112.81 2xdm n ALA 271 Ca 0.42 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.87 2xdm n ALA 271 Cb 1.71 0.00 0.07 0.00 0.00 0.00 0.00 19.45 21.23 2xdm n ALA 271 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2xdm n ASP 272 N 1.42 0.00 -4.57 0.00 5.68 -1.26 -4.64 116.55 113.18 2xdm n ASP 272 Ca 0.00 -1.53 -0.41 0.00 -0.50 0.00 0.00 54.79 52.35 2xdm n ASP 272 Cb 0.00 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 39.90 2xdm n ASP 272 CO 0.00 0.00 0.00 0.26 -1.33 0.00 0.00 177.20 176.13 2xdm s TRP 273 N -2.00 3.19 -0.12 2.11 0.52 -1.26 -4.96 118.94 116.43 2xdm s TRP 273 Ca 0.04 0.32 0.06 0.00 0.02 0.00 0.00 56.10 56.53 2xdm s TRP 273 Cb 0.02 -2.91 -0.11 0.00 -1.15 0.00 0.00 33.47 29.31 2xdm s TRP 273 CO 0.03 -0.49 -0.03 0.00 0.02 0.00 0.00 176.95 176.48 2xdm n GLN 274 N 5.75 1.51 -2.52 4.98 10.64 -1.26 -4.69 117.38 131.79 2xdm n GLN 274 Ca -0.04 0.03 -0.34 0.00 -1.83 0.00 0.00 57.00 54.82 2xdm n GLN 274 Cb 0.49 -1.27 0.00 0.00 -0.86 0.00 0.00 30.24 28.61 2xdm n GLN 274 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 2xdm n ASP 275 N -2.59 5.99 -4.77 2.61 -0.08 -1.26 -5.06 116.55 111.39 2xdm n ASP 275 Ca -0.20 -3.73 -0.41 0.00 -1.51 0.00 0.00 54.79 48.94 2xdm n ASP 275 Cb 0.81 -0.81 -0.01 0.00 2.34 0.00 0.00 41.12 43.44 2xdm n ASP 275 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2xdm s ALA 276 N -3.86 3.55 -0.25 -1.67 0.00 -1.26 -4.66 121.76 113.61 2xdm s ALA 276 Ca 0.47 1.43 -0.16 0.00 0.00 0.00 0.00 51.96 53.70 2xdm s ALA 276 Cb 0.32 -3.55 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 2xdm s ALA 276 CO -0.21 -0.87 0.45 -2.00 0.00 0.00 0.00 175.76 173.12 2xdm s GLU 277 N -1.89 4.07 -0.44 0.00 2.56 0.20 -4.95 118.70 118.24 2xdm s GLU 277 Ca 0.51 0.20 -0.21 0.00 0.00 0.00 0.00 54.97 55.48 2xdm s GLU 277 Cb -0.43 -3.64 0.02 0.00 2.00 0.00 0.00 34.13 32.08 2xdm s GLU 277 CO 0.58 -0.28 0.65 0.08 -0.56 0.00 0.00 175.26 175.73 2xdm s VAL 278 N 2.06 4.82 -0.20 3.70 1.01 -1.26 -0.21 120.40 130.33 2xdm s VAL 278 Ca 0.19 0.10 0.20 0.00 0.00 0.00 0.00 61.98 62.47 2xdm s VAL 278 Cb -0.16 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 31.98 2xdm s VAL 278 CO 0.09 -0.61 1.01 -0.07 0.00 0.00 0.00 175.10 175.52 2xdm h LEU 279 N 9.71 0.00 -7.00 3.92 3.38 -0.53 -3.48 115.31 121.31 2xdm h LEU 279 Ca -0.25 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.79 2xdm h LEU 279 Cb 1.10 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.60 2xdm h LEU 279 CO 0.90 0.24 0.50 0.00 0.09 0.00 0.00 178.44 180.17 2xdm s ALA 280 N -3.17 -1.95 0.21 1.53 0.00 -1.22 -3.92 121.76 113.24 2xdm s ALA 280 Ca -0.01 1.71 -0.01 0.00 0.00 0.00 0.00 51.96 53.66 2xdm s ALA 280 Cb 0.09 -1.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.13 2xdm s ALA 280 CO 0.79 -0.27 0.13 0.16 0.00 0.00 0.00 175.76 176.56 2xdm s ASP 281 N -0.48 0.28 0.02 0.00 3.84 -1.26 0.60 116.67 119.67 2xdm s ASP 281 Ca 0.00 -1.39 -0.04 0.00 -0.00 0.00 0.00 52.55 51.12 2xdm s ASP 281 Cb -0.03 0.36 -0.01 0.00 -1.38 0.00 0.00 42.92 41.86 2xdm s ASP 281 CO -0.02 -0.83 0.05 -2.28 -0.00 0.00 0.00 175.17 172.09 2xdm s HIS 282 N -4.11 0.18 -0.08 2.11 2.46 0.36 -4.86 115.29 111.37 2xdm s HIS 282 Ca 0.39 -0.41 0.01 0.00 0.47 0.00 0.00 55.06 55.52 2xdm s HIS 282 Cb 0.07 -0.14 0.02 0.00 -0.13 0.00 0.00 32.58 32.40 2xdm s HIS 282 CO 0.12 -0.27 -0.07 0.99 -2.47 0.00 0.00 174.74 173.05 2xdm s THR 283 N -1.77 0.84 0.92 0.89 2.01 -1.26 -2.02 115.64 115.25 2xdm s THR 283 Ca -0.12 -0.24 -0.12 0.00 0.31 0.00 0.00 61.69 61.52 2xdm s THR 283 Cb -0.07 -0.85 0.14 0.00 0.01 0.00 0.00 72.50 71.74 2xdm s THR 283 CO -0.01 0.31 1.09 -0.94 -0.69 0.00 0.00 174.62 174.38 2xdm s SER 284 N 1.23 3.27 0.90 3.53 1.04 -0.32 -4.97 113.70 118.38 2xdm s SER 284 Ca -0.05 1.37 -0.11 0.00 0.48 0.00 0.00 55.95 57.64 2xdm s SER 284 Cb -0.14 -2.05 0.13 0.00 0.10 0.00 0.00 66.02 64.06 2xdm s SER 284 CO -0.02 -2.75 1.11 0.00 0.98 0.00 0.00 173.24 172.55 2xdm n ALA 285 N -3.95 -0.80 -1.53 5.32 0.00 -1.26 -4.55 120.51 113.74 2xdm n ALA 285 Ca 0.06 -0.52 -0.33 0.00 0.00 0.00 0.00 53.44 52.65 2xdm n ALA 285 Cb 0.56 -2.18 0.04 0.00 0.00 0.00 0.00 19.45 17.87 2xdm n ALA 285 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2xdm s GLU 286 N -4.47 2.87 0.27 0.00 2.02 -1.26 -4.55 118.70 113.58 2xdm s GLU 286 Ca 0.67 1.33 0.01 0.00 0.02 0.00 0.00 54.97 57.00 2xdm s GLU 286 Cb -0.24 -1.96 0.62 0.00 0.10 0.00 0.00 34.13 32.65 2xdm s GLU 286 CO 0.57 -1.18 1.70 1.25 0.02 0.00 0.00 175.26 177.62 2xdm h LEU 287 N 0.02 0.28 -1.60 1.80 5.85 -0.03 -0.12 115.31 121.52 2xdm h LEU 287 Ca -0.46 0.14 0.15 0.00 0.84 0.00 0.00 57.88 58.55 2xdm h LEU 287 Cb 1.24 0.13 -0.05 0.00 0.37 0.00 0.00 40.66 42.35 2xdm h LEU 287 CO 0.55 0.03 0.51 0.77 -0.34 0.00 0.00 178.44 179.95 2xdm h SER 288 N 0.40 0.37 0.74 1.25 4.64 -1.73 0.18 113.55 119.40 2xdm h SER 288 Ca 0.50 0.02 -0.25 0.00 -0.47 0.00 0.00 61.79 61.59 2xdm h SER 288 Cb 0.90 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.90 2xdm h SER 288 CO -0.50 0.19 -1.34 -0.33 -0.87 0.00 0.00 176.83 173.98 2xdm h GLU 289 N 0.39 0.03 0.00 4.77 4.39 -1.33 -3.29 114.58 119.54 2xdm h GLU 289 Ca 0.37 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.96 2xdm h GLU 289 Cb 0.89 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.55 2xdm h GLU 289 CO -0.12 0.81 -0.28 0.82 -1.16 0.00 0.00 179.01 179.08 2xdm h ILE 290 N 0.01 0.70 0.00 3.13 2.04 -0.41 -3.18 117.51 119.80 2xdm h ILE 290 Ca -0.14 -1.26 -0.00 0.00 1.00 0.00 0.00 64.86 64.45 2xdm h ILE 290 Cb 1.89 1.81 -0.00 0.00 -0.74 0.00 0.00 36.82 39.79 2xdm h ILE 290 CO 0.11 0.28 -0.02 -0.07 0.00 0.00 0.00 178.15 178.46 2xdm h LEU 291 N 0.00 0.00 0.38 1.44 3.38 -0.77 -2.96 115.31 116.78 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 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2xdm h LEU 291 CO 0.04 0.02 -0.18 0.58 0.09 0.00 0.00 178.44 178.98 2xdm h VAL 292 N 0.00 0.00 -0.11 1.22 2.07 -1.73 0.19 116.25 117.89 2xdm h VAL 292 Ca -0.00 -0.09 0.03 0.00 0.82 0.00 0.00 66.70 67.47 2xdm h VAL 292 Cb 0.03 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.80 2xdm h VAL 292 CO 0.00 0.00 0.09 1.55 0.02 0.00 0.00 177.57 179.23 2xdm h PRO 293 N -0.59 0.00 0.53 1.57 0.13 -1.77 -0.78 132.00 131.09 2xdm h PRO 293 Ca -0.05 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.05 2xdm h PRO 293 Cb 0.39 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.52 2xdm h PRO 293 CO 0.09 0.00 -0.26 0.35 -0.23 0.00 0.00 178.00 177.95 2xdm h PHE 294 N 0.00 -0.66 0.00 1.56 -0.00 -1.45 -3.18 116.94 113.20 2xdm h PHE 294 Ca 0.05 -0.02 -0.09 0.00 -0.00 0.00 0.00 57.97 57.92 2xdm h PHE 294 Cb 0.24 0.22 -0.01 0.00 -0.00 0.00 0.00 35.95 36.39 2xdm h PHE 294 CO 0.00 -0.34 -0.64 0.52 -0.00 0.00 0.00 178.31 177.85 2xdm h MET 295 N -1.05 0.00 -0.01 1.11 2.86 -0.43 -1.97 114.93 115.44 2xdm h MET 295 Ca -0.07 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.33 2xdm h MET 295 Cb 0.62 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.29 2xdm h MET 295 CO 0.12 0.34 -0.95 0.87 1.06 0.00 0.00 176.91 178.35 2xdm h LYS 296 N 0.00 0.50 -0.01 1.72 1.79 -1.12 -3.35 116.57 116.10 2xdm h LYS 296 Ca -0.03 -0.52 0.00 0.00 -2.18 0.00 0.00 60.65 57.91 2xdm h LYS 296 Cb 1.33 0.15 0.00 0.00 -1.58 0.00 0.00 32.23 32.13 2xdm h LYS 296 CO 0.05 1.16 -0.04 1.19 -1.08 0.00 0.00 179.45 180.73 2xdm n PHE 297 N -3.78 0.00 -3.09 -1.35 3.72 -1.20 -1.63 117.46 110.13 2xdm n PHE 297 Ca -0.08 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.24 2xdm n PHE 297 Cb 0.84 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.42 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 0.33 -6.90 -4.54 4.37 2.88 -0.78 -4.95 113.62 104.03 2xdm n SER 298 Ca 0.05 -0.42 -0.43 0.00 -1.33 0.00 0.00 58.87 56.74 2xdm n SER 298 Cb 0.22 -5.05 -0.04 0.00 -0.75 0.00 0.00 64.21 58.59 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 -3.19 6.41 0.12 -3.46 3.04 -0.96 -4.95 114.94 111.93 2xdm s ASN 299 Ca 0.25 -0.14 -0.18 0.00 0.04 0.00 0.00 52.86 52.84 2xdm s ASN 299 Cb -0.03 -2.46 -0.04 0.00 -1.54 0.00 0.00 41.25 37.18 2xdm s ASN 299 CO 0.71 -1.21 1.68 0.78 -3.04 0.00 0.00 177.10 176.01 2xdm h ASN 300 N 9.28 0.42 -0.49 -4.21 2.35 -1.92 -2.93 115.58 118.08 2xdm h ASN 300 Ca -0.25 -0.15 0.10 0.00 -0.55 0.00 0.00 56.30 55.45 2xdm h ASN 300 Cb 1.07 -0.11 -0.10 0.00 0.05 0.00 0.00 38.32 39.23 2xdm h ASN 300 CO 1.08 0.45 -0.28 1.23 -1.65 0.00 0.00 177.43 178.27 2xdm h GLY 301 N 0.36 -0.03 0.00 2.83 0.00 -1.87 -0.97 103.07 103.40 2xdm h GLY 301 Ca 0.11 0.36 0.12 0.00 0.00 0.00 0.00 47.33 47.92 2xdm h GLY 301 CO -0.01 -0.21 0.02 0.45 0.00 0.00 0.00 176.54 176.79 2xdm h HIS 302 N -0.17 -0.00 -0.76 5.60 3.86 -1.89 -1.90 115.15 119.90 2xdm h HIS 302 Ca 0.22 0.04 0.03 0.00 -1.16 0.00 0.00 60.37 59.50 2xdm h HIS 302 Cb 0.51 0.09 -0.05 0.00 1.06 0.00 0.00 27.41 29.03 2xdm h HIS 302 CO -0.54 -0.14 0.48 0.00 0.86 0.00 0.00 177.93 178.59 2xdm h ALA 303 N 1.54 0.99 0.00 2.45 0.00 -1.01 -0.58 119.26 122.64 2xdm h ALA 303 Ca 0.31 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 55.04 2xdm h ALA 303 Cb 0.50 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2xdm h ALA 303 CO -0.50 0.28 -0.73 0.93 0.00 0.00 0.00 179.25 179.24 2xdm h GLU 304 N 0.94 0.00 -0.28 0.00 4.39 -1.05 -2.06 114.58 116.52 2xdm h GLU 304 Ca 0.30 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.94 2xdm h GLU 304 Cb 0.01 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 2xdm h GLU 304 CO -0.11 0.73 -0.08 0.52 -1.16 0.00 0.00 179.01 178.91 2xdm h MET 305 N 0.00 0.55 -0.67 2.33 2.86 -0.91 -2.03 114.93 117.06 2xdm h MET 305 Ca -0.01 -0.22 0.04 0.00 -2.06 0.00 0.00 59.70 57.46 2xdm h MET 305 Cb 1.46 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 33.04 2xdm h MET 305 CO 0.09 0.76 0.40 -0.07 1.06 0.00 0.00 176.91 179.16 2xdm h LEU 306 N 0.31 0.64 -0.19 1.22 3.38 -1.00 0.14 115.31 119.81 2xdm h LEU 306 Ca 0.07 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.09 2xdm h LEU 306 Cb 0.56 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 2xdm h LEU 306 CO 0.03 0.43 -0.07 0.58 0.09 0.00 0.00 178.44 179.50 2xdm h VAL 307 N 0.77 0.75 -0.05 1.22 2.07 -1.28 0.29 116.25 120.03 2xdm h VAL 307 Ca 0.28 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.72 2xdm h VAL 307 Cb 0.08 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2xdm h VAL 307 CO -0.13 0.00 -0.32 0.11 0.02 0.00 0.00 177.57 177.25 2xdm h LYS 308 N -0.04 0.09 -0.36 1.57 1.57 -1.00 0.17 116.57 118.57 2xdm h LYS 308 Ca 0.10 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 2xdm h LYS 308 Cb 0.19 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2xdm h LYS 308 CO -0.22 0.41 0.08 0.77 -0.57 0.00 0.00 179.45 179.92 2xdm h SER 309 N 0.08 0.56 -0.85 0.86 0.02 -0.25 -1.26 113.55 112.72 2xdm h SER 309 Ca 0.01 -0.24 0.06 0.00 -0.84 0.00 0.00 61.79 60.78 2xdm h SER 309 Cb 0.61 -0.15 -0.06 0.00 0.14 0.00 0.00 62.40 62.94 2xdm h SER 309 CO 0.04 0.66 0.52 0.40 -1.14 0.00 0.00 176.83 177.32 2xdm h ILE 310 N 0.44 1.03 -0.76 3.27 2.04 0.23 -1.67 117.51 122.10 2xdm h ILE 310 Ca 0.11 -0.33 0.09 0.00 1.00 0.00 0.00 64.86 65.73 2xdm h ILE 310 Cb 0.33 -0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.34 2xdm h ILE 310 CO 0.00 0.17 0.42 1.23 0.00 0.00 0.00 178.15 179.98 2xdm h GLY 311 N 0.95 1.16 0.82 5.37 0.00 -0.32 -1.00 103.07 110.05 2xdm h GLY 311 Ca 0.37 -0.28 -0.07 0.00 0.00 0.00 0.00 47.33 47.35 2xdm h GLY 311 CO -0.18 0.11 -0.15 1.46 0.00 0.00 0.00 176.54 177.79 2xdm h GLN 312 N 0.72 0.47 -0.59 4.80 1.08 -0.51 -1.52 115.11 119.55 2xdm h GLN 312 Ca 0.37 -0.23 -0.09 0.00 -1.45 0.00 0.00 58.65 57.25 2xdm h GLN 312 Cb 0.33 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.74 2xdm h GLN 312 CO -0.24 0.78 0.01 1.49 -0.95 0.00 0.00 178.83 179.92 2xdm h GLU 313 N 0.15 1.02 0.00 1.46 4.57 -1.20 0.11 114.58 120.71 2xdm h GLU 313 Ca 0.04 -0.31 0.00 0.00 -1.18 0.00 0.00 59.36 57.91 2xdm h GLU 313 Cb 0.67 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 2xdm h GLU 313 CO 0.04 0.99 -0.75 0.25 -1.18 0.00 0.00 179.01 178.37 2xdm n THR 314 N -4.19 0.09 -1.83 0.32 -2.24 -0.39 -4.57 114.28 101.47 2xdm n THR 314 Ca 0.03 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2xdm n THR 314 Cb 0.33 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 2xdm n THR 314 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2xdm n ALA 315 N -1.64 1.25 -1.99 6.98 0.00 -0.60 -5.00 120.51 119.51 2xdm n ALA 315 Ca 0.04 -0.14 -0.11 0.00 0.00 0.00 0.00 53.44 53.23 2xdm n ALA 315 Cb 0.38 -0.03 -0.02 0.00 0.00 0.00 0.00 19.45 19.78 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 0.14 2.72 0.00 0.00 0.39 -4.92 105.19 103.53 2xdm n GLY 316 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.32 1.20 -1.12 4.61 0.00 -1.05 -4.90 121.76 118.18 2xdm s ALA 317 Ca 0.00 -1.13 -0.15 0.00 0.00 0.00 0.00 51.96 50.68 2xdm s ALA 317 Cb 0.00 -1.38 -0.07 0.00 0.00 0.00 0.00 23.12 21.68 2xdm s ALA 317 CO 0.00 -1.41 2.17 0.41 0.00 0.00 0.00 175.76 176.93 2xdm n GLY 318 N 4.98 3.47 3.33 0.00 0.00 -1.25 -3.02 105.19 112.69 2xdm n GLY 318 Ca -0.06 -1.34 -0.17 0.00 0.00 0.00 0.00 46.02 44.44 2xdm n GLY 318 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2xdm s THR 319 N 3.84 1.30 0.02 2.61 -4.23 -1.26 -1.50 115.64 116.42 2xdm s THR 319 Ca 0.52 -2.09 -0.24 0.00 -1.18 0.00 0.00 61.69 58.71 2xdm s THR 319 Cb 0.14 -2.17 -0.17 0.00 1.34 0.00 0.00 72.50 71.64 2xdm s THR 319 CO 0.00 -0.48 1.40 -0.50 -0.54 0.00 0.00 174.62 174.50 2xdm h TRP 320 N 2.54 0.12 -0.92 3.99 6.55 -1.91 -0.99 115.95 125.33 2xdm h TRP 320 Ca -0.38 -0.03 0.16 0.00 0.95 0.00 0.00 58.89 59.59 2xdm h TRP 320 Cb 1.22 -0.03 -0.10 0.00 -0.86 0.00 0.00 29.16 29.39 2xdm h TRP 320 CO 0.64 0.44 0.52 -0.44 -1.05 0.00 0.00 178.44 178.55 2xdm h ASP 321 N -0.24 0.67 0.69 -3.49 3.32 -1.96 0.17 116.42 115.58 2xdm h ASP 321 Ca 0.01 0.09 -0.26 0.00 0.02 0.00 0.00 57.03 56.89 2xdm h ASP 321 Cb 0.40 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 2xdm h ASP 321 CO 0.01 0.27 -1.38 0.00 -1.72 0.00 0.00 179.24 176.42 2xdm h ALA 322 N 1.59 0.50 -0.05 3.45 0.00 -1.84 -3.28 119.26 119.62 2xdm h ALA 322 Ca 0.51 -1.17 -0.19 0.00 0.00 0.00 0.00 54.91 54.06 2xdm h ALA 322 Cb 0.72 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2xdm h ALA 322 CO -0.36 1.36 -0.79 0.78 0.00 0.00 0.00 179.25 180.24 2xdm h GLY 323 N 2.92 0.42 2.00 0.00 0.00 -0.43 -2.10 103.07 105.88 2xdm h GLY 323 Ca -0.16 -0.63 -0.05 0.00 0.00 0.00 0.00 47.33 46.49 2xdm h GLY 323 CO 0.12 0.56 -0.23 1.41 0.00 0.00 0.00 176.54 178.40 2xdm h LEU 324 N 0.24 0.00 -0.09 3.11 4.07 -0.84 0.84 115.31 122.64 2xdm h LEU 324 Ca -0.04 0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.72 2xdm h LEU 324 Cb 1.38 0.00 0.01 0.00 1.08 0.00 0.00 40.66 43.14 2xdm h LEU 324 CO 0.13 0.23 -0.71 0.58 -1.08 0.00 0.00 178.44 177.59 2xdm h VAL 325 N 0.00 1.33 -0.43 1.22 2.07 -1.60 -2.76 116.25 116.08 2xdm h VAL 325 Ca -0.00 -1.98 -0.09 0.00 0.82 0.00 0.00 66.70 65.45 2xdm h VAL 325 Cb 0.95 2.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.90 2xdm h VAL 325 CO 0.03 0.61 -0.10 1.23 0.02 0.00 0.00 177.57 179.36 2xdm h GLY 326 N 0.28 0.82 0.82 2.17 0.00 -1.09 -1.55 103.07 104.52 2xdm h GLY 326 Ca -0.06 -0.60 -0.00 0.00 0.00 0.00 0.00 47.33 46.67 2xdm h GLY 326 CO 0.14 0.55 0.00 -2.08 0.00 0.00 0.00 176.54 175.16 2xdm h VAL 327 N 0.69 1.15 -0.64 4.60 2.07 -0.89 -1.08 116.25 122.14 2xdm h VAL 327 Ca 0.12 -0.44 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 2xdm h VAL 327 Cb 0.56 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 2xdm h VAL 327 CO 0.03 0.11 0.19 -0.08 0.02 0.00 0.00 177.57 177.85 2xdm h GLU 328 N -0.17 0.99 -0.01 1.57 4.22 -1.43 -1.28 114.58 118.46 2xdm h GLU 328 Ca 0.00 -0.20 -0.24 0.00 0.08 0.00 0.00 59.36 59.00 2xdm h GLU 328 Cb 0.18 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.30 2xdm h GLU 328 CO -0.00 0.85 -0.96 0.93 -2.18 0.00 0.00 179.01 177.66 2xdm h GLU 329 N 0.95 0.53 -0.73 1.92 5.08 -1.26 -2.59 114.58 118.47 2xdm h GLU 329 Ca 0.21 -0.55 -0.06 0.00 -1.00 0.00 0.00 59.36 57.96 2xdm h GLU 329 Cb 0.29 0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2xdm h GLU 329 CO -0.01 1.18 0.21 0.00 -1.00 0.00 0.00 179.01 179.40 2xdm h ALA 330 N 0.63 0.99 -0.42 3.43 0.00 -1.01 -1.90 119.26 120.98 2xdm h ALA 330 Ca -0.09 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 2xdm h ALA 330 Cb 1.60 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 2xdm h ALA 330 CO 0.18 0.67 0.03 -0.07 0.00 0.00 0.00 179.25 180.05 2xdm h LEU 331 N 1.10 0.71 -1.02 0.00 3.38 -1.19 -0.94 115.31 117.35 2xdm h LEU 331 Ca 0.23 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 2xdm h LEU 331 Cb 0.33 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2xdm h LEU 331 CO -0.00 0.82 -0.00 0.77 0.09 0.00 0.00 178.44 180.11 2xdm h SER 332 N 0.57 0.66 0.12 -0.43 4.64 -1.46 -1.50 113.55 116.16 2xdm h SER 332 Ca 0.12 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 2xdm h SER 332 Cb 0.44 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2xdm h SER 332 CO 0.02 0.73 -0.08 1.23 -0.87 0.00 0.00 176.83 177.86 2xdm h GLY 333 N 0.94 0.00 1.24 -0.77 0.00 -0.90 -1.94 103.07 101.65 2xdm h GLY 333 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2xdm h GLY 333 CO 0.02 0.00 -0.20 -0.10 0.00 0.00 0.00 176.54 176.25 2xdm n LEU 334 N -4.18 0.36 0.00 3.11 7.94 -0.40 -4.92 117.00 118.91 2xdm n LEU 334 Ca -0.03 0.15 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 2xdm n LEU 334 Cb 0.16 -0.30 0.00 0.00 0.53 0.00 0.00 43.42 43.82 2xdm n LEU 334 CO 0.33 0.08 0.00 0.61 -1.11 0.00 0.00 177.39 177.29 2xdm n GLY 335 N 1.42 0.83 3.69 -3.96 0.00 -0.73 -4.86 105.19 101.58 2xdm n GLY 335 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 4.80 -0.48 1.61 1.01 -0.64 -4.97 120.40 119.73 2xdm s VAL 336 Ca 0.00 2.05 -0.28 0.00 0.00 0.00 0.00 61.98 63.75 2xdm s VAL 336 Cb 0.00 -4.32 -0.00 0.00 0.00 0.00 0.00 36.38 32.06 2xdm s VAL 336 CO 0.00 0.03 1.62 -0.62 0.00 0.00 0.00 175.10 176.13 2xdm s ASP 337 N 1.08 5.91 -0.09 3.32 2.15 -1.26 -3.82 116.67 123.97 2xdm s ASP 337 Ca 0.49 0.68 0.08 0.00 0.43 0.00 0.00 52.55 54.23 2xdm s ASP 337 Cb -0.19 -2.54 0.38 0.00 -0.30 0.00 0.00 42.92 40.28 2xdm s ASP 337 CO 0.19 -1.80 1.15 0.35 -0.17 0.00 0.00 175.17 174.89 2xdm n THR 338 N 7.13 1.13 -0.02 1.71 -2.24 -1.26 -4.51 114.28 116.22 2xdm n THR 338 Ca 0.18 -0.63 -0.04 0.00 -2.27 0.00 0.00 64.05 61.29 2xdm n THR 338 Cb 0.49 -0.23 0.20 0.00 -2.10 0.00 0.00 70.33 68.69 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 3.16 1.12 -0.01 6.98 0.00 -2.01 -2.53 119.26 125.97 2xdm h ALA 339 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2xdm h ALA 339 Cb 1.04 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2xdm h ALA 339 CO 0.18 0.55 -0.22 0.41 0.00 0.00 0.00 179.25 180.17 2xdm n GLY 340 N -0.48 -0.72 3.71 0.00 0.00 -1.26 -4.92 105.19 101.52 2xdm n GLY 340 Ca 0.00 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.51 4.36 -0.18 0.99 1.43 -0.95 -4.44 118.68 117.38 2xdm s LEU 341 Ca 0.25 1.53 0.01 0.00 -1.03 0.00 0.00 54.13 54.89 2xdm s LEU 341 Cb 0.19 -3.43 0.02 0.00 0.03 0.00 0.00 46.19 43.01 2xdm s LEU 341 CO 0.51 -0.21 -0.17 -0.69 0.23 0.00 0.00 176.35 176.02 2xdm s VAL 342 N 0.92 1.90 -0.28 -1.59 1.01 0.47 -4.97 120.40 117.86 2xdm s VAL 342 Ca 0.48 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.49 2xdm s VAL 342 Cb -0.20 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.41 2xdm s VAL 342 CO 0.25 0.45 0.06 -0.76 0.00 0.00 0.00 175.10 175.10 2xdm s LEU 343 N 1.34 3.67 -0.02 3.92 1.02 -1.26 -1.27 118.68 126.07 2xdm s LEU 343 Ca 0.04 -0.63 0.07 0.00 0.02 0.00 0.00 54.13 53.63 2xdm s LEU 343 Cb -0.14 -1.86 -0.11 0.00 0.02 0.00 0.00 46.19 44.11 2xdm s LEU 343 CO -0.11 -0.15 0.13 -3.20 0.02 0.00 0.00 176.35 173.03 2xdm n ASN 344 N 4.86 3.34 -3.40 2.29 5.15 -1.26 -4.99 115.26 121.24 2xdm n ASN 344 Ca -0.15 0.00 -0.10 0.00 -0.60 0.00 0.00 54.58 53.73 2xdm n ASN 344 Cb 0.49 1.17 -0.01 0.00 -0.53 0.00 0.00 39.78 40.89 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 -3.07 0.13 0.20 1.20 1.47 -1.26 -4.99 116.67 110.34 2xdm s ASP 345 Ca -0.03 -1.07 0.21 0.00 1.18 0.00 0.00 52.55 52.84 2xdm s ASP 345 Cb 0.04 0.73 0.01 0.00 -0.34 0.00 0.00 42.92 43.36 2xdm s ASP 345 CO 0.30 -1.43 1.08 1.23 0.68 0.00 0.00 175.17 177.02 2xdm h GLY 346 N 2.07 0.00 0.92 2.12 0.00 -1.94 -3.39 103.07 102.86 2xdm h GLY 346 Ca -0.27 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.99 2xdm h GLY 346 CO 0.36 0.00 -1.24 -1.14 0.00 0.00 0.00 176.54 174.52 2xdm n SER 347 N -2.80 0.79 0.00 0.19 3.41 -1.26 -3.87 113.62 110.08 2xdm n SER 347 Ca -0.02 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 2xdm n SER 347 Cb 0.62 0.43 0.00 0.00 -0.26 0.00 0.00 64.21 65.01 2xdm n SER 347 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2xdm n GLY 348 N 1.28 0.76 0.26 5.00 0.00 -1.26 -4.06 105.19 107.18 2xdm n GLY 348 Ca -0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 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 0.69 -9.72 0.99 6.46 -1.93 -3.36 115.31 108.44 2xdm h LEU 349 Ca 0.00 -0.22 -0.52 0.00 -0.12 0.00 0.00 57.88 57.03 2xdm h LEU 349 Cb 0.00 -0.19 0.02 0.00 -0.73 0.00 0.00 40.66 39.77 2xdm h LEU 349 CO 0.00 0.86 0.54 -0.55 -0.62 0.00 0.00 178.44 178.67 2xdm s SER 350 N -6.74 7.12 0.00 1.25 0.15 -1.26 -4.88 113.70 109.34 2xdm s SER 350 Ca -0.09 2.28 0.13 0.00 0.70 0.00 0.00 55.95 58.97 2xdm s SER 350 Cb 0.14 -2.62 0.55 0.00 -1.71 0.00 0.00 66.02 62.38 2xdm s SER 350 CO 0.81 -0.31 1.39 0.54 1.20 0.00 0.00 173.24 176.87 2xdm n ARG 351 N 1.98 1.40 -0.30 5.44 1.74 -1.26 -3.11 116.66 122.55 2xdm n ARG 351 Ca 0.02 -0.60 0.12 0.00 -0.77 0.00 0.00 57.85 56.61 2xdm n ARG 351 Cb 0.44 -1.24 0.28 0.00 -1.02 0.00 0.00 32.46 30.92 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 0.88 2.22 3.84 -0.13 0.00 -1.26 -4.93 105.19 105.81 2xdm n GLY 352 Ca 0.11 -0.76 -0.32 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 -1.17 6.76 -0.14 1.61 0.01 -1.18 -4.39 114.94 116.44 2xdm s ASN 353 Ca 0.44 1.41 -0.08 0.00 -0.71 0.00 0.00 52.86 53.93 2xdm s ASN 353 Cb 0.24 -2.43 0.05 0.00 0.41 0.00 0.00 41.25 39.52 2xdm s ASN 353 CO 0.32 -0.33 0.34 -0.76 -1.51 0.00 0.00 177.10 175.16 2xdm s LEU 354 N -3.32 0.12 0.00 0.60 1.43 -0.40 -4.31 118.68 112.80 2xdm s LEU 354 Ca 0.57 0.74 0.02 0.00 -1.03 0.00 0.00 54.13 54.42 2xdm s LEU 354 Cb -0.10 1.09 0.02 0.00 0.03 0.00 0.00 46.19 47.22 2xdm s LEU 354 CO 0.20 -0.18 0.14 1.33 0.23 0.00 0.00 176.35 178.07 2xdm n VAL 355 N 4.26 0.00 -4.17 -1.59 0.24 0.40 -0.39 118.33 117.08 2xdm n VAL 355 Ca -0.24 -1.82 -0.14 0.00 -2.04 0.00 0.00 64.34 60.09 2xdm n VAL 355 Cb 0.54 0.16 -0.11 0.00 -1.47 0.00 0.00 33.84 32.97 2xdm n VAL 355 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2xdm s THR 356 N -2.32 0.92 0.32 3.34 -4.23 -1.26 -0.67 115.64 111.73 2xdm s THR 356 Ca 0.11 -1.61 0.03 0.00 -1.18 0.00 0.00 61.69 59.04 2xdm s THR 356 Cb -0.01 -1.32 0.14 0.00 1.34 0.00 0.00 72.50 72.65 2xdm s THR 356 CO 0.07 -0.55 1.84 0.00 -0.54 0.00 0.00 174.62 175.44 2xdm h ALA 357 N 3.61 1.30 -0.17 3.99 0.00 -1.70 -1.85 119.26 124.44 2xdm h ALA 357 Ca -0.37 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.34 2xdm h ALA 357 Cb 1.19 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 2xdm h ALA 357 CO 0.52 0.47 -0.03 -0.44 0.00 0.00 0.00 179.25 179.77 2xdm h ASP 358 N 0.51 -0.13 -0.84 0.00 3.32 -1.26 -1.57 116.42 116.45 2xdm h ASP 358 Ca 0.10 0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.23 2xdm h ASP 358 Cb 0.39 0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.99 2xdm h ASP 358 CO 0.02 -0.04 0.54 0.74 -1.72 0.00 0.00 179.24 178.77 2xdm h THR 359 N 0.01 1.14 -0.32 0.35 2.02 -1.61 0.25 112.91 114.76 2xdm h THR 359 Ca 0.08 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 66.88 2xdm h THR 359 Cb 0.12 -0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.50 2xdm h THR 359 CO -0.16 0.19 0.13 0.58 0.37 0.00 0.00 175.52 176.63 2xdm h VAL 360 N 1.06 1.18 -0.71 3.16 2.07 -1.14 0.11 116.25 121.98 2xdm h VAL 360 Ca 0.33 -0.54 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 2xdm h VAL 360 Cb -0.01 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 2xdm h VAL 360 CO -0.11 0.19 0.23 0.58 0.02 0.00 0.00 177.57 178.48 2xdm h VAL 361 N 0.37 1.26 -0.12 2.57 2.07 -0.91 -0.19 116.25 121.30 2xdm h VAL 361 Ca 0.11 -0.88 0.04 0.00 0.82 0.00 0.00 66.70 66.79 2xdm h VAL 361 Cb 0.17 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.38 2xdm h VAL 361 CO -0.01 0.34 -0.15 -0.78 0.02 0.00 0.00 177.57 177.00 2xdm h ASP 362 N 1.05 -0.46 -0.41 0.57 3.58 -0.22 -1.64 116.42 118.88 2xdm h ASP 362 Ca 0.23 0.08 0.08 0.00 0.42 0.00 0.00 57.03 57.84 2xdm h ASP 362 Cb 0.29 0.22 -0.07 0.00 1.72 0.00 0.00 39.33 41.49 2xdm h ASP 362 CO -0.01 -0.19 -0.01 0.25 -2.88 0.00 0.00 179.24 176.40 2xdm h LEU 363 N -0.19 -0.19 -1.97 2.28 5.85 -0.33 -1.52 115.31 119.24 2xdm h LEU 363 Ca 0.09 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 2xdm h LEU 363 Cb 0.32 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 2xdm h LEU 363 CO -0.23 -0.06 -0.10 -0.07 -0.34 0.00 0.00 178.44 177.64 2xdm h LEU 364 N 0.10 0.00 0.07 2.25 3.38 -0.69 -0.74 115.31 119.69 2xdm h LEU 364 Ca 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 2xdm h LEU 364 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2xdm h LEU 364 CO -0.35 0.10 -0.04 1.23 0.09 0.00 0.00 178.44 179.48 2xdm h GLY 365 N 0.52 -0.10 2.00 0.83 0.00 -0.57 -3.18 103.07 102.56 2xdm h GLY 365 Ca -0.00 0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 2xdm h GLY 365 CO 0.01 -0.04 -0.14 1.46 0.00 0.00 0.00 176.54 177.83 2xdm h GLN 366 N -0.80 0.00 0.00 4.80 1.08 -0.82 -2.65 115.11 116.72 2xdm h GLN 366 Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2xdm h GLN 366 Cb 0.61 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.04 2xdm h GLN 366 CO 0.02 0.14 -0.20 0.00 -0.95 0.00 0.00 178.83 177.84 2xdm h ALA 367 N 1.86 0.89 0.00 3.87 0.00 -1.24 -3.00 119.26 121.64 2xdm h ALA 367 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2xdm h ALA 367 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2xdm h ALA 367 CO 0.02 0.00 -0.20 0.78 0.00 0.00 0.00 179.25 179.85 2xdm h GLY 368 N 4.16 0.00 0.00 0.00 0.00 -1.44 -3.31 103.07 102.47 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 0.00 0.00 -1.26 -1.14 0.00 0.00 0.00 176.54 174.14 2xdm n SER 369 N -2.34 0.73 -4.78 0.19 3.41 -1.19 -4.86 113.62 104.78 2xdm n SER 369 Ca 0.05 -0.71 -0.35 0.00 -0.26 0.00 0.00 58.87 57.60 2xdm n SER 369 Cb 0.45 1.28 -0.02 0.00 -0.26 0.00 0.00 64.21 65.66 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 -3.10 2.84 0.24 7.33 0.00 -1.14 -4.95 121.76 122.97 2xdm s ALA 370 Ca 0.03 0.76 -0.11 0.00 0.00 0.00 0.00 51.96 52.64 2xdm s ALA 370 Cb 0.15 -3.32 0.33 0.00 0.00 0.00 0.00 23.12 20.28 2xdm s ALA 370 CO 0.86 -0.54 1.60 -1.35 0.00 0.00 0.00 175.76 176.33 2xdm h PRO 371 N 1.60 0.00 -0.99 0.00 0.11 -1.94 -0.52 132.00 130.26 2xdm h PRO 371 Ca -0.50 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2xdm h PRO 371 Cb 1.24 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2xdm h PRO 371 CO 0.59 0.00 0.01 -2.67 -0.21 0.00 0.00 178.00 175.72 2xdm n TRP 372 N -5.51 0.09 0.31 0.65 4.27 -1.26 -4.42 117.44 111.57 2xdm n TRP 372 Ca 0.11 -0.22 0.20 0.00 -3.89 0.00 0.00 57.50 53.70 2xdm n TRP 372 Cb 0.40 -0.18 1.02 0.00 -1.36 0.00 0.00 31.31 31.19 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 2.03 1.08 0.10 -1.67 0.00 -1.26 -2.93 119.26 116.61 2xdm h ALA 373 Ca 0.01 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 2xdm h ALA 373 Cb 0.75 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2xdm h ALA 373 CO 0.03 0.02 -1.94 0.94 0.00 0.00 0.00 179.25 178.30 2xdm n GLN 374 N -3.21 0.73 0.06 0.00 0.00 -1.26 -2.53 117.38 111.17 2xdm n GLN 374 Ca -0.02 0.27 -0.09 0.00 -0.00 0.00 0.00 57.00 57.16 2xdm n GLN 374 Cb 0.15 -1.73 0.05 0.00 0.00 0.00 0.00 30.24 28.71 2xdm n GLN 374 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.06 178.85 2xdm h THR 375 N 0.06 1.39 -0.53 1.69 1.35 -1.92 -1.71 112.91 113.23 2xdm h THR 375 Ca -0.40 -2.12 0.06 0.00 -0.55 0.00 0.00 66.41 63.40 2xdm h THR 375 Cb 2.03 2.09 -0.05 0.00 -1.73 0.00 0.00 68.15 70.49 2xdm h THR 375 CO 0.09 0.63 0.25 -0.25 -0.25 0.00 0.00 175.52 175.99 2xdm h TRP 376 N 0.25 0.45 0.00 4.73 2.91 -1.63 -1.12 115.95 121.54 2xdm h TRP 376 Ca -0.02 0.02 -0.07 0.00 1.13 0.00 0.00 58.89 59.95 2xdm h TRP 376 Cb 1.26 -0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 29.78 2xdm h TRP 376 CO 0.04 0.19 -0.40 0.66 -1.03 0.00 0.00 178.44 177.90 2xdm h SER 377 N 0.47 0.00 0.52 2.65 4.64 -1.50 -3.16 113.55 117.17 2xdm h SER 377 Ca 0.25 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.47 2xdm h SER 377 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2xdm h SER 377 CO -0.20 0.30 -0.44 0.00 -0.87 0.00 0.00 176.83 175.62 2xdm h ALA 378 N 1.70 1.19 0.00 5.18 0.00 -0.77 -3.22 119.26 123.34 2xdm h ALA 378 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2xdm h ALA 378 Cb 1.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2xdm h ALA 378 CO 0.04 0.55 0.00 0.66 0.00 0.00 0.00 179.25 180.50 2xdm h SER 379 N 0.00 0.00 -3.71 0.00 4.64 -1.18 -3.46 113.55 109.85 2xdm h SER 379 Ca -0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.80 2xdm h SER 379 Cb 0.82 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.93 2xdm h SER 379 CO 0.06 0.00 0.51 -0.76 -0.87 0.00 0.00 176.83 175.77 2xdm s LEU 380 N -5.42 4.51 0.26 5.97 1.43 -1.22 -3.27 118.68 120.94 2xdm s LEU 380 Ca 0.07 2.29 -0.29 0.00 -1.03 0.00 0.00 54.13 55.16 2xdm s LEU 380 Cb 0.09 -3.62 -0.14 0.00 0.03 0.00 0.00 46.19 42.54 2xdm s LEU 380 CO 0.59 -0.25 1.05 -2.65 0.23 0.00 0.00 176.35 175.32 2xdm n PRO 381 N 1.60 1.31 -3.77 1.29 -0.02 -1.24 -4.74 135.00 129.43 2xdm n PRO 381 Ca 0.01 0.46 -0.37 0.00 -2.02 0.00 0.00 63.50 61.58 2xdm n PRO 381 Cb 0.45 -1.86 -0.13 0.00 -0.02 0.00 0.00 33.50 31.94 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 -0.82 4.10 -0.17 -1.45 1.01 -0.64 -1.55 120.40 120.88 2xdm s VAL 382 Ca 0.62 -0.35 -0.39 0.00 0.00 0.00 0.00 61.98 61.86 2xdm s VAL 382 Cb -0.74 -2.96 -0.16 0.00 0.00 0.00 0.00 36.38 32.52 2xdm s VAL 382 CO 0.58 0.28 1.59 0.00 0.00 0.00 0.00 175.10 177.55 2xdm n ALA 383 N 4.90 -0.63 -3.37 5.51 0.00 0.42 -2.95 120.51 124.38 2xdm n ALA 383 Ca -0.16 0.44 -0.19 0.00 0.00 0.00 0.00 53.44 53.53 2xdm n ALA 383 Cb 0.50 -2.14 0.07 0.00 0.00 0.00 0.00 19.45 17.88 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 3.56 -0.27 3.31 0.00 0.00 -0.07 -0.91 105.19 110.80 2xdm n GLY 384 Ca 0.24 0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.99 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 -5.95 3.37 0.18 1.61 0.41 -1.15 -4.59 118.70 112.58 2xdm s GLU 385 Ca 0.42 -0.63 0.26 0.00 -0.41 0.00 0.00 54.97 54.61 2xdm s GLU 385 Cb -0.18 -3.00 0.89 0.00 -1.78 0.00 0.00 34.13 30.06 2xdm s GLU 385 CO 0.60 -0.19 1.79 -1.13 -0.49 0.00 0.00 175.26 175.84 2xdm n SER 386 N 4.77 0.66 -4.61 -0.19 3.41 -1.26 -3.32 113.62 113.08 2xdm n SER 386 Ca -0.18 0.57 -0.43 0.00 -0.26 0.00 0.00 58.87 58.57 2xdm n SER 386 Cb 0.51 -0.75 -0.03 0.00 -0.26 0.00 0.00 64.21 63.69 2xdm n SER 386 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2xdm s ASP 387 N -4.24 5.95 0.58 4.04 -1.08 -1.26 -4.87 116.67 115.79 2xdm s ASP 387 Ca 0.11 1.66 0.28 0.00 -0.52 0.00 0.00 52.55 54.08 2xdm s ASP 387 Cb 0.13 -2.52 1.54 0.00 -1.46 0.00 0.00 42.92 40.60 2xdm s ASP 387 CO 0.56 -1.60 1.99 -0.65 0.52 0.00 0.00 175.17 175.99 2xdm h PRO 388 N 12.70 0.00 -0.00 4.34 0.11 -1.93 0.14 132.00 147.36 2xdm h PRO 388 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2xdm h PRO 388 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2xdm h PRO 388 CO 1.00 0.00 -0.38 1.19 -0.21 0.00 0.00 178.00 179.60 2xdm n PHE 389 N -3.84 0.00 -0.11 0.65 3.01 -1.26 -1.03 117.46 114.88 2xdm n PHE 389 Ca 0.06 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.30 2xdm n PHE 389 Cb 0.53 -0.23 -0.07 0.00 -0.01 0.00 0.00 39.48 39.69 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 -1.24 1.25 0.05 -4.37 0.31 0.28 -4.73 118.33 109.88 2xdm n VAL 390 Ca 0.08 -0.25 -0.10 0.00 -0.01 0.00 0.00 64.34 64.06 2xdm n VAL 390 Cb 0.33 -1.85 -0.13 0.00 -0.91 0.00 0.00 33.84 31.28 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 -0.80 0.08 0.00 2.92 0.00 -0.95 -1.70 103.07 102.62 2xdm h GLY 391 Ca -0.50 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.62 2xdm h GLY 391 CO -0.30 0.18 0.00 0.61 0.00 0.00 0.00 176.54 177.03 2xdm n GLY 392 N 1.46 3.19 0.00 4.60 0.00 -0.20 -1.16 105.19 113.09 2xdm n GLY 392 Ca -0.07 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.05 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 0.32 -0.41 2.61 -2.24 -0.64 -2.25 114.28 111.67 2xdm n THR 393 Ca 0.00 0.08 0.07 0.00 -2.27 0.00 0.00 64.05 61.93 2xdm n THR 393 Cb 0.00 -0.75 0.22 0.00 -2.10 0.00 0.00 70.33 67.70 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 -1.24 3.48 -0.20 3.22 4.77 -0.31 -4.73 117.00 121.98 2xdm n LEU 394 Ca 0.10 -2.25 -0.08 0.00 -0.03 0.00 0.00 56.01 53.75 2xdm n LEU 394 Cb 0.15 -0.37 0.04 0.00 -2.33 0.00 0.00 43.42 40.92 2xdm n LEU 394 CO 0.15 0.76 0.83 0.00 -1.33 0.00 0.00 177.39 177.80 2xdm h ALA 395 N 2.51 0.86 -0.60 -1.18 0.00 -1.35 -0.12 119.26 119.40 2xdm h ALA 395 Ca 0.00 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 2xdm h ALA 395 Cb 0.99 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2xdm h ALA 395 CO 0.07 0.66 0.07 0.09 0.00 0.00 0.00 179.25 180.15 2xdm n ASN 396 N -4.18 5.39 -4.41 0.00 5.03 -1.26 -3.60 115.26 112.23 2xdm n ASN 396 Ca 0.03 -3.03 -0.31 0.00 0.87 0.00 0.00 54.58 52.14 2xdm n ASN 396 Cb 0.35 -0.69 -0.14 0.00 -1.02 0.00 0.00 39.78 38.27 2xdm n ASN 396 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2xdm s ARG 397 N -2.84 2.15 -1.45 3.52 0.52 -0.91 -4.74 118.95 115.19 2xdm s ARG 397 Ca 0.54 -0.91 0.00 0.00 -0.52 0.00 0.00 55.73 54.84 2xdm s ARG 397 Cb 0.42 -2.17 0.00 0.00 0.52 0.00 0.00 34.95 33.72 2xdm s ARG 397 CO 0.15 0.56 0.00 -1.33 0.02 0.00 0.00 175.30 174.70 2xdm n MET 398 N 2.01 -1.03 -2.20 3.54 2.81 -1.26 -0.89 117.12 120.09 2xdm n MET 398 Ca -0.16 0.93 -0.42 0.00 -1.81 0.00 0.00 57.70 56.23 2xdm n MET 398 Cb 0.52 -5.09 -0.03 0.00 -0.71 0.00 0.00 33.22 27.92 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 -3.57 4.24 0.00 0.03 0.52 -1.26 -2.92 118.95 115.99 2xdm s ARG 399 Ca 0.00 1.97 0.00 0.00 -0.52 0.00 0.00 55.73 57.18 2xdm s ARG 399 Cb 0.00 -3.73 0.00 0.00 0.52 0.00 0.00 34.95 31.74 2xdm s ARG 399 CO 0.00 -0.68 0.00 0.41 0.02 0.00 0.00 175.30 175.05 2xdm n GLY 400 N 3.78 0.74 3.61 -3.53 0.00 -1.26 -5.05 105.19 103.48 2xdm n GLY 400 Ca 0.14 -0.36 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.00 2.64 0.65 2.61 -4.23 -1.15 -4.73 115.64 109.43 2xdm s THR 401 Ca 0.00 -2.02 0.27 0.00 -1.18 0.00 0.00 61.69 58.77 2xdm s THR 401 Cb 0.00 -2.76 0.29 0.00 1.34 0.00 0.00 72.50 71.37 2xdm s THR 401 CO 0.00 -0.22 1.83 0.00 -0.54 0.00 0.00 174.62 175.69 2xdm h ALA 402 N 1.86 1.56 0.00 3.99 0.00 -1.88 -1.69 119.26 123.10 2xdm h ALA 402 Ca -0.43 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 2xdm h ALA 402 Cb 1.25 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2xdm h ALA 402 CO 0.66 -0.47 -0.66 0.00 0.00 0.00 0.00 179.25 178.78 2xdm h ALA 403 N 1.24 0.72 -2.34 0.00 0.00 -1.84 -3.43 119.26 113.61 2xdm h ALA 403 Ca 0.04 -0.34 -0.56 0.00 0.00 0.00 0.00 54.91 54.05 2xdm h ALA 403 Cb 0.89 0.03 0.04 0.00 0.00 0.00 0.00 17.79 18.75 2xdm h ALA 403 CO -0.00 0.42 1.04 -1.91 0.00 0.00 0.00 179.25 178.80 2xdm n GLU 404 N -3.02 2.51 -0.40 0.00 2.13 -0.64 -0.79 120.64 120.44 2xdm n GLU 404 Ca -0.00 0.91 0.00 0.00 0.66 0.00 0.00 57.16 58.73 2xdm n GLU 404 Cb 0.67 -2.77 0.00 0.00 0.27 0.00 0.00 31.44 29.61 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 4.09 1.97 0.27 8.31 0.00 -0.09 -4.82 105.19 114.91 2xdm n GLY 405 Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 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 1.36 -2.24 1.61 0.31 0.03 -4.94 118.33 112.46 2xdm n VAL 406 Ca 0.00 0.21 -0.42 0.00 -0.01 0.00 0.00 64.34 64.11 2xdm n VAL 406 Cb 0.00 -2.15 -0.03 0.00 -0.91 0.00 0.00 33.84 30.75 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 -2.63 3.83 -0.35 2.52 1.01 -0.79 -4.50 120.40 119.49 2xdm s VAL 407 Ca -0.22 1.15 -0.09 0.00 0.00 0.00 0.00 61.98 62.82 2xdm s VAL 407 Cb 0.03 -3.74 0.03 0.00 0.00 0.00 0.00 36.38 32.70 2xdm s VAL 407 CO 0.33 -0.03 0.15 -1.61 0.00 0.00 0.00 175.10 173.93 2xdm s GLU 408 N 2.78 2.84 -0.05 2.72 2.02 -0.64 -0.44 118.70 127.93 2xdm s GLU 408 Ca 0.63 -1.05 -0.15 0.00 0.02 0.00 0.00 54.97 54.42 2xdm s GLU 408 Cb -0.30 -3.58 0.03 0.00 0.10 0.00 0.00 34.13 30.39 2xdm s GLU 408 CO 0.25 -0.63 0.35 0.00 0.02 0.00 0.00 175.26 175.24 2xdm s ALA 409 N 1.50 -0.87 -0.19 5.21 0.00 -0.59 0.91 121.76 127.72 2xdm s ALA 409 Ca 0.01 0.60 -0.19 0.00 0.00 0.00 0.00 51.96 52.38 2xdm s ALA 409 Cb -0.19 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 2xdm s ALA 409 CO 0.05 -0.24 0.52 0.21 0.00 0.00 0.00 175.76 176.30 2xdm s LYS 410 N -0.85 4.21 0.95 0.00 2.47 0.14 -3.67 119.74 122.98 2xdm s LYS 410 Ca -0.09 0.43 -0.15 0.00 -1.56 0.00 0.00 55.97 54.60 2xdm s LYS 410 Cb -0.04 -3.55 0.17 0.00 -1.46 0.00 0.00 37.83 32.95 2xdm s LYS 410 CO 0.03 -0.12 1.23 0.95 0.16 0.00 0.00 175.35 177.60 2xdm s THR 411 N 1.53 1.95 -0.30 3.43 -4.23 -1.26 -2.62 115.64 114.15 2xdm s THR 411 Ca 0.25 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.57 2xdm s THR 411 Cb -0.15 -2.89 0.19 0.00 1.34 0.00 0.00 72.50 70.98 2xdm s THR 411 CO 0.10 0.00 1.23 -0.83 -0.54 0.00 0.00 174.62 174.58 2xdm s GLY 412 N -4.53 0.10 0.01 3.99 0.00 -1.10 -3.71 107.32 102.09 2xdm s GLY 412 Ca 0.69 3.41 0.01 0.00 0.00 0.00 0.00 44.72 48.83 2xdm s GLY 412 CO 0.52 3.58 -0.05 -1.59 0.00 0.00 0.00 173.10 175.56 2xdm s THR 413 N 2.42 0.37 0.30 0.90 2.01 -1.26 -0.57 115.64 119.80 2xdm s THR 413 Ca -0.03 -0.50 -0.19 0.00 0.31 0.00 0.00 61.69 61.28 2xdm s THR 413 Cb -0.04 -0.37 0.05 0.00 0.01 0.00 0.00 72.50 72.15 2xdm s THR 413 CO -0.13 -0.10 0.84 0.00 -0.69 0.00 0.00 174.62 174.54 2xdm s MET 414 N -0.64 1.84 -0.15 4.92 0.23 -0.50 -4.81 119.30 120.18 2xdm s MET 414 Ca -0.03 -1.13 -0.39 0.00 -1.03 0.00 0.00 55.69 53.11 2xdm s MET 414 Cb -0.05 0.55 -0.16 0.00 -1.53 0.00 0.00 34.83 33.65 2xdm s MET 414 CO -0.00 -0.86 1.64 0.43 -2.03 0.00 0.00 175.02 174.20 2xdm n SER 415 N -1.05 2.28 0.00 -1.18 7.64 -1.26 -1.40 113.62 118.65 2xdm n SER 415 Ca -0.06 1.08 0.00 0.00 1.01 0.00 0.00 58.87 60.90 2xdm n SER 415 Cb 0.60 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.62 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 3.72 0.43 2.99 0.23 0.00 -1.26 -4.97 105.19 106.32 2xdm n GLY 416 Ca 0.24 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.98 -0.04 -0.16 1.61 1.01 -0.49 -2.48 120.40 117.87 2xdm s VAL 417 Ca 0.00 0.13 -0.27 0.00 0.00 0.00 0.00 61.98 61.84 2xdm s VAL 417 Cb 0.00 -0.28 0.07 0.00 0.00 0.00 0.00 36.38 36.17 2xdm s VAL 417 CO 0.00 0.05 0.68 -0.55 0.00 0.00 0.00 175.10 175.28 2xdm s SER 418 N 0.97 -0.68 0.06 3.32 0.15 -0.52 -1.41 113.70 115.58 2xdm s SER 418 Ca -0.07 1.07 -0.12 0.00 0.70 0.00 0.00 55.95 57.53 2xdm s SER 418 Cb -0.09 1.01 0.01 0.00 -1.71 0.00 0.00 66.02 65.24 2xdm s SER 418 CO -0.05 -0.41 0.26 0.00 1.20 0.00 0.00 173.24 174.24 2xdm s ALA 419 N -0.35 -0.53 -0.21 5.45 0.00 0.27 0.25 121.76 126.64 2xdm s ALA 419 Ca -0.05 -0.18 -0.04 0.00 0.00 0.00 0.00 51.96 51.69 2xdm s ALA 419 Cb -0.03 0.36 0.10 0.00 0.00 0.00 0.00 23.12 23.56 2xdm s ALA 419 CO 0.05 -0.43 0.30 -1.17 0.00 0.00 0.00 175.76 174.51 2xdm s LEU 420 N -2.25 -0.37 -0.01 0.00 2.96 0.99 -2.70 118.68 117.30 2xdm s LEU 420 Ca -0.03 0.15 0.02 0.00 -0.22 0.00 0.00 54.13 54.06 2xdm s LEU 420 Cb 0.00 0.77 -0.00 0.00 0.50 0.00 0.00 46.19 47.45 2xdm s LEU 420 CO -0.05 -0.30 -0.07 -0.44 -1.32 0.00 0.00 176.35 174.17 2xdm s SER 421 N 2.44 0.83 0.00 3.68 0.01 -1.08 0.68 113.70 120.27 2xdm s SER 421 Ca 0.08 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.21 2xdm s SER 421 Cb -0.15 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 65.98 2xdm s SER 421 CO -0.13 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.21 2xdm n GLY 422 N 2.95 -0.74 3.36 3.44 0.00 0.15 -0.69 105.19 113.66 2xdm n GLY 422 Ca -0.14 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 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 -3.82 2.45 -0.72 1.61 2.02 0.26 -1.41 117.35 117.75 2xdm s TYR 423 Ca 0.00 -0.38 -0.01 0.00 -0.37 0.00 0.00 57.07 56.31 2xdm s TYR 423 Cb 0.00 -1.55 0.18 0.00 -0.40 0.00 0.00 41.96 40.19 2xdm s TYR 423 CO 0.00 0.02 0.54 0.08 -1.57 0.00 0.00 175.55 174.62 2xdm s VAL 424 N -0.61 3.76 0.81 0.71 1.01 0.10 -1.62 120.40 124.56 2xdm s VAL 424 Ca 0.09 -3.43 -0.14 0.00 0.00 0.00 0.00 61.98 58.50 2xdm s VAL 424 Cb -0.10 -3.42 0.03 0.00 0.00 0.00 0.00 36.38 32.89 2xdm s VAL 424 CO -0.00 -0.96 0.83 -0.81 0.00 0.00 0.00 175.10 174.17 2xdm n PRO 425 N 2.91 0.14 -4.30 2.72 -0.04 -1.26 -1.24 135.00 133.93 2xdm n PRO 425 Ca 0.13 0.11 -0.18 0.00 -0.04 0.00 0.00 63.50 63.52 2xdm n PRO 425 Cb 0.37 -2.13 -0.09 0.00 -0.04 0.00 0.00 33.50 31.61 2xdm n PRO 425 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2xdm s GLY 426 N -1.88 2.11 -0.45 0.55 0.00 -1.25 -4.84 107.32 101.56 2xdm s GLY 426 Ca 0.68 -1.86 0.00 0.00 0.00 0.00 0.00 44.72 43.55 2xdm s GLY 426 CO 0.56 -1.51 1.90 -1.55 0.00 0.00 0.00 173.10 172.50 2xdm n PRO 427 N -0.56 2.18 0.00 2.90 -0.04 -1.26 -4.42 135.00 133.80 2xdm n PRO 427 Ca 0.04 -2.49 0.00 0.00 -0.04 0.00 0.00 63.50 61.01 2xdm n PRO 427 Cb 0.64 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 32.12 2xdm n PRO 427 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2xdm n GLU 428 N -0.56 0.00 0.00 0.54 1.02 -1.26 -5.12 120.64 115.26 2xdm n GLU 428 Ca 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.62 2xdm n GLU 428 Cb 0.95 -0.17 0.00 0.00 -0.02 0.00 0.00 31.44 32.20 2xdm n GLU 428 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2xdm n GLY 429 N 0.99 4.37 3.81 0.62 0.00 -1.26 -5.01 105.19 108.71 2xdm n GLY 429 Ca 0.00 -0.66 -0.36 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.95 4.26 -0.09 1.61 2.12 -1.26 -3.80 118.70 118.58 2xdm s GLU 430 Ca 0.00 0.88 -0.09 0.00 0.36 0.00 0.00 54.97 56.13 2xdm s GLU 430 Cb 0.00 -2.86 -0.04 0.00 0.26 0.00 0.00 34.13 31.49 2xdm s GLU 430 CO 0.00 0.38 0.19 -0.51 -0.54 0.00 0.00 175.26 174.78 2xdm s LEU 431 N -2.01 4.41 -0.08 2.70 1.02 -0.37 -1.62 118.68 122.71 2xdm s LEU 431 Ca 0.44 0.57 -0.01 0.00 0.02 0.00 0.00 54.13 55.14 2xdm s LEU 431 Cb -0.16 -2.18 -0.03 0.00 0.02 0.00 0.00 46.19 43.83 2xdm s LEU 431 CO 0.21 0.39 -0.01 0.00 0.02 0.00 0.00 176.35 176.96 2xdm s ALA 432 N -1.04 3.21 0.05 4.21 0.00 0.46 0.02 121.76 128.67 2xdm s ALA 432 Ca 0.17 -0.83 -0.12 0.00 0.00 0.00 0.00 51.96 51.18 2xdm s ALA 432 Cb -0.13 -1.42 0.01 0.00 0.00 0.00 0.00 23.12 21.58 2xdm s ALA 432 CO 0.06 0.58 0.27 -0.59 0.00 0.00 0.00 175.76 176.08 2xdm s PHE 433 N -0.85 -0.04 -0.13 0.00 -0.12 -0.50 -0.47 117.98 115.88 2xdm s PHE 433 Ca 0.13 -0.16 -0.05 0.00 -0.05 0.00 0.00 56.93 56.80 2xdm s PHE 433 Cb -0.11 0.05 0.07 0.00 -0.63 0.00 0.00 43.02 42.40 2xdm s PHE 433 CO 0.02 -0.50 0.26 0.45 -0.05 0.00 0.00 175.22 175.40 2xdm s SER 434 N -2.21 0.38 -0.20 1.98 0.15 -0.74 -0.67 113.70 112.39 2xdm s SER 434 Ca -0.03 0.57 -0.04 0.00 0.70 0.00 0.00 55.95 57.15 2xdm s SER 434 Cb -0.00 0.69 -0.02 0.00 -1.71 0.00 0.00 66.02 64.98 2xdm s SER 434 CO -0.05 -0.24 -0.03 -0.63 1.20 0.00 0.00 173.24 173.49 2xdm s ILE 435 N 2.42 3.65 -0.13 6.45 1.01 0.22 -1.92 121.20 132.89 2xdm s ILE 435 Ca 0.01 -0.41 -0.01 0.00 0.00 0.00 0.00 60.65 60.24 2xdm s ILE 435 Cb -0.12 -2.64 0.04 0.00 0.01 0.00 0.00 42.46 39.74 2xdm s ILE 435 CO -0.09 0.43 -0.03 -0.69 0.00 0.00 0.00 174.94 174.56 2xdm s VAL 436 N 1.15 0.82 -0.24 2.92 1.01 -0.12 -0.01 120.40 125.93 2xdm s VAL 436 Ca 0.02 -0.33 -0.04 0.00 0.00 0.00 0.00 61.98 61.63 2xdm s VAL 436 Cb -0.15 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.25 2xdm s VAL 436 CO 0.00 0.19 -0.03 0.20 0.00 0.00 0.00 175.10 175.46 2xdm s ASN 437 N 1.77 4.44 0.08 3.32 0.01 0.14 -1.42 114.94 123.28 2xdm s ASN 437 Ca 0.03 -0.56 0.08 0.00 -0.71 0.00 0.00 52.86 51.70 2xdm s ASN 437 Cb -0.14 -1.74 -0.03 0.00 0.41 0.00 0.00 41.25 39.74 2xdm s ASN 437 CO -0.07 -0.08 -0.21 0.20 -1.51 0.00 0.00 177.10 175.43 2xdm s ASN 438 N 1.45 2.58 0.00 -1.22 0.02 -0.08 -1.44 114.94 116.24 2xdm s ASN 438 Ca 0.04 -0.62 0.00 0.00 -1.02 0.00 0.00 52.86 51.26 2xdm s ASN 438 Cb -0.15 -0.17 0.00 0.00 0.02 0.00 0.00 41.25 40.94 2xdm s ASN 438 CO -0.03 0.11 0.00 0.61 0.02 0.00 0.00 177.10 177.82 2xdm n GLY 439 N 1.39 0.72 3.75 0.66 0.00 -1.04 0.30 105.19 110.98 2xdm n GLY 439 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.55 3.66 -0.00 1.61 -3.43 -1.26 -4.05 115.29 109.26 2xdm s HIS 440 Ca 0.00 1.73 0.11 0.00 -0.80 0.00 0.00 55.06 56.09 2xdm s HIS 440 Cb 0.00 -3.23 -0.12 0.00 -1.43 0.00 0.00 32.58 27.80 2xdm s HIS 440 CO 0.00 -0.37 1.24 0.77 -2.00 0.00 0.00 174.74 174.38 2xdm h SER 441 N 4.09 0.00 -1.94 7.38 0.02 -1.83 -3.40 113.55 117.86 2xdm h SER 441 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2xdm h SER 441 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2xdm h SER 441 CO 0.68 0.81 0.00 0.61 -1.14 0.00 0.00 176.83 177.79 2xdm n GLY 442 N 1.33 0.84 3.69 -3.77 0.00 -1.26 -4.97 105.19 101.05 2xdm n GLY 442 Ca -0.02 -1.91 -0.31 0.00 0.00 0.00 0.00 46.02 43.78 2xdm n GLY 442 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2xdm s PRO 443 N 0.35 1.25 0.14 1.61 0.02 -1.26 -4.73 135.00 132.37 2xdm s PRO 443 Ca 0.00 1.49 -0.34 0.00 0.02 0.00 0.00 61.00 62.17 2xdm s PRO 443 Cb 0.00 -1.76 -0.16 0.00 0.02 0.00 0.00 34.50 32.60 2xdm s PRO 443 CO 0.00 -2.45 1.15 0.00 -0.33 0.00 0.00 177.00 175.36 2xdm n ALA 444 N -4.09 -1.25 -1.11 -1.55 0.00 -1.26 -4.83 120.51 106.42 2xdm n ALA 444 Ca 0.11 0.49 -0.31 0.00 0.00 0.00 0.00 53.44 53.73 2xdm n ALA 444 Cb 0.52 -1.98 -0.04 0.00 0.00 0.00 0.00 19.45 17.95 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 1.82 3.05 -0.18 0.00 -0.04 -1.26 -4.63 135.00 133.76 2xdm n PRO 445 Ca 0.16 -1.84 -0.08 0.00 -0.04 0.00 0.00 63.50 61.70 2xdm n PRO 445 Cb 0.22 -2.60 0.01 0.00 -0.04 0.00 0.00 33.50 31.09 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 7.06 0.69 -1.70 1.53 3.38 -2.00 -2.45 115.31 121.82 2xdm h LEU 446 Ca 0.69 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.48 2xdm h LEU 446 Cb 0.39 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2xdm h LEU 446 CO 1.50 0.65 -0.17 0.00 0.09 0.00 0.00 178.44 180.50 2xdm h ALA 447 N 1.07 1.30 0.05 1.53 0.00 -1.99 -0.28 119.26 120.93 2xdm h ALA 447 Ca 0.17 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2xdm h ALA 447 Cb 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2xdm h ALA 447 CO -0.02 0.22 -0.02 0.28 0.00 0.00 0.00 179.25 179.71 2xdm h VAL 448 N 0.00 1.27 -0.44 0.00 2.07 -1.88 -1.80 116.25 115.47 2xdm h VAL 448 Ca -0.00 -1.10 0.08 0.00 0.82 0.00 0.00 66.70 66.51 2xdm h VAL 448 Cb 0.43 1.98 -0.07 0.00 -1.52 0.00 0.00 31.29 32.11 2xdm h VAL 448 CO 0.02 0.27 -0.02 1.56 0.02 0.00 0.00 177.57 179.42 2xdm h GLN 449 N -0.55 0.08 -0.51 1.57 4.20 -0.93 -0.89 115.11 118.08 2xdm h GLN 449 Ca -0.01 -0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.72 2xdm h GLN 449 Cb 0.50 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.22 2xdm h GLN 449 CO 0.01 0.05 0.31 -0.44 -0.67 0.00 0.00 178.83 178.09 2xdm h ASP 450 N 0.09 0.50 -0.55 1.46 3.32 -1.14 -1.95 116.42 118.15 2xdm h ASP 450 Ca 0.22 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.31 2xdm h ASP 450 Cb 0.32 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 2xdm h ASP 450 CO -0.38 0.36 0.31 0.00 -1.72 0.00 0.00 179.24 177.81 2xdm h ALA 451 N 1.22 0.71 -0.31 3.45 0.00 -0.48 0.45 119.26 124.31 2xdm h ALA 451 Ca 0.20 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2xdm h ALA 451 Cb 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2xdm h ALA 451 CO -0.09 0.00 0.12 0.82 0.00 0.00 0.00 179.25 180.11 2xdm h ILE 452 N 0.61 1.18 -0.64 0.00 2.04 -1.07 -1.03 117.51 118.60 2xdm h ILE 452 Ca 0.23 -0.56 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 2xdm h ILE 452 Cb 0.08 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 2xdm h ILE 452 CO -0.13 0.19 0.31 0.00 0.00 0.00 0.00 178.15 178.52 2xdm h ALA 453 N 0.97 0.82 -0.04 1.87 0.00 -0.91 -0.18 119.26 121.79 2xdm h ALA 453 Ca 0.10 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2xdm h ALA 453 Cb 0.19 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2xdm h ALA 453 CO -0.01 0.38 0.02 0.28 0.00 0.00 0.00 179.25 179.92 2xdm h VAL 454 N 0.88 1.12 -0.29 0.00 2.07 -0.05 -1.02 116.25 118.96 2xdm h VAL 454 Ca 0.22 -0.36 0.08 0.00 0.82 0.00 0.00 66.70 67.46 2xdm h VAL 454 Cb 0.11 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 2xdm h VAL 454 CO -0.03 0.10 0.24 -0.09 0.02 0.00 0.00 177.57 177.81 2xdm h ARG 455 N -0.09 0.00 0.10 1.57 9.65 -0.83 -0.87 114.38 123.91 2xdm h ARG 455 Ca 0.01 0.00 -0.26 0.00 -1.10 0.00 0.00 59.98 58.63 2xdm h ARG 455 Cb 0.15 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.73 2xdm h ARG 455 CO -0.00 0.00 -1.17 -0.07 2.80 0.00 0.00 179.97 181.53 2xdm h LEU 456 N 0.00 0.44 -0.76 3.80 3.38 -0.61 -2.81 115.31 118.75 2xdm h LEU 456 Ca 0.14 -0.44 -0.10 0.00 0.09 0.00 0.00 57.88 57.56 2xdm h LEU 456 Cb 0.61 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2xdm h LEU 456 CO -0.00 1.31 -0.16 0.00 0.09 0.00 0.00 178.44 179.68 2xdm h ALA 457 N 0.63 0.95 -0.29 1.53 0.00 0.15 -0.50 119.26 121.73 2xdm h ALA 457 Ca -0.12 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.36 2xdm h ALA 457 Cb 1.87 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 2xdm h ALA 457 CO 0.19 0.61 -0.18 0.93 0.00 0.00 0.00 179.25 180.80 2xdm h GLU 458 N 0.68 0.63 -1.00 0.00 5.08 -1.42 -0.95 114.58 117.61 2xdm h GLU 458 Ca 0.11 -0.29 0.09 0.00 -1.00 0.00 0.00 59.36 58.26 2xdm h GLU 458 Cb 0.66 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 2xdm h GLU 458 CO 0.05 0.88 0.64 -0.92 -1.00 0.00 0.00 179.01 178.66 2xdm h TYR 459 N 0.37 1.16 -0.16 4.33 3.20 -1.21 -1.81 116.97 122.85 2xdm h TYR 459 Ca 0.06 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.96 2xdm h TYR 459 Cb 0.72 -0.38 0.00 0.00 1.54 0.00 0.00 36.73 38.61 2xdm h TYR 459 CO 0.07 0.54 0.00 0.00 -1.64 0.00 0.00 178.16 177.12 2xdm n ALA 460 N -2.36 2.52 0.00 1.82 0.00 -0.22 -4.89 120.51 117.38 2xdm n ALA 460 Ca 0.17 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2xdm n ALA 460 Cb 0.27 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 1.01 1.22 3.90 0.00 0.00 -0.68 -4.30 105.19 106.35 2xdm n GLY 461 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 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 3.41 0.11 1.61 3.76 -0.39 -4.98 115.29 116.82 2xdm s HIS 462 Ca 0.00 0.11 0.07 0.00 -0.15 0.00 0.00 55.06 55.09 2xdm s HIS 462 Cb 0.00 -1.65 -0.04 0.00 1.11 0.00 0.00 32.58 32.00 2xdm s HIS 462 CO 0.00 0.53 -0.17 -0.65 -0.85 0.00 0.00 174.74 173.60 2xdm s GLN 463 N -3.04 1.05 -0.09 1.40 -0.21 -1.26 -4.12 119.66 113.38 2xdm s GLN 463 Ca 0.34 -1.16 -0.36 0.00 0.02 0.00 0.00 55.36 54.19 2xdm s GLN 463 Cb -0.11 -1.13 -0.14 0.00 1.00 0.00 0.00 33.01 32.63 2xdm s GLN 463 CO 0.27 0.25 1.74 0.00 -2.12 0.00 0.00 175.29 175.43 2xdm n ALA 464 N 0.89 0.42 -0.97 6.09 0.00 -1.26 -4.38 120.51 121.29 2xdm n ALA 464 Ca -0.18 0.36 -0.32 0.00 0.00 0.00 0.00 53.44 53.31 2xdm n ALA 464 Cb 0.55 -2.35 0.13 0.00 0.00 0.00 0.00 19.45 17.78 2xdm n ALA 464 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2xdm s PRO 465 N 3.08 1.58 0.00 0.00 0.04 -1.26 -4.88 135.00 133.55 2xdm s PRO 465 Ca 0.92 1.48 0.00 0.00 0.04 0.00 0.00 61.00 63.43 2xdm s PRO 465 Cb -0.83 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 31.91 2xdm s PRO 465 CO 0.53 -2.21 0.00 0.39 0.04 0.00 0.00 177.00 175.76