#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ddn n LEU 4 N 0.00 2.94 -4.77 2.46 4.32 -1.26 -4.96 117.00 115.73 3ddn n LEU 4 Ca 0.00 1.14 -0.40 0.00 -0.02 0.00 0.00 56.01 56.72 3ddn n LEU 4 Cb 0.00 -1.41 -0.02 0.00 -1.62 0.00 0.00 43.42 40.38 3ddn n LEU 4 CO 0.00 -0.55 0.98 -2.84 -1.22 0.00 0.00 177.39 173.76 3ddn s PRO 5 N -0.26 4.24 -0.28 3.23 0.02 -1.26 -4.65 135.00 136.04 3ddn s PRO 5 Ca 0.70 2.21 -0.16 0.00 0.02 0.00 0.00 61.00 63.77 3ddn s PRO 5 Cb -0.67 -2.98 -0.03 0.00 0.02 0.00 0.00 34.50 30.83 3ddn s PRO 5 CO 0.49 -0.28 0.42 0.08 -0.33 0.00 0.00 177.00 177.37 3ddn s VAL 6 N -1.18 5.14 -0.39 3.83 1.01 -1.26 -0.95 120.40 126.61 3ddn s VAL 6 Ca 0.51 0.61 -0.11 0.00 0.00 0.00 0.00 61.98 62.99 3ddn s VAL 6 Cb -0.39 -3.75 0.03 0.00 0.00 0.00 0.00 36.38 32.27 3ddn s VAL 6 CO 0.52 0.10 0.22 -0.69 0.00 0.00 0.00 175.10 175.26 3ddn s VAL 7 N 2.15 4.60 -0.33 2.92 1.01 0.15 -0.52 120.40 130.38 3ddn s VAL 7 Ca 0.17 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 61.02 3ddn s VAL 7 Cb -0.16 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.61 3ddn s VAL 7 CO 0.10 -0.29 0.62 -0.22 0.00 0.00 0.00 175.10 175.31 3ddn s LEU 8 N 1.55 4.20 -0.35 3.92 0.20 -0.02 -1.17 118.68 127.01 3ddn s LEU 8 Ca 0.02 0.29 -0.16 0.00 0.69 0.00 0.00 54.13 54.97 3ddn s LEU 8 Cb -0.20 -2.78 -0.01 0.00 -0.43 0.00 0.00 46.19 42.77 3ddn s LEU 8 CO 0.06 -0.52 0.39 -0.63 -0.29 0.00 0.00 176.35 175.36 3ddn s ILE 9 N 2.62 5.14 -1.25 6.68 -1.09 0.96 -0.85 121.20 133.42 3ddn s ILE 9 Ca 0.24 0.04 0.20 0.00 -2.23 0.00 0.00 60.65 58.90 3ddn s ILE 9 Cb -0.15 -3.86 -0.14 0.00 -1.58 0.00 0.00 42.46 36.73 3ddn s ILE 9 CO 0.13 -0.14 0.89 0.00 -1.23 0.00 0.00 174.94 174.59 3ddn n ALA 10 N 5.44 4.13 -4.65 9.38 0.00 -0.27 -1.02 120.51 133.53 3ddn n ALA 10 Ca -0.08 -0.57 -0.31 0.00 0.00 0.00 0.00 53.44 52.48 3ddn n ALA 10 Cb 0.49 -0.71 -0.07 0.00 0.00 0.00 0.00 19.45 19.16 3ddn n ALA 10 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3ddn n ASP 11 N -0.95 2.47 -3.61 0.00 10.43 -1.26 -0.07 116.55 123.56 3ddn n ASP 11 Ca 0.05 -3.23 -0.42 0.00 2.57 0.00 0.00 54.79 53.76 3ddn n ASP 11 Cb 0.35 0.66 -0.05 0.00 1.84 0.00 0.00 41.12 43.92 3ddn n ASP 11 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3ddn n LYS 12 N -1.13 1.73 -4.07 -1.24 4.01 -1.26 -4.90 118.16 111.30 3ddn n LYS 12 Ca -0.15 -1.93 -0.35 0.00 -0.51 0.00 0.00 58.31 55.37 3ddn n LYS 12 Cb 0.64 -2.94 -0.13 0.00 -0.51 0.00 0.00 35.03 32.08 3ddn n LYS 12 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 3ddn s LEU 13 N 1.25 3.18 0.53 -0.35 1.02 -1.26 -5.09 118.68 117.95 3ddn s LEU 13 Ca 0.55 -0.24 -0.20 0.00 0.02 0.00 0.00 54.13 54.26 3ddn s LEU 13 Cb 0.14 -1.80 -0.06 0.00 0.02 0.00 0.00 46.19 44.49 3ddn s LEU 13 CO 0.08 0.05 1.17 0.00 0.02 0.00 0.00 176.35 177.67 3ddn s ALA 14 N 1.06 2.75 0.36 4.21 0.00 -1.26 -4.93 121.76 123.96 3ddn s ALA 14 Ca 0.02 0.92 0.12 0.00 0.00 0.00 0.00 51.96 53.02 3ddn s ALA 14 Cb -0.14 -3.40 0.91 0.00 0.00 0.00 0.00 23.12 20.48 3ddn s ALA 14 CO 0.01 -0.85 1.82 -1.35 0.00 0.00 0.00 175.76 175.40 3ddn h PRO 15 N 1.40 0.58 -0.42 0.00 0.11 -1.99 -1.79 132.00 129.88 3ddn h PRO 15 Ca -0.50 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.44 3ddn h PRO 15 Cb 1.27 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3ddn h PRO 15 CO 0.58 0.38 -0.25 0.66 -0.21 0.00 0.00 178.00 179.15 3ddn h SER 16 N 0.60 0.96 -0.09 -2.05 4.64 -2.00 -1.86 113.55 113.74 3ddn h SER 16 Ca 0.51 -0.42 0.03 0.00 -0.47 0.00 0.00 61.79 61.44 3ddn h SER 16 Cb 1.01 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 62.83 3ddn h SER 16 CO -0.26 1.17 0.17 0.74 -0.87 0.00 0.00 176.83 177.78 3ddn h THR 17 N 0.75 0.26 0.00 2.95 2.02 -1.69 -2.57 112.91 114.63 3ddn h THR 17 Ca 0.09 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.27 3ddn h THR 17 Cb 0.83 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 3ddn h THR 17 CO 0.07 0.00 -0.08 0.55 0.37 0.00 0.00 175.52 176.43 3ddn n VAL 18 N -3.43 1.89 0.31 3.16 3.14 -0.75 -3.10 118.33 119.55 3ddn n VAL 18 Ca -0.01 -2.35 0.20 0.00 -2.96 0.00 0.00 64.34 59.22 3ddn n VAL 18 Cb 0.26 -0.22 0.98 0.00 -1.06 0.00 0.00 33.84 33.80 3ddn n VAL 18 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3ddn h ALA 19 N 0.13 1.05 -0.08 1.55 0.00 -0.99 -2.42 119.26 118.50 3ddn h ALA 19 Ca -0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3ddn h ALA 19 Cb 1.01 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3ddn h ALA 19 CO 0.00 0.02 0.10 0.00 0.00 0.00 0.00 179.25 179.37 3ddn h ALA 20 N 1.98 1.61 -2.97 0.00 0.00 -1.84 -3.40 119.26 114.65 3ddn h ALA 20 Ca -0.00 -0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.36 3ddn h ALA 20 Cb 0.21 0.01 0.12 0.00 0.00 0.00 0.00 17.79 18.13 3ddn h ALA 20 CO 0.00 -0.15 0.59 -0.51 0.00 0.00 0.00 179.25 179.18 3ddn s LEU 21 N -7.47 3.87 0.00 0.00 1.43 -0.91 -4.81 118.68 110.79 3ddn s LEU 21 Ca -0.05 2.68 0.00 0.00 -1.03 0.00 0.00 54.13 55.73 3ddn s LEU 21 Cb 0.15 -4.27 0.00 0.00 0.03 0.00 0.00 46.19 42.10 3ddn s LEU 21 CO 0.53 -1.46 0.00 0.61 0.23 0.00 0.00 176.35 176.26 3ddn n GLY 22 N 0.67 -1.81 1.33 -3.19 0.00 -1.26 -4.90 105.19 96.03 3ddn n GLY 22 Ca 0.10 -1.43 0.10 0.00 0.00 0.00 0.00 46.02 44.80 3ddn n GLY 22 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ddn n ASP 23 N 0.00 3.87 -1.47 1.61 3.85 -1.26 -4.43 116.55 118.72 3ddn n ASP 23 Ca 0.00 -2.11 0.09 0.00 -0.71 0.00 0.00 54.79 52.06 3ddn n ASP 23 Cb 0.00 -0.48 0.33 0.00 -1.35 0.00 0.00 41.12 39.62 3ddn n ASP 23 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3ddn n GLN 24 N 1.38 3.39 -4.11 0.11 1.13 -1.26 -4.92 117.38 113.10 3ddn n GLN 24 Ca 0.23 -2.64 -0.15 0.00 -1.94 0.00 0.00 57.00 52.51 3ddn n GLN 24 Cb 0.65 -1.80 -0.11 0.00 0.11 0.00 0.00 30.24 29.08 3ddn n GLN 24 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 3ddn s VAL 25 N -1.70 0.75 -0.35 5.09 -7.23 -1.26 -4.19 120.40 111.51 3ddn s VAL 25 Ca 0.48 -1.24 -0.17 0.00 -1.81 0.00 0.00 61.98 59.24 3ddn s VAL 25 Cb 0.30 -0.86 -0.01 0.00 0.56 0.00 0.00 36.38 36.37 3ddn s VAL 25 CO 0.25 -0.38 0.45 -0.70 -0.31 0.00 0.00 175.10 174.41 3ddn s GLU 26 N -1.84 3.57 -0.25 4.82 2.12 -0.13 -4.97 118.70 122.03 3ddn s GLU 26 Ca -0.05 -0.29 -0.13 0.00 0.36 0.00 0.00 54.97 54.86 3ddn s GLU 26 Cb -0.09 -3.81 -0.04 0.00 0.26 0.00 0.00 34.13 30.45 3ddn s GLU 26 CO 0.01 -0.60 0.27 0.08 -0.54 0.00 0.00 175.26 174.47 3ddn s VAL 27 N 2.23 5.27 0.27 3.70 1.01 -1.26 -0.68 120.40 130.94 3ddn s VAL 27 Ca 0.16 0.37 0.12 0.00 0.00 0.00 0.00 61.98 62.62 3ddn s VAL 27 Cb -0.16 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 3ddn s VAL 27 CO 0.13 0.25 -0.19 -0.13 0.00 0.00 0.00 175.10 175.16 3ddn s ARG 28 N 1.55 1.71 0.13 2.72 0.52 -0.31 -4.97 118.95 120.28 3ddn s ARG 28 Ca 0.11 -1.73 0.08 0.00 -0.52 0.00 0.00 55.73 53.68 3ddn s ARG 28 Cb -0.15 -1.80 -0.04 0.00 0.52 0.00 0.00 34.95 33.48 3ddn s ARG 28 CO 0.08 0.34 -0.13 -1.58 0.02 0.00 0.00 175.30 174.03 3ddn s TRP 29 N -2.43 2.63 0.05 -0.53 0.51 -1.26 -0.03 118.94 117.87 3ddn s TRP 29 Ca 0.29 -0.22 -0.06 0.00 -2.12 0.00 0.00 56.10 53.99 3ddn s TRP 29 Cb -0.05 -1.36 -0.01 0.00 -0.81 0.00 0.00 33.47 31.23 3ddn s TRP 29 CO 0.15 0.43 0.12 0.54 -0.51 0.00 0.00 176.95 177.67 3ddn s VAL 30 N -1.28 0.14 -1.03 4.03 0.11 -0.19 -4.89 120.40 117.28 3ddn s VAL 30 Ca 0.21 -1.12 -0.23 0.00 -2.93 0.00 0.00 61.98 57.91 3ddn s VAL 30 Cb -0.10 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 33.80 3ddn s VAL 30 CO 0.12 -0.62 1.48 -0.62 -3.33 0.00 0.00 175.10 172.14 3ddn s ASP 31 N -2.26 6.46 0.16 3.54 3.68 -1.26 -4.31 116.67 122.68 3ddn s ASP 31 Ca -0.03 -1.46 -0.20 0.00 2.13 0.00 0.00 52.55 52.99 3ddn s ASP 31 Cb 0.00 -2.57 0.06 0.00 -1.45 0.00 0.00 42.92 38.96 3ddn s ASP 31 CO -0.06 -1.54 1.65 1.23 0.13 0.00 0.00 175.17 176.58 3ddn h GLY 32 N 12.97 0.03 0.41 2.66 0.00 -0.81 -0.98 103.07 117.35 3ddn h GLY 32 Ca 0.21 0.23 0.16 0.00 0.00 0.00 0.00 47.33 47.93 3ddn h GLY 32 CO 1.42 -0.18 0.64 -2.55 0.00 0.00 0.00 176.54 175.87 3ddn h PRO 33 N -0.15 0.00 -5.90 4.80 0.11 -1.77 -3.37 132.00 125.72 3ddn h PRO 33 Ca 0.16 0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.66 3ddn h PRO 33 Cb 0.39 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 31.38 3ddn h PRO 33 CO -0.40 0.00 0.53 0.34 -0.21 0.00 0.00 178.00 178.27 3ddn s ASP 34 N -4.79 6.38 0.17 -2.05 3.68 -0.37 -4.94 116.67 114.74 3ddn s ASP 34 Ca -0.04 -0.23 -0.12 0.00 2.13 0.00 0.00 52.55 54.29 3ddn s ASP 34 Cb 0.15 -2.43 0.06 0.00 -1.45 0.00 0.00 42.92 39.25 3ddn s ASP 34 CO 0.52 -1.14 1.69 0.03 0.13 0.00 0.00 175.17 176.39 3ddn h ARG 35 N 9.22 0.89 -0.63 4.34 2.47 -1.83 -1.82 114.38 127.03 3ddn h ARG 35 Ca -0.26 -0.20 0.01 0.00 -1.26 0.00 0.00 59.98 58.28 3ddn h ARG 35 Cb 1.08 -0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 29.24 3ddn h ARG 35 CO 1.06 0.82 0.41 -0.44 0.56 0.00 0.00 179.97 182.37 3ddn h ASP 36 N 0.81 0.70 0.13 7.04 3.45 -1.93 -1.07 116.42 125.54 3ddn h ASP 36 Ca 0.18 -0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.62 3ddn h ASP 36 Cb 0.30 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 38.91 3ddn h ASP 36 CO -0.00 0.50 -0.06 0.11 -1.57 0.00 0.00 179.24 178.21 3ddn h LYS 37 N 0.83 -0.17 0.03 3.56 1.79 -1.77 -2.13 116.57 118.71 3ddn h LYS 37 Ca 0.24 0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.74 3ddn h LYS 37 Cb -0.07 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.59 3ddn h LYS 37 CO -0.06 0.04 -0.22 1.25 -1.08 0.00 0.00 179.45 179.38 3ddn h LEU 38 N -0.36 -0.65 -1.75 2.94 6.46 -1.22 -0.65 115.31 120.09 3ddn h LEU 38 Ca -0.02 0.09 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 3ddn h LEU 38 Cb 0.29 0.26 -0.00 0.00 -0.73 0.00 0.00 40.66 40.48 3ddn h LEU 38 CO 0.03 -0.30 -0.11 -0.07 -0.62 0.00 0.00 178.44 177.38 3ddn h LEU 39 N -0.37 0.02 -0.35 2.25 4.07 -1.21 -0.85 115.31 118.88 3ddn h LEU 39 Ca 0.05 -0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.87 3ddn h LEU 39 Cb 0.43 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.15 3ddn h LEU 39 CO -0.18 0.13 -0.68 0.00 -1.08 0.00 0.00 178.44 176.63 3ddn h ALA 40 N 1.87 0.69 0.00 1.53 0.00 -0.66 -3.34 119.26 119.35 3ddn h ALA 40 Ca 0.00 -0.62 -0.10 0.00 0.00 0.00 0.00 54.91 54.20 3ddn h ALA 40 Cb 0.20 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3ddn h ALA 40 CO 0.01 0.85 -1.31 0.00 0.00 0.00 0.00 179.25 178.81 3ddn n ALA 41 N -2.33 2.21 0.15 0.00 0.00 -0.32 -4.46 120.51 115.76 3ddn n ALA 41 Ca 0.00 -0.44 0.04 0.00 0.00 0.00 0.00 53.44 53.04 3ddn n ALA 41 Cb 0.74 -0.99 0.07 0.00 0.00 0.00 0.00 19.45 19.27 3ddn n ALA 41 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 3ddn h VAL 42 N 0.00 0.76 -0.99 0.00 3.04 -1.31 -3.31 116.25 114.44 3ddn h VAL 42 Ca -0.10 -2.03 0.25 0.00 -1.01 0.00 0.00 66.70 63.81 3ddn h VAL 42 Cb 1.33 2.34 -0.07 0.00 -2.01 0.00 0.00 31.29 32.88 3ddn h VAL 42 CO 0.02 0.43 0.66 -0.65 -1.01 0.00 0.00 177.57 177.02 3ddn h PRO 43 N 0.00 0.32 -0.00 4.17 0.11 -1.76 -0.73 132.00 134.11 3ddn h PRO 43 Ca -0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 3ddn h PRO 43 Cb 1.31 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3ddn h PRO 43 CO 0.06 0.21 -0.19 0.39 -0.21 0.00 0.00 178.00 178.25 3ddn n GLU 44 N -4.51 0.57 -2.65 1.05 1.02 -1.25 -4.34 120.64 110.54 3ddn n GLU 44 Ca 0.22 -0.25 -0.42 0.00 -0.02 0.00 0.00 57.16 56.70 3ddn n GLU 44 Cb 0.85 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.75 3ddn n GLU 44 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ddn s ALA 45 N -2.60 3.23 -0.05 0.62 0.00 -0.28 -4.55 121.76 118.13 3ddn s ALA 45 Ca 0.24 0.61 0.10 0.00 0.00 0.00 0.00 51.96 52.92 3ddn s ALA 45 Cb 0.19 -3.35 -0.23 0.00 0.00 0.00 0.00 23.12 19.73 3ddn s ALA 45 CO 0.52 -0.23 0.65 -0.44 0.00 0.00 0.00 175.76 176.27 3ddn h ASP 46 N 6.50 0.05 -4.78 0.00 5.19 -1.01 -3.09 116.42 119.28 3ddn h ASP 46 Ca -0.42 -0.10 -0.25 0.00 -0.62 0.00 0.00 57.03 55.65 3ddn h ASP 46 Cb 1.22 -0.01 -0.20 0.00 0.18 0.00 0.00 39.33 40.51 3ddn h ASP 46 CO 0.75 1.09 -0.72 0.00 -3.12 0.00 0.00 179.24 177.24 3ddn s ALA 47 N -2.60 0.60 -0.09 3.45 0.00 -0.61 -0.11 121.76 122.39 3ddn s ALA 47 Ca -0.06 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 3ddn s ALA 47 Cb 0.08 0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.31 3ddn s ALA 47 CO 0.82 -0.09 -0.04 -1.17 0.00 0.00 0.00 175.76 175.28 3ddn s LEU 48 N -1.90 0.95 0.02 0.00 2.96 -0.45 -0.84 118.68 119.42 3ddn s LEU 48 Ca -0.06 -0.20 0.03 0.00 -0.22 0.00 0.00 54.13 53.68 3ddn s LEU 48 Cb -0.06 -0.65 -0.04 0.00 0.50 0.00 0.00 46.19 45.94 3ddn s LEU 48 CO -0.01 -0.14 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.10 3ddn s LEU 49 N 1.75 3.40 0.09 -0.68 1.43 -0.03 -0.31 118.68 124.33 3ddn s LEU 49 Ca 0.04 -0.09 -0.14 0.00 -1.03 0.00 0.00 54.13 52.90 3ddn s LEU 49 Cb -0.13 -2.00 0.02 0.00 0.03 0.00 0.00 46.19 44.12 3ddn s LEU 49 CO -0.06 0.25 0.33 0.54 0.23 0.00 0.00 176.35 177.64 3ddn s VAL 50 N -1.12 0.09 0.00 -1.59 0.11 -0.33 -1.12 120.40 116.45 3ddn s VAL 50 Ca 0.20 -0.72 0.00 0.00 -2.93 0.00 0.00 61.98 58.54 3ddn s VAL 50 Cb -0.11 -1.12 0.00 0.00 -1.53 0.00 0.00 36.38 33.62 3ddn s VAL 50 CO 0.11 -0.40 0.00 -1.14 -3.33 0.00 0.00 175.10 170.35 3ddn n ARG 51 N 0.11 0.00 0.00 1.54 0.63 -1.26 -0.81 116.66 116.87 3ddn n ARG 51 Ca -0.17 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.76 3ddn n ARG 51 Cb 0.62 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.53 3ddn n ARG 51 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3ddn n SER 52 N 0.00 1.09 0.07 6.15 3.41 -1.26 -4.50 113.62 118.58 3ddn n SER 52 Ca 0.00 -0.12 -0.02 0.00 -0.26 0.00 0.00 58.87 58.47 3ddn n SER 52 Cb 0.00 0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 64.35 3ddn n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ddn h ALA 53 N 0.00 0.59 -2.82 7.33 0.00 -1.96 -3.45 119.26 118.96 3ddn h ALA 53 Ca 0.00 -0.81 -0.58 0.00 0.00 0.00 0.00 54.91 53.52 3ddn h ALA 53 Cb 0.00 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 3ddn h ALA 53 CO 0.00 0.99 -0.11 0.99 0.00 0.00 0.00 179.25 181.12 3ddn s THR 54 N -2.83 5.06 -0.27 0.00 2.01 -1.26 -4.43 115.64 113.92 3ddn s THR 54 Ca 0.00 1.03 -0.11 0.00 0.31 0.00 0.00 61.69 62.92 3ddn s THR 54 Cb 0.09 -3.83 -0.05 0.00 0.01 0.00 0.00 72.50 68.71 3ddn s THR 54 CO 0.79 0.41 0.21 0.42 -0.69 0.00 0.00 174.62 175.76 3ddn s THR 55 N 0.00 5.31 -1.09 -0.82 -4.23 -1.26 -4.81 115.64 108.73 3ddn s THR 55 Ca 0.27 0.22 -0.08 0.00 -1.18 0.00 0.00 61.69 60.93 3ddn s THR 55 Cb -0.16 -3.54 0.28 0.00 1.34 0.00 0.00 72.50 70.41 3ddn s THR 55 CO 0.13 0.26 1.12 0.52 -0.54 0.00 0.00 174.62 176.12 3ddn n VAL 56 N 4.86 4.48 -2.22 2.29 0.31 0.15 -4.88 118.33 123.32 3ddn n VAL 56 Ca -0.14 -5.41 -0.06 0.00 -0.01 0.00 0.00 64.34 58.72 3ddn n VAL 56 Cb 0.52 -2.52 0.03 0.00 -0.91 0.00 0.00 33.84 30.96 3ddn n VAL 56 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3ddn n ASP 57 N 2.49 0.30 -0.23 4.52 5.68 -1.26 -1.91 116.55 126.13 3ddn n ASP 57 Ca 0.24 -1.26 -0.03 0.00 -0.50 0.00 0.00 54.79 53.24 3ddn n ASP 57 Cb 0.38 -0.17 0.15 0.00 -1.14 0.00 0.00 41.12 40.35 3ddn n ASP 57 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3ddn h ALA 58 N -0.64 1.22 -0.18 2.12 0.00 -1.95 -2.09 119.26 117.73 3ddn h ALA 58 Ca -0.08 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.72 3ddn h ALA 58 Cb 0.29 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 3ddn h ALA 58 CO 0.08 0.59 -0.10 1.49 0.00 0.00 0.00 179.25 181.31 3ddn h GLU 59 N 1.03 -0.08 -0.36 0.00 4.81 -1.98 0.35 114.58 118.36 3ddn h GLU 59 Ca 0.25 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.53 3ddn h GLU 59 Cb 0.14 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 3ddn h GLU 59 CO -0.03 -0.06 0.10 0.28 -0.73 0.00 0.00 179.01 178.57 3ddn h VAL 60 N -0.09 0.86 -0.37 0.32 2.07 -1.84 -2.21 116.25 114.99 3ddn h VAL 60 Ca 0.10 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 3ddn h VAL 60 Cb 0.24 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 3ddn h VAL 60 CO -0.24 0.04 0.10 -0.07 0.02 0.00 0.00 177.57 177.42 3ddn h LEU 61 N 0.23 0.56 -1.69 2.57 3.38 -0.65 -1.80 115.31 117.91 3ddn h LEU 61 Ca 0.17 -0.22 0.07 0.00 0.09 0.00 0.00 57.88 57.98 3ddn h LEU 61 Cb 0.17 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 3ddn h LEU 61 CO -0.19 0.64 0.33 0.00 0.09 0.00 0.00 178.44 179.30 3ddn h ALA 62 N 0.95 1.98 -0.00 1.53 0.00 -0.20 -1.72 119.26 121.79 3ddn h ALA 62 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3ddn h ALA 62 Cb 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3ddn h ALA 62 CO -0.00 -0.07 -0.13 0.00 0.00 0.00 0.00 179.25 179.04 3ddn n ALA 63 N -2.52 2.68 -3.76 0.00 0.00 -0.72 -4.47 120.51 111.73 3ddn n ALA 63 Ca 0.07 -0.18 -0.33 0.00 0.00 0.00 0.00 53.44 53.00 3ddn n ALA 63 Cb 0.29 -1.37 -0.09 0.00 0.00 0.00 0.00 19.45 18.27 3ddn n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ddn s ALA 64 N -2.94 3.92 0.36 0.00 0.00 -0.65 -3.59 121.76 118.87 3ddn s ALA 64 Ca 0.15 -3.69 0.29 0.00 0.00 0.00 0.00 51.96 48.72 3ddn s ALA 64 Cb 0.19 -2.55 1.46 0.00 0.00 0.00 0.00 23.12 22.22 3ddn s ALA 64 CO 0.57 -2.12 2.06 -1.35 0.00 0.00 0.00 175.76 174.91 3ddn h PRO 65 N 6.06 0.00 -0.21 0.00 0.11 -1.77 -2.90 132.00 133.29 3ddn h PRO 65 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 3ddn h PRO 65 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 3ddn h PRO 65 CO 0.77 0.11 0.00 0.36 -0.21 0.00 0.00 178.00 179.03 3ddn n LYS 66 N -3.49 2.60 -1.83 1.05 2.85 -1.26 -5.02 118.16 113.06 3ddn n LYS 66 Ca -0.01 -2.59 -0.42 0.00 -1.05 0.00 0.00 58.31 54.24 3ddn n LYS 66 Cb 0.26 -1.64 -0.03 0.00 -0.65 0.00 0.00 35.03 32.97 3ddn n LYS 66 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 3ddn s LEU 67 N -2.44 4.37 -0.06 -5.58 0.20 -1.10 -4.39 118.68 109.69 3ddn s LEU 67 Ca 0.35 2.71 0.10 0.00 0.69 0.00 0.00 54.13 57.98 3ddn s LEU 67 Cb 0.27 -3.59 -0.15 0.00 -0.43 0.00 0.00 46.19 42.30 3ddn s LEU 67 CO 0.08 -0.91 0.14 0.29 -0.29 0.00 0.00 176.35 175.67 3ddn n LYS 68 N 4.40 1.32 -3.74 1.98 5.02 0.84 -4.77 118.16 123.20 3ddn n LYS 68 Ca 0.15 -0.05 -0.12 0.00 -2.02 0.00 0.00 58.31 56.27 3ddn n LYS 68 Cb 0.38 -1.26 -0.13 0.00 -0.02 0.00 0.00 35.03 34.00 3ddn n LYS 68 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3ddn s ILE 69 N -2.51 -0.03 -0.21 -0.18 1.01 -1.19 -1.83 121.20 116.26 3ddn s ILE 69 Ca -0.05 0.11 -0.04 0.00 0.00 0.00 0.00 60.65 60.67 3ddn s ILE 69 Cb 0.05 -0.38 -0.01 0.00 0.01 0.00 0.00 42.46 42.13 3ddn s ILE 69 CO 0.44 0.04 -0.04 -0.69 0.00 0.00 0.00 174.94 174.69 3ddn s VAL 70 N 0.95 3.44 -0.17 2.92 1.01 0.15 -1.35 120.40 127.35 3ddn s VAL 70 Ca -0.07 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.43 3ddn s VAL 70 Cb -0.08 -2.56 -0.00 0.00 0.00 0.00 0.00 36.38 33.74 3ddn s VAL 70 CO -0.06 0.43 -0.12 0.00 0.00 0.00 0.00 175.10 175.35 3ddn s ALA 71 N 1.34 2.60 -0.33 5.51 0.00 0.58 -1.15 121.76 130.31 3ddn s ALA 71 Ca 0.04 -1.06 -0.12 0.00 0.00 0.00 0.00 51.96 50.82 3ddn s ALA 71 Cb -0.14 -1.36 -0.02 0.00 0.00 0.00 0.00 23.12 21.61 3ddn s ALA 71 CO -0.02 -0.12 0.21 0.50 0.00 0.00 0.00 175.76 176.33 3ddn s ARG 72 N 0.96 3.46 -1.27 0.00 3.00 -0.39 -1.18 118.95 123.52 3ddn s ARG 72 Ca -0.02 -0.66 -0.19 0.00 -1.00 0.00 0.00 55.73 53.87 3ddn s ARG 72 Cb -0.15 -3.72 0.07 0.00 0.00 0.00 0.00 34.95 31.15 3ddn s ARG 72 CO -0.01 -0.43 1.71 0.00 0.00 0.00 0.00 175.30 176.57 3ddn s ALA 73 N 1.69 3.24 0.00 6.12 0.00 0.01 -3.14 121.76 129.68 3ddn s ALA 73 Ca 0.06 -2.85 0.00 0.00 0.00 0.00 0.00 51.96 49.17 3ddn s ALA 73 Cb -0.17 -4.64 0.00 0.00 0.00 0.00 0.00 23.12 18.31 3ddn s ALA 73 CO 0.09 -3.35 0.00 0.41 0.00 0.00 0.00 175.76 172.91 3ddn n GLY 74 N 5.55 -1.25 0.15 0.00 0.00 -1.26 -4.78 105.19 103.60 3ddn n GLY 74 Ca 0.47 -1.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.24 3ddn n GLY 74 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ddn n VAL 75 N 6.23 1.26 -1.26 1.61 0.31 -1.26 -0.06 118.33 125.15 3ddn n VAL 75 Ca 0.00 -0.44 -0.31 0.00 -0.01 0.00 0.00 64.34 63.57 3ddn n VAL 75 Cb 0.00 -1.40 0.10 0.00 -0.91 0.00 0.00 33.84 31.63 3ddn n VAL 75 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 3ddn s GLY 76 N -5.96 1.79 -0.06 2.92 0.00 -1.26 -4.87 107.32 99.88 3ddn s GLY 76 Ca -0.30 0.39 0.10 0.00 0.00 0.00 0.00 44.72 44.91 3ddn s GLY 76 CO 0.48 0.76 1.08 1.04 0.00 0.00 0.00 173.10 176.46 3ddn n LEU 77 N -3.41 1.13 0.09 0.66 4.77 -1.26 -4.86 117.00 114.12 3ddn n LEU 77 Ca 0.10 -2.03 0.09 0.00 -0.03 0.00 0.00 56.01 54.14 3ddn n LEU 77 Cb 0.53 -0.20 0.56 0.00 -2.33 0.00 0.00 43.42 41.97 3ddn n LEU 77 CO 0.52 0.50 1.13 0.44 -1.33 0.00 0.00 177.39 178.65 3ddn h ASP 78 N 0.10 0.21 -0.19 -1.43 3.32 -1.98 -2.57 116.42 113.87 3ddn h ASP 78 Ca -0.01 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3ddn h ASP 78 Cb 1.25 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3ddn h ASP 78 CO 0.01 0.14 0.00 -0.46 -1.72 0.00 0.00 179.24 177.21 3ddn n ASN 79 N -4.49 1.98 -4.14 6.45 6.94 -1.26 -4.79 115.26 115.95 3ddn n ASN 79 Ca 0.03 -1.75 -0.30 0.00 -0.02 0.00 0.00 54.58 52.54 3ddn n ASN 79 Cb 0.20 -0.12 -0.17 0.00 -2.36 0.00 0.00 39.78 37.34 3ddn n ASN 79 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3ddn s VAL 80 N -1.76 1.74 -1.02 3.53 1.01 -0.97 0.32 120.40 123.25 3ddn s VAL 80 Ca 0.33 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 61.27 3ddn s VAL 80 Cb 0.18 -1.53 0.06 0.00 0.00 0.00 0.00 36.38 35.10 3ddn s VAL 80 CO 0.28 0.49 1.42 -0.62 0.00 0.00 0.00 175.10 176.67 3ddn s ASP 81 N 0.54 6.53 0.47 3.32 3.68 -0.80 -4.85 116.67 125.55 3ddn s ASP 81 Ca -0.16 -1.58 0.24 0.00 2.13 0.00 0.00 52.55 53.19 3ddn s ASP 81 Cb -0.17 -2.55 1.15 0.00 -1.45 0.00 0.00 42.92 39.91 3ddn s ASP 81 CO 0.06 -1.44 1.95 0.58 0.13 0.00 0.00 175.17 176.45 3ddn h VAL 82 N 6.62 0.68 -0.08 1.11 2.07 -1.89 -2.23 116.25 122.54 3ddn h VAL 82 Ca 0.21 -0.86 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 3ddn h VAL 82 Cb 1.00 1.55 -0.00 0.00 -1.52 0.00 0.00 31.29 32.32 3ddn h VAL 82 CO 1.39 0.20 -0.07 0.44 0.02 0.00 0.00 177.57 179.55 3ddn h ASP 83 N 0.00 0.20 -0.95 0.57 3.45 -1.94 -1.14 116.42 116.62 3ddn h ASP 83 Ca -0.00 -0.47 0.02 0.00 0.43 0.00 0.00 57.03 57.00 3ddn h ASP 83 Cb 0.53 -0.06 -0.05 0.00 -0.56 0.00 0.00 39.33 39.20 3ddn h ASP 83 CO 0.03 0.63 0.63 0.00 -1.57 0.00 0.00 179.24 178.95 3ddn h ALA 84 N 0.57 1.34 -0.45 3.45 0.00 -1.92 0.29 119.26 122.55 3ddn h ALA 84 Ca 0.01 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 3ddn h ALA 84 Cb 0.57 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3ddn h ALA 84 CO 0.02 0.60 0.09 0.00 0.00 0.00 0.00 179.25 179.96 3ddn h ALA 85 N 1.42 0.59 -0.39 0.00 0.00 -1.26 -1.44 119.26 118.17 3ddn h ALA 85 Ca 0.35 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3ddn h ALA 85 Cb -0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3ddn h ALA 85 CO -0.08 0.30 0.14 1.15 0.00 0.00 0.00 179.25 180.75 3ddn h THR 86 N 0.60 1.20 -0.91 0.00 2.02 -0.84 0.51 112.91 115.48 3ddn h THR 86 Ca 0.14 -0.65 0.23 0.00 0.77 0.00 0.00 66.41 66.89 3ddn h THR 86 Cb 0.35 0.89 -0.06 0.00 -1.74 0.00 0.00 68.15 67.60 3ddn h THR 86 CO 0.01 0.23 0.62 0.00 0.37 0.00 0.00 175.52 176.74 3ddn h ALA 87 N 0.99 2.39 -0.51 6.16 0.00 -0.07 -0.14 119.26 128.09 3ddn h ALA 87 Ca 0.13 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ddn h ALA 87 Cb 0.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3ddn h ALA 87 CO -0.01 -0.68 0.00 0.54 0.00 0.00 0.00 179.25 179.10 3ddn n ARG 88 N -4.45 3.41 -1.60 0.00 1.74 -0.58 -4.96 116.66 110.21 3ddn n ARG 88 Ca 0.20 -2.71 -0.08 0.00 -0.77 0.00 0.00 57.85 54.49 3ddn n ARG 88 Cb 0.79 -1.75 -0.02 0.00 -1.02 0.00 0.00 32.46 30.46 3ddn n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ddn n GLY 89 N 0.67 0.62 3.57 -0.13 0.00 -0.06 -4.95 105.19 104.90 3ddn n GLY 89 Ca 0.22 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 3ddn n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ddn s VAL 90 N -2.34 5.19 0.09 1.61 1.01 0.17 -2.76 120.40 123.38 3ddn s VAL 90 Ca 0.00 0.21 -0.31 0.00 0.00 0.00 0.00 61.98 61.88 3ddn s VAL 90 Cb 0.00 -3.74 -0.09 0.00 0.00 0.00 0.00 36.38 32.54 3ddn s VAL 90 CO 0.00 0.03 1.79 -0.22 0.00 0.00 0.00 175.10 176.70 3ddn s LEU 91 N 1.99 4.39 -0.13 3.92 2.96 -0.76 -3.99 118.68 127.06 3ddn s LEU 91 Ca 0.12 2.65 -0.04 0.00 -0.22 0.00 0.00 54.13 56.64 3ddn s LEU 91 Cb -0.16 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 3ddn s LEU 91 CO 0.11 -0.97 0.03 -0.69 -1.32 0.00 0.00 176.35 173.51 3ddn s VAL 92 N 2.95 4.58 0.05 1.68 1.01 -1.26 -0.68 120.40 128.73 3ddn s VAL 92 Ca 0.79 -0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.68 3ddn s VAL 92 Cb -0.43 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 3ddn s VAL 92 CO 0.35 0.55 -0.12 0.54 0.00 0.00 0.00 175.10 176.43 3ddn s VAL 93 N -0.40 0.89 0.00 2.92 0.11 -0.30 -0.51 120.40 123.10 3ddn s VAL 93 Ca 0.09 -1.14 0.00 0.00 -2.93 0.00 0.00 61.98 57.99 3ddn s VAL 93 Cb -0.12 -0.87 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 3ddn s VAL 93 CO 0.02 -0.23 0.00 -0.46 -3.33 0.00 0.00 175.10 171.10 3ddn n ASN 94 N 1.50 1.66 -3.91 3.54 0.23 -1.24 -1.26 115.26 115.77 3ddn n ASN 94 Ca -0.21 -0.74 -0.29 0.00 -0.53 0.00 0.00 54.58 52.82 3ddn n ASN 94 Cb 0.55 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.12 3ddn n ASN 94 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3ddn s ALA 95 N -2.00 3.68 0.18 -2.53 0.00 0.91 -4.67 121.76 117.33 3ddn s ALA 95 Ca 0.00 -3.69 0.31 0.00 0.00 0.00 0.00 51.96 48.58 3ddn s ALA 95 Cb 0.00 -2.17 1.30 0.00 0.00 0.00 0.00 23.12 22.25 3ddn s ALA 95 CO 0.00 -2.08 1.97 -1.00 0.00 0.00 0.00 175.76 174.65 3ddn h PRO 96 N 5.70 0.00 -0.10 0.00 0.13 -1.92 -2.78 132.00 133.03 3ddn h PRO 96 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3ddn h PRO 96 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 3ddn h PRO 96 CO 0.71 0.08 0.00 0.25 -0.23 0.00 0.00 178.00 178.81 3ddn n THR 97 N -3.25 1.49 0.11 1.56 -2.24 -1.26 -4.74 114.28 105.95 3ddn n THR 97 Ca -0.00 -1.54 -0.02 0.00 -2.27 0.00 0.00 64.05 60.21 3ddn n THR 97 Cb 0.32 0.15 0.05 0.00 -2.10 0.00 0.00 70.33 68.74 3ddn n THR 97 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3ddn h SER 98 N 0.63 0.00 -0.28 3.42 4.64 -1.85 -3.21 113.55 116.91 3ddn h SER 98 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ddn h SER 98 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 3ddn h SER 98 CO 0.04 0.74 0.00 -0.46 -0.87 0.00 0.00 176.83 176.28 3ddn n ASN 99 N -3.50 2.87 -0.14 4.97 6.94 -1.26 -4.62 115.26 120.52 3ddn n ASN 99 Ca -0.00 -1.91 -0.09 0.00 -0.02 0.00 0.00 54.58 52.56 3ddn n ASN 99 Cb 0.76 -0.18 -0.01 0.00 -2.36 0.00 0.00 39.78 37.99 3ddn n ASN 99 CO 0.00 0.00 0.00 0.16 -1.03 0.00 0.00 177.26 176.39 3ddn h ILE 100 N 3.84 1.22 -0.53 1.53 3.07 -1.89 -0.24 117.51 124.51 3ddn h ILE 100 Ca 0.00 -0.74 -0.10 0.00 1.55 0.00 0.00 64.86 65.57 3ddn h ILE 100 Cb 0.84 0.93 -0.02 0.00 -0.27 0.00 0.00 36.82 38.30 3ddn h ILE 100 CO 0.00 0.26 -0.06 0.45 -1.05 0.00 0.00 178.15 177.74 3ddn h HIS 101 N 0.51 1.08 -0.25 0.16 3.86 -1.85 -0.82 115.15 117.85 3ddn h HIS 101 Ca 0.13 -0.21 -0.11 0.00 -1.16 0.00 0.00 60.37 59.02 3ddn h HIS 101 Cb 0.28 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 3ddn h HIS 101 CO 0.01 1.00 -0.30 0.77 0.86 0.00 0.00 177.93 180.28 3ddn h SER 102 N 0.84 0.51 -0.08 2.45 0.02 -1.77 -1.11 113.55 114.41 3ddn h SER 102 Ca 0.14 -0.19 -0.09 0.00 -0.84 0.00 0.00 61.79 60.81 3ddn h SER 102 Cb 0.62 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.02 3ddn h SER 102 CO 0.04 0.79 -0.30 0.00 -1.14 0.00 0.00 176.83 176.21 3ddn h ALA 103 N 1.25 0.15 -0.40 3.77 0.00 -0.74 -1.64 119.26 121.64 3ddn h ALA 103 Ca 0.06 -0.43 0.07 0.00 0.00 0.00 0.00 54.91 54.60 3ddn h ALA 103 Cb 0.74 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.46 3ddn h ALA 103 CO 0.06 0.18 0.05 0.00 0.00 0.00 0.00 179.25 179.54 3ddn h ALA 104 N 0.45 0.40 -0.51 0.00 0.00 -1.10 -0.35 119.26 118.16 3ddn h ALA 104 Ca -0.01 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3ddn h ALA 104 Cb 0.94 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3ddn h ALA 104 CO 0.06 -0.35 0.14 0.93 0.00 0.00 0.00 179.25 180.03 3ddn h GLU 105 N 0.17 0.76 -0.04 0.00 5.08 -1.22 -1.29 114.58 118.03 3ddn h GLU 105 Ca 0.19 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.27 3ddn h GLU 105 Cb 0.25 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3ddn h GLU 105 CO -0.28 0.68 -0.60 1.25 -1.00 0.00 0.00 179.01 179.06 3ddn h HIS 106 N 0.74 0.19 -0.07 4.33 2.76 -0.82 0.30 115.15 122.58 3ddn h HIS 106 Ca 0.17 -0.07 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 3ddn h HIS 106 Cb 0.25 -0.03 -0.00 0.00 1.55 0.00 0.00 27.41 29.18 3ddn h HIS 106 CO 0.01 0.71 0.02 0.00 -1.30 0.00 0.00 177.93 177.37 3ddn h ALA 107 N 1.27 0.09 -0.56 5.26 0.00 -0.40 -0.31 119.26 124.61 3ddn h ALA 107 Ca -0.01 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.80 3ddn h ALA 107 Cb 1.08 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3ddn h ALA 107 CO 0.09 -0.29 0.35 -0.07 0.00 0.00 0.00 179.25 179.33 3ddn h LEU 108 N -0.09 0.59 -0.39 0.00 -0.00 -1.09 0.13 115.31 114.47 3ddn h LEU 108 Ca 0.02 -0.00 0.08 0.00 -0.00 0.00 0.00 57.88 57.98 3ddn h LEU 108 Cb 0.23 -0.13 -0.08 0.00 -0.00 0.00 0.00 40.66 40.68 3ddn h LEU 108 CO -0.00 0.42 -0.12 0.00 -0.00 0.00 0.00 178.44 178.74 3ddn h ALA 109 N 1.23 0.23 -0.28 1.53 0.00 -0.17 -1.19 119.26 120.61 3ddn h ALA 109 Ca 0.22 0.15 -0.06 0.00 0.00 0.00 0.00 54.91 55.22 3ddn h ALA 109 Cb -0.02 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3ddn h ALA 109 CO -0.08 -0.47 -0.07 -0.07 0.00 0.00 0.00 179.25 178.55 3ddn h LEU 110 N -0.03 0.42 -0.25 0.00 4.07 -0.56 0.04 115.31 118.99 3ddn h LEU 110 Ca 0.19 -0.09 -0.10 0.00 0.08 0.00 0.00 57.88 57.96 3ddn h LEU 110 Cb 0.32 -0.11 -0.00 0.00 1.08 0.00 0.00 40.66 41.94 3ddn h LEU 110 CO -0.42 0.54 -0.22 0.25 -1.08 0.00 0.00 178.44 177.52 3ddn h LEU 111 N 0.42 0.63 -0.39 1.67 6.46 -0.10 -2.11 115.31 121.88 3ddn h LEU 111 Ca 0.09 -0.46 -0.14 0.00 -0.12 0.00 0.00 57.88 57.25 3ddn h LEU 111 Cb 0.39 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.14 3ddn h LEU 111 CO 0.02 0.96 -0.30 -0.07 -0.62 0.00 0.00 178.44 178.42 3ddn h LEU 112 N 0.31 0.95 -1.65 2.25 3.38 -1.15 -0.82 115.31 118.57 3ddn h LEU 112 Ca 0.05 -0.44 -0.04 0.00 0.09 0.00 0.00 57.88 57.53 3ddn h LEU 112 Cb 0.76 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3ddn h LEU 112 CO 0.06 1.19 -0.19 0.00 0.09 0.00 0.00 178.44 179.58 3ddn h ALA 113 N 0.79 1.58 0.14 1.53 0.00 -0.96 -1.39 119.26 120.96 3ddn h ALA 113 Ca 0.07 -0.17 -0.26 0.00 0.00 0.00 0.00 54.91 54.55 3ddn h ALA 113 Cb 0.89 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.65 3ddn h ALA 113 CO 0.08 0.24 -1.28 0.00 0.00 0.00 0.00 179.25 178.29 3ddn h ALA 114 N 1.81 0.07 -0.10 0.00 0.00 -1.25 -0.85 119.26 118.94 3ddn h ALA 114 Ca -0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 54.91 53.94 3ddn h ALA 114 Cb 0.36 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3ddn h ALA 114 CO 0.02 0.71 0.03 0.77 0.00 0.00 0.00 179.25 180.78 3ddn h SER 115 N -0.25 0.12 -0.11 0.00 0.02 -0.92 -3.08 113.55 109.32 3ddn h SER 115 Ca -0.26 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 3ddn h SER 115 Cb 1.79 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 64.30 3ddn h SER 115 CO 0.11 0.12 0.00 0.54 -1.14 0.00 0.00 176.83 176.47 3ddn n ARG 116 N -4.48 2.82 -3.29 3.45 5.12 -0.54 -1.50 116.66 118.23 3ddn n ARG 116 Ca -0.01 -1.80 -0.24 0.00 -1.93 0.00 0.00 57.85 53.87 3ddn n ARG 116 Cb 0.11 -1.15 0.02 0.00 -1.16 0.00 0.00 32.46 30.28 3ddn n ARG 116 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3ddn n GLN 117 N -0.29 -4.40 -0.09 5.56 6.02 -0.41 -4.87 117.38 118.91 3ddn n GLN 117 Ca 0.05 0.68 -0.07 0.00 -0.01 0.00 0.00 57.00 57.65 3ddn n GLN 117 Cb 0.36 -5.48 -0.01 0.00 1.02 0.00 0.00 30.24 26.13 3ddn n GLN 117 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 3ddn h ILE 118 N -1.32 0.32 -0.05 5.09 5.03 -1.63 -1.73 117.51 123.22 3ddn h ILE 118 Ca -0.49 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 64.27 3ddn h ILE 118 Cb 1.33 0.32 -0.03 0.00 -3.03 0.00 0.00 36.82 35.42 3ddn h ILE 118 CO 0.56 0.00 -0.09 -0.65 -0.68 0.00 0.00 178.15 177.29 3ddn h PRO 119 N -0.24 -0.13 -0.50 2.37 0.11 -1.90 0.15 132.00 131.87 3ddn h PRO 119 Ca 0.16 0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.34 3ddn h PRO 119 Cb 0.49 0.03 -0.05 0.00 0.11 0.00 0.00 31.00 31.58 3ddn h PRO 119 CO -0.47 -0.08 0.20 0.00 -0.21 0.00 0.00 178.00 177.44 3ddn h ALA 120 N 0.89 0.62 -0.36 -0.75 0.00 -1.86 0.11 119.26 117.92 3ddn h ALA 120 Ca 0.05 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3ddn h ALA 120 Cb 0.20 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3ddn h ALA 120 CO -0.13 -0.18 0.17 0.00 0.00 0.00 0.00 179.25 179.11 3ddn h ALA 121 N 1.31 0.46 -0.74 0.00 0.00 -0.92 -0.10 119.26 119.28 3ddn h ALA 121 Ca 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3ddn h ALA 121 Cb 0.22 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 3ddn h ALA 121 CO -0.22 0.03 0.45 0.22 0.00 0.00 0.00 179.25 179.74 3ddn h ASP 122 N 0.44 0.87 -0.59 0.00 1.82 -0.25 -2.37 116.42 116.34 3ddn h ASP 122 Ca 0.12 -0.04 -0.06 0.00 -0.39 0.00 0.00 57.03 56.66 3ddn h ASP 122 Cb 0.13 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 39.90 3ddn h ASP 122 CO -0.01 0.67 0.15 0.00 -1.61 0.00 0.00 179.24 178.43 3ddn h ALA 123 N 1.49 0.78 -0.71 -0.78 0.00 0.00 -1.83 119.26 118.21 3ddn h ALA 123 Ca 0.27 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3ddn h ALA 123 Cb -0.05 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 3ddn h ALA 123 CO -0.05 0.48 0.40 0.66 0.00 0.00 0.00 179.25 180.74 3ddn h SER 124 N 0.85 0.88 1.03 0.00 4.64 -0.53 -0.25 113.55 120.17 3ddn h SER 124 Ca 0.19 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 61.39 3ddn h SER 124 Cb 0.34 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3ddn h SER 124 CO 0.00 0.72 -0.12 -0.07 -0.87 0.00 0.00 176.83 176.49 3ddn h LEU 125 N 0.98 0.00 0.00 5.97 3.38 -1.37 -2.01 115.31 122.26 3ddn h LEU 125 Ca 0.25 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.10 3ddn h LEU 125 Cb 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3ddn h LEU 125 CO -0.04 0.12 -0.62 -0.09 0.09 0.00 0.00 178.44 177.90 3ddn h ARG 126 N 0.00 0.00 -0.68 1.13 9.65 -0.40 -2.47 114.38 121.60 3ddn h ARG 126 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3ddn h ARG 126 Cb 0.66 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.24 3ddn h ARG 126 CO 0.02 0.58 0.00 0.39 2.80 0.00 0.00 179.97 183.76 3ddn n GLU 127 N -3.24 2.95 -3.77 0.20 1.02 -0.20 -4.93 120.64 112.67 3ddn n GLU 127 Ca 0.01 -1.75 -0.25 0.00 -0.02 0.00 0.00 57.16 55.15 3ddn n GLU 127 Cb 0.77 -1.80 0.04 0.00 -0.02 0.00 0.00 31.44 30.43 3ddn n GLU 127 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3ddn n HIS 128 N 0.46 -2.16 -4.19 -0.32 8.25 -0.93 -4.99 115.22 111.35 3ddn n HIS 128 Ca 0.16 0.88 -0.11 0.00 -0.26 0.00 0.00 57.72 58.39 3ddn n HIS 128 Cb 0.69 -4.31 -0.10 0.00 1.12 0.00 0.00 29.99 27.39 3ddn n HIS 128 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3ddn s THR 129 N -3.48 0.33 -0.46 1.59 2.01 -0.79 -5.03 115.64 109.80 3ddn s THR 129 Ca 0.31 -1.94 0.04 0.00 0.31 0.00 0.00 61.69 60.42 3ddn s THR 129 Cb -0.15 -2.08 0.12 0.00 0.01 0.00 0.00 72.50 70.40 3ddn s THR 129 CO 0.81 -0.47 0.19 0.86 -0.69 0.00 0.00 174.62 175.32 3ddn s TRP 130 N -3.90 3.37 -0.53 4.92 -0.11 -1.26 -3.65 118.94 117.78 3ddn s TRP 130 Ca 0.24 -3.11 0.02 0.00 1.22 0.00 0.00 56.10 54.47 3ddn s TRP 130 Cb 0.07 -2.85 0.43 0.00 -1.50 0.00 0.00 33.47 29.62 3ddn s TRP 130 CO 0.03 -0.81 1.55 1.63 -4.62 0.00 0.00 176.95 174.73 3ddn n LYS 131 N 3.49 3.17 -0.35 5.86 4.01 -1.26 -4.76 118.16 128.31 3ddn n LYS 131 Ca 0.05 -3.89 0.08 0.00 -0.51 0.00 0.00 58.31 54.03 3ddn n LYS 131 Cb 0.35 -2.27 0.25 0.00 -0.51 0.00 0.00 35.03 32.85 3ddn n LYS 131 CO 0.00 0.00 0.00 -0.09 -1.11 0.00 0.00 177.40 176.20 3ddn h ARG 132 N 2.38 0.88 0.00 1.97 2.43 -1.97 -1.29 114.38 118.78 3ddn h ARG 132 Ca 0.45 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.57 3ddn h ARG 132 Cb 0.92 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 3ddn h ARG 132 CO 1.13 0.58 0.00 0.66 -1.51 0.00 0.00 179.97 180.83 3ddn h SER 133 N 0.91 0.00 0.89 -3.80 4.64 -2.05 -2.96 113.55 111.18 3ddn h SER 133 Ca 0.50 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.61 3ddn h SER 133 Cb 0.57 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.64 3ddn h SER 133 CO -0.29 0.00 -1.00 0.28 -0.87 0.00 0.00 176.83 174.94 3ddn h SER 134 N 0.00 0.09 -3.53 4.97 0.02 -1.62 -3.46 113.55 110.01 3ddn h SER 134 Ca 0.00 -0.09 -0.51 0.00 -0.84 0.00 0.00 61.79 60.35 3ddn h SER 134 Cb 0.22 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 3ddn h SER 134 CO 0.00 1.03 -0.02 -0.36 -1.14 0.00 0.00 176.83 176.34 3ddn s PHE 135 N -2.80 3.43 -0.22 3.45 0.40 -1.12 -5.08 117.98 116.04 3ddn s PHE 135 Ca -0.00 0.96 -0.05 0.00 -0.60 0.00 0.00 56.93 57.24 3ddn s PHE 135 Cb 0.10 -2.34 0.11 0.00 0.51 0.00 0.00 43.02 41.39 3ddn s PHE 135 CO 0.83 0.14 0.39 0.45 0.70 0.00 0.00 175.22 177.72 3ddn s SER 136 N -2.60 0.01 0.67 1.36 0.15 -1.26 -5.07 113.70 106.95 3ddn s SER 136 Ca 0.49 0.60 0.02 0.00 0.70 0.00 0.00 55.95 57.77 3ddn s SER 136 Cb -0.11 1.20 0.12 0.00 -1.71 0.00 0.00 66.02 65.53 3ddn s SER 136 CO 0.23 -0.26 0.87 0.61 1.20 0.00 0.00 173.24 175.89 3ddn n GLY 137 N 5.38 0.99 3.09 9.45 0.00 -1.26 -4.94 105.19 117.89 3ddn n GLY 137 Ca -0.06 -2.07 -0.25 0.00 0.00 0.00 0.00 46.02 43.64 3ddn n GLY 137 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ddn s THR 138 N -2.69 1.28 -0.01 2.61 2.01 -0.57 -5.00 115.64 113.27 3ddn s THR 138 Ca 0.60 -0.61 -0.17 0.00 0.31 0.00 0.00 61.69 61.81 3ddn s THR 138 Cb -0.04 -1.12 -0.06 0.00 0.01 0.00 0.00 72.50 71.30 3ddn s THR 138 CO 0.39 0.38 0.49 -0.70 -0.69 0.00 0.00 174.62 174.49 3ddn s GLU 139 N 0.24 4.15 0.04 4.92 2.12 -1.26 -4.76 118.70 124.14 3ddn s GLU 139 Ca -0.07 0.54 0.02 0.00 0.36 0.00 0.00 54.97 55.82 3ddn s GLU 139 Cb -0.12 -3.30 -0.25 0.00 0.26 0.00 0.00 34.13 30.72 3ddn s GLU 139 CO 0.03 0.50 0.97 0.82 -0.54 0.00 0.00 175.26 177.04 3ddn h ILE 140 N 3.98 1.30 -1.88 -3.70 2.04 -2.00 -3.45 117.51 113.80 3ddn h ILE 140 Ca -0.48 -2.98 -0.65 0.00 1.00 0.00 0.00 64.86 61.75 3ddn h ILE 140 Cb 1.21 2.75 0.05 0.00 -0.74 0.00 0.00 36.82 40.09 3ddn h ILE 140 CO 0.67 0.82 0.66 0.33 0.00 0.00 0.00 178.15 180.63 3ddn n PHE 141 N -3.37 1.88 -0.03 1.37 7.35 -1.25 -1.38 117.46 122.02 3ddn n PHE 141 Ca -0.11 0.46 0.00 0.00 -0.76 0.00 0.00 57.45 57.04 3ddn n PHE 141 Cb 1.02 -2.44 0.00 0.00 0.35 0.00 0.00 39.48 38.41 3ddn n PHE 141 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3ddn n GLY 142 N 3.13 2.03 3.89 7.13 0.00 0.81 -4.93 105.19 117.26 3ddn n GLY 142 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 3ddn n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ddn s LYS 143 N -0.30 2.85 -0.17 1.61 -0.14 -0.48 -4.66 119.74 118.45 3ddn s LYS 143 Ca 0.00 0.33 -0.11 0.00 -1.36 0.00 0.00 55.97 54.83 3ddn s LYS 143 Cb 0.00 -2.08 -0.05 0.00 -1.68 0.00 0.00 37.83 34.02 3ddn s LYS 143 CO 0.00 -0.96 0.21 0.99 -0.76 0.00 0.00 175.35 174.82 3ddn s THR 144 N -3.27 5.36 -0.17 2.17 2.01 -1.26 -0.21 115.64 120.27 3ddn s THR 144 Ca 0.57 0.36 -0.00 0.00 0.31 0.00 0.00 61.69 62.93 3ddn s THR 144 Cb -0.11 -3.54 0.00 0.00 0.01 0.00 0.00 72.50 68.86 3ddn s THR 144 CO 0.50 0.44 -0.14 -0.69 -0.69 0.00 0.00 174.62 174.04 3ddn s VAL 145 N 0.20 2.68 -0.29 3.82 1.01 0.16 -0.79 120.40 127.19 3ddn s VAL 145 Ca 0.13 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 61.20 3ddn s VAL 145 Cb -0.12 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 3ddn s VAL 145 CO 0.02 0.50 0.39 -0.83 0.00 0.00 0.00 175.10 175.17 3ddn s GLY 146 N 1.04 1.88 -0.36 4.51 0.00 0.15 -1.26 107.32 113.28 3ddn s GLY 146 Ca -0.01 -0.88 -0.13 0.00 0.00 0.00 0.00 44.72 43.69 3ddn s GLY 146 CO -0.03 1.01 0.26 0.14 0.00 0.00 0.00 173.10 174.47 3ddn s VAL 147 N 2.09 5.28 -0.63 1.40 1.01 0.25 -0.87 120.40 128.93 3ddn s VAL 147 Ca 0.15 -0.34 -0.17 0.00 0.00 0.00 0.00 61.98 61.61 3ddn s VAL 147 Cb -0.16 -3.78 0.13 0.00 0.00 0.00 0.00 36.38 32.57 3ddn s VAL 147 CO 0.10 -0.10 0.68 -0.69 0.00 0.00 0.00 175.10 175.10 3ddn s VAL 148 N 1.71 5.04 0.00 2.92 1.01 -0.07 -1.63 120.40 129.37 3ddn s VAL 148 Ca 0.06 -1.38 0.00 0.00 0.00 0.00 0.00 61.98 60.65 3ddn s VAL 148 Cb -0.18 -4.46 0.00 0.00 0.00 0.00 0.00 36.38 31.74 3ddn s VAL 148 CO 0.10 -1.07 0.00 0.61 0.00 0.00 0.00 175.10 174.75 3ddn n GLY 149 N 5.11 1.26 2.46 4.51 0.00 0.12 0.54 105.19 119.18 3ddn n GLY 149 Ca -0.05 -1.10 -0.29 0.00 0.00 0.00 0.00 46.02 44.58 3ddn n GLY 149 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ddn n LEU 150 N 0.00 5.37 0.00 0.99 4.77 -1.26 -4.36 117.00 122.50 3ddn n LEU 150 Ca 0.00 -5.02 0.00 0.00 -0.03 0.00 0.00 56.01 50.96 3ddn n LEU 150 Cb 0.00 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 3ddn n LEU 150 CO 0.00 2.10 0.00 0.61 -1.33 0.00 0.00 177.39 178.77 3ddn n GLY 151 N -0.56 -1.74 0.28 -0.72 0.00 -1.26 -4.64 105.19 96.56 3ddn n GLY 151 Ca 0.44 -1.55 -0.06 0.00 0.00 0.00 0.00 46.02 44.85 3ddn n GLY 151 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3ddn h ARG 152 N 0.00 -0.18 -0.24 1.61 9.65 -1.94 -0.57 114.38 122.70 3ddn h ARG 152 Ca 0.00 0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 58.82 3ddn h ARG 152 Cb 0.00 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.61 3ddn h ARG 152 CO 0.00 -0.12 -0.11 0.82 2.80 0.00 0.00 179.97 183.36 3ddn h ILE 153 N -0.18 1.30 -0.10 1.20 2.04 -1.92 -2.00 117.51 117.84 3ddn h ILE 153 Ca 0.18 -1.18 0.03 0.00 1.00 0.00 0.00 64.86 64.89 3ddn h ILE 153 Cb 0.47 1.55 -0.00 0.00 -0.74 0.00 0.00 36.82 38.10 3ddn h ILE 153 CO -0.48 0.37 0.08 1.23 0.00 0.00 0.00 178.15 179.34 3ddn h GLY 154 N 0.23 0.00 1.21 5.37 0.00 -1.70 -0.42 103.07 107.76 3ddn h GLY 154 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.20 3ddn h GLY 154 CO 0.03 0.00 -0.56 1.46 0.00 0.00 0.00 176.54 177.47 3ddn h GLN 155 N 0.00 0.83 -0.29 4.80 4.20 -0.66 -1.98 115.11 122.02 3ddn h GLN 155 Ca 0.05 -0.53 -0.16 0.00 0.06 0.00 0.00 58.65 58.07 3ddn h GLN 155 Cb 0.20 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 3ddn h GLN 155 CO -0.00 1.16 -0.47 -0.07 -0.67 0.00 0.00 178.83 178.79 3ddn h LEU 156 N 0.63 0.82 -0.46 1.46 3.38 -0.41 -1.81 115.31 118.92 3ddn h LEU 156 Ca 0.01 -0.40 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 3ddn h LEU 156 Cb 1.16 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 3ddn h LEU 156 CO 0.12 1.15 0.17 0.58 0.09 0.00 0.00 178.44 180.56 3ddn h VAL 157 N 0.60 1.21 -0.78 1.22 2.07 -1.17 -1.25 116.25 118.16 3ddn h VAL 157 Ca 0.03 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 66.89 3ddn h VAL 157 Cb 1.03 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.55 3ddn h VAL 157 CO 0.10 0.25 0.51 0.00 0.02 0.00 0.00 177.57 178.45 3ddn h ALA 158 N 1.02 0.99 -0.54 1.67 0.00 -1.19 0.82 119.26 122.04 3ddn h ALA 158 Ca 0.15 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3ddn h ALA 158 Cb 0.22 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3ddn h ALA 158 CO -0.01 0.37 0.23 1.96 0.00 0.00 0.00 179.25 181.80 3ddn h GLN 159 N 1.03 0.80 -0.29 0.00 4.20 -0.93 -0.76 115.11 119.16 3ddn h GLN 159 Ca 0.29 -0.14 -0.12 0.00 0.06 0.00 0.00 58.65 58.74 3ddn h GLN 159 Cb -0.09 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.56 3ddn h GLN 159 CO -0.08 0.69 -0.30 0.00 -0.67 0.00 0.00 178.83 178.48 3ddn h ARG 160 N 0.73 0.72 0.00 1.46 3.08 -1.01 -3.21 114.38 116.15 3ddn h ARG 160 Ca 0.18 -0.38 -0.08 0.00 0.07 0.00 0.00 59.98 59.77 3ddn h ARG 160 Cb 0.18 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 3ddn h ARG 160 CO -0.02 1.00 -0.39 0.97 -1.07 0.00 0.00 179.97 180.46 3ddn h ILE 161 N 0.47 1.13 0.00 2.04 6.09 -0.76 -2.88 117.51 123.60 3ddn h ILE 161 Ca 0.05 -1.41 -0.08 0.00 -1.37 0.00 0.00 64.86 62.04 3ddn h ILE 161 Cb 0.87 1.79 -0.01 0.00 0.47 0.00 0.00 36.82 39.94 3ddn h ILE 161 CO 0.07 0.38 -0.38 0.00 -3.07 0.00 0.00 178.15 175.16 3ddn h ALA 162 N 1.61 1.22 0.00 0.18 0.00 -1.14 -1.20 119.26 119.93 3ddn h ALA 162 Ca -0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3ddn h ALA 162 Cb 0.76 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3ddn h ALA 162 CO 0.05 0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.78 3ddn n ALA 163 N -2.40 1.93 1.79 0.00 0.00 -1.09 -1.70 120.51 119.04 3ddn n ALA 163 Ca -0.01 -0.01 0.15 0.00 0.00 0.00 0.00 53.44 53.57 3ddn n ALA 163 Cb 0.44 -1.39 0.82 0.00 0.00 0.00 0.00 19.45 19.33 3ddn n ALA 163 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3ddn n PHE 164 N -1.94 0.00 -0.64 0.00 3.72 -0.45 -4.89 117.46 113.25 3ddn n PHE 164 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 3ddn n PHE 164 Cb 0.28 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.77 3ddn n PHE 164 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ddn n GLY 165 N 1.09 0.61 3.87 1.37 0.00 -0.69 -3.92 105.19 107.51 3ddn n GLY 165 Ca 0.21 -0.66 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 3ddn n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ddn s ALA 166 N -2.00 3.54 0.01 4.61 0.00 -1.23 -0.13 121.76 126.55 3ddn s ALA 166 Ca 0.00 -0.22 -0.23 0.00 0.00 0.00 0.00 51.96 51.51 3ddn s ALA 166 Cb 0.00 -2.49 -0.05 0.00 0.00 0.00 0.00 23.12 20.58 3ddn s ALA 166 CO 0.00 0.48 0.69 -0.47 0.00 0.00 0.00 175.76 176.46 3ddn s TYR 167 N -1.79 3.69 -0.18 0.00 5.04 0.71 -4.55 117.35 120.26 3ddn s TYR 167 Ca 0.47 1.33 -0.04 0.00 -2.44 0.00 0.00 57.07 56.39 3ddn s TYR 167 Cb -0.12 -2.74 -0.02 0.00 0.35 0.00 0.00 41.96 39.44 3ddn s TYR 167 CO 0.20 0.27 -0.03 0.08 -1.34 0.00 0.00 175.55 174.73 3ddn s VAL 168 N 0.05 3.74 0.26 3.14 1.01 -1.26 0.39 120.40 127.72 3ddn s VAL 168 Ca 0.35 -0.39 0.12 0.00 0.00 0.00 0.00 61.98 62.06 3ddn s VAL 168 Cb -0.19 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.47 3ddn s VAL 168 CO 0.20 0.46 -0.21 0.68 0.00 0.00 0.00 175.10 176.23 3ddn s VAL 169 N 0.83 2.43 0.03 2.92 -7.23 -0.39 -3.25 120.40 115.75 3ddn s VAL 169 Ca -0.01 -2.31 -0.08 0.00 -1.81 0.00 0.00 61.98 57.78 3ddn s VAL 169 Cb -0.14 -2.25 -0.00 0.00 0.56 0.00 0.00 36.38 34.54 3ddn s VAL 169 CO 0.02 -0.33 0.15 0.00 -0.31 0.00 0.00 175.10 174.63 3ddn s ALA 170 N -2.30 -0.26 -0.17 1.32 0.00 -0.53 -0.58 121.76 119.23 3ddn s ALA 170 Ca 0.27 -0.33 0.01 0.00 0.00 0.00 0.00 51.96 51.91 3ddn s ALA 170 Cb -0.06 0.23 0.01 0.00 0.00 0.00 0.00 23.12 23.31 3ddn s ALA 170 CO 0.14 -0.31 -0.18 -0.47 0.00 0.00 0.00 175.76 174.93 3ddn s TYR 171 N -2.31 2.77 -0.30 0.00 6.14 -0.65 0.41 117.35 123.42 3ddn s TYR 171 Ca -0.07 -1.41 -0.05 0.00 0.64 0.00 0.00 57.07 56.18 3ddn s TYR 171 Cb -0.03 -1.91 0.19 0.00 0.42 0.00 0.00 41.96 40.63 3ddn s TYR 171 CO -0.03 -0.68 0.88 0.34 0.64 0.00 0.00 175.55 176.69 3ddn s ASP 172 N 1.12 -0.87 0.00 4.32 -1.08 -1.26 -0.70 116.67 118.20 3ddn s ASP 172 Ca 0.01 0.14 0.03 0.00 -0.52 0.00 0.00 52.55 52.21 3ddn s ASP 172 Cb -0.14 1.57 0.18 0.00 -1.46 0.00 0.00 42.92 43.07 3ddn s ASP 172 CO -0.07 -0.16 0.90 -2.65 0.52 0.00 0.00 175.17 173.71 3ddn n PRO 173 N 5.25 0.06 -0.56 4.34 -0.02 -1.26 -2.89 135.00 139.92 3ddn n PRO 173 Ca 0.06 0.22 0.04 0.00 -2.02 0.00 0.00 63.50 61.80 3ddn n PRO 173 Cb 0.56 -1.50 0.23 0.00 -0.02 0.00 0.00 33.50 32.77 3ddn n PRO 173 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3ddn n TYR 174 N -1.25 0.96 -4.86 6.00 4.01 -1.26 -4.54 117.16 116.22 3ddn n TYR 174 Ca 0.02 -1.16 -0.26 0.00 -0.16 0.00 0.00 57.90 56.34 3ddn n TYR 174 Cb 0.03 -0.38 -0.16 0.00 -0.31 0.00 0.00 39.34 38.52 3ddn n TYR 174 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3ddn s VAL 175 N -2.99 1.46 0.56 -0.72 1.01 -1.14 -4.85 120.40 113.73 3ddn s VAL 175 Ca 0.43 -0.75 -0.20 0.00 0.00 0.00 0.00 61.98 61.46 3ddn s VAL 175 Cb 0.36 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 3ddn s VAL 175 CO 0.05 0.42 1.20 -0.94 0.00 0.00 0.00 175.10 175.83 3ddn s SER 176 N -0.06 5.43 0.40 3.32 1.04 -0.85 -4.89 113.70 118.10 3ddn s SER 176 Ca -0.02 2.37 0.14 0.00 0.48 0.00 0.00 55.95 58.92 3ddn s SER 176 Cb -0.11 -2.60 0.98 0.00 0.10 0.00 0.00 66.02 64.40 3ddn s SER 176 CO 0.02 -1.43 1.89 -0.65 0.98 0.00 0.00 173.24 174.05 3ddn h PRO 177 N 1.16 0.49 -0.19 4.02 0.11 -1.96 -1.72 132.00 133.91 3ddn h PRO 177 Ca -0.50 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 65.40 3ddn h PRO 177 Cb 1.28 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 3ddn h PRO 177 CO 0.56 0.32 -0.60 0.00 -0.21 0.00 0.00 178.00 178.08 3ddn h ALA 178 N 1.62 0.60 -0.24 -0.75 0.00 -1.97 -1.28 119.26 117.23 3ddn h ALA 178 Ca 0.41 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3ddn h ALA 178 Cb 0.87 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3ddn h ALA 178 CO -0.16 0.70 0.11 -0.09 0.00 0.00 0.00 179.25 179.81 3ddn h ARG 179 N 0.47 0.36 -0.75 0.00 9.65 -1.80 -0.26 114.38 122.05 3ddn h ARG 179 Ca -0.00 -0.06 0.01 0.00 -1.10 0.00 0.00 59.98 58.83 3ddn h ARG 179 Cb 1.17 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.65 3ddn h ARG 179 CO 0.12 0.38 0.49 0.00 2.80 0.00 0.00 179.97 183.76 3ddn h ALA 180 N 0.96 0.96 -0.76 2.80 0.00 -1.26 -1.58 119.26 120.38 3ddn h ALA 180 Ca 0.08 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3ddn h ALA 180 Cb 0.15 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3ddn h ALA 180 CO -0.01 0.35 0.28 0.00 0.00 0.00 0.00 179.25 179.87 3ddn h ALA 181 N 1.29 1.06 -0.71 0.00 0.00 -1.12 0.84 119.26 120.61 3ddn h ALA 181 Ca 0.28 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3ddn h ALA 181 Cb -0.09 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.37 3ddn h ALA 181 CO -0.07 0.65 0.47 1.96 0.00 0.00 0.00 179.25 182.26 3ddn h GLN 182 N 1.11 0.90 0.00 0.00 4.20 -0.46 0.09 115.11 120.95 3ddn h GLN 182 Ca 0.25 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.91 3ddn h GLN 182 Cb 0.24 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 27.82 3ddn h GLN 182 CO -0.02 0.59 0.00 1.28 -0.67 0.00 0.00 178.83 180.02 3ddn n LEU 183 N -4.44 0.00 -1.05 1.46 4.77 -0.65 -4.89 117.00 112.20 3ddn n LEU 183 Ca 0.08 0.45 -0.08 0.00 -0.03 0.00 0.00 56.01 56.43 3ddn n LEU 183 Cb 0.07 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 3ddn n LEU 183 CO 0.36 -0.12 -0.07 0.61 -1.33 0.00 0.00 177.39 176.84 3ddn n GLY 184 N 0.66 0.10 3.37 -0.72 0.00 0.02 -5.03 105.19 103.59 3ddn n GLY 184 Ca 0.06 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 3ddn n GLY 184 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ddn s ILE 185 N -2.53 2.69 -0.28 -0.61 1.01 0.20 -4.88 121.20 116.81 3ddn s ILE 185 Ca 0.04 -0.83 -0.25 0.00 0.00 0.00 0.00 60.65 59.61 3ddn s ILE 185 Cb -0.02 -2.05 0.00 0.00 0.01 0.00 0.00 42.46 40.40 3ddn s ILE 185 CO 0.05 0.57 0.84 -0.70 0.00 0.00 0.00 174.94 175.69 3ddn s GLU 186 N -0.23 4.07 0.03 2.79 2.12 -1.20 -3.97 118.70 122.31 3ddn s GLU 186 Ca -0.00 0.80 -0.30 0.00 0.36 0.00 0.00 54.97 55.82 3ddn s GLU 186 Cb -0.13 -3.69 -0.04 0.00 0.26 0.00 0.00 34.13 30.53 3ddn s GLU 186 CO 0.03 -0.64 0.98 -0.51 -0.54 0.00 0.00 175.26 174.59 3ddn s LEU 187 N 2.99 4.40 0.12 2.70 1.43 -1.26 -1.46 118.68 127.60 3ddn s LEU 187 Ca 0.35 1.70 0.05 0.00 -1.03 0.00 0.00 54.13 55.20 3ddn s LEU 187 Cb -0.14 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 3ddn s LEU 187 CO 0.11 -0.23 -0.13 -0.76 0.23 0.00 0.00 176.35 175.57 3ddn s LEU 188 N 0.80 2.41 0.76 1.79 1.43 0.16 -4.93 118.68 121.10 3ddn s LEU 188 Ca 0.51 -0.81 -0.15 0.00 -1.03 0.00 0.00 54.13 52.65 3ddn s LEU 188 Cb -0.22 -0.50 0.04 0.00 0.03 0.00 0.00 46.19 45.54 3ddn s LEU 188 CO 0.28 -0.17 1.07 -1.54 0.23 0.00 0.00 176.35 176.23 3ddn n SER 189 N 0.52 0.76 -0.29 2.29 3.41 -1.26 -4.22 113.62 114.82 3ddn n SER 189 Ca -0.15 0.64 -0.03 0.00 -0.26 0.00 0.00 58.87 59.07 3ddn n SER 189 Cb 0.57 -1.46 0.09 0.00 -0.26 0.00 0.00 64.21 63.16 3ddn n SER 189 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3ddn h LEU 190 N -0.49 0.88 -0.61 1.04 5.85 -1.97 -1.33 115.31 118.69 3ddn h LEU 190 Ca -0.47 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.28 3ddn h LEU 190 Cb 1.32 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 42.10 3ddn h LEU 190 CO 0.47 0.62 0.34 0.44 -0.34 0.00 0.00 178.44 179.96 3ddn h ASP 191 N 1.04 0.52 -0.23 1.25 3.32 -1.99 0.04 116.42 120.36 3ddn h ASP 191 Ca 0.31 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.27 3ddn h ASP 191 Cb -0.04 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3ddn h ASP 191 CO -0.09 0.35 -0.26 0.44 -1.72 0.00 0.00 179.24 177.96 3ddn h ASP 192 N 0.65 0.73 0.04 6.45 3.32 -1.87 -1.74 116.42 124.00 3ddn h ASP 192 Ca 0.26 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 3ddn h ASP 192 Cb 0.12 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3ddn h ASP 192 CO -0.15 0.95 -0.02 0.25 -1.72 0.00 0.00 179.24 178.55 3ddn h LEU 193 N 0.62 -0.05 -0.61 1.55 6.46 -0.54 -2.33 115.31 120.41 3ddn h LEU 193 Ca 0.08 -0.12 0.13 0.00 -0.12 0.00 0.00 57.88 57.85 3ddn h LEU 193 Cb 0.76 0.01 -0.10 0.00 -0.73 0.00 0.00 40.66 40.60 3ddn h LEU 193 CO 0.06 0.09 0.00 -0.07 -0.62 0.00 0.00 178.44 177.90 3ddn h LEU 194 N -0.19 -0.27 -1.43 2.25 4.07 -0.94 -0.94 115.31 117.86 3ddn h LEU 194 Ca -0.01 0.15 -0.04 0.00 0.08 0.00 0.00 57.88 58.07 3ddn h LEU 194 Cb 0.17 0.27 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 3ddn h LEU 194 CO 0.01 -0.11 -0.03 0.00 -1.08 0.00 0.00 178.44 177.23 3ddn h ALA 195 N 1.56 1.54 0.00 1.53 0.00 -1.13 -3.17 119.26 119.58 3ddn h ALA 195 Ca 0.32 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 3ddn h ALA 195 Cb 0.51 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3ddn h ALA 195 CO -0.52 0.33 -2.14 0.54 0.00 0.00 0.00 179.25 177.46 3ddn n ARG 196 N -4.33 0.67 -2.79 0.00 1.74 -0.57 -4.45 116.66 106.93 3ddn n ARG 196 Ca 0.00 -0.10 -0.42 0.00 -0.77 0.00 0.00 57.85 56.57 3ddn n ARG 196 Cb 0.22 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 3ddn n ARG 196 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ddn s ALA 197 N -3.04 3.25 0.08 7.54 0.00 -0.46 -4.69 121.76 124.43 3ddn s ALA 197 Ca -0.09 0.40 0.06 0.00 0.00 0.00 0.00 51.96 52.33 3ddn s ALA 197 Cb 0.10 -3.26 -0.23 0.00 0.00 0.00 0.00 23.12 19.74 3ddn s ALA 197 CO 0.87 -0.28 1.11 -0.44 0.00 0.00 0.00 175.76 177.03 3ddn h ASP 198 N 6.86 0.07 -4.29 0.00 3.32 -1.32 -3.39 116.42 117.68 3ddn h ASP 198 Ca -0.39 -0.09 -0.57 0.00 0.02 0.00 0.00 57.03 56.01 3ddn h ASP 198 Cb 1.20 -0.02 -0.26 0.00 0.22 0.00 0.00 39.33 40.47 3ddn h ASP 198 CO 0.77 1.07 -0.84 -0.36 -1.72 0.00 0.00 179.24 178.16 3ddn s PHE 199 N -2.68 1.76 -0.12 4.55 0.40 -0.92 -2.30 117.98 118.68 3ddn s PHE 199 Ca -0.01 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 55.96 3ddn s PHE 199 Cb 0.09 -1.05 0.02 0.00 0.51 0.00 0.00 43.02 42.59 3ddn s PHE 199 CO 0.83 0.08 -0.14 0.42 0.70 0.00 0.00 175.22 177.11 3ddn s ILE 200 N -0.80 1.46 -0.18 0.64 1.01 -0.33 0.30 121.20 123.30 3ddn s ILE 200 Ca 0.07 -0.60 -0.00 0.00 0.00 0.00 0.00 60.65 60.11 3ddn s ILE 200 Cb -0.09 -1.36 0.00 0.00 0.01 0.00 0.00 42.46 41.03 3ddn s ILE 200 CO 0.02 0.44 -0.14 -0.55 0.00 0.00 0.00 174.94 174.70 3ddn s SER 201 N 1.17 3.62 -0.06 3.58 0.15 -0.05 0.37 113.70 122.48 3ddn s SER 201 Ca -0.03 -0.52 -0.17 0.00 0.70 0.00 0.00 55.95 55.93 3ddn s SER 201 Cb -0.14 -1.57 -0.05 0.00 -1.71 0.00 0.00 66.02 62.55 3ddn s SER 201 CO -0.04 0.03 0.47 0.68 1.20 0.00 0.00 173.24 175.57 3ddn s VAL 202 N 1.14 5.09 -0.24 4.45 -7.23 -0.30 -0.90 120.40 122.41 3ddn s VAL 202 Ca 0.01 0.95 0.22 0.00 -1.81 0.00 0.00 61.98 61.35 3ddn s VAL 202 Cb -0.14 -3.80 0.50 0.00 0.56 0.00 0.00 36.38 33.50 3ddn s VAL 202 CO -0.05 0.42 1.12 1.41 -0.31 0.00 0.00 175.10 177.69 3ddn n HIS 203 N 2.95 1.28 -2.87 2.82 8.25 0.19 -4.13 115.22 123.71 3ddn n HIS 203 Ca -0.09 -2.02 -0.32 0.00 -0.26 0.00 0.00 57.72 55.03 3ddn n HIS 203 Cb 0.52 -0.23 -0.05 0.00 1.12 0.00 0.00 29.99 31.34 3ddn n HIS 203 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3ddn s LEU 204 N -3.51 3.89 0.73 2.41 1.43 -1.20 -4.55 118.68 117.88 3ddn s LEU 204 Ca 0.29 1.36 -0.11 0.00 -1.03 0.00 0.00 54.13 54.64 3ddn s LEU 204 Cb 0.33 -4.21 0.03 0.00 0.03 0.00 0.00 46.19 42.37 3ddn s LEU 204 CO -0.04 -0.36 1.09 -2.16 0.23 0.00 0.00 176.35 175.11 3ddn s PRO 205 N -3.48 2.68 -0.31 1.29 0.04 -1.26 -4.40 135.00 129.56 3ddn s PRO 205 Ca 0.55 0.57 -0.19 0.00 0.04 0.00 0.00 61.00 61.98 3ddn s PRO 205 Cb -0.10 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 3ddn s PRO 205 CO 0.23 -1.19 0.55 0.21 0.04 0.00 0.00 177.00 176.85 3ddn s LYS 206 N -5.26 3.82 0.08 4.56 2.20 -1.26 -4.78 119.74 119.10 3ddn s LYS 206 Ca 0.59 0.10 -0.06 0.00 -0.36 0.00 0.00 55.97 56.23 3ddn s LYS 206 Cb -0.12 -3.74 -0.01 0.00 -1.51 0.00 0.00 37.83 32.44 3ddn s LYS 206 CO 0.53 -0.55 0.13 0.95 -0.36 0.00 0.00 175.35 176.05 3ddn s THR 207 N 2.45 0.16 -0.53 3.43 -4.23 -1.26 -4.77 115.64 110.88 3ddn s THR 207 Ca 0.21 -1.39 0.21 0.00 -1.18 0.00 0.00 61.69 59.54 3ddn s THR 207 Cb -0.15 -1.44 0.21 0.00 1.34 0.00 0.00 72.50 72.46 3ddn s THR 207 CO 0.12 -0.72 1.64 -0.81 -0.54 0.00 0.00 174.62 174.30 3ddn n PRO 208 N -0.02 0.15 0.28 3.99 -0.04 -1.26 -0.89 135.00 137.21 3ddn n PRO 208 Ca -0.14 0.44 0.18 0.00 -0.04 0.00 0.00 63.50 63.94 3ddn n PRO 208 Cb 0.62 -1.82 0.82 0.00 -0.04 0.00 0.00 33.50 33.08 3ddn n PRO 208 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3ddn h GLU 209 N 0.00 0.00 0.00 0.54 3.07 -1.96 -3.33 114.58 112.90 3ddn h GLU 209 Ca 0.00 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.75 3ddn h GLU 209 Cb 0.27 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 3ddn h GLU 209 CO 0.00 0.00 -1.41 2.41 -1.40 0.00 0.00 179.01 178.61 3ddn n THR 210 N -3.02 0.41 -1.59 1.13 -1.04 -0.06 -4.92 114.28 105.18 3ddn n THR 210 Ca -0.00 -0.18 -0.51 0.00 -2.04 0.00 0.00 64.05 61.32 3ddn n THR 210 Cb 0.23 -0.78 -0.05 0.00 -1.82 0.00 0.00 70.33 67.91 3ddn n THR 210 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3ddn n ALA 211 N -2.60 -0.81 -2.15 2.41 0.00 -0.48 -0.87 120.51 116.00 3ddn n ALA 211 Ca -0.12 0.50 -0.15 0.00 0.00 0.00 0.00 53.44 53.67 3ddn n ALA 211 Cb 0.65 -2.08 -0.02 0.00 0.00 0.00 0.00 19.45 17.99 3ddn n ALA 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ddn n GLY 212 N 2.46 0.03 0.29 0.00 0.00 -0.99 -4.86 105.19 102.11 3ddn n GLY 212 Ca 0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 3ddn n GLY 212 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3ddn h LEU 213 N 0.00 -0.48 -7.94 0.99 6.46 -0.67 -3.23 115.31 110.43 3ddn h LEU 213 Ca -0.34 0.21 -0.75 0.00 -0.12 0.00 0.00 57.88 56.89 3ddn h LEU 213 Cb 1.18 0.40 -0.23 0.00 -0.73 0.00 0.00 40.66 41.29 3ddn h LEU 213 CO 0.43 -0.22 0.28 -0.63 -0.62 0.00 0.00 178.44 177.68 3ddn s ILE 214 N -6.15 5.21 0.00 4.05 1.09 -0.52 -4.86 121.20 120.02 3ddn s ILE 214 Ca -0.14 -1.92 0.00 0.00 -1.10 0.00 0.00 60.65 57.49 3ddn s ILE 214 Cb 0.23 -4.55 0.00 0.00 -1.06 0.00 0.00 42.46 37.08 3ddn s ILE 214 CO 0.76 -1.17 0.00 -0.90 -0.10 0.00 0.00 174.94 173.53 3ddn n ASP 215 N 5.16 0.28 -0.30 3.58 3.85 -1.22 -0.78 116.55 127.11 3ddn n ASP 215 Ca 0.11 -0.95 -0.00 0.00 -0.71 0.00 0.00 54.79 53.24 3ddn n ASP 215 Cb 0.46 0.00 0.13 0.00 -1.35 0.00 0.00 41.12 40.36 3ddn n ASP 215 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.20 176.69 3ddn h LYS 216 N 0.00 0.92 -0.74 0.11 3.64 -1.92 0.44 116.57 119.02 3ddn h LYS 216 Ca 0.00 -0.06 0.08 0.00 -1.27 0.00 0.00 60.65 59.41 3ddn h LYS 216 Cb 0.00 -0.21 -0.07 0.00 -0.41 0.00 0.00 32.23 31.54 3ddn h LYS 216 CO 0.00 0.61 0.40 0.93 -2.27 0.00 0.00 179.45 179.13 3ddn h GLU 217 N 0.95 0.68 0.17 1.90 5.08 -1.97 -1.00 114.58 120.40 3ddn h GLU 217 Ca 0.35 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.66 3ddn h GLU 217 Cb 0.13 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3ddn h GLU 217 CO -0.16 0.45 -0.08 0.00 -1.00 0.00 0.00 179.01 178.22 3ddn h ALA 218 N 1.42 -0.23 -1.18 3.43 0.00 -1.63 -3.05 119.26 118.01 3ddn h ALA 218 Ca 0.35 -0.22 0.35 0.00 0.00 0.00 0.00 54.91 55.39 3ddn h ALA 218 Cb 0.32 0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.09 3ddn h ALA 218 CO -0.24 -0.36 0.77 -0.07 0.00 0.00 0.00 179.25 179.35 3ddn h LEU 219 N -0.76 0.31 -0.21 0.00 4.07 -0.83 0.18 115.31 118.08 3ddn h LEU 219 Ca -0.02 0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.03 3ddn h LEU 219 Cb 0.52 0.06 0.00 0.00 1.08 0.00 0.00 40.66 42.31 3ddn h LEU 219 CO 0.04 -0.03 0.00 0.00 -1.08 0.00 0.00 178.44 177.37 3ddn n ALA 220 N -2.53 2.07 0.81 1.53 0.00 -0.39 -2.83 120.51 119.17 3ddn n ALA 220 Ca 0.30 -0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.86 3ddn n ALA 220 Cb 1.16 -1.43 0.18 0.00 0.00 0.00 0.00 19.45 19.35 3ddn n ALA 220 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ddn n LYS 221 N -2.13 0.13 -1.35 0.00 5.02 0.62 -4.94 118.16 115.50 3ddn n LYS 221 Ca 0.05 0.02 -0.30 0.00 -2.02 0.00 0.00 58.31 56.06 3ddn n LYS 221 Cb 0.35 -1.57 0.12 0.00 -0.02 0.00 0.00 35.03 33.91 3ddn n LYS 221 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3ddn s THR 222 N -3.08 2.78 0.18 -0.18 -4.23 -1.13 -3.83 115.64 106.15 3ddn s THR 222 Ca 0.08 0.25 -0.31 0.00 -1.18 0.00 0.00 61.69 60.54 3ddn s THR 222 Cb 0.16 -2.85 -0.09 0.00 1.34 0.00 0.00 72.50 71.06 3ddn s THR 222 CO 0.73 -0.33 1.40 -0.54 -0.54 0.00 0.00 174.62 175.34 3ddn s LYS 223 N -5.03 4.32 0.17 3.99 1.02 -1.20 -4.93 119.74 118.08 3ddn s LYS 223 Ca 0.62 2.16 -0.33 0.00 0.02 0.00 0.00 55.97 58.44 3ddn s LYS 223 Cb -0.16 -3.18 -0.14 0.00 -0.52 0.00 0.00 37.83 33.83 3ddn s LYS 223 CO 0.56 -0.39 1.54 -0.35 -0.92 0.00 0.00 175.35 175.78 3ddn n PRO 224 N 3.08 2.09 -0.16 -1.68 -0.04 -1.26 -1.43 135.00 135.60 3ddn n PRO 224 Ca 0.09 0.75 0.00 0.00 -0.04 0.00 0.00 63.50 64.30 3ddn n PRO 224 Cb 0.41 -2.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.38 3ddn n PRO 224 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ddn n GLY 225 N 3.13 0.68 3.64 0.55 0.00 0.19 -5.01 105.19 108.37 3ddn n GLY 225 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3ddn n GLY 225 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3ddn n VAL 226 N -2.00 2.52 -4.63 1.61 0.24 -0.52 -4.11 118.33 111.44 3ddn n VAL 226 Ca 0.00 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.34 61.47 3ddn n VAL 226 Cb 0.00 -1.26 -0.13 0.00 -1.47 0.00 0.00 33.84 30.98 3ddn n VAL 226 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3ddn s ILE 227 N -1.26 3.44 -0.08 1.34 1.09 -0.97 -0.84 121.20 123.93 3ddn s ILE 227 Ca 0.63 -0.53 0.03 0.00 -1.10 0.00 0.00 60.65 59.68 3ddn s ILE 227 Cb -0.54 -2.46 0.01 0.00 -1.06 0.00 0.00 42.46 38.41 3ddn s ILE 227 CO 0.57 0.53 -0.16 -0.63 -0.10 0.00 0.00 174.94 175.15 3ddn s ILE 228 N 0.12 1.42 -0.06 2.92 1.01 -0.89 -1.19 121.20 124.52 3ddn s ILE 228 Ca -0.04 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.03 3ddn s ILE 228 Cb -0.14 -1.27 -0.01 0.00 0.01 0.00 0.00 42.46 41.05 3ddn s ILE 228 CO 0.04 0.42 -0.25 -0.69 0.00 0.00 0.00 174.94 174.46 3ddn s VAL 229 N 0.59 2.05 -0.29 2.92 1.01 0.16 -1.53 120.40 125.30 3ddn s VAL 229 Ca -0.16 -1.06 -0.01 0.00 0.00 0.00 0.00 61.98 60.75 3ddn s VAL 229 Cb -0.16 -1.74 0.09 0.00 0.00 0.00 0.00 36.38 34.57 3ddn s VAL 229 CO 0.05 0.57 0.08 0.21 0.00 0.00 0.00 175.10 176.01 3ddn s ASN 230 N -0.13 3.95 -0.23 3.32 3.04 0.09 -1.15 114.94 123.83 3ddn s ASN 230 Ca -0.04 -1.55 0.12 0.00 0.04 0.00 0.00 52.86 51.42 3ddn s ASN 230 Cb -0.14 -0.91 0.45 0.00 -1.54 0.00 0.00 41.25 39.11 3ddn s ASN 230 CO 0.04 -0.39 1.34 0.00 -3.04 0.00 0.00 177.10 175.06 3ddn n ALA 231 N 4.81 3.68 -1.11 1.71 0.00 -1.26 -1.75 120.51 126.59 3ddn n ALA 231 Ca -0.03 -3.02 0.00 0.00 0.00 0.00 0.00 53.44 50.39 3ddn n ALA 231 Cb 0.43 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.31 3ddn n ALA 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ddn n ALA 232 N -1.09 0.00 -2.84 0.00 0.00 -1.26 -4.92 120.51 110.40 3ddn n ALA 232 Ca 0.25 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.56 3ddn n ALA 232 Cb 0.86 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.18 3ddn n ALA 232 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3ddn s ARG 233 N 0.00 0.30 0.20 0.00 1.81 -1.26 -4.98 118.95 115.02 3ddn s ARG 233 Ca 0.00 -0.29 -0.33 0.00 -1.72 0.00 0.00 55.73 53.40 3ddn s ARG 233 Cb 0.00 -0.20 -0.14 0.00 -0.45 0.00 0.00 34.95 34.16 3ddn s ARG 233 CO 0.00 0.05 1.47 0.41 -0.68 0.00 0.00 175.30 176.54 3ddn n GLY 234 N 2.55 0.88 1.15 -3.53 0.00 -1.26 -2.67 105.19 102.31 3ddn n GLY 234 Ca -0.16 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.44 3ddn n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ddn n GLY 235 N 2.69 1.79 0.36 -0.02 0.00 -1.26 -4.56 105.19 104.19 3ddn n GLY 235 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.27 3ddn n GLY 235 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ddn h LEU 236 N 0.00 0.82 -8.83 0.99 4.07 -1.83 -2.64 115.31 107.90 3ddn h LEU 236 Ca 0.00 0.08 -0.64 0.00 0.08 0.00 0.00 57.88 57.40 3ddn h LEU 236 Cb 0.00 -0.08 -0.19 0.00 1.08 0.00 0.00 40.66 41.47 3ddn h LEU 236 CO 0.00 0.35 -0.57 -0.69 -1.08 0.00 0.00 178.44 176.45 3ddn s VAL 237 N -5.87 4.78 -0.15 1.22 1.01 -1.26 -1.44 120.40 118.68 3ddn s VAL 237 Ca -0.11 -0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 3ddn s VAL 237 Cb 0.24 -3.24 -0.07 0.00 0.00 0.00 0.00 36.38 33.31 3ddn s VAL 237 CO 0.80 0.33 2.13 -0.67 0.00 0.00 0.00 175.10 177.70 3ddn n ASP 238 N 4.67 3.41 -0.14 3.32 -0.08 0.03 -4.85 116.55 122.91 3ddn n ASP 238 Ca -0.15 0.47 -0.04 0.00 -1.51 0.00 0.00 54.79 53.56 3ddn n ASP 238 Cb 0.52 -1.51 0.05 0.00 2.34 0.00 0.00 41.12 42.52 3ddn n ASP 238 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 3ddn h GLU 239 N 13.17 0.28 -0.24 -0.67 5.08 -1.91 -0.10 114.58 130.20 3ddn h GLU 239 Ca -0.43 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 57.77 3ddn h GLU 239 Cb 1.25 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 3ddn h GLU 239 CO 0.96 0.19 -0.44 0.00 -1.00 0.00 0.00 179.01 178.71 3ddn h ALA 240 N 1.32 0.78 -0.48 3.43 0.00 -2.00 -1.73 119.26 120.58 3ddn h ALA 240 Ca 0.22 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3ddn h ALA 240 Cb 0.25 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3ddn h ALA 240 CO -0.25 0.66 0.04 0.00 0.00 0.00 0.00 179.25 179.70 3ddn h ALA 241 N 1.03 1.16 0.61 0.00 0.00 -1.81 -0.96 119.26 119.29 3ddn h ALA 241 Ca 0.03 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3ddn h ALA 241 Cb 0.97 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.57 3ddn h ALA 241 CO 0.09 0.55 -0.29 1.25 0.00 0.00 0.00 179.25 180.85 3ddn h LEU 242 N 0.73 -0.69 -0.82 0.00 6.46 -0.78 -0.95 115.31 119.26 3ddn h LEU 242 Ca 0.15 -0.02 0.18 0.00 -0.12 0.00 0.00 57.88 58.07 3ddn h LEU 242 Cb 0.39 0.18 -0.11 0.00 -0.73 0.00 0.00 40.66 40.39 3ddn h LEU 242 CO 0.01 -0.41 0.32 0.00 -0.62 0.00 0.00 178.44 177.74 3ddn h ALA 243 N -0.63 1.21 -0.30 1.25 0.00 -1.13 0.52 119.26 120.17 3ddn h ALA 243 Ca -0.08 0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.99 3ddn h ALA 243 Cb 0.67 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 3ddn h ALA 243 CO 0.14 -0.28 0.16 -0.44 0.00 0.00 0.00 179.25 178.82 3ddn h ASP 244 N 0.40 0.24 0.18 0.00 3.45 -0.92 0.45 116.42 120.22 3ddn h ASP 244 Ca 0.48 0.01 -0.15 0.00 0.43 0.00 0.00 57.03 57.80 3ddn h ASP 244 Cb 0.83 -0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 39.55 3ddn h ASP 244 CO -0.48 0.18 -0.56 0.00 -1.57 0.00 0.00 179.24 176.81 3ddn h ALA 245 N 1.15 0.79 0.49 3.45 0.00 0.70 0.10 119.26 125.94 3ddn h ALA 245 Ca 0.12 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 3ddn h ALA 245 Cb 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3ddn h ALA 245 CO -0.08 0.70 -0.24 0.82 0.00 0.00 0.00 179.25 180.45 3ddn h ILE 246 N 0.31 0.42 -0.00 0.00 1.08 0.05 -1.46 117.51 117.91 3ddn h ILE 246 Ca 0.00 -0.37 0.03 0.00 -0.39 0.00 0.00 64.86 64.13 3ddn h ILE 246 Cb 1.07 0.57 -0.03 0.00 -3.07 0.00 0.00 36.82 35.36 3ddn h ILE 246 CO 0.10 0.05 -0.17 0.74 -0.69 0.00 0.00 178.15 178.18 3ddn h THR 247 N -0.91 0.59 0.00 -0.27 2.02 -0.83 -0.52 112.91 112.99 3ddn h THR 247 Ca -0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.11 3ddn h THR 247 Cb 0.60 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 3ddn h THR 247 CO 0.11 0.00 0.15 1.23 0.37 0.00 0.00 175.52 177.38 3ddn h GLY 248 N -0.28 0.00 0.00 2.16 0.00 -0.87 -3.46 103.07 100.62 3ddn h GLY 248 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 3ddn h GLY 248 CO -0.17 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.98 3ddn n GLY 249 N -1.18 2.64 0.34 4.60 0.00 -0.20 -4.97 105.19 106.42 3ddn n GLY 249 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 3ddn n GLY 249 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3ddn h HIS 250 N 0.00 1.11 -3.48 1.61 -0.00 -1.51 -3.36 115.15 109.52 3ddn h HIS 250 Ca 0.00 0.03 -0.63 0.00 -0.00 0.00 0.00 60.37 59.77 3ddn h HIS 250 Cb 0.00 -0.37 -0.18 0.00 -0.00 0.00 0.00 27.41 26.85 3ddn h HIS 250 CO 0.00 0.67 -0.58 0.14 -0.00 0.00 0.00 177.93 178.16 3ddn s VAL 251 N -6.11 4.67 0.13 5.26 -7.23 -1.01 -0.64 120.40 115.46 3ddn s VAL 251 Ca -0.13 -0.07 -0.13 0.00 -1.81 0.00 0.00 61.98 59.85 3ddn s VAL 251 Cb 0.17 -3.14 -0.03 0.00 0.56 0.00 0.00 36.38 33.94 3ddn s VAL 251 CO 0.80 0.40 1.52 -0.09 -0.31 0.00 0.00 175.10 177.41 3ddn h ARG 252 N 7.38 0.83 -3.20 4.82 2.43 -1.14 -3.37 114.38 122.13 3ddn h ARG 252 Ca -0.37 -0.35 -0.00 0.00 -0.81 0.00 0.00 59.98 58.45 3ddn h ARG 252 Cb 1.17 -0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 30.60 3ddn h ARG 252 CO 0.64 0.98 0.10 0.00 -1.51 0.00 0.00 179.97 180.18 3ddn s ALA 253 N -4.68 -1.10 0.13 2.80 0.00 -1.22 -4.86 121.76 112.83 3ddn s ALA 253 Ca -0.12 -0.11 -0.11 0.00 0.00 0.00 0.00 51.96 51.62 3ddn s ALA 253 Cb 0.10 0.86 0.00 0.00 0.00 0.00 0.00 23.12 24.09 3ddn s ALA 253 CO 0.84 -0.84 0.28 0.00 0.00 0.00 0.00 175.76 176.04 3ddn s ALA 254 N -3.86 -0.32 -0.03 0.00 0.00 -0.79 -2.10 121.76 114.66 3ddn s ALA 254 Ca 0.08 -0.58 0.01 0.00 0.00 0.00 0.00 51.96 51.47 3ddn s ALA 254 Cb -0.02 0.68 0.01 0.00 0.00 0.00 0.00 23.12 23.79 3ddn s ALA 254 CO -0.03 -0.60 -0.05 0.20 0.00 0.00 0.00 175.76 175.28 3ddn s GLY 255 N -2.89 0.37 -0.02 0.00 0.00 -0.58 0.28 107.32 104.48 3ddn s GLY 255 Ca 0.09 -0.12 0.02 0.00 0.00 0.00 0.00 44.72 44.71 3ddn s GLY 255 CO -0.07 0.16 -0.07 1.08 0.00 0.00 0.00 173.10 174.21 3ddn s LEU 256 N 0.46 1.73 0.00 0.66 1.43 0.49 -0.73 118.68 122.72 3ddn s LEU 256 Ca -0.06 -0.14 0.05 0.00 -1.03 0.00 0.00 54.13 52.96 3ddn s LEU 256 Cb -0.09 -0.43 -0.04 0.00 0.03 0.00 0.00 46.19 45.66 3ddn s LEU 256 CO -0.00 0.03 0.30 -0.67 0.23 0.00 0.00 176.35 176.24 3ddn n ASP 257 N 3.38 0.46 -4.03 2.29 4.64 -0.72 -1.28 116.55 121.30 3ddn n ASP 257 Ca -0.19 -0.73 -0.12 0.00 -1.38 0.00 0.00 54.79 52.38 3ddn n ASP 257 Cb 0.54 0.83 -0.11 0.00 -1.04 0.00 0.00 41.12 41.34 3ddn n ASP 257 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 3ddn s VAL 258 N -1.32 0.38 0.04 5.18 -7.23 -1.26 0.32 120.40 116.51 3ddn s VAL 258 Ca 0.03 -0.99 0.03 0.00 -1.81 0.00 0.00 61.98 59.24 3ddn s VAL 258 Cb 0.04 -0.47 -0.02 0.00 0.56 0.00 0.00 36.38 36.49 3ddn s VAL 258 CO 0.19 -0.40 -0.09 -0.36 -0.31 0.00 0.00 175.10 174.13 3ddn s PHE 259 N -1.36 0.75 0.32 2.82 0.08 -1.26 -4.54 117.98 114.79 3ddn s PHE 259 Ca -0.12 -0.43 0.10 0.00 0.12 0.00 0.00 56.93 56.60 3ddn s PHE 259 Cb -0.10 -0.44 0.96 0.00 -0.57 0.00 0.00 43.02 42.87 3ddn s PHE 259 CO -0.00 -0.05 1.64 0.00 -0.10 0.00 0.00 175.22 176.71 3ddn h ALA 260 N 4.70 1.68 -3.55 5.36 0.00 -1.93 -3.35 119.26 122.18 3ddn h ALA 260 Ca -0.35 0.23 -0.32 0.00 0.00 0.00 0.00 54.91 54.46 3ddn h ALA 260 Cb 1.20 0.27 -0.33 0.00 0.00 0.00 0.00 17.79 18.93 3ddn h ALA 260 CO 0.42 -0.58 -0.74 -0.08 0.00 0.00 0.00 179.25 178.27 3ddn s THR 261 N -5.77 0.10 0.07 0.00 -1.32 -1.26 -4.82 115.64 102.63 3ddn s THR 261 Ca -0.11 0.10 0.06 0.00 -1.21 0.00 0.00 61.69 60.53 3ddn s THR 261 Cb 0.29 -0.19 -0.03 0.00 -1.51 0.00 0.00 72.50 71.06 3ddn s THR 261 CO 0.78 0.11 -0.16 -1.83 -2.21 0.00 0.00 174.62 171.31 3ddn s GLU 262 N 0.87 0.95 0.26 7.08 -1.05 -1.26 -3.79 118.70 121.76 3ddn s GLU 262 Ca -0.08 -0.95 -0.31 0.00 -0.15 0.00 0.00 54.97 53.48 3ddn s GLU 262 Cb -0.12 -1.03 -0.12 0.00 -0.44 0.00 0.00 34.13 32.43 3ddn s GLU 262 CO -0.02 0.24 1.65 -2.14 0.95 0.00 0.00 175.26 175.94 3ddn s PRO 263 N -1.59 4.12 -0.20 -4.83 0.02 -1.26 -5.13 135.00 126.13 3ddn s PRO 263 Ca 0.01 2.59 -0.01 0.00 0.02 0.00 0.00 61.00 63.62 3ddn s PRO 263 Cb -0.09 -3.04 0.01 0.00 0.02 0.00 0.00 34.50 31.39 3ddn s PRO 263 CO 0.02 -0.68 -0.12 0.00 -0.33 0.00 0.00 177.00 175.89 3ddn n THR 265 N 4.69 0.00 -0.84 0.00 -2.24 -1.26 -4.84 114.28 109.79 3ddn n THR 265 Ca -0.19 -0.34 0.03 0.00 -2.27 0.00 0.00 64.05 61.28 3ddn n THR 265 Cb 0.50 1.20 0.04 0.00 -2.10 0.00 0.00 70.33 69.97 3ddn n THR 265 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3ddn n ASP 266 N -0.26 1.41 -4.77 3.42 3.85 -1.26 -5.06 116.55 113.88 3ddn n ASP 266 Ca 0.00 -2.14 -0.41 0.00 -0.71 0.00 0.00 54.79 51.52 3ddn n ASP 266 Cb 0.05 -0.16 -0.00 0.00 -1.35 0.00 0.00 41.12 39.65 3ddn n ASP 266 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.20 175.95 3ddn n SER 267 N -0.61 3.83 -0.05 -1.12 2.88 -1.26 -4.89 113.62 112.40 3ddn n SER 267 Ca 0.05 1.21 0.02 0.00 -1.33 0.00 0.00 58.87 58.82 3ddn n SER 267 Cb 0.49 -1.62 0.35 0.00 -0.75 0.00 0.00 64.21 62.69 3ddn n SER 267 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3ddn h PRO 268 N 3.43 0.63 -0.98 -1.46 0.11 -1.97 -1.84 132.00 129.92 3ddn h PRO 268 Ca -0.50 -0.06 0.28 0.00 0.11 0.00 0.00 66.00 65.83 3ddn h PRO 268 Cb 1.24 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 3ddn h PRO 268 CO 0.68 0.47 0.70 -0.07 -0.21 0.00 0.00 178.00 179.57 3ddn h LEU 269 N 0.64 0.00 0.00 2.35 3.38 -1.91 0.36 115.31 120.13 3ddn h LEU 269 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3ddn h LEU 269 Cb 0.03 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3ddn h LEU 269 CO -0.03 0.00 0.00 0.49 0.09 0.00 0.00 178.44 178.99 3ddn n PHE 270 N -4.24 0.00 1.09 1.13 3.72 -0.69 -1.51 117.46 116.95 3ddn n PHE 270 Ca 0.20 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.73 3ddn n PHE 270 Cb 1.04 -0.46 0.26 0.00 -0.94 0.00 0.00 39.48 39.37 3ddn n PHE 270 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3ddn n GLU 271 N -1.46 2.12 -3.99 -1.08 -0.58 0.13 -4.88 120.64 110.89 3ddn n GLU 271 Ca 0.03 -1.63 -0.35 0.00 -0.42 0.00 0.00 57.16 54.79 3ddn n GLU 271 Cb 0.13 -1.47 -0.13 0.00 -0.57 0.00 0.00 31.44 29.40 3ddn n GLU 271 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3ddn s LEU 272 N -1.92 3.03 0.11 -4.62 1.43 -0.57 -5.00 118.68 111.14 3ddn s LEU 272 Ca 0.32 -0.32 -0.15 0.00 -1.03 0.00 0.00 54.13 52.95 3ddn s LEU 272 Cb 0.20 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.61 3ddn s LEU 272 CO 0.31 0.01 1.52 0.00 0.23 0.00 0.00 176.35 178.42 3ddn h ALA 273 N 7.88 0.49 0.00 4.21 0.00 -1.90 -3.01 119.26 126.94 3ddn h ALA 273 Ca -0.39 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3ddn h ALA 273 Cb 1.17 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3ddn h ALA 273 CO 0.60 0.33 0.00 0.00 0.00 0.00 0.00 179.25 180.18 3ddn n GLN 274 N -4.41 0.33 -4.02 0.00 0.00 -1.26 -4.41 117.38 103.61 3ddn n GLN 274 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 57.00 56.65 3ddn n GLN 274 Cb 0.33 -1.20 -0.15 0.00 0.00 0.00 0.00 30.24 29.22 3ddn n GLN 274 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3ddn s VAL 275 N -2.00 2.40 -0.00 -0.39 1.01 -1.14 -1.88 120.40 118.39 3ddn s VAL 275 Ca 0.07 -1.62 -0.27 0.00 0.00 0.00 0.00 61.98 60.15 3ddn s VAL 275 Cb 0.03 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 3ddn s VAL 275 CO 0.05 -0.09 0.87 -0.69 0.00 0.00 0.00 175.10 175.24 3ddn s VAL 276 N 1.13 4.86 0.01 2.92 1.01 0.14 -4.91 120.40 125.57 3ddn s VAL 276 Ca -0.07 1.83 0.04 0.00 0.00 0.00 0.00 61.98 63.78 3ddn s VAL 276 Cb -0.20 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 31.95 3ddn s VAL 276 CO -0.04 0.23 -0.13 0.68 0.00 0.00 0.00 175.10 175.84 3ddn s VAL 277 N 0.70 1.01 0.00 2.92 -7.23 -1.26 -0.38 120.40 116.16 3ddn s VAL 277 Ca 0.46 -0.71 -0.00 0.00 -1.81 0.00 0.00 61.98 59.91 3ddn s VAL 277 Cb -0.20 -0.87 -0.00 0.00 0.56 0.00 0.00 36.38 35.86 3ddn s VAL 277 CO 0.25 0.16 -0.00 0.42 -0.31 0.00 0.00 175.10 175.62 3ddn s THR 278 N -0.52 0.03 -1.28 5.32 -4.23 -0.40 -4.97 115.64 109.59 3ddn s THR 278 Ca 0.03 -0.22 -0.16 0.00 -1.18 0.00 0.00 61.69 60.16 3ddn s THR 278 Cb -0.06 -0.08 -0.01 0.00 1.34 0.00 0.00 72.50 73.69 3ddn s THR 278 CO 0.00 -0.12 2.14 -0.81 -0.54 0.00 0.00 174.62 175.29 3ddn n PRO 279 N 2.71 2.51 -3.53 3.99 -0.04 -1.26 -4.28 135.00 135.10 3ddn n PRO 279 Ca -0.15 -2.42 -0.21 0.00 -0.04 0.00 0.00 63.50 60.68 3ddn n PRO 279 Cb 0.59 -3.20 0.02 0.00 -0.04 0.00 0.00 33.50 30.87 3ddn n PRO 279 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 3ddn n HIS 280 N 6.53 -2.25 0.78 0.54 -0.00 0.15 -4.91 115.22 116.06 3ddn n HIS 280 Ca 0.51 0.74 0.09 0.00 -0.00 0.00 0.00 57.72 59.06 3ddn n HIS 280 Cb 0.40 -3.47 0.02 0.00 -0.00 0.00 0.00 29.99 26.93 3ddn n HIS 280 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3ddn n LEU 281 N -3.11 1.91 -0.40 0.27 4.32 -1.26 -4.67 117.00 114.05 3ddn n LEU 281 Ca -0.12 -0.82 0.33 0.00 -0.02 0.00 0.00 56.01 55.38 3ddn n LEU 281 Cb 0.59 0.00 0.63 0.00 -1.62 0.00 0.00 43.42 43.02 3ddn n LEU 281 CO 0.62 0.35 1.26 1.23 -1.22 0.00 0.00 177.39 179.64 3ddn h GLY 282 N 3.75 0.97 -1.09 -0.72 0.00 -1.89 0.37 103.07 104.46 3ddn h GLY 282 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.21 3ddn h GLY 282 CO 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 176.54 176.33 3ddn n ALA 283 N -2.57 2.29 -2.03 3.60 0.00 -1.26 -2.53 120.51 118.00 3ddn n ALA 283 Ca 0.32 -0.93 -0.39 0.00 0.00 0.00 0.00 53.44 52.43 3ddn n ALA 283 Cb 1.25 -0.40 -0.03 0.00 0.00 0.00 0.00 19.45 20.28 3ddn n ALA 283 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3ddn n SER 284 N 0.52 3.83 -3.78 0.00 7.64 0.13 -4.53 113.62 117.43 3ddn n SER 284 Ca 0.09 -2.81 -0.13 0.00 1.01 0.00 0.00 58.87 57.04 3ddn n SER 284 Cb 0.36 -1.62 -0.13 0.00 -1.01 0.00 0.00 64.21 61.82 3ddn n SER 284 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3ddn s THR 285 N 5.88 -0.02 0.23 0.44 2.01 -1.26 -5.04 115.64 117.89 3ddn s THR 285 Ca 0.57 0.06 -0.06 0.00 0.31 0.00 0.00 61.69 62.57 3ddn s THR 285 Cb 0.07 -0.31 0.20 0.00 0.01 0.00 0.00 72.50 72.46 3ddn s THR 285 CO 0.06 0.02 1.83 0.00 -0.69 0.00 0.00 174.62 175.85 3ddn h ALA 286 N 6.34 1.12 -0.87 7.40 0.00 -1.99 -1.34 119.26 129.92 3ddn h ALA 286 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3ddn h ALA 286 Cb 1.18 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 3ddn h ALA 286 CO 0.38 0.19 0.55 0.93 0.00 0.00 0.00 179.25 181.31 3ddn h GLU 287 N 0.87 1.15 -0.20 0.00 3.07 -1.96 0.17 114.58 117.69 3ddn h GLU 287 Ca 0.36 -0.08 -0.17 0.00 -0.50 0.00 0.00 59.36 58.97 3ddn h GLU 287 Cb 0.21 -0.25 -0.00 0.00 -0.84 0.00 0.00 28.75 27.87 3ddn h GLU 287 CO -0.19 0.78 -0.56 0.00 -1.40 0.00 0.00 179.01 177.64 3ddn h ALA 288 N 1.30 0.63 -0.12 3.43 0.00 -1.70 -0.93 119.26 121.88 3ddn h ALA 288 Ca 0.31 -0.52 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 3ddn h ALA 288 Cb -0.10 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3ddn h ALA 288 CO -0.06 0.69 -0.41 1.96 0.00 0.00 0.00 179.25 181.43 3ddn h GLN 289 N 0.48 0.48 -0.74 0.00 1.08 -1.07 -1.58 115.11 113.76 3ddn h GLN 289 Ca 0.01 -0.36 0.08 0.00 -1.45 0.00 0.00 58.65 56.93 3ddn h GLN 289 Cb 1.12 0.07 -0.07 0.00 -0.05 0.00 0.00 27.48 28.55 3ddn h GLN 289 CO 0.11 0.99 0.40 -0.44 -0.95 0.00 0.00 178.83 178.93 3ddn h ASP 290 N 0.08 0.55 -0.36 1.46 3.45 -0.67 -2.44 116.42 118.49 3ddn h ASP 290 Ca -0.02 0.05 -0.12 0.00 0.43 0.00 0.00 57.03 57.37 3ddn h ASP 290 Cb 1.03 -0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 39.74 3ddn h ASP 290 CO 0.09 0.33 -0.25 -0.09 -1.57 0.00 0.00 179.24 177.74 3ddn h ARG 291 N 0.68 0.81 -0.89 3.56 2.43 -1.06 -0.51 114.38 119.39 3ddn h ARG 291 Ca 0.35 -0.39 0.19 0.00 -0.81 0.00 0.00 59.98 59.32 3ddn h ARG 291 Cb 0.32 -0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 29.75 3ddn h ARG 291 CO -0.24 1.02 0.44 0.00 -1.51 0.00 0.00 179.97 179.68 3ddn h ALA 292 N 0.77 1.41 -0.04 2.80 0.00 -1.17 0.30 119.26 123.34 3ddn h ALA 292 Ca 0.07 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 3ddn h ALA 292 Cb 0.82 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3ddn h ALA 292 CO 0.07 -0.22 -0.12 0.78 0.00 0.00 0.00 179.25 179.76 3ddn h GLY 293 N 0.53 0.16 1.88 0.00 0.00 -0.89 -2.33 103.07 102.41 3ddn h GLY 293 Ca 0.53 -0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.55 3ddn h GLY 293 CO -0.45 0.19 -0.41 -0.91 0.00 0.00 0.00 176.54 174.96 3ddn h THR 294 N -0.42 1.30 0.47 4.70 1.35 -0.82 0.73 112.91 120.23 3ddn h THR 294 Ca -0.00 -1.47 -0.02 0.00 -0.55 0.00 0.00 66.41 64.36 3ddn h THR 294 Cb 0.75 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 3ddn h THR 294 CO 0.03 0.43 -0.25 0.44 -0.25 0.00 0.00 175.52 175.92 3ddn h ASP 295 N 0.12 -0.61 -0.33 5.36 3.32 -0.44 -2.65 116.42 121.18 3ddn h ASP 295 Ca 0.01 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.18 3ddn h ASP 295 Cb 0.78 0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 3ddn h ASP 295 CO 0.06 -0.41 0.26 1.62 -1.72 0.00 0.00 179.24 179.05 3ddn h VAL 296 N -0.66 0.74 -0.19 -1.35 3.04 -1.34 0.65 116.25 117.14 3ddn h VAL 296 Ca -0.06 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.54 3ddn h VAL 296 Cb 0.52 0.82 -0.01 0.00 -2.01 0.00 0.00 31.29 30.60 3ddn h VAL 296 CO 0.09 0.00 -0.25 0.00 -1.01 0.00 0.00 177.57 176.40 3ddn h ALA 297 N 1.80 1.22 -0.00 3.17 0.00 -0.74 -1.69 119.26 123.02 3ddn h ALA 297 Ca 0.16 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 3ddn h ALA 297 Cb 0.67 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.37 3ddn h ALA 297 CO -0.00 0.51 -0.54 1.49 0.00 0.00 0.00 179.25 180.71 3ddn h GLU 298 N 0.31 0.37 -0.88 0.00 4.57 -0.54 -2.32 114.58 116.09 3ddn h GLU 298 Ca 0.05 -0.39 0.15 0.00 -1.18 0.00 0.00 59.36 57.98 3ddn h GLU 298 Cb 0.61 0.11 -0.09 0.00 -0.16 0.00 0.00 28.75 29.22 3ddn h GLU 298 CO 0.04 1.07 0.47 0.77 -1.18 0.00 0.00 179.01 180.19 3ddn h SER 299 N -0.18 0.59 0.22 1.04 0.02 -1.26 -0.28 113.55 113.70 3ddn h SER 299 Ca -0.07 0.09 -0.11 0.00 -0.84 0.00 0.00 61.79 60.86 3ddn h SER 299 Cb 1.26 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 3ddn h SER 299 CO 0.11 0.25 -0.41 0.58 -1.14 0.00 0.00 176.83 176.22 3ddn h VAL 300 N 0.67 1.31 0.37 2.27 2.07 -1.28 -1.62 116.25 120.04 3ddn h VAL 300 Ca 0.48 -1.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 3ddn h VAL 300 Cb 0.66 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 3ddn h VAL 300 CO -0.35 0.45 -0.18 -0.09 0.02 0.00 0.00 177.57 177.42 3ddn h ARG 301 N 0.21 -0.48 -0.61 1.57 2.43 -0.62 -2.05 114.38 114.84 3ddn h ARG 301 Ca 0.02 0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.33 3ddn h ARG 301 Cb 0.81 0.11 -0.08 0.00 -0.42 0.00 0.00 29.97 30.39 3ddn h ARG 301 CO 0.06 -0.17 0.17 -0.07 -1.51 0.00 0.00 179.97 178.45 3ddn h LEU 302 N -0.79 0.10 -1.44 3.80 3.38 -1.05 0.14 115.31 119.45 3ddn h LEU 302 Ca -0.05 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3ddn h LEU 302 Cb 0.52 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3ddn h LEU 302 CO 0.08 0.06 -0.01 0.00 0.09 0.00 0.00 178.44 178.66 3ddn h ALA 303 N 1.46 1.55 0.00 1.53 0.00 -1.28 -0.27 119.26 122.25 3ddn h ALA 303 Ca 0.32 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3ddn h ALA 303 Cb 0.45 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3ddn h ALA 303 CO -0.37 0.33 -0.46 -0.07 0.00 0.00 0.00 179.25 178.68 3ddn h LEU 304 N 0.34 0.00 -1.59 0.00 3.38 -0.51 -3.17 115.31 113.77 3ddn h LEU 304 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3ddn h LEU 304 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3ddn h LEU 304 CO 0.01 0.08 0.00 0.00 0.09 0.00 0.00 178.44 178.62 3ddn n ALA 305 N -2.16 2.80 -0.98 1.53 0.00 -0.07 -4.85 120.51 116.79 3ddn n ALA 305 Ca 0.02 -0.62 -0.04 0.00 0.00 0.00 0.00 53.44 52.80 3ddn n ALA 305 Cb 0.57 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.99 3ddn n ALA 305 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ddn n GLY 306 N 0.49 0.37 3.95 0.00 0.00 -1.15 -4.94 105.19 103.92 3ddn n GLY 306 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 3ddn n GLY 306 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ddn s GLU 307 N -2.06 0.82 0.01 1.61 2.12 -0.19 -5.02 118.70 115.99 3ddn s GLU 307 Ca 0.00 -0.65 -0.18 0.00 0.36 0.00 0.00 54.97 54.50 3ddn s GLU 307 Cb 0.00 -1.97 -0.06 0.00 0.26 0.00 0.00 34.13 32.36 3ddn s GLU 307 CO 0.00 -2.22 0.50 0.12 -0.54 0.00 0.00 175.26 173.13 3ddn s PHE 308 N -3.71 3.72 -0.47 5.30 5.36 -1.26 -4.41 117.98 122.51 3ddn s PHE 308 Ca 0.73 1.11 -0.04 0.00 -0.96 0.00 0.00 56.93 57.78 3ddn s PHE 308 Cb -0.04 -2.45 0.12 0.00 -0.34 0.00 0.00 43.02 40.32 3ddn s PHE 308 CO 0.51 0.52 0.28 0.08 -1.46 0.00 0.00 175.22 175.15 3ddn s VAL 309 N -0.74 3.51 0.30 3.12 1.01 -1.26 -4.85 120.40 121.49 3ddn s VAL 309 Ca 0.27 -2.25 -0.01 0.00 0.00 0.00 0.00 61.98 59.99 3ddn s VAL 309 Cb -0.18 -3.37 0.27 0.00 0.00 0.00 0.00 36.38 33.11 3ddn s VAL 309 CO 0.16 -0.75 1.95 -0.65 0.00 0.00 0.00 175.10 175.80 3ddn h PRO 310 N 7.85 1.05 -0.54 2.72 0.11 -1.96 -1.84 132.00 139.40 3ddn h PRO 310 Ca -0.11 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3ddn h PRO 310 Cb 1.03 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.90 3ddn h PRO 310 CO 0.72 0.70 0.00 -0.25 -0.21 0.00 0.00 178.00 178.96 3ddn n ASP 311 N -4.44 2.38 -4.72 -2.05 10.43 -1.26 -4.44 116.55 112.45 3ddn n ASP 311 Ca 0.11 -2.18 -0.36 0.00 2.57 0.00 0.00 54.79 54.93 3ddn n ASP 311 Cb 0.10 -0.38 0.08 0.00 1.84 0.00 0.00 41.12 42.76 3ddn n ASP 311 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3ddn s ALA 312 N -1.66 2.26 -0.03 2.24 0.00 -0.69 -3.58 121.76 120.30 3ddn s ALA 312 Ca 0.24 1.15 0.04 0.00 0.00 0.00 0.00 51.96 53.38 3ddn s ALA 312 Cb 0.15 -3.54 -0.05 0.00 0.00 0.00 0.00 23.12 19.67 3ddn s ALA 312 CO 0.12 -1.75 0.09 0.28 0.00 0.00 0.00 175.76 174.50 3ddn n VAL 313 N -2.20 0.00 -3.46 0.00 0.31 0.33 -4.65 118.33 108.66 3ddn n VAL 313 Ca 0.15 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 3ddn n VAL 313 Cb 0.49 0.52 0.00 0.00 -0.91 0.00 0.00 33.84 33.93 3ddn n VAL 313 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3ddn n ASN 314 N -1.53 0.00 -4.21 4.52 6.94 -1.25 0.10 115.26 119.83 3ddn n ASN 314 Ca -0.00 -0.80 -0.32 0.00 -0.02 0.00 0.00 54.58 53.43 3ddn n ASN 314 Cb 0.09 0.00 -0.16 0.00 -2.36 0.00 0.00 39.78 37.34 3ddn n ASN 314 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3ddn s VAL 315 N -2.21 2.17 -0.23 3.53 1.01 -1.26 -4.77 120.40 118.65 3ddn s VAL 315 Ca 0.00 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 60.91 3ddn s VAL 315 Cb 0.00 -1.86 0.08 0.00 0.00 0.00 0.00 36.38 34.60 3ddn s VAL 315 CO 0.00 0.55 0.53 -0.83 0.00 0.00 0.00 175.10 175.35 3ddn s GLY 316 N 0.62 -0.48 0.00 4.51 0.00 -1.26 -4.69 107.32 106.01 3ddn s GLY 316 Ca -0.11 1.92 0.00 0.00 0.00 0.00 0.00 44.72 46.52 3ddn s GLY 316 CO 0.03 2.20 0.00 0.61 0.00 0.00 0.00 173.10 175.94 3ddn n GLY 317 N 4.60 0.32 0.19 0.20 0.00 -1.11 -4.26 105.19 105.13 3ddn n GLY 317 Ca -0.19 -1.83 0.14 0.00 0.00 0.00 0.00 46.02 44.14 3ddn n GLY 317 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3ddn h GLY 318 N 0.00 0.00 -0.81 -0.02 0.00 -2.00 -3.34 103.07 96.89 3ddn h GLY 318 Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 47.33 47.58 3ddn h GLY 318 CO 0.00 0.00 0.57 3.33 0.00 0.00 0.00 176.54 180.44 3ddn n VAL 319 N -2.51 -0.03 -3.66 4.60 0.24 -1.26 -4.06 118.33 111.64 3ddn n VAL 319 Ca 0.01 0.71 -0.06 0.00 -2.04 0.00 0.00 64.34 62.96 3ddn n VAL 319 Cb 0.21 -1.18 -0.07 0.00 -1.47 0.00 0.00 33.84 31.33 3ddn n VAL 319 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3ddn s VAL 320 N -3.98 -0.49 0.86 3.34 1.01 -1.26 -5.01 120.40 114.87 3ddn s VAL 320 Ca -0.03 0.06 -0.16 0.00 0.00 0.00 0.00 61.98 61.85 3ddn s VAL 320 Cb 0.13 -0.86 -0.11 0.00 0.00 0.00 0.00 36.38 35.54 3ddn s VAL 320 CO 0.39 0.02 -0.34 -3.20 0.00 0.00 0.00 175.10 171.98 3ddn n ASN 321 N 4.94 -4.42 0.25 3.32 2.85 -1.26 -4.80 115.26 116.14 3ddn n ASN 321 Ca -0.15 0.35 0.14 0.00 -0.11 0.00 0.00 54.58 54.81 3ddn n ASN 321 Cb 0.53 -0.90 0.51 0.00 1.24 0.00 0.00 39.78 41.17 3ddn n ASN 321 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 3ddn h GLU 322 N -0.81 0.00 0.16 1.20 5.08 -1.99 -2.22 114.58 116.01 3ddn h GLU 322 Ca -0.43 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 57.66 3ddn h GLU 322 Cb 1.33 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.61 3ddn h GLU 322 CO 0.31 0.07 -1.14 0.93 -1.00 0.00 0.00 179.01 178.17 3ddn h GLU 323 N 0.00 0.48 0.11 2.33 4.39 -2.01 -3.35 114.58 116.53 3ddn h GLU 323 Ca -0.00 -0.74 -0.29 0.00 0.34 0.00 0.00 59.36 58.67 3ddn h GLU 323 Cb 0.69 0.26 0.03 0.00 -0.10 0.00 0.00 28.75 29.62 3ddn h GLU 323 CO 0.01 1.34 -1.22 0.28 -1.16 0.00 0.00 179.01 178.26 3ddn h VAL 324 N 0.01 1.30 -0.87 3.13 2.07 -1.93 -3.40 116.25 116.56 3ddn h VAL 324 Ca -0.19 -2.49 0.21 0.00 0.82 0.00 0.00 66.70 65.06 3ddn h VAL 324 Cb 1.87 2.67 -0.16 0.00 -1.52 0.00 0.00 31.29 34.16 3ddn h VAL 324 CO 0.22 0.76 0.01 0.00 0.02 0.00 0.00 177.57 178.57 3ddn h ALA 325 N 0.35 0.95 0.00 1.67 0.00 -1.53 0.35 119.26 121.05 3ddn h ALA 325 Ca -0.18 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ddn h ALA 325 Cb 1.89 0.50 0.00 0.00 0.00 0.00 0.00 17.79 20.18 3ddn h ALA 325 CO 0.23 -0.48 0.00 -1.35 0.00 0.00 0.00 179.25 177.65 3ddn h PRO 326 N 0.07 0.00 0.00 0.00 0.11 -1.79 -2.62 132.00 127.77 3ddn h PRO 326 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 3ddn h PRO 326 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 3ddn h PRO 326 CO -0.79 0.00 0.00 -1.49 -0.21 0.00 0.00 178.00 175.51 3ddn h TRP 327 N 0.00 0.00 -0.51 0.65 4.06 -0.56 -3.34 115.95 116.26 3ddn h TRP 327 Ca 0.00 0.00 0.01 0.00 2.06 0.00 0.00 58.89 60.96 3ddn h TRP 327 Cb 0.31 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.44 3ddn h TRP 327 CO 0.00 0.00 0.32 -0.07 -3.56 0.00 0.00 178.44 175.13 3ddn h LEU 328 N 0.00 0.54 -0.47 -4.49 4.07 -1.55 -0.90 115.31 112.51 3ddn h LEU 328 Ca 0.00 -0.01 -0.16 0.00 0.08 0.00 0.00 57.88 57.79 3ddn h LEU 328 Cb 0.75 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 42.34 3ddn h LEU 328 CO 0.00 0.39 -0.76 -0.78 -1.08 0.00 0.00 178.44 176.20 3ddn h ASP 329 N 0.65 0.07 -0.15 -0.43 3.58 -1.79 -1.65 116.42 116.71 3ddn h ASP 329 Ca 0.20 -0.05 -0.04 0.00 0.42 0.00 0.00 57.03 57.56 3ddn h ASP 329 Cb -0.03 -0.02 -0.00 0.00 1.72 0.00 0.00 39.33 41.00 3ddn h ASP 329 CO -0.07 0.80 -0.05 0.25 -2.88 0.00 0.00 179.24 177.29 3ddn h LEU 330 N 0.03 0.30 -1.28 2.28 5.85 -1.60 -2.78 115.31 118.12 3ddn h LEU 330 Ca -0.01 -0.39 -0.07 0.00 0.84 0.00 0.00 57.88 58.24 3ddn h LEU 330 Cb 1.35 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 3ddn h LEU 330 CO 0.10 0.62 -0.35 0.58 -0.34 0.00 0.00 178.44 179.05 3ddn h VAL 331 N -0.03 1.18 -0.74 1.05 2.07 -1.08 -0.51 116.25 118.19 3ddn h VAL 331 Ca 0.03 -1.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.30 3ddn h VAL 331 Cb 0.50 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.92 3ddn h VAL 331 CO 0.02 0.35 0.42 -0.09 0.02 0.00 0.00 177.57 178.29 3ddn h ARG 332 N 0.00 1.02 -0.20 1.57 2.43 -1.24 -1.90 114.38 116.06 3ddn h ARG 332 Ca -0.00 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 58.94 3ddn h ARG 332 Cb 0.66 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 3ddn h ARG 332 CO 0.05 0.74 -0.37 0.87 -1.51 0.00 0.00 179.97 179.75 3ddn h LYS 333 N 1.02 0.44 -0.61 0.20 1.57 -0.86 -1.74 116.57 116.59 3ddn h LYS 333 Ca 0.26 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3ddn h LYS 333 Cb 0.01 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 3ddn h LYS 333 CO -0.05 0.75 0.33 -0.07 -0.57 0.00 0.00 179.45 179.85 3ddn h LEU 334 N 0.37 0.77 -0.83 2.94 3.38 -0.96 -1.54 115.31 119.43 3ddn h LEU 334 Ca 0.04 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.94 3ddn h LEU 334 Cb 0.83 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.33 3ddn h LEU 334 CO 0.07 0.65 0.54 1.23 0.09 0.00 0.00 178.44 181.02 3ddn h GLY 335 N 0.83 1.21 0.96 0.83 0.00 -1.05 0.13 103.07 105.98 3ddn h GLY 335 Ca 0.22 -0.41 0.01 0.00 0.00 0.00 0.00 47.33 47.14 3ddn h GLY 335 CO -0.03 0.36 0.20 -2.08 0.00 0.00 0.00 176.54 174.98 3ddn h VAL 336 N 1.05 1.06 -0.03 4.60 2.07 -1.05 -2.14 116.25 121.81 3ddn h VAL 336 Ca 0.33 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 3ddn h VAL 336 Cb -0.01 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 3ddn h VAL 336 CO -0.11 0.07 0.00 0.25 0.02 0.00 0.00 177.57 177.81 3ddn h LEU 337 N 0.41 0.06 -1.98 2.57 5.85 -0.81 -1.16 115.31 120.25 3ddn h LEU 337 Ca 0.12 -0.30 0.07 0.00 0.84 0.00 0.00 57.88 58.61 3ddn h LEU 337 Cb -0.02 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 3ddn h LEU 337 CO -0.04 0.34 0.18 0.00 -0.34 0.00 0.00 178.44 178.58 3ddn h ALA 338 N 0.72 2.20 0.08 1.25 0.00 -0.75 0.70 119.26 123.46 3ddn h ALA 338 Ca 0.01 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.64 3ddn h ALA 338 Cb 0.31 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.13 3ddn h ALA 338 CO 0.00 -0.26 -1.15 0.78 0.00 0.00 0.00 179.25 178.62 3ddn h GLY 339 N 0.03 0.59 0.97 0.00 0.00 -0.98 -2.90 103.07 100.77 3ddn h GLY 339 Ca 0.12 -1.18 -0.13 0.00 0.00 0.00 0.00 47.33 46.14 3ddn h GLY 339 CO -0.00 1.04 -0.32 -2.08 0.00 0.00 0.00 176.54 175.17 3ddn h VAL 340 N 0.25 1.31 0.00 4.60 2.07 -0.58 -3.04 116.25 120.85 3ddn h VAL 340 Ca -0.15 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 65.87 3ddn h VAL 340 Cb 1.82 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 33.23 3ddn h VAL 340 CO 0.21 0.48 0.00 0.18 0.02 0.00 0.00 177.57 178.46 3ddn n LEU 341 N -4.25 0.31 -4.80 2.57 4.77 0.18 -4.77 117.00 111.00 3ddn n LEU 341 Ca -0.04 0.57 -0.37 0.00 -0.03 0.00 0.00 56.01 56.14 3ddn n LEU 341 Cb 0.49 -0.53 -0.06 0.00 -2.33 0.00 0.00 43.42 41.00 3ddn n LEU 341 CO 0.45 -0.37 0.50 -0.44 -1.33 0.00 0.00 177.39 176.21 3ddn s SER 342 N -3.57 7.18 0.05 -1.43 0.01 -1.10 -5.00 113.70 109.85 3ddn s SER 342 Ca 0.06 1.58 -0.22 0.00 1.31 0.00 0.00 55.95 58.68 3ddn s SER 342 Cb 0.10 -2.48 -0.13 0.00 0.21 0.00 0.00 66.02 63.72 3ddn s SER 342 CO 0.34 0.01 1.49 0.44 0.41 0.00 0.00 173.24 175.94 3ddn h ASP 343 N 3.41 0.20 -4.34 2.44 3.32 -1.86 -3.46 116.42 116.13 3ddn h ASP 343 Ca -0.47 -0.29 -0.54 0.00 0.02 0.00 0.00 57.03 55.74 3ddn h ASP 343 Cb 1.19 -0.05 -0.13 0.00 0.22 0.00 0.00 39.33 40.56 3ddn h ASP 343 CO 0.65 0.44 -0.49 -1.61 -1.72 0.00 0.00 179.24 176.52 3ddn s GLU 344 N -5.04 1.92 -0.03 3.56 8.01 -1.26 -5.10 118.70 120.76 3ddn s GLU 344 Ca -0.14 -2.16 -0.35 0.00 0.01 0.00 0.00 54.97 52.33 3ddn s GLU 344 Cb 0.05 -0.17 -0.13 0.00 -4.31 0.00 0.00 34.13 29.57 3ddn s GLU 344 CO 0.70 -0.60 1.73 -0.11 0.01 0.00 0.00 175.26 176.99 3ddn n LEU 345 N -0.83 3.04 -4.75 1.80 -0.00 -1.26 -4.93 117.00 110.06 3ddn n LEU 345 Ca -0.00 1.03 -0.35 0.00 -0.00 0.00 0.00 56.01 56.69 3ddn n LEU 345 Cb 0.63 -1.34 0.05 0.00 -0.00 0.00 0.00 43.42 42.77 3ddn n LEU 345 CO 0.33 -0.26 0.82 -2.16 -0.00 0.00 0.00 177.39 176.12 3ddn s PRO 346 N 2.77 2.73 0.33 1.96 0.04 -1.26 -4.72 135.00 136.85 3ddn s PRO 346 Ca 0.89 1.77 0.18 0.00 0.04 0.00 0.00 61.00 63.88 3ddn s PRO 346 Cb -0.76 -1.90 0.15 0.00 0.04 0.00 0.00 34.50 32.03 3ddn s PRO 346 CO 0.49 -1.38 1.49 -0.39 0.04 0.00 0.00 177.00 177.25 3ddn h VAL 347 N 0.49 0.56 -3.32 -0.36 -1.51 -1.02 -3.46 116.25 107.63 3ddn h VAL 347 Ca -0.49 -1.80 -0.04 0.00 -1.23 0.00 0.00 66.70 63.14 3ddn h VAL 347 Cb 1.29 2.27 -0.12 0.00 -2.13 0.00 0.00 31.29 32.61 3ddn h VAL 347 CO 0.54 0.32 -0.00 -0.94 -1.23 0.00 0.00 177.57 176.25 3ddn s SER 348 N -6.36 -0.29 -0.18 4.19 1.04 -1.15 -2.29 113.70 108.67 3ddn s SER 348 Ca 0.05 -0.33 -0.02 0.00 0.48 0.00 0.00 55.95 56.13 3ddn s SER 348 Cb 0.07 0.52 -0.01 0.00 0.10 0.00 0.00 66.02 66.70 3ddn s SER 348 CO 0.72 -0.93 -0.09 -0.76 0.98 0.00 0.00 173.24 173.16 3ddn s LEU 349 N -2.82 2.79 -0.31 2.42 1.43 -0.36 -0.14 118.68 121.70 3ddn s LEU 349 Ca 0.05 -0.36 -0.11 0.00 -1.03 0.00 0.00 54.13 52.67 3ddn s LEU 349 Cb 0.01 -1.67 -0.03 0.00 0.03 0.00 0.00 46.19 44.53 3ddn s LEU 349 CO -0.09 0.07 0.20 -0.44 0.23 0.00 0.00 176.35 176.32 3ddn s SER 350 N 0.92 5.90 -0.34 2.29 0.01 0.20 -1.56 113.70 121.13 3ddn s SER 350 Ca -0.02 -0.30 -0.14 0.00 1.31 0.00 0.00 55.95 56.80 3ddn s SER 350 Cb -0.15 -2.10 -0.02 0.00 0.21 0.00 0.00 66.02 63.97 3ddn s SER 350 CO 0.00 -0.16 0.33 -0.69 0.41 0.00 0.00 173.24 173.13 3ddn s VAL 351 N 1.71 5.20 -0.23 3.43 1.01 0.08 0.08 120.40 131.68 3ddn s VAL 351 Ca 0.06 0.02 -0.10 0.00 0.00 0.00 0.00 61.98 61.96 3ddn s VAL 351 Cb -0.17 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 3ddn s VAL 351 CO 0.10 -0.05 0.15 -1.58 0.00 0.00 0.00 175.10 173.72 3ddn s GLN 352 N 1.94 4.08 -0.19 2.72 2.00 0.08 -0.57 119.66 129.72 3ddn s GLN 352 Ca 0.10 -0.27 -0.03 0.00 -2.00 0.00 0.00 55.36 53.17 3ddn s GLN 352 Cb -0.17 -3.49 -0.01 0.00 0.80 0.00 0.00 33.01 30.14 3ddn s GLN 352 CO 0.11 0.11 -0.06 0.08 -0.50 0.00 0.00 175.29 175.04 3ddn s VAL 353 N 0.90 3.40 0.07 1.34 1.01 0.21 -0.66 120.40 126.67 3ddn s VAL 353 Ca 0.07 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.60 3ddn s VAL 353 Cb -0.13 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 3ddn s VAL 353 CO 0.03 0.46 -0.14 -0.13 0.00 0.00 0.00 175.10 175.32 3ddn s ARG 354 N 1.05 0.82 3.00 2.72 0.52 -0.67 -1.09 118.95 125.29 3ddn s ARG 354 Ca 0.01 -0.97 0.00 0.00 -0.52 0.00 0.00 55.73 54.25 3ddn s ARG 354 Cb -0.15 -0.80 0.00 0.00 0.52 0.00 0.00 34.95 34.53 3ddn s ARG 354 CO -0.00 0.17 0.00 0.41 0.02 0.00 0.00 175.30 175.90 3ddn n GLY 355 N 1.22 -0.23 0.35 -3.53 0.00 -0.78 -2.21 105.19 100.02 3ddn n GLY 355 Ca -0.21 -1.13 -0.04 0.00 0.00 0.00 0.00 46.02 44.64 3ddn n GLY 355 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ddn h GLU 356 N 0.00 1.24 -0.15 1.61 5.08 -1.27 -0.73 114.58 120.37 3ddn h GLU 356 Ca 0.00 -0.17 0.04 0.00 -1.00 0.00 0.00 59.36 58.23 3ddn h GLU 356 Cb 0.00 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.01 3ddn h GLU 356 CO 0.00 0.93 0.23 1.25 -1.00 0.00 0.00 179.01 180.42 3ddn h LEU 357 N 1.24 0.00 -1.10 1.33 5.85 -1.82 -2.16 115.31 118.64 3ddn h LEU 357 Ca 0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.02 3ddn h LEU 357 Cb 0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.11 3ddn h LEU 357 CO -0.04 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.06 3ddn n ALA 358 N -2.21 1.36 1.29 1.25 0.00 -0.28 -1.35 120.51 120.56 3ddn n ALA 358 Ca 0.01 0.15 0.14 0.00 0.00 0.00 0.00 53.44 53.74 3ddn n ALA 358 Cb 0.33 -1.36 0.57 0.00 0.00 0.00 0.00 19.45 18.99 3ddn n ALA 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ddn n ALA 359 N -1.79 2.79 -2.03 0.00 0.00 -0.81 -4.89 120.51 113.78 3ddn n ALA 359 Ca 0.00 -0.25 -0.20 0.00 0.00 0.00 0.00 53.44 53.00 3ddn n ALA 359 Cb 0.14 -1.33 0.02 0.00 0.00 0.00 0.00 19.45 18.28 3ddn n ALA 359 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3ddn s GLU 360 N -2.63 2.69 -0.43 0.00 0.41 -0.46 -5.04 118.70 113.24 3ddn s GLU 360 Ca 0.24 -0.92 -0.26 0.00 -0.41 0.00 0.00 54.97 53.62 3ddn s GLU 360 Cb 0.20 -2.60 0.02 0.00 -1.78 0.00 0.00 34.13 29.97 3ddn s GLU 360 CO 0.51 -0.51 0.92 -1.21 -0.49 0.00 0.00 175.26 174.49 3ddn s GLU 361 N -4.59 3.64 -0.06 1.61 8.01 -1.26 -4.93 118.70 121.12 3ddn s GLU 361 Ca 0.55 0.30 0.09 0.00 0.01 0.00 0.00 54.97 55.92 3ddn s GLU 361 Cb -0.10 -3.88 0.14 0.00 -4.31 0.00 0.00 34.13 25.98 3ddn s GLU 361 CO 0.36 -1.13 1.03 1.33 0.01 0.00 0.00 175.26 176.86 3ddn n VAL 362 N 6.27 1.11 -0.35 2.63 0.24 -1.26 -4.77 118.33 122.21 3ddn n VAL 362 Ca 0.06 -1.30 0.08 0.00 -2.04 0.00 0.00 64.34 61.15 3ddn n VAL 362 Cb 0.48 0.18 0.26 0.00 -1.47 0.00 0.00 33.84 33.29 3ddn n VAL 362 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 3ddn h GLU 363 N 0.00 0.87 -0.78 7.34 4.39 -2.01 -1.07 114.58 123.32 3ddn h GLU 363 Ca 0.00 -0.05 0.19 0.00 0.34 0.00 0.00 59.36 59.84 3ddn h GLU 363 Cb 1.00 -0.20 -0.05 0.00 -0.10 0.00 0.00 28.75 29.41 3ddn h GLU 363 CO 0.00 0.58 0.54 -0.39 -1.16 0.00 0.00 179.01 178.57 3ddn h VAL 364 N 0.90 0.70 -0.93 3.13 -1.51 -1.95 -1.63 116.25 114.95 3ddn h VAL 364 Ca 0.51 -0.09 0.05 0.00 -1.23 0.00 0.00 66.70 65.94 3ddn h VAL 364 Cb 0.60 0.42 -0.06 0.00 -2.13 0.00 0.00 31.29 30.13 3ddn h VAL 364 CO -0.30 0.05 0.60 -0.07 -1.23 0.00 0.00 177.57 176.61 3ddn h LEU 365 N 0.25 0.98 -1.00 4.19 3.38 -1.56 0.19 115.31 121.74 3ddn h LEU 365 Ca 0.39 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.51 3ddn h LEU 365 Cb 1.15 -0.21 -0.09 0.00 0.09 0.00 0.00 40.66 41.59 3ddn h LEU 365 CO -0.09 0.66 0.62 -0.09 0.09 0.00 0.00 178.44 179.62 3ddn h ARG 366 N 1.14 0.88 -0.16 1.13 2.43 -1.38 -1.80 114.38 116.61 3ddn h ARG 366 Ca 0.39 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 59.31 3ddn h ARG 366 Cb 0.07 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.42 3ddn h ARG 366 CO -0.14 0.58 -0.66 -0.07 -1.51 0.00 0.00 179.97 178.17 3ddn h LEU 367 N 0.91 0.73 -0.24 3.80 3.38 -0.69 -3.00 115.31 120.19 3ddn h LEU 367 Ca 0.53 -0.44 0.03 0.00 0.09 0.00 0.00 57.88 58.09 3ddn h LEU 367 Cb 0.64 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 3ddn h LEU 367 CO -0.31 1.19 0.05 0.28 0.09 0.00 0.00 178.44 179.74 3ddn h SER 368 N 0.46 0.02 -0.45 -0.43 0.02 -0.76 -0.35 113.55 112.05 3ddn h SER 368 Ca -0.02 0.04 0.09 0.00 -0.84 0.00 0.00 61.79 61.06 3ddn h SER 368 Cb 1.25 0.05 -0.08 0.00 0.14 0.00 0.00 62.40 63.75 3ddn h SER 368 CO 0.13 0.04 -0.07 0.00 -1.14 0.00 0.00 176.83 175.79 3ddn h ALA 369 N 1.17 0.35 -0.69 3.77 0.00 -1.33 -0.28 119.26 122.24 3ddn h ALA 369 Ca 0.11 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 3ddn h ALA 369 Cb 0.10 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3ddn h ALA 369 CO -0.14 -0.43 0.16 -0.07 0.00 0.00 0.00 179.25 178.77 3ddn h LEU 370 N 0.04 1.05 -0.95 0.00 3.38 -1.35 0.66 115.31 118.13 3ddn h LEU 370 Ca 0.22 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ddn h LEU 370 Cb 0.34 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 3ddn h LEU 370 CO -0.44 1.01 0.59 -0.09 0.09 0.00 0.00 178.44 179.60 3ddn h ARG 371 N 1.05 1.28 0.09 1.13 1.12 -0.45 -1.13 114.38 117.47 3ddn h ARG 371 Ca 0.22 -0.11 -0.00 0.00 -1.11 0.00 0.00 59.98 58.98 3ddn h ARG 371 Cb 0.38 -0.27 0.00 0.00 -0.01 0.00 0.00 29.97 30.07 3ddn h ARG 371 CO 0.00 0.88 -0.04 0.78 -3.11 0.00 0.00 179.97 178.48 3ddn h GLY 372 N 1.30 -0.13 0.12 2.80 0.00 -0.61 -2.41 103.07 104.16 3ddn h GLY 372 Ca 0.34 0.05 0.19 0.00 0.00 0.00 0.00 47.33 47.91 3ddn h GLY 372 CO -0.07 -0.05 0.59 -2.00 0.00 0.00 0.00 176.54 175.02 3ddn h LEU 373 N -0.58 0.75 -2.79 3.11 5.85 -0.61 -2.50 115.31 118.54 3ddn h LEU 373 Ca -0.01 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.81 3ddn h LEU 373 Cb 0.48 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3ddn h LEU 373 CO 0.02 0.26 0.00 0.49 -0.34 0.00 0.00 178.44 178.87 3ddn n PHE 374 N -4.78 1.23 -0.29 1.25 3.01 -0.45 -4.64 117.46 112.79 3ddn n PHE 374 Ca 0.23 -0.53 0.18 0.00 1.01 0.00 0.00 57.45 58.35 3ddn n PHE 374 Cb 0.57 -0.15 0.46 0.00 -0.01 0.00 0.00 39.48 40.35 3ddn n PHE 374 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3ddn h SER 375 N 3.93 0.51 0.11 4.37 0.02 -0.95 0.98 113.55 122.52 3ddn h SER 375 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3ddn h SER 375 Cb 1.21 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.73 3ddn h SER 375 CO 0.14 0.18 0.00 0.00 -1.14 0.00 0.00 176.83 176.01 3ddn h ALA 376 N 1.62 1.00 0.00 3.77 0.00 -1.85 -1.47 119.26 122.32 3ddn h ALA 376 Ca 0.53 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.43 3ddn h ALA 376 Cb 1.18 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 3ddn h ALA 376 CO -0.25 0.00 -0.16 1.33 0.00 0.00 0.00 179.25 180.17 3ddn n VAL 377 N -2.92 1.81 -4.91 0.00 0.24 0.32 -4.80 118.33 108.07 3ddn n VAL 377 Ca -0.02 -2.32 -0.27 0.00 -2.04 0.00 0.00 64.34 59.68 3ddn n VAL 377 Cb 0.09 -0.17 -0.16 0.00 -1.47 0.00 0.00 33.84 32.12 3ddn n VAL 377 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3ddn s ILE 378 N -2.73 1.56 0.33 1.34 1.01 -0.56 -4.88 121.20 117.27 3ddn s ILE 378 Ca 0.31 -0.77 -0.25 0.00 0.00 0.00 0.00 60.65 59.94 3ddn s ILE 378 Cb 0.28 -1.35 -0.10 0.00 0.01 0.00 0.00 42.46 41.31 3ddn s ILE 378 CO 0.00 0.45 0.93 -1.61 0.00 0.00 0.00 174.94 174.71 3ddn s GLU 379 N 0.15 4.52 0.18 2.79 2.02 -1.26 -4.87 118.70 122.23 3ddn s GLU 379 Ca -0.08 1.27 -0.14 0.00 0.02 0.00 0.00 54.97 56.05 3ddn s GLU 379 Cb -0.13 -2.71 0.15 0.00 0.10 0.00 0.00 34.13 31.54 3ddn s GLU 379 CO 0.04 0.24 1.73 -0.44 0.02 0.00 0.00 175.26 176.85 3ddn h ASP 380 N 3.00 0.07 -0.96 -0.19 3.45 -1.94 -2.70 116.42 117.14 3ddn h ASP 380 Ca -0.47 0.07 0.22 0.00 0.43 0.00 0.00 57.03 57.27 3ddn h ASP 380 Cb 1.19 0.08 -0.12 0.00 -0.56 0.00 0.00 39.33 39.92 3ddn h ASP 380 CO 0.64 0.07 0.53 0.00 -1.57 0.00 0.00 179.24 178.92 3ddn h ALA 381 N 1.34 1.62 -2.89 3.45 0.00 -1.97 -3.41 119.26 117.40 3ddn h ALA 381 Ca 0.23 0.12 -0.53 0.00 0.00 0.00 0.00 54.91 54.73 3ddn h ALA 381 Cb 0.27 0.02 0.08 0.00 0.00 0.00 0.00 17.79 18.17 3ddn h ALA 381 CO -0.27 -0.22 0.64 0.08 0.00 0.00 0.00 179.25 179.48 3ddn s VAL 382 N -5.84 2.55 0.00 0.00 1.01 -1.02 -4.86 120.40 112.24 3ddn s VAL 382 Ca -0.11 0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.37 3ddn s VAL 382 Cb 0.26 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 33.33 3ddn s VAL 382 CO 0.79 0.09 0.00 0.41 0.00 0.00 0.00 175.10 176.39 3ddn n THR 383 N 0.24 0.00 -4.01 3.92 -1.04 0.11 -4.94 114.28 108.56 3ddn n THR 383 Ca 0.03 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.73 3ddn n THR 383 Cb 0.43 -0.45 -0.06 0.00 -1.82 0.00 0.00 70.33 68.43 3ddn n THR 383 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 3ddn s PHE 384 N -1.60 3.34 0.12 -1.42 2.19 -1.16 -4.80 117.98 114.65 3ddn s PHE 384 Ca 0.00 0.18 0.04 0.00 0.33 0.00 0.00 56.93 57.47 3ddn s PHE 384 Cb 0.00 -1.70 -0.04 0.00 -1.31 0.00 0.00 43.02 39.97 3ddn s PHE 384 CO 0.00 0.56 -0.09 0.14 1.83 0.00 0.00 175.22 177.66 3ddn s VAL 385 N -1.38 0.99 -0.50 3.12 -7.23 -1.26 -4.78 120.40 109.36 3ddn s VAL 385 Ca 0.30 -1.91 -0.28 0.00 -1.81 0.00 0.00 61.98 58.27 3ddn s VAL 385 Cb -0.12 -1.67 0.03 0.00 0.56 0.00 0.00 36.38 35.17 3ddn s VAL 385 CO 0.22 -0.73 1.10 0.21 -0.31 0.00 0.00 175.10 175.59 3ddn s ASN 386 N -2.94 6.56 0.04 4.85 3.84 -1.26 -4.94 114.94 121.10 3ddn s ASN 386 Ca 0.12 0.31 -0.25 0.00 0.21 0.00 0.00 52.86 53.25 3ddn s ASN 386 Cb 0.02 -2.53 -0.17 0.00 -0.55 0.00 0.00 41.25 38.02 3ddn s ASN 386 CO -0.01 -1.25 1.49 0.00 -2.79 0.00 0.00 177.10 174.54 3ddn h ALA 387 N 9.26 -0.20 -0.96 1.71 0.00 -1.99 -0.89 119.26 126.19 3ddn h ALA 387 Ca -0.24 -0.13 0.17 0.00 0.00 0.00 0.00 54.91 54.72 3ddn h ALA 387 Cb 1.06 0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 3ddn h ALA 387 CO 1.12 -0.51 0.56 -1.35 0.00 0.00 0.00 179.25 179.07 3ddn h PRO 388 N -0.40 0.73 -0.23 0.00 0.11 -1.96 0.17 132.00 130.42 3ddn h PRO 388 Ca -0.02 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.90 3ddn h PRO 388 Cb 0.32 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.26 3ddn h PRO 388 CO 0.03 0.48 -0.42 0.00 -0.21 0.00 0.00 178.00 177.89 3ddn h ALA 389 N 1.61 0.35 -0.36 -0.75 0.00 -1.94 -2.16 119.26 116.01 3ddn h ALA 389 Ca 0.54 -0.46 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3ddn h ALA 389 Cb 0.79 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 3ddn h ALA 389 CO -0.37 0.47 0.18 1.25 0.00 0.00 0.00 179.25 180.79 3ddn h LEU 390 N 0.39 0.27 -0.28 0.00 5.85 -0.44 0.22 115.31 121.32 3ddn h LEU 390 Ca 0.01 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.78 3ddn h LEU 390 Cb 1.02 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 3ddn h LEU 390 CO 0.09 0.20 0.10 0.00 -0.34 0.00 0.00 178.44 178.50 3ddn h ALA 391 N 1.19 0.32 -0.40 1.25 0.00 -0.64 0.98 119.26 121.95 3ddn h ALA 391 Ca 0.15 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 3ddn h ALA 391 Cb 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3ddn h ALA 391 CO -0.10 -0.30 -0.12 0.00 0.00 0.00 0.00 179.25 178.73 3ddn h ALA 392 N 1.17 0.56 -0.01 0.00 0.00 -1.24 -0.87 119.26 118.86 3ddn h ALA 392 Ca 0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3ddn h ALA 392 Cb 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3ddn h ALA 392 CO -0.12 0.45 -0.04 1.49 0.00 0.00 0.00 179.25 181.03 3ddn h GLU 393 N 0.61 0.05 0.00 0.00 4.81 -0.45 -3.40 114.58 116.20 3ddn h GLU 393 Ca 0.10 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3ddn h GLU 393 Cb 0.65 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.03 3ddn h GLU 393 CO 0.04 0.63 -0.63 0.54 -0.73 0.00 0.00 179.01 178.87 3ddn n ARG 394 N -4.76 3.26 -0.55 1.92 1.74 0.33 -4.95 116.66 113.65 3ddn n ARG 394 Ca -0.09 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 3ddn n ARG 394 Cb 0.32 -0.98 0.00 0.00 -1.02 0.00 0.00 32.46 30.78 3ddn n ARG 394 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ddn n GLY 395 N 1.37 0.71 3.40 -0.13 0.00 -0.33 -2.01 105.19 108.21 3ddn n GLY 395 Ca 0.01 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 3ddn n GLY 395 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ddn s VAL 396 N -2.00 3.05 0.42 1.61 1.01 -1.25 -4.84 120.40 118.39 3ddn s VAL 396 Ca 0.00 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.36 3ddn s VAL 396 Cb 0.00 -2.25 -0.06 0.00 0.00 0.00 0.00 36.38 34.07 3ddn s VAL 396 CO 0.00 0.55 0.10 0.42 0.00 0.00 0.00 175.10 176.17 3ddn s THR 397 N 0.00 2.10 0.02 3.92 -4.23 -0.97 -3.60 115.64 112.88 3ddn s THR 397 Ca -0.04 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 58.63 3ddn s THR 397 Cb -0.14 -2.94 -0.01 0.00 1.34 0.00 0.00 72.50 70.74 3ddn s THR 397 CO 0.04 0.00 -0.03 0.00 -0.54 0.00 0.00 174.62 174.09 3ddn s ALA 398 N -2.67 0.18 0.17 3.99 0.00 -1.26 -1.22 121.76 120.96 3ddn s ALA 398 Ca 0.37 -0.44 0.05 0.00 0.00 0.00 0.00 51.96 51.93 3ddn s ALA 398 Cb 0.06 0.08 -0.05 0.00 0.00 0.00 0.00 23.12 23.21 3ddn s ALA 398 CO 0.20 -0.08 -0.08 -1.83 0.00 0.00 0.00 175.76 173.96 3ddn s GLU 399 N -1.01 1.15 -0.02 0.00 -1.05 -0.60 -4.97 118.70 112.20 3ddn s GLU 399 Ca -0.10 -1.51 0.04 0.00 -0.15 0.00 0.00 54.97 53.25 3ddn s GLU 399 Cb -0.07 -0.67 -0.03 0.00 -0.44 0.00 0.00 34.13 32.92 3ddn s GLU 399 CO -0.00 0.05 -0.14 0.42 0.95 0.00 0.00 175.26 176.53 3ddn s ILE 400 N -3.31 3.09 -0.02 1.83 -1.09 -1.26 -0.74 121.20 119.70 3ddn s ILE 400 Ca 0.20 -0.85 0.03 0.00 -2.23 0.00 0.00 60.65 57.80 3ddn s ILE 400 Cb 0.03 -2.26 -0.00 0.00 -1.58 0.00 0.00 42.46 38.65 3ddn s ILE 400 CO 0.03 0.49 -0.10 0.00 -1.23 0.00 0.00 174.94 174.13 3ddn s LYS 402 N -0.04 2.45 -0.01 0.00 1.02 -1.26 -0.62 119.74 121.29 3ddn s LYS 402 Ca 0.01 -0.88 -0.00 0.00 0.02 0.00 0.00 55.97 55.11 3ddn s LYS 402 Cb -0.06 -2.49 0.01 0.00 -0.52 0.00 0.00 37.83 34.76 3ddn s LYS 402 CO 0.00 0.53 0.02 0.00 -0.92 0.00 0.00 175.35 174.98 3ddn s ALA 403 N -1.29 -0.02 0.22 5.17 0.00 -0.25 -4.93 121.76 120.65 3ddn s ALA 403 Ca 0.25 0.08 -0.08 0.00 0.00 0.00 0.00 51.96 52.21 3ddn s ALA 403 Cb -0.12 -0.06 0.17 0.00 0.00 0.00 0.00 23.12 23.12 3ddn s ALA 403 CO 0.17 -0.02 1.81 0.77 0.00 0.00 0.00 175.76 178.49 3ddn h SER 404 N 6.29 1.07 -3.30 0.00 0.02 -1.87 -2.39 113.55 113.38 3ddn h SER 404 Ca -0.27 -0.13 -0.58 0.00 -0.84 0.00 0.00 61.79 59.96 3ddn h SER 404 Cb 1.20 -0.27 -0.08 0.00 0.14 0.00 0.00 62.40 63.38 3ddn h SER 404 CO 0.50 0.90 -0.18 -0.70 -1.14 0.00 0.00 176.83 176.21 3ddn s GLU 405 N -5.70 4.29 -0.14 3.45 2.12 -1.26 -1.86 118.70 119.59 3ddn s GLU 405 Ca -0.13 0.38 -0.03 0.00 0.36 0.00 0.00 54.97 55.56 3ddn s GLU 405 Cb 0.16 -3.42 -0.03 0.00 0.26 0.00 0.00 34.13 31.11 3ddn s GLU 405 CO 0.83 0.22 -0.05 0.45 -0.54 0.00 0.00 175.26 176.16 3ddn s SER 406 N 0.44 4.67 0.39 -1.70 0.15 -1.26 -4.00 113.70 112.39 3ddn s SER 406 Ca 0.24 -0.14 0.06 0.00 0.70 0.00 0.00 55.95 56.81 3ddn s SER 406 Cb -0.15 -1.69 0.79 0.00 -1.71 0.00 0.00 66.02 63.26 3ddn s SER 406 CO 0.09 0.19 2.03 1.55 1.20 0.00 0.00 173.24 178.30 3ddn h PRO 407 N 6.51 0.64 0.00 5.44 0.13 -1.96 -3.43 132.00 139.34 3ddn h PRO 407 Ca -0.32 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 3ddn h PRO 407 Cb 1.19 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.18 3ddn h PRO 407 CO 0.61 0.43 0.00 -1.71 -0.23 0.00 0.00 178.00 177.09 3ddn n ASN 408 N -4.46 0.06 -4.79 1.44 5.15 -1.26 -5.07 115.26 106.33 3ddn n ASN 408 Ca 0.06 0.07 -0.33 0.00 -0.60 0.00 0.00 54.58 53.77 3ddn n ASN 408 Cb 0.10 0.02 0.02 0.00 -0.53 0.00 0.00 39.78 39.39 3ddn n ASN 408 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 3ddn s HIS 409 N -1.18 2.83 0.51 1.20 3.76 -1.26 -4.92 115.29 116.22 3ddn s HIS 409 Ca 0.00 1.53 0.15 0.00 -0.15 0.00 0.00 55.06 56.59 3ddn s HIS 409 Cb 0.00 -3.10 1.22 0.00 1.11 0.00 0.00 32.58 31.80 3ddn s HIS 409 CO 0.00 -1.32 2.14 0.00 -0.85 0.00 0.00 174.74 174.70 3ddn h ARG 410 N 0.54 0.07 -3.36 1.40 3.08 -1.95 -3.42 114.38 110.75 3ddn h ARG 410 Ca -0.48 -0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.39 3ddn h ARG 410 Cb 1.23 -0.02 -0.25 0.00 0.08 0.00 0.00 29.97 31.01 3ddn h ARG 410 CO 0.56 0.05 -0.51 -1.12 -1.07 0.00 0.00 179.97 177.88 3ddn s SER 411 N -7.00 -0.14 0.00 7.04 0.01 -1.26 -0.96 113.70 111.39 3ddn s SER 411 Ca -0.05 0.23 -0.06 0.00 1.31 0.00 0.00 55.95 57.38 3ddn s SER 411 Cb 0.17 0.32 -0.00 0.00 0.21 0.00 0.00 66.02 66.72 3ddn s SER 411 CO 0.68 -0.12 0.12 0.54 0.41 0.00 0.00 173.24 174.87 3ddn s VAL 412 N -0.20 0.08 -0.15 3.43 0.11 -0.94 -4.68 120.40 118.06 3ddn s VAL 412 Ca -0.03 -0.67 0.01 0.00 -2.93 0.00 0.00 61.98 58.36 3ddn s VAL 412 Cb -0.02 -0.40 0.00 0.00 -1.53 0.00 0.00 36.38 34.43 3ddn s VAL 412 CO 0.00 -0.37 -0.17 -0.69 -3.33 0.00 0.00 175.10 170.55 3ddn s VAL 413 N -1.29 2.55 -0.17 2.04 1.01 -0.67 -1.67 120.40 122.20 3ddn s VAL 413 Ca -0.14 -0.81 -0.06 0.00 0.00 0.00 0.00 61.98 60.97 3ddn s VAL 413 Cb -0.07 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 3ddn s VAL 413 CO 0.01 0.52 0.02 -1.81 0.00 0.00 0.00 175.10 173.84 3ddn s ASP 414 N 0.79 5.24 -0.35 3.32 -0.00 0.17 -1.54 116.67 124.31 3ddn s ASP 414 Ca -0.06 -0.02 -0.11 0.00 -0.00 0.00 0.00 52.55 52.36 3ddn s ASP 414 Cb -0.15 -1.88 0.01 0.00 -0.00 0.00 0.00 42.92 40.89 3ddn s ASP 414 CO -0.00 0.17 0.20 -0.69 -0.00 0.00 0.00 175.17 174.85 3ddn s VAL 415 N 0.38 4.77 -0.34 -1.27 1.01 0.10 -0.74 120.40 124.31 3ddn s VAL 415 Ca -0.00 -0.59 -0.17 0.00 0.00 0.00 0.00 61.98 61.22 3ddn s VAL 415 Cb -0.13 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 3ddn s VAL 415 CO 0.01 -0.11 0.45 -0.13 0.00 0.00 0.00 175.10 175.33 3ddn s ARG 416 N 1.61 3.64 -0.36 2.72 0.52 0.11 -1.71 118.95 125.49 3ddn s ARG 416 Ca 0.04 -0.22 -0.17 0.00 -0.52 0.00 0.00 55.73 54.86 3ddn s ARG 416 Cb -0.18 -3.79 -0.00 0.00 0.52 0.00 0.00 34.95 31.49 3ddn s ARG 416 CO 0.07 -0.57 0.43 0.00 0.02 0.00 0.00 175.30 175.25 3ddn s ALA 417 N 2.24 3.48 -0.19 2.13 0.00 0.96 0.62 121.76 130.99 3ddn s ALA 417 Ca 0.16 -1.19 -0.07 0.00 0.00 0.00 0.00 51.96 50.86 3ddn s ALA 417 Cb -0.16 -2.93 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 3ddn s ALA 417 CO 0.12 -1.22 0.06 0.54 0.00 0.00 0.00 175.76 175.26 3ddn s VAL 418 N 2.18 4.64 0.48 0.00 0.11 0.81 -1.26 120.40 127.35 3ddn s VAL 418 Ca 0.14 -0.08 -0.11 0.00 -2.93 0.00 0.00 61.98 59.00 3ddn s VAL 418 Cb -0.16 -3.10 -0.06 0.00 -1.53 0.00 0.00 36.38 31.53 3ddn s VAL 418 CO 0.13 0.44 0.86 -0.83 -3.33 0.00 0.00 175.10 172.37 3ddn s GLY 419 N 0.60 1.84 0.62 6.54 0.00 0.26 -0.40 107.32 116.77 3ddn s GLY 419 Ca 0.03 -0.16 0.31 0.00 0.00 0.00 0.00 44.72 44.90 3ddn s GLY 419 CO 0.01 0.06 2.03 0.00 0.00 0.00 0.00 173.10 175.20 3ddn h ALA 420 N 0.75 1.67 -0.24 3.20 0.00 -1.88 0.14 119.26 122.90 3ddn h ALA 420 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3ddn h ALA 420 Cb 1.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3ddn h ALA 420 CO 0.63 -0.37 0.00 -0.40 0.00 0.00 0.00 179.25 179.11 3ddn n ASP 421 N -3.45 2.34 0.00 0.00 3.85 -1.26 -4.91 116.55 113.12 3ddn n ASP 421 Ca 0.02 -1.82 0.00 0.00 -0.71 0.00 0.00 54.79 52.27 3ddn n ASP 421 Cb 0.39 -0.15 0.00 0.00 -1.35 0.00 0.00 41.12 40.01 3ddn n ASP 421 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3ddn n GLY 422 N 1.27 0.75 3.88 6.12 0.00 0.50 -5.05 105.19 112.65 3ddn n GLY 422 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 3ddn n GLY 422 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ddn s SER 423 N -2.47 6.22 -0.01 1.61 1.04 -1.26 -4.80 113.70 114.03 3ddn s SER 423 Ca 0.00 1.34 0.00 0.00 0.48 0.00 0.00 55.95 57.78 3ddn s SER 423 Cb 0.00 -2.43 0.01 0.00 0.10 0.00 0.00 66.02 63.70 3ddn s SER 423 CO 0.00 -0.84 -0.00 -0.69 0.98 0.00 0.00 173.24 172.69 3ddn s VAL 424 N -3.12 0.11 -0.12 5.02 1.01 -1.26 -0.58 120.40 121.47 3ddn s VAL 424 Ca 0.54 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.55 3ddn s VAL 424 Cb -0.11 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.10 3ddn s VAL 424 CO 0.53 0.08 -0.16 -0.69 0.00 0.00 0.00 175.10 174.85 3ddn s VAL 425 N 0.45 2.81 -0.09 2.92 1.01 -0.39 -4.96 120.40 122.15 3ddn s VAL 425 Ca -0.04 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.23 3ddn s VAL 425 Cb -0.06 -2.15 -0.00 0.00 0.00 0.00 0.00 36.38 34.16 3ddn s VAL 425 CO -0.01 0.54 -0.23 -0.89 0.00 0.00 0.00 175.10 174.50 3ddn s THR 426 N 0.29 1.98 -0.02 3.92 2.01 -1.26 -0.03 115.64 122.52 3ddn s THR 426 Ca -0.12 -0.99 0.02 0.00 0.31 0.00 0.00 61.69 60.92 3ddn s THR 426 Cb -0.16 -1.70 0.01 0.00 0.01 0.00 0.00 72.50 70.65 3ddn s THR 426 CO 0.06 0.54 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.78 3ddn s VAL 427 N 0.23 0.60 0.07 3.82 1.01 -0.69 -0.70 120.40 124.74 3ddn s VAL 427 Ca -0.14 -0.25 0.08 0.00 0.00 0.00 0.00 61.98 61.66 3ddn s VAL 427 Cb -0.17 -0.55 -0.03 0.00 0.00 0.00 0.00 36.38 35.63 3ddn s VAL 427 CO 0.07 0.20 -0.21 -0.44 0.00 0.00 0.00 175.10 174.72 3ddn s SER 428 N 0.29 2.52 0.08 3.32 0.01 -0.27 0.02 113.70 119.66 3ddn s SER 428 Ca -0.04 -0.60 0.00 0.00 1.31 0.00 0.00 55.95 56.62 3ddn s SER 428 Cb -0.08 -0.17 -0.04 0.00 0.21 0.00 0.00 66.02 65.93 3ddn s SER 428 CO 0.00 0.11 -0.05 -0.83 0.41 0.00 0.00 173.24 172.88 3ddn s GLY 429 N -1.54 0.63 0.30 3.44 0.00 -0.59 -0.39 107.32 109.17 3ddn s GLY 429 Ca 0.07 -1.27 0.04 0.00 0.00 0.00 0.00 44.72 43.55 3ddn s GLY 429 CO 0.03 -1.38 0.04 -0.51 0.00 0.00 0.00 173.10 171.28 3ddn s THR 430 N -3.72 1.16 0.02 0.90 -4.23 -0.39 -1.67 115.64 107.71 3ddn s THR 430 Ca 0.09 -2.02 0.07 0.00 -1.18 0.00 0.00 61.69 58.66 3ddn s THR 430 Cb 0.06 -2.67 -0.03 0.00 1.34 0.00 0.00 72.50 71.20 3ddn s THR 430 CO -0.07 -0.09 -0.22 -0.76 -0.54 0.00 0.00 174.62 172.95 3ddn s LEU 431 N -3.44 2.39 0.09 4.79 1.43 -1.26 -0.80 118.68 121.88 3ddn s LEU 431 Ca 0.35 -0.46 -0.25 0.00 -1.03 0.00 0.00 54.13 52.74 3ddn s LEU 431 Cb 0.08 -1.42 0.07 0.00 0.03 0.00 0.00 46.19 44.94 3ddn s LEU 431 CO 0.14 0.28 0.61 -0.72 0.23 0.00 0.00 176.35 176.89 3ddn s TYR 432 N -0.81 -0.55 0.00 0.29 -0.85 -1.17 -4.94 117.35 109.31 3ddn s TYR 432 Ca 0.13 0.57 0.00 0.00 -0.52 0.00 0.00 57.07 57.24 3ddn s TYR 432 Cb -0.10 0.48 0.00 0.00 0.38 0.00 0.00 41.96 42.72 3ddn s TYR 432 CO 0.03 -0.75 0.00 0.41 -1.52 0.00 0.00 175.55 173.71 3ddn n GLY 433 N 0.09 1.90 0.37 5.49 0.00 -1.26 -2.32 105.19 109.45 3ddn n GLY 433 Ca -0.18 -2.01 0.16 0.00 0.00 0.00 0.00 46.02 44.00 3ddn n GLY 433 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ddn h PRO 434 N 0.00 0.19 -0.01 1.61 0.13 -2.02 0.21 132.00 132.11 3ddn h PRO 434 Ca 0.00 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 3ddn h PRO 434 Cb 0.00 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.09 3ddn h PRO 434 CO 0.00 0.13 -0.55 1.04 -0.23 0.00 0.00 178.00 178.38 3ddn n GLN 435 N -4.43 0.67 -3.59 0.86 1.13 -1.26 -4.98 117.38 105.78 3ddn n GLN 435 Ca 0.10 -0.51 -0.20 0.00 -1.94 0.00 0.00 57.00 54.45 3ddn n GLN 435 Cb 0.50 -1.49 0.05 0.00 0.11 0.00 0.00 30.24 29.42 3ddn n GLN 435 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3ddn n LEU 436 N -0.72 -3.54 -4.76 1.08 4.77 0.06 -4.90 117.00 109.00 3ddn n LEU 436 Ca 0.08 -0.77 -0.41 0.00 -0.03 0.00 0.00 56.01 54.89 3ddn n LEU 436 Cb 0.39 -2.82 -0.02 0.00 -2.33 0.00 0.00 43.42 38.64 3ddn n LEU 436 CO 0.32 0.38 1.01 -0.94 -1.33 0.00 0.00 177.39 176.83 3ddn s SER 437 N -4.25 6.74 -0.10 -1.43 1.04 -0.98 -4.60 113.70 110.13 3ddn s SER 437 Ca 0.06 2.68 -0.29 0.00 0.48 0.00 0.00 55.95 58.88 3ddn s SER 437 Cb -0.01 -2.64 -0.02 0.00 0.10 0.00 0.00 66.02 63.45 3ddn s SER 437 CO 0.79 -0.58 0.97 -1.10 0.98 0.00 0.00 173.24 174.29 3ddn s GLN 438 N -1.40 4.43 -0.06 4.02 -0.21 -1.26 -3.05 119.66 122.13 3ddn s GLN 438 Ca 0.52 1.33 0.03 0.00 0.02 0.00 0.00 55.36 57.25 3ddn s GLN 438 Cb -0.40 -3.53 0.01 0.00 1.00 0.00 0.00 33.01 30.09 3ddn s GLN 438 CO 0.50 -0.26 -0.13 0.15 -2.12 0.00 0.00 175.29 173.44 3ddn s LYS 439 N 1.82 1.64 -0.08 2.91 -0.14 0.02 -1.30 119.74 124.60 3ddn s LYS 439 Ca 0.47 -0.43 -0.28 0.00 -1.36 0.00 0.00 55.97 54.37 3ddn s LYS 439 Cb -0.18 -1.38 -0.02 0.00 -1.68 0.00 0.00 37.83 34.57 3ddn s LYS 439 CO 0.19 0.07 0.93 0.42 -0.76 0.00 0.00 175.35 176.20 3ddn s ILE 440 N 0.51 4.86 0.00 2.17 1.01 0.93 -1.26 121.20 129.42 3ddn s ILE 440 Ca -0.12 1.90 0.00 0.00 0.00 0.00 0.00 60.65 62.43 3ddn s ILE 440 Cb -0.14 -4.25 0.00 0.00 0.01 0.00 0.00 42.46 38.08 3ddn s ILE 440 CO 0.03 0.09 0.00 1.33 0.00 0.00 0.00 174.94 176.39 3ddn n VAL 441 N 4.29 0.00 -3.67 2.92 0.24 0.47 -1.54 118.33 121.04 3ddn n VAL 441 Ca 0.06 -0.39 -0.14 0.00 -2.04 0.00 0.00 64.34 61.83 3ddn n VAL 441 Cb 0.50 0.97 -0.08 0.00 -1.47 0.00 0.00 33.84 33.75 3ddn n VAL 441 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3ddn s GLN 442 N -0.87 0.71 -0.08 7.34 0.74 -1.16 -1.65 119.66 124.68 3ddn s GLN 442 Ca 0.00 0.75 -0.00 0.00 0.05 0.00 0.00 55.36 56.15 3ddn s GLN 442 Cb 0.00 0.34 0.03 0.00 1.10 0.00 0.00 33.01 34.48 3ddn s GLN 442 CO 0.00 -0.10 -0.03 0.42 -0.55 0.00 0.00 175.29 175.03 3ddn s ILE 443 N 0.17 0.60 -1.27 -2.34 1.01 0.04 -1.11 121.20 118.29 3ddn s ILE 443 Ca -0.01 -0.05 -0.26 0.00 0.00 0.00 0.00 60.65 60.33 3ddn s ILE 443 Cb -0.04 -0.68 0.03 0.00 0.01 0.00 0.00 42.46 41.78 3ddn s ILE 443 CO 0.01 0.28 0.57 0.59 0.00 0.00 0.00 174.94 176.40 3ddn n ASN 444 N 4.82 -3.25 0.00 3.58 3.02 0.12 -1.02 115.26 122.53 3ddn n ASN 444 Ca -0.13 -1.25 0.00 0.00 -0.03 0.00 0.00 54.58 53.17 3ddn n ASN 444 Cb 0.50 -1.92 0.00 0.00 -0.61 0.00 0.00 39.78 37.75 3ddn n ASN 444 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ddn n GLY 445 N -2.13 1.12 3.69 7.41 0.00 -1.26 -5.00 105.19 109.02 3ddn n GLY 445 Ca -0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 3ddn n GLY 445 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ddn s ARG 446 N -0.09 3.83 0.03 1.61 3.00 -0.18 -5.10 118.95 122.05 3ddn s ARG 446 Ca 0.00 -0.30 0.02 0.00 0.00 0.00 0.00 55.73 55.45 3ddn s ARG 446 Cb 0.00 -3.20 -0.04 0.00 0.00 0.00 0.00 34.95 31.71 3ddn s ARG 446 CO 0.00 0.39 0.02 -1.01 0.00 0.00 0.00 175.30 174.70 3ddn s HIS 447 N 0.04 3.09 0.02 -0.53 3.76 -1.26 -0.78 115.29 119.63 3ddn s HIS 447 Ca 0.06 0.06 -0.03 0.00 -0.15 0.00 0.00 55.06 55.00 3ddn s HIS 447 Cb -0.12 -1.63 0.01 0.00 1.11 0.00 0.00 32.58 31.95 3ddn s HIS 447 CO 0.01 0.48 0.16 1.97 -0.85 0.00 0.00 174.74 176.51 3ddn n PHE 448 N 1.02 -0.57 -3.41 1.40 1.16 -0.66 -4.97 117.46 111.44 3ddn n PHE 448 Ca -0.12 -0.17 -0.20 0.00 -1.87 0.00 0.00 57.45 55.08 3ddn n PHE 448 Cb 0.52 0.08 -0.10 0.00 -1.61 0.00 0.00 39.48 38.38 3ddn n PHE 448 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 3ddn s ASP 449 N -1.38 1.88 -0.04 5.98 -1.08 -1.25 -4.18 116.67 116.59 3ddn s ASP 449 Ca 0.04 -1.37 0.04 0.00 -0.52 0.00 0.00 52.55 50.73 3ddn s ASP 449 Cb -0.00 0.29 0.00 0.00 -1.46 0.00 0.00 42.92 41.75 3ddn s ASP 449 CO 0.01 -0.33 -0.15 -0.76 0.52 0.00 0.00 175.17 174.46 3ddn s LEU 450 N 1.76 1.85 0.01 -1.34 1.43 -0.59 -4.97 118.68 116.82 3ddn s LEU 450 Ca 0.14 -0.32 -0.39 0.00 -1.03 0.00 0.00 54.13 52.53 3ddn s LEU 450 Cb -0.16 -0.88 -0.18 0.00 0.03 0.00 0.00 46.19 45.00 3ddn s LEU 450 CO -0.16 0.12 1.28 0.54 0.23 0.00 0.00 176.35 178.35 3ddn n ARG 451 N 3.29 0.69 -2.77 1.70 1.74 -1.26 -0.05 116.66 119.99 3ddn n ARG 451 Ca -0.19 0.25 -0.43 0.00 -0.77 0.00 0.00 57.85 56.71 3ddn n ARG 451 Cb 0.53 -1.84 -0.00 0.00 -1.02 0.00 0.00 32.46 30.13 3ddn n ARG 451 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ddn s ALA 452 N 0.60 3.60 0.12 7.54 0.00 -0.42 -4.68 121.76 128.51 3ddn s ALA 452 Ca 0.89 -3.07 -0.25 0.00 0.00 0.00 0.00 51.96 49.52 3ddn s ALA 452 Cb -1.10 -4.35 0.07 0.00 0.00 0.00 0.00 23.12 17.74 3ddn s ALA 452 CO 0.53 -3.05 0.84 1.14 0.00 0.00 0.00 175.76 175.22 3ddn s GLN 453 N 2.94 1.16 1.75 0.00 -2.07 -1.26 -4.88 119.66 117.30 3ddn s GLN 453 Ca 0.47 -0.54 0.00 0.00 -1.82 0.00 0.00 55.36 53.46 3ddn s GLN 453 Cb -0.00 0.46 0.00 0.00 -1.09 0.00 0.00 33.01 32.38 3ddn s GLN 453 CO 0.02 -0.52 0.00 0.41 -1.32 0.00 0.00 175.29 173.88 3ddn n GLY 454 N -0.37 -1.20 3.63 2.60 0.00 -1.26 -4.58 105.19 104.01 3ddn n GLY 454 Ca -0.09 -1.13 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 3ddn n GLY 454 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ddn s ILE 455 N 0.00 4.87 -0.12 -0.61 1.09 -1.25 -0.04 121.20 125.15 3ddn s ILE 455 Ca 0.00 1.33 0.01 0.00 -1.10 0.00 0.00 60.65 60.88 3ddn s ILE 455 Cb 0.00 -4.07 -0.01 0.00 -1.06 0.00 0.00 42.46 37.32 3ddn s ILE 455 CO 0.00 -0.09 -0.15 0.20 -0.10 0.00 0.00 174.94 174.80 3ddn s ASN 456 N 1.46 3.87 -0.18 3.58 0.01 0.20 0.02 114.94 123.90 3ddn s ASN 456 Ca 0.31 -0.36 -0.07 0.00 -0.71 0.00 0.00 52.86 52.03 3ddn s ASN 456 Cb -0.15 -1.54 -0.04 0.00 0.41 0.00 0.00 41.25 39.93 3ddn s ASN 456 CO 0.09 0.17 0.07 -0.22 -1.51 0.00 0.00 177.10 175.70 3ddn s LEU 457 N 0.29 3.88 -0.06 0.60 2.96 0.94 -0.23 118.68 127.05 3ddn s LEU 457 Ca -0.11 0.12 0.03 0.00 -0.22 0.00 0.00 54.13 53.95 3ddn s LEU 457 Cb -0.16 -1.98 0.01 0.00 0.50 0.00 0.00 46.19 44.56 3ddn s LEU 457 CO 0.06 0.20 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.51 3ddn s ILE 458 N 0.24 1.28 -0.06 6.68 1.01 0.61 0.84 121.20 131.81 3ddn s ILE 458 Ca 0.05 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 60.12 3ddn s ILE 458 Cb -0.12 -1.15 0.02 0.00 0.01 0.00 0.00 42.46 41.22 3ddn s ILE 458 CO 0.00 0.39 -0.03 -0.63 0.00 0.00 0.00 174.94 174.66 3ddn s ILE 459 N 0.51 0.52 -0.17 2.92 1.01 -0.31 -0.17 121.20 125.51 3ddn s ILE 459 Ca -0.13 -0.06 -0.06 0.00 0.00 0.00 0.00 60.65 60.40 3ddn s ILE 459 Cb -0.15 -0.58 -0.04 0.00 0.01 0.00 0.00 42.46 41.70 3ddn s ILE 459 CO 0.04 0.24 0.03 -1.00 0.00 0.00 0.00 174.94 174.25 3ddn s HIS 460 N 1.27 3.17 0.26 3.97 3.76 0.15 -1.45 115.29 126.42 3ddn s HIS 460 Ca -0.06 -0.06 -0.12 0.00 -0.15 0.00 0.00 55.06 54.68 3ddn s HIS 460 Cb -0.14 -2.04 -0.00 0.00 1.11 0.00 0.00 32.58 31.51 3ddn s HIS 460 CO -0.02 0.09 0.49 1.52 -0.85 0.00 0.00 174.74 175.97 3ddn s TYR 461 N 0.37 0.42 0.00 1.40 1.13 -0.33 -0.82 117.35 119.52 3ddn s TYR 461 Ca 0.01 -0.78 0.00 0.00 -1.41 0.00 0.00 57.07 54.89 3ddn s TYR 461 Cb -0.13 0.18 0.00 0.00 -1.10 0.00 0.00 41.96 40.91 3ddn s TYR 461 CO 0.01 -1.02 0.00 0.28 -2.51 0.00 0.00 175.55 172.31 3ddn n VAL 462 N -0.40 0.00 -3.11 -3.49 0.31 -0.77 -0.59 118.33 110.28 3ddn n VAL 462 Ca -0.02 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.89 3ddn n VAL 462 Cb 0.62 -0.83 -0.07 0.00 -0.91 0.00 0.00 33.84 32.65 3ddn n VAL 462 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3ddn s ASP 463 N -2.86 6.35 -0.25 4.52 2.15 -0.91 -4.66 116.67 121.01 3ddn s ASP 463 Ca 0.00 -0.19 -0.17 0.00 0.43 0.00 0.00 52.55 52.62 3ddn s ASP 463 Cb 0.00 -2.32 -0.14 0.00 -0.30 0.00 0.00 42.92 40.15 3ddn s ASP 463 CO 0.00 -0.73 -0.14 0.54 -0.17 0.00 0.00 175.17 174.67 3ddn n ARG 464 N 6.21 0.58 -1.89 4.34 1.74 -1.26 -4.70 116.66 121.68 3ddn n ARG 464 Ca -0.01 0.38 -0.42 0.00 -0.77 0.00 0.00 57.85 57.03 3ddn n ARG 464 Cb 0.48 -1.59 -0.03 0.00 -1.02 0.00 0.00 32.46 30.30 3ddn n ARG 464 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 3ddn s PRO 465 N -2.46 4.20 -0.37 5.56 0.02 -1.26 -1.16 135.00 139.53 3ddn s PRO 465 Ca -0.35 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.09 3ddn s PRO 465 Cb 0.11 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.51 3ddn s PRO 465 CO 0.52 -0.61 0.00 0.41 -0.33 0.00 0.00 177.00 176.99 3ddn n GLY 466 N 3.42 0.51 0.31 0.52 0.00 -1.26 -4.91 105.19 103.78 3ddn n GLY 466 Ca 0.13 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 3ddn n GLY 466 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ddn h ALA 467 N 0.00 0.83 -0.49 4.61 0.00 -1.42 -1.25 119.26 121.55 3ddn h ALA 467 Ca -0.07 -0.31 0.08 0.00 0.00 0.00 0.00 54.91 54.60 3ddn h ALA 467 Cb 0.68 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 3ddn h ALA 467 CO 0.10 0.68 0.13 1.25 0.00 0.00 0.00 179.25 181.41 3ddn h LEU 468 N 0.99 0.08 -0.23 0.00 5.85 -1.91 -0.55 115.31 119.54 3ddn h LEU 468 Ca 0.18 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.97 3ddn h LEU 468 Cb 0.56 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 3ddn h LEU 468 CO 0.03 0.07 0.15 1.23 -0.34 0.00 0.00 178.44 179.58 3ddn h GLY 469 N 0.29 0.33 0.89 3.75 0.00 -1.87 -1.21 103.07 105.24 3ddn h GLY 469 Ca 0.24 -0.13 0.02 0.00 0.00 0.00 0.00 47.33 47.46 3ddn h GLY 469 CO -0.29 0.12 0.14 0.50 0.00 0.00 0.00 176.54 177.02 3ddn h LYS 470 N 0.30 0.29 0.24 4.80 1.57 -0.74 0.19 116.57 123.22 3ddn h LYS 470 Ca 0.08 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 3ddn h LYS 470 Cb -0.02 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.23 3ddn h LYS 470 CO -0.02 0.19 -0.12 0.82 -0.57 0.00 0.00 179.45 179.76 3ddn h ILE 471 N 0.30 0.81 -0.04 1.86 2.04 -1.04 -1.61 117.51 119.83 3ddn h ILE 471 Ca 0.11 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 3ddn h ILE 471 Cb 0.02 1.15 -0.00 0.00 -0.74 0.00 0.00 36.82 37.26 3ddn h ILE 471 CO -0.07 0.13 -0.01 1.23 0.00 0.00 0.00 178.15 179.43 3ddn h GLY 472 N -0.66 0.06 0.84 5.37 0.00 -1.17 -1.26 103.07 106.25 3ddn h GLY 472 Ca -0.03 -0.02 -0.15 0.00 0.00 0.00 0.00 47.33 47.12 3ddn h GLY 472 CO 0.05 0.02 -0.57 -0.84 0.00 0.00 0.00 176.54 175.21 3ddn h THR 473 N 0.06 1.39 -0.33 4.70 2.02 -0.82 -1.92 112.91 118.01 3ddn h THR 473 Ca 0.01 -1.96 0.01 0.00 0.77 0.00 0.00 66.41 65.24 3ddn h THR 473 Cb 0.06 2.40 -0.02 0.00 -1.74 0.00 0.00 68.15 68.85 3ddn h THR 473 CO 0.00 0.58 0.20 -0.07 0.37 0.00 0.00 175.52 176.60 3ddn h LEU 474 N 0.02 0.33 -0.76 2.58 3.38 -0.98 -0.69 115.31 119.18 3ddn h LEU 474 Ca -0.06 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3ddn h LEU 474 Cb 1.25 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.89 3ddn h LEU 474 CO 0.11 0.24 0.43 -0.07 0.09 0.00 0.00 178.44 179.24 3ddn h LEU 475 N 0.41 0.94 -0.09 1.67 4.07 -1.29 -1.62 115.31 119.41 3ddn h LEU 475 Ca 0.13 -0.09 -0.08 0.00 0.08 0.00 0.00 57.88 57.91 3ddn h LEU 475 Cb -0.01 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.48 3ddn h LEU 475 CO -0.05 0.76 -0.39 1.23 -1.08 0.00 0.00 178.44 178.90 3ddn h GLY 476 N 1.05 0.00 1.70 0.83 0.00 -1.16 -0.13 103.07 105.35 3ddn h GLY 476 Ca 0.27 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.45 3ddn h GLY 476 CO -0.04 0.00 -0.58 -0.84 0.00 0.00 0.00 176.54 175.07 3ddn h THR 477 N 0.00 1.37 0.00 4.70 2.02 -0.93 -2.69 112.91 117.38 3ddn h THR 477 Ca -0.00 -1.91 0.00 0.00 0.77 0.00 0.00 66.41 65.26 3ddn h THR 477 Cb 1.27 1.93 0.00 0.00 -1.74 0.00 0.00 68.15 69.61 3ddn h THR 477 CO 0.05 0.57 0.00 0.00 0.37 0.00 0.00 175.52 176.51 3ddn n ALA 478 N -2.48 2.33 -0.84 6.16 0.00 -0.62 -4.86 120.51 120.19 3ddn n ALA 478 Ca -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.28 3ddn n ALA 478 Cb 0.61 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3ddn n ALA 478 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ddn n GLY 479 N 0.47 0.64 3.64 0.00 0.00 -1.01 -5.02 105.19 103.90 3ddn n GLY 479 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3ddn n GLY 479 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ddn s VAL 480 N -2.28 4.87 0.32 1.61 1.01 -0.11 -4.99 120.40 120.84 3ddn s VAL 480 Ca 0.00 1.48 -0.27 0.00 0.00 0.00 0.00 61.98 63.19 3ddn s VAL 480 Cb 0.00 -4.08 -0.09 0.00 0.00 0.00 0.00 36.38 32.21 3ddn s VAL 480 CO 0.00 -0.05 1.04 0.20 0.00 0.00 0.00 175.10 176.29 3ddn s ASN 481 N 1.35 7.15 -0.34 3.32 0.01 -1.26 -4.18 114.94 120.99 3ddn s ASN 481 Ca 0.33 2.09 -0.06 0.00 -0.71 0.00 0.00 52.86 54.51 3ddn s ASN 481 Cb -0.15 -2.60 0.04 0.00 0.41 0.00 0.00 41.25 38.94 3ddn s ASN 481 CO 0.08 -0.22 0.10 -0.63 -1.51 0.00 0.00 177.10 174.92 3ddn s ILE 482 N -1.40 3.76 -0.06 0.60 1.01 -1.26 -2.01 121.20 121.84 3ddn s ILE 482 Ca 0.49 -1.13 -0.20 0.00 0.00 0.00 0.00 60.65 59.81 3ddn s ILE 482 Cb -0.26 -3.12 -0.31 0.00 0.01 0.00 0.00 42.46 38.78 3ddn s ILE 482 CO 0.33 -0.17 0.81 1.56 0.00 0.00 0.00 174.94 177.47 3ddn h GLN 483 N 8.21 0.30 -3.74 2.79 4.20 -0.02 -3.49 115.11 123.37 3ddn h GLN 483 Ca -0.23 -0.52 -0.08 0.00 0.06 0.00 0.00 58.65 57.88 3ddn h GLN 483 Cb 1.08 0.19 -0.12 0.00 0.30 0.00 0.00 27.48 28.93 3ddn h GLN 483 CO 0.60 1.25 -0.24 0.00 -0.67 0.00 0.00 178.83 179.77 3ddn s ALA 484 N -2.45 -0.25 -0.06 3.87 0.00 -1.20 -4.98 121.76 116.70 3ddn s ALA 484 Ca -0.15 -0.70 -0.30 0.00 0.00 0.00 0.00 51.96 50.81 3ddn s ALA 484 Cb 0.02 0.83 0.07 0.00 0.00 0.00 0.00 23.12 24.04 3ddn s ALA 484 CO 0.82 -0.68 0.67 0.00 0.00 0.00 0.00 175.76 176.57 3ddn s ALA 485 N -3.94 -1.73 -0.07 0.00 0.00 -1.26 -1.63 121.76 113.14 3ddn s ALA 485 Ca 0.14 1.30 -0.03 0.00 0.00 0.00 0.00 51.96 53.37 3ddn s ALA 485 Cb 0.02 -0.03 0.04 0.00 0.00 0.00 0.00 23.12 23.15 3ddn s ALA 485 CO -0.02 -0.36 0.15 -1.14 0.00 0.00 0.00 175.76 174.39 3ddn s GLN 486 N -1.15 0.08 -0.04 0.00 -0.44 0.03 -4.99 119.66 113.16 3ddn s GLN 486 Ca -0.11 0.42 -0.16 0.00 -2.50 0.00 0.00 55.36 53.01 3ddn s GLN 486 Cb -0.00 -0.20 0.03 0.00 -1.64 0.00 0.00 33.01 31.20 3ddn s GLN 486 CO 0.09 -0.20 0.36 -0.48 0.50 0.00 0.00 175.29 175.57 3ddn s LEU 487 N 1.45 0.64 -0.14 3.68 0.05 -1.26 0.59 118.68 123.69 3ddn s LEU 487 Ca -0.06 0.25 -0.29 0.00 0.05 0.00 0.00 54.13 54.08 3ddn s LEU 487 Cb -0.12 1.42 0.08 0.00 -2.05 0.00 0.00 46.19 45.52 3ddn s LEU 487 CO -0.06 -0.42 0.76 -0.94 -0.55 0.00 0.00 176.35 175.14 3ddn s SER 488 N -1.10 -0.63 -0.00 1.48 1.04 -0.71 -5.01 113.70 108.78 3ddn s SER 488 Ca -0.11 0.87 -0.25 0.00 0.48 0.00 0.00 55.95 56.94 3ddn s SER 488 Cb -0.04 0.77 -0.05 0.00 0.10 0.00 0.00 66.02 66.80 3ddn s SER 488 CO 0.04 -0.45 0.76 -1.83 0.98 0.00 0.00 173.24 172.74 3ddn s GLU 489 N -0.68 4.47 0.38 4.02 -1.05 -1.26 -1.56 118.70 123.03 3ddn s GLU 489 Ca -0.06 1.02 -0.23 0.00 -0.15 0.00 0.00 54.97 55.55 3ddn s GLU 489 Cb -0.02 -3.40 -0.14 0.00 -0.44 0.00 0.00 34.13 30.14 3ddn s GLU 489 CO 0.05 0.18 0.49 -0.25 0.95 0.00 0.00 175.26 176.68 3ddn n ASP 490 N 3.24 -1.16 -0.11 0.83 9.92 -0.82 -4.91 116.55 123.54 3ddn n ASP 490 Ca -0.01 0.93 -0.12 0.00 -0.53 0.00 0.00 54.79 55.06 3ddn n ASP 490 Cb 0.51 -1.06 -0.03 0.00 -0.64 0.00 0.00 41.12 39.89 3ddn n ASP 490 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3ddn h ALA 491 N 0.81 0.47 -3.23 2.24 0.00 -1.95 -3.41 119.26 114.18 3ddn h ALA 491 Ca -0.38 -0.32 -0.56 0.00 0.00 0.00 0.00 54.91 53.64 3ddn h ALA 491 Cb 1.41 -0.12 -0.35 0.00 0.00 0.00 0.00 17.79 18.73 3ddn h ALA 491 CO 0.52 0.35 -0.82 -1.21 0.00 0.00 0.00 179.25 178.09 3ddn s GLU 492 N -4.67 1.95 0.00 0.00 8.01 -1.26 -5.10 118.70 117.63 3ddn s GLU 492 Ca -0.13 -0.45 0.00 0.00 0.01 0.00 0.00 54.97 54.41 3ddn s GLU 492 Cb 0.09 -1.78 0.00 0.00 -4.31 0.00 0.00 34.13 28.13 3ddn s GLU 492 CO 0.81 -0.15 0.00 0.41 0.01 0.00 0.00 175.26 176.33 3ddn n GLY 493 N 4.50 1.12 0.03 -1.39 0.00 -1.26 -4.79 105.19 103.40 3ddn n GLY 493 Ca -0.17 -2.25 0.13 0.00 0.00 0.00 0.00 46.02 43.73 3ddn n GLY 493 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ddn n PRO 494 N -1.15 0.07 -1.60 1.61 -0.04 -1.26 -4.83 135.00 127.81 3ddn n PRO 494 Ca 0.00 0.05 -0.29 0.00 -0.04 0.00 0.00 63.50 63.22 3ddn n PRO 494 Cb 0.00 -1.57 0.12 0.00 -0.04 0.00 0.00 33.50 32.00 3ddn n PRO 494 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3ddn s GLY 495 N -3.16 1.59 0.18 0.55 0.00 -1.26 -4.64 107.32 100.57 3ddn s GLY 495 Ca 0.12 -0.47 -0.16 0.00 0.00 0.00 0.00 44.72 44.21 3ddn s GLY 495 CO 0.59 0.04 0.47 0.00 0.00 0.00 0.00 173.10 174.20 3ddn s ALA 496 N -3.30 -0.76 0.02 3.20 0.00 0.24 -1.95 121.76 119.21 3ddn s ALA 496 Ca 0.63 -0.34 -0.05 0.00 0.00 0.00 0.00 51.96 52.20 3ddn s ALA 496 Cb -0.14 0.84 -0.01 0.00 0.00 0.00 0.00 23.12 23.81 3ddn s ALA 496 CO 0.53 -0.76 0.09 0.95 0.00 0.00 0.00 175.76 176.56 3ddn s THR 497 N -3.89 0.10 -0.12 0.00 -4.23 -0.60 -1.18 115.64 105.72 3ddn s THR 497 Ca 0.10 -0.87 -0.14 0.00 -1.18 0.00 0.00 61.69 59.61 3ddn s THR 497 Cb -0.00 -0.54 0.04 0.00 1.34 0.00 0.00 72.50 73.33 3ddn s THR 497 CO -0.03 -0.48 0.38 -0.51 -0.54 0.00 0.00 174.62 173.45 3ddn s ILE 498 N -1.79 0.01 -0.08 2.99 2.07 -0.53 -1.73 121.20 122.14 3ddn s ILE 498 Ca -0.12 -0.07 0.03 0.00 -1.41 0.00 0.00 60.65 59.08 3ddn s ILE 498 Cb -0.06 -0.56 0.01 0.00 0.13 0.00 0.00 42.46 41.98 3ddn s ILE 498 CO -0.01 -0.04 -0.16 -0.22 -1.91 0.00 0.00 174.94 172.60 3ddn s LEU 499 N -0.04 1.80 -0.03 8.50 0.20 0.20 -1.16 118.68 128.15 3ddn s LEU 499 Ca -0.02 -0.40 0.04 0.00 0.69 0.00 0.00 54.13 54.44 3ddn s LEU 499 Cb -0.03 -1.04 -0.01 0.00 -0.43 0.00 0.00 46.19 44.68 3ddn s LEU 499 CO 0.01 0.07 -0.15 -0.76 -0.29 0.00 0.00 176.35 175.23 3ddn s LEU 500 N 0.60 1.95 -0.18 -0.68 1.02 0.25 -0.79 118.68 120.86 3ddn s LEU 500 Ca -0.15 -0.30 -0.18 0.00 0.02 0.00 0.00 54.13 53.52 3ddn s LEU 500 Cb -0.16 -0.84 -0.04 0.00 0.02 0.00 0.00 46.19 45.17 3ddn s LEU 500 CO 0.05 0.16 0.48 -0.60 0.02 0.00 0.00 176.35 176.46 3ddn s ARG 501 N -0.15 4.23 0.31 1.70 3.52 -0.64 -0.04 118.95 127.88 3ddn s ARG 501 Ca 0.01 0.37 0.09 0.00 -0.13 0.00 0.00 55.73 56.08 3ddn s ARG 501 Cb -0.08 -3.52 -0.05 0.00 -1.56 0.00 0.00 34.95 29.74 3ddn s ARG 501 CO 0.01 -0.03 0.01 -0.51 -0.81 0.00 0.00 175.30 173.96 3ddn s LEU 502 N 1.26 3.06 0.00 -0.88 1.43 0.10 0.73 118.68 124.39 3ddn s LEU 502 Ca 0.23 -0.84 0.25 0.00 -1.03 0.00 0.00 54.13 52.74 3ddn s LEU 502 Cb -0.15 -1.51 0.56 0.00 0.03 0.00 0.00 46.19 45.12 3ddn s LEU 502 CO 0.09 -0.15 1.44 -0.90 0.23 0.00 0.00 176.35 177.07 3ddn n ASP 503 N -0.94 1.04 -3.87 2.29 5.75 -0.85 -3.78 116.55 116.19 3ddn n ASP 503 Ca -0.05 -0.84 -0.09 0.00 -0.01 0.00 0.00 54.79 53.81 3ddn n ASP 503 Cb 0.61 0.24 -0.04 0.00 -1.03 0.00 0.00 41.12 40.91 3ddn n ASP 503 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ddn s GLN 504 N -2.63 1.57 0.94 0.11 -2.07 -1.26 -4.99 119.66 111.33 3ddn s GLN 504 Ca 0.20 -1.04 -0.12 0.00 -1.82 0.00 0.00 55.36 52.58 3ddn s GLN 504 Cb 0.19 0.53 0.16 0.00 -1.09 0.00 0.00 33.01 32.79 3ddn s GLN 504 CO 0.58 -0.68 1.09 0.34 -1.32 0.00 0.00 175.29 175.30 3ddn s ASP 505 N -2.94 3.05 -0.29 12.60 3.68 -1.26 -4.94 116.67 126.57 3ddn s ASP 505 Ca 0.14 1.46 -0.07 0.00 2.13 0.00 0.00 52.55 56.22 3ddn s ASP 505 Cb -0.02 -2.14 0.00 0.00 -1.45 0.00 0.00 42.92 39.31 3ddn s ASP 505 CO 0.04 -2.90 0.08 -0.69 0.13 0.00 0.00 175.17 171.83 3ddn s VAL 506 N -2.88 4.02 0.64 1.11 1.01 -1.26 -5.02 120.40 118.01 3ddn s VAL 506 Ca 0.64 -0.59 -0.17 0.00 0.00 0.00 0.00 61.98 61.86 3ddn s VAL 506 Cb -0.19 -3.03 -0.06 0.00 0.00 0.00 0.00 36.38 33.10 3ddn s VAL 506 CO 0.58 0.13 0.61 -2.65 0.00 0.00 0.00 175.10 173.77 3ddn n PRO 507 N 4.88 0.48 -0.22 2.72 -0.02 -1.26 -4.70 135.00 136.89 3ddn n PRO 507 Ca -0.15 0.20 -0.08 0.00 -2.02 0.00 0.00 63.50 61.45 3ddn n PRO 507 Cb 0.49 -1.84 0.03 0.00 -0.02 0.00 0.00 33.50 32.16 3ddn n PRO 507 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3ddn h ASP 508 N 0.01 0.91 -0.20 2.55 3.32 -1.99 -1.61 116.42 119.42 3ddn h ASP 508 Ca -0.46 -0.22 0.00 0.00 0.02 0.00 0.00 57.03 56.37 3ddn h ASP 508 Cb 1.37 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.67 3ddn h ASP 508 CO 0.46 0.89 0.13 -2.24 -1.72 0.00 0.00 179.24 176.75 3ddn h ASP 509 N 0.89 0.23 -0.84 6.45 2.03 -1.99 0.31 116.42 123.50 3ddn h ASP 509 Ca 0.20 -0.01 -0.03 0.00 -0.73 0.00 0.00 57.03 56.46 3ddn h ASP 509 Cb 0.31 -0.06 -0.04 0.00 -0.83 0.00 0.00 39.33 38.72 3ddn h ASP 509 CO -0.00 0.16 0.42 1.62 -1.03 0.00 0.00 179.24 180.41 3ddn h VAL 510 N 0.27 1.25 -0.85 4.15 3.04 -1.87 0.23 116.25 122.46 3ddn h VAL 510 Ca 0.07 -0.69 0.07 0.00 -1.01 0.00 0.00 66.70 65.15 3ddn h VAL 510 Cb -0.03 0.16 -0.06 0.00 -2.01 0.00 0.00 31.29 29.34 3ddn h VAL 510 CO -0.02 0.30 0.52 0.03 -1.01 0.00 0.00 177.57 177.39 3ddn h ARG 511 N 1.19 0.89 -0.46 4.17 3.08 -0.90 0.18 114.38 122.53 3ddn h ARG 511 Ca 0.29 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.24 3ddn h ARG 511 Cb 0.09 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 3ddn h ARG 511 CO -0.04 0.59 0.10 1.15 -1.07 0.00 0.00 179.97 180.70 3ddn h THR 512 N 0.92 1.24 -0.51 2.04 2.02 0.15 -0.38 112.91 118.39 3ddn h THR 512 Ca 0.38 -0.85 0.02 0.00 0.77 0.00 0.00 66.41 66.73 3ddn h THR 512 Cb 0.22 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 3ddn h THR 512 CO -0.19 0.30 0.31 0.00 0.37 0.00 0.00 175.52 176.31 3ddn h ALA 513 N 0.97 0.65 -0.16 6.16 0.00 0.25 -0.84 119.26 126.30 3ddn h ALA 513 Ca 0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3ddn h ALA 513 Cb 0.34 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3ddn h ALA 513 CO 0.00 0.02 0.04 0.82 0.00 0.00 0.00 179.25 180.14 3ddn h ILE 514 N 0.62 1.19 -0.45 0.00 2.04 -0.43 0.32 117.51 120.80 3ddn h ILE 514 Ca 0.20 -0.60 0.08 0.00 1.00 0.00 0.00 64.86 65.54 3ddn h ILE 514 Cb 0.01 1.29 -0.07 0.00 -0.74 0.00 0.00 36.82 37.32 3ddn h ILE 514 CO -0.09 0.18 0.05 0.00 0.00 0.00 0.00 178.15 178.30 3ddn h ALA 515 N 0.85 0.46 -0.39 1.87 0.00 -0.87 -1.51 119.26 119.68 3ddn h ALA 515 Ca 0.05 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3ddn h ALA 515 Cb 0.24 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3ddn h ALA 515 CO -0.00 -0.35 0.22 0.00 0.00 0.00 0.00 179.25 179.12 3ddn h ALA 516 N 1.36 0.49 -0.74 0.00 0.00 -0.91 0.18 119.26 119.65 3ddn h ALA 516 Ca 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3ddn h ALA 516 Cb 0.30 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 3ddn h ALA 516 CO -0.32 0.01 0.48 0.00 0.00 0.00 0.00 179.25 179.42 3ddn h ALA 517 N 1.08 1.45 -0.15 0.00 0.00 0.61 -3.07 119.26 119.17 3ddn h ALA 517 Ca 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3ddn h ALA 517 Cb 0.05 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.53 3ddn h ALA 517 CO -0.02 0.50 0.00 1.33 0.00 0.00 0.00 179.25 181.06 3ddn n VAL 518 N -4.41 0.84 -3.25 0.00 0.24 -0.75 -4.99 118.33 106.01 3ddn n VAL 518 Ca 0.08 -0.92 -0.11 0.00 -2.04 0.00 0.00 64.34 61.35 3ddn n VAL 518 Cb 0.04 0.60 0.04 0.00 -1.47 0.00 0.00 33.84 33.05 3ddn n VAL 518 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3ddn n ASP 519 N 0.06 -6.89 -4.78 -1.34 -0.08 0.45 -2.15 116.55 101.81 3ddn n ASP 519 Ca 0.05 -0.51 -0.37 0.00 -1.51 0.00 0.00 54.79 52.45 3ddn n ASP 519 Cb 0.31 -4.92 -0.06 0.00 2.34 0.00 0.00 41.12 38.78 3ddn n ASP 519 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ddn s ALA 520 N -3.23 3.23 -0.08 -1.67 0.00 -0.03 -1.84 121.76 118.13 3ddn s ALA 520 Ca 0.27 0.49 0.19 0.00 0.00 0.00 0.00 51.96 52.91 3ddn s ALA 520 Cb -0.05 -3.15 -0.28 0.00 0.00 0.00 0.00 23.12 19.64 3ddn s ALA 520 CO 0.76 0.19 0.31 2.48 0.00 0.00 0.00 175.76 179.51 3ddn n TYR 521 N 0.60 0.00 -4.24 0.00 4.11 -0.00 -4.95 117.16 112.67 3ddn n TYR 521 Ca 0.01 0.00 -0.20 0.00 -0.00 0.00 0.00 57.90 57.72 3ddn n TYR 521 Cb 0.50 -0.62 -0.16 0.00 -0.00 0.00 0.00 39.34 39.06 3ddn n TYR 521 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 3ddn s LYS 522 N -3.07 0.84 -0.05 -3.48 2.20 -0.95 -4.99 119.74 110.24 3ddn s LYS 522 Ca -0.08 -0.18 -0.02 0.00 -0.36 0.00 0.00 55.97 55.33 3ddn s LYS 522 Cb 0.10 -0.82 0.03 0.00 -1.51 0.00 0.00 37.83 35.64 3ddn s LYS 522 CO 0.81 0.00 0.07 -1.17 -0.36 0.00 0.00 175.35 174.70 3ddn s LEU 523 N 0.57 0.14 0.03 5.43 1.98 -1.26 -0.67 118.68 124.90 3ddn s LEU 523 Ca -0.08 0.04 0.02 0.00 -2.89 0.00 0.00 54.13 51.22 3ddn s LEU 523 Cb -0.11 -0.12 -0.02 0.00 0.66 0.00 0.00 46.19 46.59 3ddn s LEU 523 CO 0.00 -0.26 -0.07 -1.61 -1.89 0.00 0.00 176.35 172.53 3ddn s GLU 524 N 2.17 0.47 -0.18 1.98 8.01 0.76 -5.00 118.70 126.91 3ddn s GLU 524 Ca 0.05 -0.61 0.01 0.00 0.01 0.00 0.00 54.97 54.43 3ddn s GLU 524 Cb -0.12 -0.27 0.02 0.00 -4.31 0.00 0.00 34.13 29.45 3ddn s GLU 524 CO -0.04 0.05 -0.19 0.08 0.01 0.00 0.00 175.26 175.17 3ddn s VAL 525 N -1.11 2.08 -0.02 2.63 1.01 -1.26 -0.29 120.40 123.44 3ddn s VAL 525 Ca -0.08 -0.97 0.06 0.00 0.00 0.00 0.00 61.98 60.99 3ddn s VAL 525 Cb -0.08 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 3ddn s VAL 525 CO 0.00 0.51 -0.19 0.54 0.00 0.00 0.00 175.10 175.96 3ddn s VAL 526 N 1.28 1.54 -0.31 2.92 0.11 0.67 -4.96 120.40 121.66 3ddn s VAL 526 Ca 0.04 -0.82 -0.16 0.00 -2.93 0.00 0.00 61.98 58.11 3ddn s VAL 526 Cb -0.13 -1.29 -0.02 0.00 -1.53 0.00 0.00 36.38 33.41 3ddn s VAL 526 CO -0.13 0.44 0.44 -0.62 -3.33 0.00 0.00 175.10 171.90 3ddn s ASP 527 N -0.33 6.28 -0.37 3.54 2.15 -1.26 0.62 116.67 127.29 3ddn s ASP 527 Ca 0.04 0.10 0.07 0.00 0.43 0.00 0.00 52.55 53.20 3ddn s ASP 527 Cb -0.09 -2.24 0.69 0.00 -0.30 0.00 0.00 42.92 40.98 3ddn s ASP 527 CO 0.00 -0.33 1.82 0.18 -0.17 0.00 0.00 175.17 176.67 3ddn n LEU 528 N 5.51 6.14 -0.90 -1.34 4.77 0.95 -4.97 117.00 127.16 3ddn n LEU 528 Ca -0.07 -3.45 0.11 0.00 -0.03 0.00 0.00 56.01 52.58 3ddn n LEU 528 Cb 0.50 -0.77 0.09 0.00 -2.33 0.00 0.00 43.42 40.91 3ddn n LEU 528 CO 0.41 0.96 0.61 -1.20 -1.33 0.00 0.00 177.39 176.83