#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dle s ILE 2 N 0.00 5.28 0.19 4.25 1.01 -1.26 -4.57 121.20 126.10 3dle s ILE 2 Ca 0.00 0.55 -0.32 0.00 0.00 0.00 0.00 60.65 60.89 3dle s ILE 2 Cb 0.00 -3.65 -0.11 0.00 0.01 0.00 0.00 42.46 38.71 3dle s ILE 2 CO 0.00 0.33 1.66 -0.44 0.00 0.00 0.00 174.94 176.49 3dle s SER 3 N 0.76 6.47 0.00 3.58 0.01 0.28 -4.74 113.70 120.06 3dle s SER 3 Ca 0.16 2.76 -0.03 0.00 1.31 0.00 0.00 55.95 60.15 3dle s SER 3 Cb -0.14 -2.60 -0.13 0.00 0.21 0.00 0.00 66.02 63.36 3dle s SER 3 CO 0.05 -0.91 2.62 -0.81 0.41 0.00 0.00 173.24 174.61 3dle n PRO 4 N 3.98 1.39 -3.55 12.44 -0.04 -1.26 -4.42 135.00 143.53 3dle n PRO 4 Ca 0.15 -0.49 -0.30 0.00 -0.04 0.00 0.00 63.50 62.82 3dle n PRO 4 Cb 0.37 -1.54 -0.04 0.00 -0.04 0.00 0.00 33.50 32.24 3dle n PRO 4 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3dle s ILE 5 N 0.75 5.10 0.51 0.52 1.01 -1.26 -5.07 121.20 122.76 3dle s ILE 5 Ca 0.33 0.03 -0.21 0.00 0.00 0.00 0.00 60.65 60.81 3dle s ILE 5 Cb 0.16 -3.67 -0.07 0.00 0.01 0.00 0.00 42.46 38.89 3dle s ILE 5 CO 0.00 -0.11 1.14 -1.61 0.00 0.00 0.00 174.94 174.36 3dle s GLU 6 N -3.03 3.53 0.63 2.79 2.02 -1.26 -4.83 118.70 118.55 3dle s GLU 6 Ca 0.42 1.65 -0.10 0.00 0.02 0.00 0.00 54.97 56.97 3dle s GLU 6 Cb -0.11 -2.16 -0.02 0.00 0.10 0.00 0.00 34.13 31.94 3dle s GLU 6 CO 0.26 -0.71 1.01 0.95 0.02 0.00 0.00 175.26 176.79 3dle s THR 7 N -1.70 4.19 -0.21 3.63 -4.23 -1.26 -4.99 115.64 111.08 3dle s THR 7 Ca 0.69 0.56 -0.09 0.00 -1.18 0.00 0.00 61.69 61.67 3dle s THR 7 Cb -0.25 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 69.86 3dle s THR 7 CO 0.29 -0.86 0.11 -0.69 -0.54 0.00 0.00 174.62 172.93 3dle s VAL 8 N -3.17 5.07 -0.46 2.29 1.01 -1.26 -4.98 120.40 118.90 3dle s VAL 8 Ca 0.55 0.07 -0.28 0.00 0.00 0.00 0.00 61.98 62.32 3dle s VAL 8 Cb -0.11 -3.32 -0.00 0.00 0.00 0.00 0.00 36.38 32.95 3dle s VAL 8 CO 0.51 0.41 1.63 -2.16 0.00 0.00 0.00 175.10 175.50 3dle s PRO 9 N 0.65 3.24 0.21 2.72 0.04 -1.26 -4.22 135.00 136.38 3dle s PRO 9 Ca 0.06 0.93 0.05 0.00 0.04 0.00 0.00 61.00 62.07 3dle s PRO 9 Cb -0.13 -4.18 -0.03 0.00 0.04 0.00 0.00 34.50 30.21 3dle s PRO 9 CO 0.01 -1.98 0.30 0.08 0.04 0.00 0.00 177.00 175.45 3dle s VAL 10 N 6.78 5.09 0.16 -0.36 1.01 -1.26 -5.13 120.40 126.70 3dle s VAL 10 Ca 0.67 -0.98 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 3dle s VAL 10 Cb -0.16 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 3dle s VAL 10 CO 0.29 -0.25 0.28 -0.54 0.00 0.00 0.00 175.10 174.87 3dle s LYS 11 N -3.69 1.15 0.33 2.72 1.02 -1.26 -4.76 119.74 115.25 3dle s LYS 11 Ca 0.34 -1.18 -0.06 0.00 0.02 0.00 0.00 55.97 55.08 3dle s LYS 11 Cb -0.09 0.37 -0.05 0.00 -0.52 0.00 0.00 37.83 37.53 3dle s LYS 11 CO 0.28 -0.42 0.62 -0.51 -0.92 0.00 0.00 175.35 174.40 3dle s LEU 12 N -2.97 3.97 1.08 3.17 1.43 -1.26 -0.91 118.68 123.20 3dle s LEU 12 Ca 0.18 0.83 -0.19 0.00 -1.03 0.00 0.00 54.13 53.91 3dle s LEU 12 Cb 0.03 -3.67 0.08 0.00 0.03 0.00 0.00 46.19 42.66 3dle s LEU 12 CO 0.00 -0.27 -0.16 0.29 0.23 0.00 0.00 176.35 176.44 3dle n LYS 13 N -1.13 -1.55 -1.42 1.70 5.02 0.12 -4.58 118.16 116.33 3dle n LYS 13 Ca -0.01 -0.44 -0.47 0.00 -2.02 0.00 0.00 58.31 55.37 3dle n LYS 13 Cb 0.54 -1.55 -0.12 0.00 -0.02 0.00 0.00 35.03 33.88 3dle n LYS 13 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 3dle n PRO 14 N -1.37 0.18 0.00 1.97 -0.02 -1.26 -2.87 135.00 131.63 3dle n PRO 14 Ca 0.01 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 3dle n PRO 14 Cb 0.59 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 3dle n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dle n GLY 15 N 6.78 0.96 3.10 -1.23 0.00 -1.26 -4.98 105.19 108.56 3dle n GLY 15 Ca 0.58 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.24 3dle n GLY 15 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3dle n MET 16 N 0.00 -0.02 -4.26 1.61 2.81 -1.14 -5.01 117.12 111.11 3dle n MET 16 Ca 0.00 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 55.64 3dle n MET 16 Cb 0.00 -1.14 -0.08 0.00 -0.71 0.00 0.00 33.22 31.29 3dle n MET 16 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3dle s ASP 17 N -1.15 4.29 0.72 7.83 2.15 -1.26 -4.76 116.67 124.50 3dle s ASP 17 Ca 0.45 -1.03 -0.16 0.00 0.43 0.00 0.00 52.55 52.24 3dle s ASP 17 Cb -0.23 -0.53 0.01 0.00 -0.30 0.00 0.00 42.92 41.88 3dle s ASP 17 CO 0.78 -0.37 1.01 0.61 -0.17 0.00 0.00 175.17 177.03 3dle n GLY 18 N -1.08 -0.33 3.73 2.66 0.00 -1.26 -4.95 105.19 103.97 3dle n GLY 18 Ca -0.03 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 3dle n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dle s PRO 19 N -3.40 2.01 0.00 1.61 0.04 -1.26 -4.91 135.00 129.09 3dle s PRO 19 Ca 0.74 1.43 0.00 0.00 0.04 0.00 0.00 61.00 63.21 3dle s PRO 19 Cb -0.34 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.35 3dle s PRO 19 CO 0.50 -1.87 0.32 1.63 0.04 0.00 0.00 177.00 177.62 3dle n LYS 20 N -3.35 0.15 -1.39 4.56 5.02 -1.24 -1.95 118.16 119.96 3dle n LYS 20 Ca 0.11 -0.37 -0.45 0.00 -2.02 0.00 0.00 58.31 55.58 3dle n LYS 20 Cb 0.52 -0.61 -0.01 0.00 -0.02 0.00 0.00 35.03 34.91 3dle n LYS 20 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 3dle n VAL 21 N -0.05 1.52 -3.51 -0.18 3.14 -1.20 -4.55 118.33 113.50 3dle n VAL 21 Ca 0.00 -0.50 -0.37 0.00 -2.96 0.00 0.00 64.34 60.51 3dle n VAL 21 Cb 0.30 -0.16 -0.06 0.00 -1.06 0.00 0.00 33.84 32.86 3dle n VAL 21 CO 0.00 0.00 0.00 -1.59 -6.46 0.00 0.00 176.83 168.78 3dle s LYS 22 N -1.13 3.88 0.01 1.45 -2.85 -1.26 -4.00 119.74 115.84 3dle s LYS 22 Ca 0.62 0.35 -0.34 0.00 -1.00 0.00 0.00 55.97 55.60 3dle s LYS 22 Cb -0.77 -3.14 -0.13 0.00 -2.06 0.00 0.00 37.83 31.73 3dle s LYS 22 CO 0.59 0.65 1.75 0.94 0.10 0.00 0.00 175.35 179.38 3dle n GLN 23 N 1.52 2.14 -1.89 1.78 -0.06 -1.26 -4.72 117.38 114.89 3dle n GLN 23 Ca -0.12 0.78 -0.37 0.00 -2.00 0.00 0.00 57.00 55.29 3dle n GLN 23 Cb 0.52 -2.59 0.04 0.00 -4.06 0.00 0.00 30.24 24.15 3dle n GLN 23 CO 0.00 0.00 0.00 -0.46 -0.20 0.00 0.00 177.06 176.40 3dle s TRP 24 N 2.78 2.35 0.19 3.69 -0.11 -1.26 -4.96 118.94 121.62 3dle s TRP 24 Ca 0.87 1.45 -0.29 0.00 1.22 0.00 0.00 56.10 59.35 3dle s TRP 24 Cb -0.69 -3.65 -0.08 0.00 -1.50 0.00 0.00 33.47 27.54 3dle s TRP 24 CO 0.46 -2.56 0.90 -1.25 -4.62 0.00 0.00 176.95 169.88 3dle s PRO 25 N -3.07 4.75 0.35 5.86 0.04 -1.26 -4.92 135.00 136.75 3dle s PRO 25 Ca 0.74 1.39 0.07 0.00 0.04 0.00 0.00 61.00 63.24 3dle s PRO 25 Cb -0.36 -3.30 -0.07 0.00 0.04 0.00 0.00 34.50 30.82 3dle s PRO 25 CO 0.41 0.47 -0.01 -0.51 0.04 0.00 0.00 177.00 177.40 3dle s LEU 26 N -0.94 2.60 0.69 -3.56 1.43 -1.26 -5.16 118.68 112.48 3dle s LEU 26 Ca 0.41 -1.30 -0.06 0.00 -1.03 0.00 0.00 54.13 52.15 3dle s LEU 26 Cb -0.25 -0.74 0.06 0.00 0.03 0.00 0.00 46.19 45.30 3dle s LEU 26 CO 0.30 -0.41 0.99 0.42 0.23 0.00 0.00 176.35 177.87 3dle s THR 27 N -2.90 2.32 0.44 5.49 -4.23 -1.26 -4.79 115.64 110.71 3dle s THR 27 Ca 0.34 -0.33 0.14 0.00 -1.18 0.00 0.00 61.69 60.66 3dle s THR 27 Cb 0.07 -2.99 0.17 0.00 1.34 0.00 0.00 72.50 71.09 3dle s THR 27 CO 0.16 0.00 1.97 1.05 -0.54 0.00 0.00 174.62 177.26 3dle h GLU 28 N -0.53 0.00 0.54 3.99 4.11 -1.96 -2.32 114.58 118.41 3dle h GLU 28 Ca -0.44 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 58.96 3dle h GLU 28 Cb 1.31 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.57 3dle h GLU 28 CO 0.58 0.20 -0.26 1.49 0.07 0.00 0.00 179.01 181.10 3dle h GLU 29 N 0.00 -0.69 -0.65 1.06 4.81 -1.98 -2.11 114.58 115.02 3dle h GLU 29 Ca -0.00 0.05 0.14 0.00 -0.13 0.00 0.00 59.36 59.41 3dle h GLU 29 Cb 0.36 0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 3dle h GLU 29 CO 0.03 -0.46 0.44 0.87 -0.73 0.00 0.00 179.01 179.16 3dle h LYS 30 N -0.89 0.28 -0.29 1.92 1.57 -1.94 -1.30 116.57 115.91 3dle h LYS 30 Ca -0.07 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.58 3dle h LYS 30 Cb 0.55 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 3dle h LYS 30 CO 0.12 0.18 -0.23 0.82 -0.57 0.00 0.00 179.45 179.78 3dle h ILE 31 N 0.29 1.30 -0.09 1.86 2.04 -1.41 -2.00 117.51 119.50 3dle h ILE 31 Ca 0.31 -1.38 -0.08 0.00 1.00 0.00 0.00 64.86 64.72 3dle h ILE 31 Cb 0.83 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 3dle h ILE 31 CO -0.07 0.44 -0.32 0.50 0.00 0.00 0.00 178.15 178.70 3dle h LYS 32 N 0.42 0.16 -0.21 2.37 3.64 -0.56 -0.66 116.57 121.74 3dle h LYS 32 Ca 0.05 -0.06 -0.16 0.00 -1.27 0.00 0.00 60.65 59.21 3dle h LYS 32 Cb 0.78 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 3dle h LYS 32 CO 0.06 0.47 -0.53 0.00 -2.27 0.00 0.00 179.45 177.18 3dle h ALA 33 N 1.53 0.68 -0.15 5.00 0.00 -1.16 -2.63 119.26 122.53 3dle h ALA 33 Ca 0.02 -0.50 -0.21 0.00 0.00 0.00 0.00 54.91 54.22 3dle h ALA 33 Cb 0.64 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.36 3dle h ALA 33 CO 0.05 0.68 -0.71 -0.07 0.00 0.00 0.00 179.25 179.20 3dle h LEU 34 N 0.46 0.88 -0.92 0.00 3.38 -1.02 -2.53 115.31 115.57 3dle h LEU 34 Ca 0.01 -0.63 0.04 0.00 0.09 0.00 0.00 57.88 57.40 3dle h LEU 34 Cb 1.08 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.51 3dle h LEU 34 CO 0.10 1.37 0.59 0.58 0.09 0.00 0.00 178.44 181.17 3dle h VAL 35 N 0.46 1.14 0.17 1.22 2.07 -1.13 0.23 116.25 120.41 3dle h VAL 35 Ca -0.05 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 67.09 3dle h VAL 35 Cb 1.35 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 3dle h VAL 35 CO 0.15 0.21 -0.19 -0.08 0.02 0.00 0.00 177.57 177.68 3dle h GLU 36 N 1.13 -0.38 0.28 1.57 4.81 -1.37 -1.61 114.58 119.02 3dle h GLU 36 Ca 0.37 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.62 3dle h GLU 36 Cb 0.03 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 3dle h GLU 36 CO -0.13 -0.25 -0.20 0.82 -0.73 0.00 0.00 179.01 178.52 3dle h ILE 37 N -0.39 0.57 0.00 2.32 2.04 -0.94 -2.79 117.51 118.32 3dle h ILE 37 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 3dle h ILE 37 Cb 0.38 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 3dle h ILE 37 CO -0.06 0.00 -0.03 0.00 0.00 0.00 0.00 178.15 178.06 3dle h THR 39 N 0.00 1.38 -0.29 0.00 2.02 -1.08 -0.33 112.91 114.60 3dle h THR 39 Ca -0.00 -2.62 -0.09 0.00 0.77 0.00 0.00 66.41 64.46 3dle h THR 39 Cb 0.23 2.68 -0.01 0.00 -1.74 0.00 0.00 68.15 69.30 3dle h THR 39 CO 0.00 0.78 -0.21 -0.08 0.37 0.00 0.00 175.52 176.39 3dle h GLU 40 N 0.20 0.54 0.02 6.66 4.57 -1.09 -2.44 114.58 123.05 3dle h GLU 40 Ca -0.14 -0.19 -0.15 0.00 -1.18 0.00 0.00 59.36 57.69 3dle h GLU 40 Cb 1.83 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 30.39 3dle h GLU 40 CO 0.21 0.72 -0.61 0.52 -1.18 0.00 0.00 179.01 178.67 3dle h MET 41 N 0.48 0.37 -0.95 1.92 2.86 -1.23 -2.82 114.93 115.56 3dle h MET 41 Ca 0.08 -0.43 0.12 0.00 -2.06 0.00 0.00 59.70 57.40 3dle h MET 41 Cb 0.64 0.13 -0.08 0.00 0.06 0.00 0.00 31.60 32.34 3dle h MET 41 CO 0.05 1.11 0.58 1.49 1.06 0.00 0.00 176.91 181.20 3dle h GLU 42 N -0.18 0.89 -0.43 1.72 4.81 -0.96 -1.58 114.58 118.86 3dle h GLU 42 Ca -0.08 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 3dle h GLU 42 Cb 1.35 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 3dle h GLU 42 CO 0.12 0.59 0.21 -0.22 -0.73 0.00 0.00 179.01 178.97 3dle h LYS 43 N 0.91 0.61 0.00 1.92 3.11 -1.45 -1.98 116.57 119.70 3dle h LYS 43 Ca 0.47 -0.09 0.00 0.00 -2.81 0.00 0.00 60.65 58.22 3dle h LYS 43 Cb 0.48 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 31.60 3dle h LYS 43 CO -0.27 0.53 0.00 0.39 -2.81 0.00 0.00 179.45 177.29 3dle n GLU 44 N -4.67 0.06 -0.48 1.90 1.02 -0.64 -4.84 120.64 112.99 3dle n GLU 44 Ca 0.01 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 3dle n GLU 44 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.03 3dle n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dle n GLY 45 N -0.29 0.74 0.14 0.62 0.00 -0.74 -4.74 105.19 100.91 3dle n GLY 45 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 3dle n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dle h LYS 46 N 4.03 -0.25 -5.46 1.61 1.79 -1.67 -3.42 116.57 113.19 3dle h LYS 46 Ca 0.00 0.02 -0.60 0.00 -2.18 0.00 0.00 60.65 57.89 3dle h LYS 46 Cb 0.00 0.06 -0.13 0.00 -1.58 0.00 0.00 32.23 30.57 3dle h LYS 46 CO 0.00 -0.13 -0.59 0.96 -1.08 0.00 0.00 179.45 178.61 3dle s ILE 47 N -5.98 1.62 -0.01 1.86 -4.36 -1.25 0.10 121.20 113.19 3dle s ILE 47 Ca -0.14 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.25 3dle s ILE 47 Cb 0.05 -2.80 0.01 0.00 1.25 0.00 0.00 42.46 40.97 3dle s ILE 47 CO 0.64 0.00 -0.01 -0.44 0.24 0.00 0.00 174.94 175.38 3dle s SER 48 N -3.68 0.25 0.01 4.36 0.01 0.15 -4.43 113.70 110.38 3dle s SER 48 Ca 0.31 -0.02 -0.30 0.00 1.31 0.00 0.00 55.95 57.24 3dle s SER 48 Cb 0.08 -0.09 -0.06 0.00 0.21 0.00 0.00 66.02 66.17 3dle s SER 48 CO 0.15 -0.04 1.40 -0.75 0.41 0.00 0.00 173.24 174.41 3dle s LYS 49 N 0.43 4.29 0.00 12.44 2.20 -1.26 -0.75 119.74 137.09 3dle s LYS 49 Ca -0.04 1.97 0.00 0.00 -0.36 0.00 0.00 55.97 57.54 3dle s LYS 49 Cb -0.06 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.72 3dle s LYS 49 CO -0.01 -0.56 0.00 0.44 -0.36 0.00 0.00 175.35 174.86 3dle n ILE 50 N 4.58 0.00 -3.37 5.43 -5.35 -0.13 -4.95 119.36 115.58 3dle n ILE 50 Ca 0.13 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.61 3dle n ILE 50 Cb 0.44 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.34 3dle n ILE 50 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dle n GLY 51 N 4.83 3.07 0.11 3.28 0.00 -1.26 -4.73 105.19 110.49 3dle n GLY 51 Ca 0.00 -1.29 0.11 0.00 0.00 0.00 0.00 46.02 44.83 3dle n GLY 51 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dle n PRO 52 N 0.00 -0.02 0.00 1.61 -0.02 -1.26 -3.01 135.00 132.30 3dle n PRO 52 Ca 0.00 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 3dle n PRO 52 Cb 0.00 -0.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 3dle n PRO 52 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3dle n GLU 53 N -3.72 0.00 -0.82 -0.52 -0.58 -1.26 -4.64 120.64 109.10 3dle n GLU 53 Ca 0.12 0.04 -0.38 0.00 -0.42 0.00 0.00 57.16 56.53 3dle n GLU 53 Cb 0.43 -0.49 -0.07 0.00 -0.57 0.00 0.00 31.44 30.73 3dle n GLU 53 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 3dle n ASN 54 N -0.09 0.50 0.07 1.62 2.85 -1.16 -4.86 115.26 114.18 3dle n ASN 54 Ca 0.00 0.46 0.13 0.00 -0.11 0.00 0.00 54.58 55.06 3dle n ASN 54 Cb 0.00 -0.56 0.34 0.00 1.24 0.00 0.00 39.78 40.80 3dle n ASN 54 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 3dle n PRO 55 N 4.39 0.22 -2.77 1.20 -0.02 -1.26 -4.92 135.00 131.84 3dle n PRO 55 Ca 0.32 0.13 -0.27 0.00 -2.02 0.00 0.00 63.50 61.66 3dle n PRO 55 Cb -0.03 -1.70 -0.01 0.00 -0.02 0.00 0.00 33.50 31.74 3dle n PRO 55 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 3dle s TYR 56 N -3.10 3.54 -0.06 6.00 2.02 -1.26 -4.81 117.35 119.68 3dle s TYR 56 Ca 0.10 0.78 -0.29 0.00 -0.37 0.00 0.00 57.07 57.28 3dle s TYR 56 Cb 0.14 -2.26 0.11 0.00 -0.40 0.00 0.00 41.96 39.55 3dle s TYR 56 CO 0.64 -0.20 0.91 1.21 -1.57 0.00 0.00 175.55 176.54 3dle s ASN 57 N -3.96 -0.39 0.01 2.29 2.47 -0.82 -4.68 114.94 109.85 3dle s ASN 57 Ca 0.47 0.21 0.00 0.00 0.42 0.00 0.00 52.86 53.95 3dle s ASN 57 Cb -0.10 0.37 -0.01 0.00 -1.45 0.00 0.00 41.25 40.06 3dle s ASN 57 CO 0.42 -0.52 -0.01 -0.89 -3.72 0.00 0.00 177.10 172.37 3dle s THR 58 N -2.24 0.08 -0.05 -5.21 2.01 -0.23 -3.27 115.64 106.73 3dle s THR 58 Ca 0.01 -0.26 -0.30 0.00 0.31 0.00 0.00 61.69 61.45 3dle s THR 58 Cb -0.01 -0.11 -0.05 0.00 0.01 0.00 0.00 72.50 72.34 3dle s THR 58 CO -0.04 -0.12 1.42 -2.16 -0.69 0.00 0.00 174.62 173.03 3dle s PRO 59 N -0.40 4.26 -0.08 4.92 0.04 -1.26 -3.97 135.00 138.50 3dle s PRO 59 Ca -0.04 1.94 -0.03 0.00 0.04 0.00 0.00 61.00 62.90 3dle s PRO 59 Cb -0.03 -3.69 -0.04 0.00 0.04 0.00 0.00 34.50 30.78 3dle s PRO 59 CO -0.00 -0.65 0.07 0.54 0.04 0.00 0.00 177.00 177.00 3dle s VAL 60 N 2.93 4.84 0.47 -0.36 0.11 -1.26 -1.82 120.40 125.30 3dle s VAL 60 Ca 0.64 -0.10 0.02 0.00 -2.93 0.00 0.00 61.98 59.61 3dle s VAL 60 Cb -0.30 -3.10 -0.02 0.00 -1.53 0.00 0.00 36.38 31.44 3dle s VAL 60 CO 0.25 0.57 0.06 -0.36 -3.33 0.00 0.00 175.10 172.28 3dle s PHE 61 N -1.00 1.82 -0.17 1.54 0.08 -0.67 -4.73 117.98 114.86 3dle s PHE 61 Ca 0.16 -1.12 -0.05 0.00 0.12 0.00 0.00 56.93 56.04 3dle s PHE 61 Cb -0.12 -1.40 0.06 0.00 -0.57 0.00 0.00 43.02 41.00 3dle s PHE 61 CO 0.05 -0.03 0.09 0.00 -0.10 0.00 0.00 175.22 175.24 3dle s ALA 62 N -3.03 0.42 0.19 5.36 0.00 -1.26 -2.50 121.76 120.95 3dle s ALA 62 Ca 0.14 -0.31 0.08 0.00 0.00 0.00 0.00 51.96 51.87 3dle s ALA 62 Cb 0.02 -1.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.06 3dle s ALA 62 CO 0.08 -1.18 -0.04 0.96 0.00 0.00 0.00 175.76 175.59 3dle s ILE 63 N 2.14 3.48 -0.16 0.00 -5.25 -0.75 -4.92 121.20 115.75 3dle s ILE 63 Ca 0.02 -1.59 -0.01 0.00 -0.99 0.00 0.00 60.65 58.09 3dle s ILE 63 Cb -0.16 -2.76 -0.00 0.00 2.95 0.00 0.00 42.46 42.48 3dle s ILE 63 CO -0.09 -0.15 -0.13 -0.75 -1.79 0.00 0.00 174.94 172.02 3dle s LYS 64 N -3.02 3.28 -0.20 0.37 2.20 -1.26 -0.84 119.74 120.27 3dle s LYS 64 Ca 0.27 -0.71 0.02 0.00 -0.36 0.00 0.00 55.97 55.19 3dle s LYS 64 Cb -0.09 -2.70 -0.13 0.00 -1.51 0.00 0.00 37.83 33.40 3dle s LYS 64 CO 0.18 0.01 -0.16 1.17 -0.36 0.00 0.00 175.35 176.19 3dle n LYS 65 N 4.09 0.55 -1.41 4.03 4.81 -1.26 -5.00 118.16 123.97 3dle n LYS 65 Ca -0.19 0.11 -0.04 0.00 -0.87 0.00 0.00 58.31 57.32 3dle n LYS 65 Cb 0.52 -1.40 0.11 0.00 0.02 0.00 0.00 35.03 34.28 3dle n LYS 65 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 3dle n THR 69 N -3.05 1.88 -3.42 3.15 -2.24 -1.26 -5.10 114.28 104.24 3dle n THR 69 Ca -0.35 -3.18 -0.20 0.00 -2.27 0.00 0.00 64.05 58.06 3dle n THR 69 Cb 0.88 -0.17 -0.00 0.00 -2.10 0.00 0.00 70.33 68.94 3dle n THR 69 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3dle s LYS 70 N -2.93 3.14 0.26 -0.78 -2.85 -1.26 -5.07 119.74 110.26 3dle s LYS 70 Ca 0.40 -0.88 -0.30 0.00 -1.00 0.00 0.00 55.97 54.20 3dle s LYS 70 Cb 0.38 -2.77 -0.09 0.00 -2.06 0.00 0.00 37.83 33.28 3dle s LYS 70 CO -0.05 0.03 1.29 -1.58 0.10 0.00 0.00 175.35 175.15 3dle s TRP 71 N -2.23 3.21 0.05 1.78 0.23 -1.26 -4.61 118.94 116.11 3dle s TRP 71 Ca 0.45 1.33 0.06 0.00 -2.03 0.00 0.00 56.10 55.91 3dle s TRP 71 Cb -0.10 -3.61 -0.03 0.00 0.03 0.00 0.00 33.47 29.77 3dle s TRP 71 CO 0.32 -1.78 -0.18 1.03 0.96 0.00 0.00 176.95 177.31 3dle s ARG 72 N -0.86 1.12 0.61 4.98 0.52 -0.02 -5.00 118.95 120.31 3dle s ARG 72 Ca 0.53 -0.91 -0.13 0.00 -0.52 0.00 0.00 55.73 54.70 3dle s ARG 72 Cb -0.37 -1.22 -0.04 0.00 0.52 0.00 0.00 34.95 33.84 3dle s ARG 72 CO 0.44 0.30 1.03 0.21 0.02 0.00 0.00 175.30 177.30 3dle s LYS 73 N -1.34 3.51 -0.37 3.54 2.20 -1.26 -1.81 119.74 124.21 3dle s LYS 73 Ca 0.04 0.88 0.06 0.00 -0.36 0.00 0.00 55.97 56.59 3dle s LYS 73 Cb -0.09 -2.07 0.18 0.00 -1.51 0.00 0.00 37.83 34.34 3dle s LYS 73 CO 0.02 -0.64 0.56 -1.17 -0.36 0.00 0.00 175.35 173.75 3dle s LEU 74 N -4.97 -1.21 -0.05 5.43 2.96 -1.04 -4.82 118.68 114.99 3dle s LEU 74 Ca 0.57 -0.72 -0.26 0.00 -0.22 0.00 0.00 54.13 53.50 3dle s LEU 74 Cb -0.12 1.64 -0.03 0.00 0.50 0.00 0.00 46.19 48.18 3dle s LEU 74 CO 0.48 -0.23 0.84 -0.69 -1.32 0.00 0.00 176.35 175.43 3dle s VAL 75 N 2.01 4.95 -0.78 1.68 1.01 -1.26 -1.67 120.40 126.35 3dle s VAL 75 Ca 0.14 1.73 -0.19 0.00 0.00 0.00 0.00 61.98 63.67 3dle s VAL 75 Cb -0.08 -4.17 0.13 0.00 0.00 0.00 0.00 36.38 32.25 3dle s VAL 75 CO -0.12 0.19 0.93 -0.62 0.00 0.00 0.00 175.10 175.48 3dle s ASP 76 N 0.92 6.44 -0.07 3.32 3.68 -0.76 -4.90 116.67 125.31 3dle s ASP 76 Ca 0.44 -1.78 0.09 0.00 2.13 0.00 0.00 52.55 53.43 3dle s ASP 76 Cb -0.19 -2.35 0.38 0.00 -1.45 0.00 0.00 42.92 39.31 3dle s ASP 76 CO 0.22 -1.08 1.20 0.49 0.13 0.00 0.00 175.17 176.13 3dle n PHE 77 N 6.33 0.82 -0.20 -5.34 3.01 -1.26 -4.43 117.46 116.39 3dle n PHE 77 Ca 0.08 -0.32 0.01 0.00 1.01 0.00 0.00 57.45 58.24 3dle n PHE 77 Cb 0.46 -0.18 0.10 0.00 -0.01 0.00 0.00 39.48 39.86 3dle n PHE 77 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dle h ARG 78 N 2.10 0.14 -0.30 -1.08 3.08 -1.90 0.38 114.38 116.80 3dle h ARG 78 Ca 0.00 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 3dle h ARG 78 Cb 0.93 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.94 3dle h ARG 78 CO 0.14 0.10 -0.21 0.93 -1.07 0.00 0.00 179.97 179.86 3dle h GLU 79 N 0.15 0.67 -0.08 0.04 4.39 -2.00 -1.80 114.58 115.95 3dle h GLU 79 Ca 0.32 -0.32 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 3dle h GLU 79 Cb 0.52 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 3dle h GLU 79 CO -0.50 0.92 -0.24 1.25 -1.16 0.00 0.00 179.01 179.29 3dle h LEU 80 N 0.43 0.13 -1.21 1.33 5.85 -1.75 -2.18 115.31 117.91 3dle h LEU 80 Ca 0.06 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 3dle h LEU 80 Cb 0.75 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 3dle h LEU 80 CO 0.06 0.38 -0.26 0.78 -0.34 0.00 0.00 178.44 179.06 3dle h ASN 81 N 0.12 0.00 1.78 1.25 4.21 0.11 -1.00 115.58 122.05 3dle h ASN 81 Ca 0.02 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.53 3dle h ASN 81 Cb 0.50 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.70 3dle h ASN 81 CO 0.03 0.26 -0.22 0.11 -1.29 0.00 0.00 177.43 176.33 3dle h LYS 82 N 0.00 0.00 0.00 0.81 1.57 -0.69 -3.29 116.57 114.97 3dle h LYS 82 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dle h LYS 82 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 3dle h LYS 82 CO 0.03 0.00 -0.92 0.54 -0.57 0.00 0.00 179.45 178.54 3dle n ARG 83 N -3.01 0.57 -2.94 3.15 1.74 -0.96 -4.92 116.66 110.29 3dle n ARG 83 Ca 0.03 -0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.74 3dle n ARG 83 Cb 0.53 -1.42 -0.06 0.00 -1.02 0.00 0.00 32.46 30.49 3dle n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3dle s THR 84 N -2.84 4.38 1.11 0.55 2.01 -0.42 0.13 115.64 120.57 3dle s THR 84 Ca 0.07 1.58 -0.17 0.00 0.31 0.00 0.00 61.69 63.48 3dle s THR 84 Cb 0.15 -3.96 0.12 0.00 0.01 0.00 0.00 72.50 68.82 3dle s THR 84 CO 0.80 0.21 0.17 0.00 -0.69 0.00 0.00 174.62 175.11 3dle n GLN 85 N 0.74 -1.60 -3.46 4.92 10.64 -0.09 -4.45 117.38 124.09 3dle n GLN 85 Ca -0.01 -0.45 -0.31 0.00 -1.83 0.00 0.00 57.00 54.41 3dle n GLN 85 Cb 0.50 -1.77 -0.05 0.00 -0.86 0.00 0.00 30.24 28.06 3dle n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3dle s ASP 86 N -1.93 6.54 0.29 2.61 1.11 -1.26 -4.92 116.67 119.11 3dle s ASP 86 Ca 0.58 0.78 0.07 0.00 0.18 0.00 0.00 52.55 54.16 3dle s ASP 86 Cb -0.14 -2.17 -0.06 0.00 1.07 0.00 0.00 42.92 41.62 3dle s ASP 86 CO 0.66 -0.08 -0.06 -0.36 1.18 0.00 0.00 175.17 176.52 3dle s PHE 87 N -1.85 2.01 0.32 4.23 0.40 -1.26 -5.10 117.98 116.73 3dle s PHE 87 Ca 0.45 -0.68 -0.29 0.00 -0.60 0.00 0.00 56.93 55.80 3dle s PHE 87 Cb -0.11 -1.15 -0.11 0.00 0.51 0.00 0.00 43.02 42.15 3dle s PHE 87 CO 0.24 0.31 1.57 -0.46 0.70 0.00 0.00 175.22 177.59 3dle s TRP 88 N -2.97 2.66 -0.03 0.36 -0.00 -1.26 -4.81 118.94 112.90 3dle s TRP 88 Ca 0.30 0.89 -0.40 0.00 -0.00 0.00 0.00 56.10 56.89 3dle s TRP 88 Cb 0.04 -4.08 -0.20 0.00 -0.00 0.00 0.00 33.47 29.23 3dle s TRP 88 CO 0.13 -3.49 1.08 -0.85 -0.00 0.00 0.00 176.95 173.81 3dle n GLU 89 N 1.58 0.00 -0.11 5.86 0.28 -1.26 -4.62 120.64 122.37 3dle n GLU 89 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.06 3dle n GLU 89 Cb 0.38 -1.48 0.00 0.00 1.43 0.00 0.00 31.44 31.77 3dle n GLU 89 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 3dle n VAL 90 N 1.60 0.73 -2.46 3.84 0.24 -1.26 -4.67 118.33 116.35 3dle n VAL 90 Ca 0.20 -0.11 -0.04 0.00 -2.04 0.00 0.00 64.34 62.35 3dle n VAL 90 Cb 0.07 -0.97 -0.04 0.00 -1.47 0.00 0.00 33.84 31.43 3dle n VAL 90 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 3dle n GLN 91 N 1.19 -3.83 -0.45 7.34 7.27 -1.26 -4.94 117.38 122.70 3dle n GLN 91 Ca 0.00 2.97 0.06 0.00 0.07 0.00 0.00 57.00 60.10 3dle n GLN 91 Cb 0.25 -4.57 0.22 0.00 2.41 0.00 0.00 30.24 28.55 3dle n GLN 91 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 3dle n LEU 92 N 1.32 3.57 -4.41 1.69 7.94 -1.26 -4.91 117.00 120.95 3dle n LEU 92 Ca -0.31 -3.23 -0.44 0.00 -1.11 0.00 0.00 56.01 50.92 3dle n LEU 92 Cb 0.48 -0.54 -0.06 0.00 0.53 0.00 0.00 43.42 43.83 3dle n LEU 92 CO 0.36 0.83 0.34 -0.83 -1.11 0.00 0.00 177.39 176.97 3dle s GLY 93 N -2.31 1.80 -0.21 -3.96 0.00 -1.26 -5.03 107.32 96.36 3dle s GLY 93 Ca 0.40 -2.00 -0.29 0.00 0.00 0.00 0.00 44.72 42.83 3dle s GLY 93 CO 0.05 1.48 1.60 -0.26 0.00 0.00 0.00 173.10 175.97 3dle s ILE 94 N 2.54 3.72 1.15 0.90 -0.00 -1.26 -5.01 121.20 123.24 3dle s ILE 94 Ca 0.12 0.82 -0.14 0.00 -0.00 0.00 0.00 60.65 61.45 3dle s ILE 94 Cb -0.22 -3.71 0.27 0.00 -0.00 0.00 0.00 42.46 38.80 3dle s ILE 94 CO 0.09 -0.27 1.04 -2.84 -0.00 0.00 0.00 174.94 172.96 3dle s PRO 95 N 4.56 -0.82 -0.04 0.37 0.02 -1.26 -5.05 135.00 132.79 3dle s PRO 95 Ca 0.71 0.59 0.01 0.00 0.02 0.00 0.00 61.00 62.33 3dle s PRO 95 Cb -0.25 -1.59 0.02 0.00 0.02 0.00 0.00 34.50 32.70 3dle s PRO 95 CO 0.28 -3.59 -0.04 -1.58 -0.33 0.00 0.00 177.00 171.75 3dle s HIS 96 N -2.63 0.64 0.31 6.54 2.46 -1.26 -5.04 115.29 116.31 3dle s HIS 96 Ca 0.68 -0.15 0.03 0.00 0.47 0.00 0.00 55.06 56.09 3dle s HIS 96 Cb -0.21 -0.58 0.79 0.00 -0.13 0.00 0.00 32.58 32.45 3dle s HIS 96 CO 0.62 -0.16 1.58 -1.35 -2.47 0.00 0.00 174.74 172.96 3dle h PRO 97 N 7.05 0.02 0.00 2.88 0.11 -1.96 0.54 132.00 140.64 3dle h PRO 97 Ca -0.38 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3dle h PRO 97 Cb 1.15 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3dle h PRO 97 CO 0.48 0.01 0.21 0.00 -0.21 0.00 0.00 178.00 178.50 3dle n ALA 98 N -3.03 0.73 0.19 -0.75 0.00 -1.26 -1.45 120.51 114.94 3dle n ALA 98 Ca 0.24 0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.92 3dle n ALA 98 Cb 0.79 -0.89 -0.06 0.00 0.00 0.00 0.00 19.45 19.29 3dle n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dle n GLY 99 N -1.29 -1.22 3.77 0.00 0.00 0.19 -3.87 105.19 102.77 3dle n GLY 99 Ca -0.01 -0.39 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 3dle n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dle s LEU 100 N -4.64 4.39 0.02 0.99 1.43 -0.53 -4.62 118.68 115.72 3dle s LEU 100 Ca -0.02 2.60 -0.20 0.00 -1.03 0.00 0.00 54.13 55.48 3dle s LEU 100 Cb 0.13 -3.72 -0.06 0.00 0.03 0.00 0.00 46.19 42.57 3dle s LEU 100 CO 0.84 -0.55 0.58 -0.54 0.23 0.00 0.00 176.35 176.91 3dle s LYS 101 N -1.86 4.27 0.46 1.70 1.02 -1.26 0.18 119.74 124.24 3dle s LYS 101 Ca 0.50 0.72 -0.24 0.00 0.02 0.00 0.00 55.97 56.97 3dle s LYS 101 Cb -0.38 -3.30 -0.09 0.00 -0.52 0.00 0.00 37.83 33.54 3dle s LYS 101 CO 0.50 0.47 1.19 1.17 -0.92 0.00 0.00 175.35 177.76 3dle n LYS 102 N 2.37 1.66 -3.94 1.68 4.81 -1.22 -4.87 118.16 118.65 3dle n LYS 102 Ca -0.08 0.60 -0.16 0.00 -0.87 0.00 0.00 58.31 57.80 3dle n LYS 102 Cb 0.51 -2.31 -0.16 0.00 0.02 0.00 0.00 35.03 33.09 3dle n LYS 102 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 3dle s LYS 103 N -2.33 0.24 0.47 1.64 2.47 -1.26 -4.98 119.74 115.99 3dle s LYS 103 Ca 0.65 0.03 0.22 0.00 -1.56 0.00 0.00 55.97 55.31 3dle s LYS 103 Cb -0.49 -0.37 1.23 0.00 -1.46 0.00 0.00 37.83 36.74 3dle s LYS 103 CO 0.55 -0.08 1.91 0.87 0.16 0.00 0.00 175.35 178.76 3dle h LYS 104 N 6.88 0.23 -2.82 4.03 1.57 -1.79 -3.41 116.57 121.26 3dle h LYS 104 Ca -0.38 -0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.24 3dle h LYS 104 Cb 1.15 -0.05 -0.27 0.00 0.08 0.00 0.00 32.23 33.14 3dle h LYS 104 CO 0.49 0.15 -0.35 -1.12 -0.57 0.00 0.00 179.45 178.05 3dle s SER 105 N -5.84 -0.40 -0.03 0.86 0.01 -0.61 -5.02 113.70 102.65 3dle s SER 105 Ca -0.07 0.74 0.05 0.00 1.31 0.00 0.00 55.95 57.98 3dle s SER 105 Cb 0.21 0.66 -0.01 0.00 0.21 0.00 0.00 66.02 67.09 3dle s SER 105 CO 0.77 -0.16 -0.18 -0.69 0.41 0.00 0.00 173.24 173.38 3dle s VAL 106 N 0.99 1.49 -0.05 3.43 1.01 -1.26 -0.98 120.40 125.04 3dle s VAL 106 Ca -0.07 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.15 3dle s VAL 106 Cb -0.07 -1.27 0.02 0.00 0.00 0.00 0.00 36.38 35.06 3dle s VAL 106 CO -0.08 0.43 -0.06 -0.89 0.00 0.00 0.00 175.10 174.50 3dle s THR 107 N -0.15 0.64 -0.08 3.92 2.01 0.15 -4.95 115.64 117.18 3dle s THR 107 Ca 0.00 -0.19 -0.11 0.00 0.31 0.00 0.00 61.69 61.71 3dle s THR 107 Cb -0.10 -0.64 -0.05 0.00 0.01 0.00 0.00 72.50 71.72 3dle s THR 107 CO 0.01 0.25 0.26 0.54 -0.69 0.00 0.00 174.62 174.99 3dle s VAL 108 N 0.86 5.30 -0.13 3.82 0.11 -1.26 0.27 120.40 129.36 3dle s VAL 108 Ca -0.12 0.49 0.02 0.00 -2.93 0.00 0.00 61.98 59.44 3dle s VAL 108 Cb -0.15 -3.55 0.01 0.00 -1.53 0.00 0.00 36.38 31.17 3dle s VAL 108 CO 0.01 0.57 -0.19 -0.76 -3.33 0.00 0.00 175.10 171.40 3dle s LEU 109 N -0.81 1.96 -0.05 2.54 1.02 0.19 -4.80 118.68 118.72 3dle s LEU 109 Ca 0.18 -0.54 -0.21 0.00 0.02 0.00 0.00 54.13 53.59 3dle s LEU 109 Cb -0.14 -1.31 -0.04 0.00 0.02 0.00 0.00 46.19 44.72 3dle s LEU 109 CO 0.07 0.05 0.60 -0.62 0.02 0.00 0.00 176.35 176.47 3dle s ASP 110 N 0.92 6.91 -0.38 2.29 3.68 -1.26 -0.94 116.67 127.87 3dle s ASP 110 Ca -0.06 1.08 0.13 0.00 2.13 0.00 0.00 52.55 55.83 3dle s ASP 110 Cb -0.15 -2.36 0.39 0.00 -1.45 0.00 0.00 42.92 39.35 3dle s ASP 110 CO -0.02 0.00 0.85 1.33 0.13 0.00 0.00 175.17 177.46 3dle n VAL 111 N 3.33 0.76 0.00 1.11 0.24 0.94 -4.28 118.33 120.42 3dle n VAL 111 Ca -0.05 -4.23 0.00 0.00 -2.04 0.00 0.00 64.34 58.02 3dle n VAL 111 Cb 0.51 -0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 3dle n VAL 111 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dle n GLY 112 N 0.05 -2.73 0.12 7.63 0.00 -1.25 -2.93 105.19 106.07 3dle n GLY 112 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3dle n GLY 112 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dle n ASP 113 N -0.47 0.00 0.24 1.61 5.68 -1.26 -2.52 116.55 119.84 3dle n ASP 113 Ca 0.00 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.36 3dle n ASP 113 Cb 0.00 0.00 0.59 0.00 -1.14 0.00 0.00 41.12 40.57 3dle n ASP 113 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3dle h ALA 114 N 0.96 1.83 -0.63 2.12 0.00 -1.94 -2.08 119.26 119.52 3dle h ALA 114 Ca 0.00 -0.08 0.13 0.00 0.00 0.00 0.00 54.91 54.96 3dle h ALA 114 Cb 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 17.66 3dle h ALA 114 CO 0.00 0.11 -0.12 1.88 0.00 0.00 0.00 179.25 181.12 3dle h TYR 115 N 0.00 -0.27 0.00 0.00 -1.99 -1.71 1.02 116.97 114.01 3dle h TYR 115 Ca -0.00 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.78 3dle h TYR 115 Cb 0.16 0.22 0.00 0.00 2.00 0.00 0.00 36.73 39.11 3dle h TYR 115 CO 0.00 -0.25 0.00 1.19 -0.00 0.00 0.00 178.16 179.10 3dle n PHE 116 N -5.40 0.00 0.14 4.88 3.72 -0.79 -2.87 117.46 117.15 3dle n PHE 116 Ca 0.08 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.57 3dle n PHE 116 Cb 0.34 -0.18 0.06 0.00 -0.94 0.00 0.00 39.48 38.75 3dle n PHE 116 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3dle h SER 117 N 0.00 0.00 -3.37 4.37 0.02 0.12 -3.45 113.55 111.24 3dle h SER 117 Ca 0.00 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.35 3dle h SER 117 Cb 0.14 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 62.56 3dle h SER 117 CO 0.00 0.13 -0.36 -0.69 -1.14 0.00 0.00 176.83 174.76 3dle s VAL 118 N -3.21 5.32 0.73 2.27 1.01 -1.10 0.10 120.40 125.52 3dle s VAL 118 Ca 0.03 0.45 -0.13 0.00 0.00 0.00 0.00 61.98 62.32 3dle s VAL 118 Cb 0.07 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.90 3dle s VAL 118 CO 0.74 0.37 1.13 -2.16 0.00 0.00 0.00 175.10 175.18 3dle s PRO 119 N 0.69 2.31 -0.00 2.72 0.04 -1.26 -1.38 135.00 138.11 3dle s PRO 119 Ca 0.14 1.45 -0.00 0.00 0.04 0.00 0.00 61.00 62.63 3dle s PRO 119 Cb -0.13 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 3dle s PRO 119 CO 0.03 -1.64 0.07 -1.17 0.04 0.00 0.00 177.00 174.33 3dle s LEU 120 N -5.37 3.85 -0.38 -3.56 2.96 -0.57 -4.48 118.68 111.12 3dle s LEU 120 Ca 0.67 0.12 -0.36 0.00 -0.22 0.00 0.00 54.13 54.34 3dle s LEU 120 Cb -0.22 -2.25 -0.12 0.00 0.50 0.00 0.00 46.19 44.10 3dle s LEU 120 CO 0.48 0.27 2.19 -0.67 -1.32 0.00 0.00 176.35 177.30 3dle n ASP 121 N 1.19 1.91 0.02 3.68 2.03 -1.26 -4.70 116.55 119.42 3dle n ASP 121 Ca -0.13 0.43 0.01 0.00 0.52 0.00 0.00 54.79 55.62 3dle n ASP 121 Cb 0.53 -1.21 0.05 0.00 -0.72 0.00 0.00 41.12 39.77 3dle n ASP 121 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 3dle n GLU 122 N 8.12 0.01 0.09 -0.67 0.00 -1.26 -0.14 120.64 126.79 3dle n GLU 122 Ca 0.43 0.43 0.02 0.00 0.00 0.00 0.00 57.16 58.05 3dle n GLU 122 Cb 0.19 -1.64 -0.03 0.00 0.00 0.00 0.00 31.44 29.97 3dle n GLU 122 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 3dle h ASP 123 N 0.00 0.00 0.39 -1.84 1.82 -1.96 -3.34 116.42 111.49 3dle h ASP 123 Ca 0.00 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.61 3dle h ASP 123 Cb 0.19 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.20 3dle h ASP 123 CO 0.00 0.49 -1.64 0.33 -1.61 0.00 0.00 179.24 176.81 3dle n PHE 124 N -3.01 0.40 -0.33 0.28 7.35 0.80 -4.49 117.46 118.45 3dle n PHE 124 Ca -0.04 0.12 0.23 0.00 -0.76 0.00 0.00 57.45 57.00 3dle n PHE 124 Cb 0.77 -0.72 0.46 0.00 0.35 0.00 0.00 39.48 40.34 3dle n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3dle h ARG 125 N 0.00 0.25 -0.93 -4.13 3.08 -1.58 0.57 114.38 111.66 3dle h ARG 125 Ca -0.04 -0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.14 3dle h ARG 125 Cb 1.10 -0.06 -0.08 0.00 0.08 0.00 0.00 29.97 31.02 3dle h ARG 125 CO 0.00 0.17 0.59 1.57 -1.07 0.00 0.00 179.97 181.23 3dle h LYS 126 N 0.26 0.73 0.00 0.04 2.10 -1.82 0.11 116.57 117.99 3dle h LYS 126 Ca 0.73 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 59.33 3dle h LYS 126 Cb 1.68 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 32.84 3dle h LYS 126 CO -0.64 0.48 0.00 0.66 -2.00 0.00 0.00 179.45 177.95 3dle n TYR 127 N -4.59 0.32 -0.74 0.07 4.01 0.19 -2.23 117.16 114.20 3dle n TYR 127 Ca 0.18 0.15 0.07 0.00 -0.16 0.00 0.00 57.90 58.14 3dle n TYR 127 Cb 0.47 -0.73 0.38 0.00 -0.31 0.00 0.00 39.34 39.14 3dle n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3dle n THR 128 N -1.81 2.45 -2.13 -0.72 -2.24 0.03 -4.66 114.28 105.20 3dle n THR 128 Ca 0.01 -1.28 -0.42 0.00 -2.27 0.00 0.00 64.05 60.09 3dle n THR 128 Cb 0.11 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.09 3dle n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dle s ALA 129 N -2.51 3.60 0.21 6.98 0.00 -0.95 -4.18 121.76 124.91 3dle s ALA 129 Ca 0.51 1.18 0.01 0.00 0.00 0.00 0.00 51.96 53.66 3dle s ALA 129 Cb 0.38 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.92 3dle s ALA 129 CO 0.17 -0.63 0.05 -0.59 0.00 0.00 0.00 175.76 174.76 3dle s PHE 130 N 0.64 1.34 -0.01 0.00 -0.12 -0.63 -1.07 117.98 118.13 3dle s PHE 130 Ca 0.62 -1.12 0.04 0.00 -0.05 0.00 0.00 56.93 56.42 3dle s PHE 130 Cb -0.38 -0.76 -0.01 0.00 -0.63 0.00 0.00 43.02 41.23 3dle s PHE 130 CO 0.35 -0.31 -0.14 0.99 -0.05 0.00 0.00 175.22 176.06 3dle s THR 131 N -3.75 1.11 -0.45 -4.49 2.01 -1.25 -1.96 115.64 106.87 3dle s THR 131 Ca 0.31 -0.60 -0.15 0.00 0.31 0.00 0.00 61.69 61.56 3dle s THR 131 Cb 0.07 -0.93 0.05 0.00 0.01 0.00 0.00 72.50 71.70 3dle s THR 131 CO 0.09 0.31 0.35 -0.63 -0.69 0.00 0.00 174.62 174.05 3dle s ILE 132 N -0.32 5.20 0.94 1.82 1.01 0.54 -4.65 121.20 125.74 3dle s ILE 132 Ca 0.05 -0.92 -0.13 0.00 0.00 0.00 0.00 60.65 59.66 3dle s ILE 132 Cb -0.06 -4.03 0.04 0.00 0.01 0.00 0.00 42.46 38.42 3dle s ILE 132 CO -0.01 -0.47 0.44 -0.81 0.00 0.00 0.00 174.94 174.10 3dle n PRO 133 N 5.17 -0.26 -3.95 2.79 -0.04 -1.26 -1.35 135.00 136.10 3dle n PRO 133 Ca -0.12 -0.03 -0.32 0.00 -0.04 0.00 0.00 63.50 62.99 3dle n PRO 133 Cb 0.45 -1.87 -0.05 0.00 -0.04 0.00 0.00 33.50 31.99 3dle n PRO 133 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3dle s SER 134 N -2.01 6.19 0.00 3.54 0.15 -1.26 -4.78 113.70 115.54 3dle s SER 134 Ca 0.58 0.24 0.00 0.00 0.70 0.00 0.00 55.95 57.47 3dle s SER 134 Cb -0.22 -1.88 0.00 0.00 -1.71 0.00 0.00 66.02 62.21 3dle s SER 134 CO 0.67 0.20 0.00 -0.38 1.20 0.00 0.00 173.24 174.93 3dle n ILE 135 N 0.57 0.00 0.00 6.45 5.41 -1.26 -3.64 119.36 126.88 3dle n ILE 135 Ca -0.08 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.67 3dle n ILE 135 Cb 0.52 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.45 3dle n ILE 135 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 3dle n ASN 136 N -0.03 0.00 -0.64 4.38 5.15 -1.26 -4.56 115.26 118.30 3dle n ASN 136 Ca 0.00 0.00 -0.02 0.00 -0.60 0.00 0.00 54.58 53.96 3dle n ASN 136 Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.23 3dle n ASN 136 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 3dle n ASN 137 N -0.41 -0.33 0.00 1.20 5.15 -1.24 -4.82 115.26 114.82 3dle n ASN 137 Ca 0.00 -1.26 0.00 0.00 -0.60 0.00 0.00 54.58 52.72 3dle n ASN 137 Cb 0.00 0.10 0.00 0.00 -0.53 0.00 0.00 39.78 39.35 3dle n ASN 137 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3dle n GLU 138 N 0.00 0.00 -0.46 1.20 1.02 -1.26 -4.91 120.64 116.22 3dle n GLU 138 Ca -0.09 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.76 3dle n GLU 138 Cb 0.54 0.00 0.24 0.00 -0.02 0.00 0.00 31.44 32.20 3dle n GLU 138 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3dle n THR 139 N 0.00 0.00 -2.05 2.62 -2.24 -1.26 -4.94 114.28 106.41 3dle n THR 139 Ca 0.00 -0.33 -0.37 0.00 -2.27 0.00 0.00 64.05 61.08 3dle n THR 139 Cb 0.00 -0.87 0.02 0.00 -2.10 0.00 0.00 70.33 67.38 3dle n THR 139 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 3dle s PRO 140 N -4.23 3.36 0.75 -0.78 0.02 -1.26 -4.51 135.00 128.36 3dle s PRO 140 Ca 0.63 1.93 -0.09 0.00 0.02 0.00 0.00 61.00 63.50 3dle s PRO 140 Cb -0.19 -2.23 0.08 0.00 0.02 0.00 0.00 34.50 32.18 3dle s PRO 140 CO 0.62 -0.92 1.09 0.20 -0.33 0.00 0.00 177.00 177.66 3dle s GLY 141 N -1.30 1.66 0.10 0.52 0.00 -1.26 -4.76 107.32 102.29 3dle s GLY 141 Ca 0.70 -0.86 -0.28 0.00 0.00 0.00 0.00 44.72 44.27 3dle s GLY 141 CO 0.38 -0.41 0.88 -0.42 0.00 0.00 0.00 173.10 173.53 3dle s ILE 142 N -3.39 4.53 -0.09 0.90 -1.09 -0.46 -4.82 121.20 116.78 3dle s ILE 142 Ca 0.62 1.89 0.02 0.00 -2.23 0.00 0.00 60.65 60.95 3dle s ILE 142 Cb -0.10 -4.24 -0.02 0.00 -1.58 0.00 0.00 42.46 36.52 3dle s ILE 142 CO 0.47 0.36 -0.15 -0.13 -1.23 0.00 0.00 174.94 174.26 3dle s ARG 143 N -0.20 2.94 0.34 2.79 0.52 -1.26 -0.34 118.95 123.73 3dle s ARG 143 Ca 0.43 -0.71 0.04 0.00 -0.52 0.00 0.00 55.73 54.97 3dle s ARG 143 Cb -0.23 -2.48 -0.07 0.00 0.52 0.00 0.00 34.95 32.70 3dle s ARG 143 CO 0.27 0.40 0.05 0.71 0.02 0.00 0.00 175.30 176.75 3dle s TYR 144 N -0.14 2.04 -0.01 -0.53 1.51 -0.83 -0.96 117.35 118.44 3dle s TYR 144 Ca -0.01 -0.91 -0.10 0.00 -1.01 0.00 0.00 57.07 55.04 3dle s TYR 144 Cb -0.14 -1.35 0.01 0.00 -0.11 0.00 0.00 41.96 40.38 3dle s TYR 144 CO 0.03 0.08 0.20 -1.14 -1.11 0.00 0.00 175.55 173.62 3dle s GLN 145 N -3.86 0.54 0.12 -0.62 0.74 0.07 -1.60 119.66 115.05 3dle s GLN 145 Ca 0.36 -0.30 -0.21 0.00 0.05 0.00 0.00 55.36 55.26 3dle s GLN 145 Cb 0.09 0.23 -0.07 0.00 1.10 0.00 0.00 33.01 34.36 3dle s GLN 145 CO 0.16 -0.14 0.65 0.71 -0.55 0.00 0.00 175.29 176.12 3dle s TYR 146 N -1.31 3.82 -1.59 1.67 2.02 -1.26 0.34 117.35 121.04 3dle s TYR 146 Ca -0.14 1.40 0.13 0.00 -0.37 0.00 0.00 57.07 58.09 3dle s TYR 146 Cb -0.07 -2.59 0.09 0.00 -0.40 0.00 0.00 41.96 39.00 3dle s TYR 146 CO 0.03 0.54 0.90 0.09 -1.57 0.00 0.00 175.55 175.53 3dle n ASN 147 N 1.57 2.03 -4.05 2.29 3.02 0.28 -4.68 115.26 115.71 3dle n ASN 147 Ca -0.08 -1.51 -0.14 0.00 -0.03 0.00 0.00 54.58 52.81 3dle n ASN 147 Cb 0.50 0.04 -0.10 0.00 -0.61 0.00 0.00 39.78 39.61 3dle n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3dle s VAL 148 N -1.13 0.08 -0.17 2.41 -7.23 -1.18 -1.52 120.40 111.66 3dle s VAL 148 Ca 0.15 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.03 3dle s VAL 148 Cb 0.11 -2.51 -0.06 0.00 0.56 0.00 0.00 36.38 34.47 3dle s VAL 148 CO 0.18 0.00 2.18 0.18 -0.31 0.00 0.00 175.10 177.32 3dle n LEU 149 N -0.37 3.40 -4.77 1.32 4.32 -0.48 -4.56 117.00 115.86 3dle n LEU 149 Ca 0.03 0.34 -0.38 0.00 -0.02 0.00 0.00 56.01 55.97 3dle n LEU 149 Cb 0.65 -1.54 -0.03 0.00 -1.62 0.00 0.00 43.42 40.88 3dle n LEU 149 CO 0.33 -0.52 0.82 -2.84 -1.22 0.00 0.00 177.39 173.96 3dle s PRO 150 N 6.00 4.21 0.03 3.23 0.02 -1.26 -4.11 135.00 143.11 3dle s PRO 150 Ca 0.99 1.80 -0.30 0.00 0.02 0.00 0.00 61.00 63.51 3dle s PRO 150 Cb -0.37 -2.78 -0.05 0.00 0.02 0.00 0.00 34.50 31.32 3dle s PRO 150 CO 0.37 -0.17 1.24 -0.65 -0.33 0.00 0.00 177.00 177.46 3dle s GLN 151 N -2.13 4.38 0.00 5.54 -1.52 -1.26 -2.72 119.66 121.95 3dle s GLN 151 Ca 0.54 1.79 0.00 0.00 -1.95 0.00 0.00 55.36 55.74 3dle s GLN 151 Cb -0.30 -3.43 0.00 0.00 -0.22 0.00 0.00 33.01 29.06 3dle s GLN 151 CO 0.38 -0.36 0.00 0.41 -0.25 0.00 0.00 175.29 175.47 3dle n GLY 152 N 3.33 0.13 3.77 3.09 0.00 -1.26 -4.83 105.19 109.43 3dle n GLY 152 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 3dle n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3dle s TRP 153 N -2.00 3.80 0.30 1.61 -0.00 -1.10 -4.66 118.94 116.89 3dle s TRP 153 Ca 0.00 1.43 0.03 0.00 -0.00 0.00 0.00 56.10 57.56 3dle s TRP 153 Cb 0.00 -2.69 0.75 0.00 -0.00 0.00 0.00 33.47 31.54 3dle s TRP 153 CO 0.00 0.45 1.49 1.17 -0.00 0.00 0.00 176.95 180.05 3dle n LYS 154 N 2.11 -0.07 0.00 5.86 4.81 -1.26 -1.47 118.16 128.14 3dle n LYS 154 Ca -0.06 1.42 0.13 0.00 -0.87 0.00 0.00 58.31 58.93 3dle n LYS 154 Cb 0.50 -2.26 0.50 0.00 0.02 0.00 0.00 35.03 33.78 3dle n LYS 154 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dle n GLY 155 N -1.47 -1.19 0.19 3.14 0.00 -1.26 -4.44 105.19 100.17 3dle n GLY 155 Ca 0.23 -0.25 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 3dle n GLY 155 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3dle h SER 156 N 0.25 -0.36 -0.92 1.61 0.02 -1.54 -1.71 113.55 110.90 3dle h SER 156 Ca 0.00 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.01 3dle h SER 156 Cb 0.45 0.10 -0.06 0.00 0.14 0.00 0.00 62.40 63.03 3dle h SER 156 CO 0.00 -0.25 0.59 1.55 -1.14 0.00 0.00 176.83 177.58 3dle h PRO 157 N -0.40 1.08 -0.03 3.45 0.13 -1.78 -0.37 132.00 134.08 3dle h PRO 157 Ca -0.04 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 65.02 3dle h PRO 157 Cb 0.32 -0.24 -0.00 0.00 0.13 0.00 0.00 31.00 31.20 3dle h PRO 157 CO 0.05 0.71 -0.00 0.00 -0.23 0.00 0.00 178.00 178.54 3dle h ALA 158 N 1.40 0.04 -0.76 -0.56 0.00 -1.81 -1.39 119.26 116.18 3dle h ALA 158 Ca 0.38 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 3dle h ALA 158 Cb 0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3dle h ALA 158 CO -0.15 -0.29 0.26 0.82 0.00 0.00 0.00 179.25 179.89 3dle h ILE 159 N -0.25 1.26 -0.48 0.00 2.04 -1.16 0.11 117.51 119.03 3dle h ILE 159 Ca 0.01 -0.88 -0.05 0.00 1.00 0.00 0.00 64.86 64.93 3dle h ILE 159 Cb 0.33 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 3dle h ILE 159 CO 0.00 0.35 0.09 0.15 0.00 0.00 0.00 178.15 178.74 3dle h PHE 160 N 1.12 0.84 0.44 1.37 3.04 -1.04 -0.09 116.94 122.62 3dle h PHE 160 Ca 0.25 -0.11 -0.02 0.00 3.98 0.00 0.00 57.97 62.06 3dle h PHE 160 Cb 0.28 -0.23 0.00 0.00 2.56 0.00 0.00 35.95 38.56 3dle h PHE 160 CO 0.02 0.77 -0.21 0.37 -2.02 0.00 0.00 178.31 177.24 3dle h GLN 161 N 0.66 -0.57 -0.61 1.11 5.75 -0.84 0.16 115.11 120.76 3dle h GLN 161 Ca 0.15 0.04 0.13 0.00 -0.15 0.00 0.00 58.65 58.81 3dle h GLN 161 Cb 0.37 0.13 -0.11 0.00 1.07 0.00 0.00 27.48 28.94 3dle h GLN 161 CO 0.01 -0.38 -0.09 1.03 -2.65 0.00 0.00 178.83 176.75 3dle h SER 162 N -0.60 -0.44 -0.09 -0.69 0.87 -0.88 0.52 113.55 112.23 3dle h SER 162 Ca -0.06 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 3dle h SER 162 Cb 0.46 0.33 -0.00 0.00 -0.44 0.00 0.00 62.40 62.75 3dle h SER 162 CO 0.10 -0.17 0.06 0.28 -0.53 0.00 0.00 176.83 176.57 3dle h SER 163 N 0.05 0.10 -0.52 6.23 0.02 -0.61 -2.25 113.55 116.57 3dle h SER 163 Ca 0.31 -0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.28 3dle h SER 163 Cb 0.49 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.96 3dle h SER 163 CO -0.59 0.09 0.27 -0.03 -1.14 0.00 0.00 176.83 175.43 3dle h MET 164 N 0.10 0.50 -0.50 3.45 -1.53 0.18 -2.22 114.93 114.92 3dle h MET 164 Ca 0.03 -0.03 0.09 0.00 -3.44 0.00 0.00 59.70 56.35 3dle h MET 164 Cb 0.01 -0.11 -0.08 0.00 -0.55 0.00 0.00 31.60 30.87 3dle h MET 164 CO -0.01 0.33 0.06 1.15 0.14 0.00 0.00 176.91 178.58 3dle h THR 165 N 0.52 0.67 -0.09 -0.77 2.02 -0.54 -1.02 112.91 113.69 3dle h THR 165 Ca 0.23 -0.06 -0.00 0.00 0.77 0.00 0.00 66.41 67.35 3dle h THR 165 Cb 0.13 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 67.01 3dle h THR 165 CO -0.16 0.03 0.06 0.11 0.37 0.00 0.00 175.52 175.93 3dle h LYS 166 N 0.18 0.13 -0.26 6.66 1.57 -1.04 -2.50 116.57 121.31 3dle h LYS 166 Ca 0.25 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.10 3dle h LYS 166 Cb 0.37 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3dle h LYS 166 CO -0.37 0.14 0.21 0.82 -0.57 0.00 0.00 179.45 179.68 3dle h ILE 167 N 0.08 0.73 0.00 1.86 2.04 -0.80 -2.62 117.51 118.81 3dle h ILE 167 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 3dle h ILE 167 Cb 0.05 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3dle h ILE 167 CO -0.01 0.00 -1.03 0.18 0.00 0.00 0.00 178.15 177.29 3dle n LEU 168 N -4.24 0.82 -0.31 1.44 4.77 -0.45 -4.36 117.00 114.68 3dle n LEU 168 Ca 0.03 0.32 0.14 0.00 -0.03 0.00 0.00 56.01 56.47 3dle n LEU 168 Cb 0.36 -0.06 0.31 0.00 -2.33 0.00 0.00 43.42 41.71 3dle n LEU 168 CO 0.33 -0.18 1.05 -0.08 -1.33 0.00 0.00 177.39 177.18 3dle h GLU 169 N 0.00 0.40 0.08 3.23 4.81 -1.05 -0.50 114.58 121.55 3dle h GLU 169 Ca 0.00 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3dle h GLU 169 Cb 1.00 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.29 3dle h GLU 169 CO 0.00 0.27 -0.04 -1.35 -0.73 0.00 0.00 179.01 177.16 3dle h PRO 170 N 0.41 -0.11 -0.25 0.92 0.11 -1.76 -1.80 132.00 129.53 3dle h PRO 170 Ca 0.57 0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.70 3dle h PRO 170 Cb 1.07 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 3dle h PRO 170 CO -0.52 0.05 0.13 0.35 -0.21 0.00 0.00 178.00 177.80 3dle h PHE 171 N -0.25 0.24 -1.00 0.65 3.57 -1.63 -1.42 116.94 117.10 3dle h PHE 171 Ca -0.01 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.52 3dle h PHE 171 Cb 0.21 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.83 3dle h PHE 171 CO -0.03 0.14 0.66 0.00 -2.23 0.00 0.00 178.31 176.85 3dle h ARG 172 N 0.28 1.28 0.78 1.11 3.08 -1.10 -1.23 114.38 118.58 3dle h ARG 172 Ca 0.10 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 3dle h ARG 172 Cb 0.02 -0.29 0.01 0.00 0.08 0.00 0.00 29.97 29.79 3dle h ARG 172 CO -0.06 0.85 -0.38 -0.22 -1.07 0.00 0.00 179.97 179.09 3dle h LYS 173 N 1.32 -1.01 -0.79 0.04 1.63 -0.89 -2.72 116.57 114.14 3dle h LYS 173 Ca 0.38 0.07 0.14 0.00 -0.85 0.00 0.00 60.65 60.39 3dle h LYS 173 Cb -0.09 0.23 -0.09 0.00 -0.60 0.00 0.00 32.23 31.68 3dle h LYS 173 CO -0.10 -0.68 0.37 1.96 -3.45 0.00 0.00 179.45 177.55 3dle h GLN 174 N -1.05 0.52 -2.80 1.90 4.20 -0.96 -3.34 115.11 113.58 3dle h GLN 174 Ca -0.11 -0.03 -0.60 0.00 0.06 0.00 0.00 58.65 57.97 3dle h GLN 174 Cb 0.81 -0.12 -0.40 0.00 0.30 0.00 0.00 27.48 28.07 3dle h GLN 174 CO 0.18 0.34 -0.79 0.54 -0.67 0.00 0.00 178.83 178.43 3dle s ASN 175 N -5.39 3.24 0.00 1.46 4.22 -0.49 -4.95 114.94 113.02 3dle s ASN 175 Ca -0.12 -2.66 0.26 0.00 -2.14 0.00 0.00 52.86 48.20 3dle s ASN 175 Cb 0.21 -0.82 1.29 0.00 1.28 0.00 0.00 41.25 43.21 3dle s ASN 175 CO 0.77 -0.25 1.88 -0.81 -2.04 0.00 0.00 177.10 176.65 3dle n PRO 176 N 3.47 0.32 -0.09 3.55 -0.04 -1.03 -2.90 135.00 138.28 3dle n PRO 176 Ca 0.13 0.04 0.07 0.00 -0.04 0.00 0.00 63.50 63.71 3dle n PRO 176 Cb 0.37 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.60 3dle n PRO 176 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3dle n ASP 177 N -1.31 1.21 -4.34 3.54 5.75 -1.26 -4.77 116.55 115.37 3dle n ASP 177 Ca 0.12 -1.80 -0.32 0.00 -0.01 0.00 0.00 54.79 52.78 3dle n ASP 177 Cb 0.22 -0.12 -0.15 0.00 -1.03 0.00 0.00 41.12 40.04 3dle n ASP 177 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3dle s ILE 178 N -1.77 2.35 -0.09 2.12 1.01 -1.14 -4.40 121.20 119.27 3dle s ILE 178 Ca 0.24 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 59.91 3dle s ILE 178 Cb 0.12 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.70 3dle s ILE 178 CO 0.18 0.58 -0.08 -0.69 0.00 0.00 0.00 174.94 174.93 3dle s VAL 179 N -0.43 3.59 -0.09 2.92 1.01 -0.40 -4.99 120.40 122.01 3dle s VAL 179 Ca 0.04 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.53 3dle s VAL 179 Cb -0.12 -2.48 0.02 0.00 0.00 0.00 0.00 36.38 33.80 3dle s VAL 179 CO 0.01 0.57 -0.11 -0.63 0.00 0.00 0.00 175.10 174.95 3dle s ILE 180 N -0.43 1.12 -0.21 2.22 1.01 -1.26 -0.63 121.20 123.01 3dle s ILE 180 Ca 0.06 -0.41 -0.05 0.00 0.00 0.00 0.00 60.65 60.25 3dle s ILE 180 Cb -0.12 -1.06 -0.02 0.00 0.01 0.00 0.00 42.46 41.26 3dle s ILE 180 CO 0.02 0.37 0.00 -0.47 0.00 0.00 0.00 174.94 174.86 3dle s TYR 181 N 1.12 3.03 -0.38 3.97 6.04 0.50 -4.94 117.35 126.68 3dle s TYR 181 Ca -0.06 -0.56 -0.19 0.00 0.04 0.00 0.00 57.07 56.31 3dle s TYR 181 Cb -0.14 -2.11 0.01 0.00 -1.04 0.00 0.00 41.96 38.67 3dle s TYR 181 CO -0.02 -0.33 0.54 -0.65 -1.54 0.00 0.00 175.55 173.55 3dle s GLN 182 N 1.20 3.46 -0.20 4.97 -0.21 -1.26 -0.97 119.66 126.66 3dle s GLN 182 Ca 0.03 -0.30 -0.03 0.00 0.02 0.00 0.00 55.36 55.08 3dle s GLN 182 Cb -0.15 -3.87 0.06 0.00 1.00 0.00 0.00 33.01 30.06 3dle s GLN 182 CO 0.01 -0.77 0.04 -0.47 -2.12 0.00 0.00 175.29 171.99 3dle s TYR 183 N 2.46 0.94 0.00 0.91 6.14 -0.46 -5.03 117.35 122.32 3dle s TYR 183 Ca 0.19 -0.82 0.00 0.00 0.64 0.00 0.00 57.07 57.08 3dle s TYR 183 Cb -0.15 -1.00 0.00 0.00 0.42 0.00 0.00 41.96 41.22 3dle s TYR 183 CO 0.15 -0.61 0.00 -0.12 0.64 0.00 0.00 175.55 175.61 3dle n MET 184 N 5.07 0.00 -0.16 4.97 0.00 -1.26 -0.97 117.12 124.77 3dle n MET 184 Ca -0.09 0.00 0.07 0.00 0.00 0.00 0.00 57.70 57.69 3dle n MET 184 Cb 0.47 0.00 0.22 0.00 0.00 0.00 0.00 33.22 33.91 3dle n MET 184 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 3dle n ASP 185 N 6.79 1.91 -4.51 6.12 10.43 -1.26 -4.93 116.55 131.10 3dle n ASP 185 Ca 0.00 -1.92 -0.27 0.00 2.57 0.00 0.00 54.79 55.17 3dle n ASP 185 Cb 0.00 -0.21 -0.10 0.00 1.84 0.00 0.00 41.12 42.65 3dle n ASP 185 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 3dle s ASP 186 N -1.16 3.94 -0.14 -2.24 -0.00 -0.15 -0.04 116.67 116.89 3dle s ASP 186 Ca 0.27 -0.65 -0.00 0.00 -0.00 0.00 0.00 52.55 52.17 3dle s ASP 186 Cb 0.14 -0.55 0.02 0.00 -0.00 0.00 0.00 42.92 42.54 3dle s ASP 186 CO 0.20 0.13 -0.11 -0.76 -0.00 0.00 0.00 175.17 174.62 3dle s LEU 187 N -2.62 1.48 -0.29 1.23 1.43 -0.12 -1.36 118.68 118.43 3dle s LEU 187 Ca 0.22 -0.43 -0.10 0.00 -1.03 0.00 0.00 54.13 52.80 3dle s LEU 187 Cb -0.09 -1.03 -0.02 0.00 0.03 0.00 0.00 46.19 45.08 3dle s LEU 187 CO 0.12 -0.09 0.14 -0.31 0.23 0.00 0.00 176.35 176.45 3dle s TYR 188 N 1.59 3.16 -0.26 0.29 1.51 -0.14 0.55 117.35 124.04 3dle s TYR 188 Ca 0.05 -0.36 -0.05 0.00 -1.01 0.00 0.00 57.07 55.70 3dle s TYR 188 Cb -0.13 -2.34 0.01 0.00 -0.11 0.00 0.00 41.96 39.39 3dle s TYR 188 CO -0.09 -0.36 0.02 0.08 -1.11 0.00 0.00 175.55 174.08 3dle s VAL 189 N 1.65 3.58 0.25 0.71 1.01 0.14 -0.37 120.40 127.38 3dle s VAL 189 Ca 0.06 -0.69 0.12 0.00 0.00 0.00 0.00 61.98 61.46 3dle s VAL 189 Cb -0.16 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 33.39 3dle s VAL 189 CO 0.07 0.21 -0.21 -0.83 0.00 0.00 0.00 175.10 174.34 3dle s GLY 190 N 1.46 1.81 -0.01 4.51 0.00 0.20 0.35 107.32 115.64 3dle s GLY 190 Ca 0.03 -1.79 -0.30 0.00 0.00 0.00 0.00 44.72 42.67 3dle s GLY 190 CO -0.01 -1.86 1.06 -1.35 0.00 0.00 0.00 173.10 170.94 3dle s SER 191 N -3.22 -0.20 -0.16 1.64 1.04 -0.15 -1.27 113.70 111.37 3dle s SER 191 Ca 0.27 -0.13 0.16 0.00 0.48 0.00 0.00 55.95 56.72 3dle s SER 191 Cb -0.06 0.31 0.56 0.00 0.10 0.00 0.00 66.02 66.94 3dle s SER 191 CO 0.13 -0.55 1.47 0.47 0.98 0.00 0.00 173.24 175.74 3dle n ASP 192 N -0.32 4.12 -3.78 7.02 8.00 -1.26 -1.57 116.55 128.75 3dle n ASP 192 Ca -0.06 -2.81 -0.30 0.00 0.71 0.00 0.00 54.79 52.33 3dle n ASP 192 Cb 0.61 -0.53 0.24 0.00 -0.02 0.00 0.00 41.12 41.42 3dle n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dle s LEU 193 N -2.47 0.91 0.23 0.64 1.43 -1.26 -4.83 118.68 113.33 3dle s LEU 193 Ca 0.42 0.54 -0.26 0.00 -1.03 0.00 0.00 54.13 53.80 3dle s LEU 193 Cb 0.32 -2.28 -0.09 0.00 0.03 0.00 0.00 46.19 44.18 3dle s LEU 193 CO 0.12 -4.01 0.85 -1.61 0.23 0.00 0.00 176.35 171.93 3dle s GLU 194 N -5.51 4.58 0.35 1.70 0.41 -1.26 -4.76 118.70 114.21 3dle s GLU 194 Ca 0.72 1.23 0.13 0.00 -0.41 0.00 0.00 54.97 56.64 3dle s GLU 194 Cb -0.08 -3.07 1.11 0.00 -1.78 0.00 0.00 34.13 30.30 3dle s GLU 194 CO 0.56 0.45 1.58 -0.84 -0.49 0.00 0.00 175.26 176.52 3dle h ILE 195 N 2.99 0.02 -0.49 -1.63 3.07 -1.96 0.71 117.51 120.21 3dle h ILE 195 Ca -0.47 -0.01 -0.12 0.00 1.55 0.00 0.00 64.86 65.82 3dle h ILE 195 Cb 1.20 0.00 -0.02 0.00 -0.27 0.00 0.00 36.82 37.73 3dle h ILE 195 CO 0.66 0.00 -0.16 1.23 -1.05 0.00 0.00 178.15 178.84 3dle h GLY 196 N 0.02 1.03 1.01 0.16 0.00 -1.99 -0.08 103.07 103.22 3dle h GLY 196 Ca 0.75 -0.86 -0.16 0.00 0.00 0.00 0.00 47.33 47.06 3dle h GLY 196 CO -0.82 0.78 -0.51 1.46 0.00 0.00 0.00 176.54 177.45 3dle h GLN 197 N 0.84 0.69 0.25 4.80 4.20 -0.18 -2.55 115.11 123.15 3dle h GLN 197 Ca 0.12 -0.48 0.01 0.00 0.06 0.00 0.00 58.65 58.36 3dle h GLN 197 Cb 0.71 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 3dle h GLN 197 CO 0.05 1.10 -0.40 1.25 -0.67 0.00 0.00 178.83 180.17 3dle h HIS 198 N 0.39 -1.10 -0.99 2.96 2.76 -0.15 -0.91 115.15 118.11 3dle h HIS 198 Ca -0.01 0.02 0.24 0.00 -2.20 0.00 0.00 60.37 58.42 3dle h HIS 198 Cb 1.12 0.45 -0.08 0.00 1.55 0.00 0.00 27.41 30.45 3dle h HIS 198 CO 0.09 -0.52 0.65 -0.09 -1.30 0.00 0.00 177.93 176.76 3dle h ARG 199 N -0.71 0.36 -0.22 5.26 2.43 -1.01 0.13 114.38 120.62 3dle h ARG 199 Ca -0.00 -0.02 -0.18 0.00 -0.81 0.00 0.00 59.98 58.97 3dle h ARG 199 Cb 0.69 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.16 3dle h ARG 199 CO -0.16 0.24 -0.58 1.15 -1.51 0.00 0.00 179.97 179.12 3dle h THR 200 N 0.38 1.30 -0.32 0.20 2.02 -0.82 -2.45 112.91 113.22 3dle h THR 200 Ca 0.54 -1.80 -0.14 0.00 0.77 0.00 0.00 66.41 65.78 3dle h THR 200 Cb 1.41 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 69.56 3dle h THR 200 CO -0.23 0.57 -0.36 0.11 0.37 0.00 0.00 175.52 175.98 3dle h LYS 201 N 0.54 0.72 0.15 6.66 1.79 0.48 -0.36 116.57 126.55 3dle h LYS 201 Ca 0.00 -0.36 0.00 0.00 -2.18 0.00 0.00 60.65 58.12 3dle h LYS 201 Cb 1.16 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.80 3dle h LYS 201 CO 0.12 0.97 -0.14 0.82 -1.08 0.00 0.00 179.45 180.14 3dle h ILE 202 N 0.60 0.69 -0.33 1.86 1.08 -1.06 0.12 117.51 120.47 3dle h ILE 202 Ca 0.06 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.55 3dle h ILE 202 Cb 0.89 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 35.31 3dle h ILE 202 CO 0.08 0.00 0.22 -0.08 -0.69 0.00 0.00 178.15 177.68 3dle h GLU 203 N -0.31 0.33 -0.14 2.37 4.57 -1.22 0.74 114.58 120.92 3dle h GLU 203 Ca 0.00 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.11 3dle h GLU 203 Cb 0.30 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.81 3dle h GLU 203 CO -0.03 0.22 -0.11 1.49 -1.18 0.00 0.00 179.01 179.40 3dle h GLU 204 N 0.34 0.32 0.16 1.92 4.81 -0.27 0.14 114.58 121.99 3dle h GLU 204 Ca 0.13 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 3dle h GLU 204 Cb 0.11 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.50 3dle h GLU 204 CO -0.03 0.68 -0.08 1.25 -0.73 0.00 0.00 179.01 180.11 3dle h LEU 205 N -0.05 -0.18 -0.76 1.64 6.46 0.10 0.40 115.31 122.91 3dle h LEU 205 Ca 0.03 -0.12 0.14 0.00 -0.12 0.00 0.00 57.88 57.80 3dle h LEU 205 Cb 0.61 0.05 -0.09 0.00 -0.73 0.00 0.00 40.66 40.49 3dle h LEU 205 CO 0.03 0.01 0.31 -0.09 -0.62 0.00 0.00 178.44 178.08 3dle h ARG 206 N -0.38 0.44 -0.41 1.25 2.43 0.45 0.41 114.38 118.58 3dle h ARG 206 Ca -0.02 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.04 3dle h ARG 206 Cb 0.30 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 3dle h ARG 206 CO 0.04 0.29 -0.08 0.37 -1.51 0.00 0.00 179.97 179.08 3dle h GLN 207 N 0.46 0.72 -0.54 0.20 4.15 -0.51 -1.83 115.11 117.76 3dle h GLN 207 Ca 0.42 -0.22 -0.10 0.00 0.77 0.00 0.00 58.65 59.52 3dle h GLN 207 Cb 0.63 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.23 3dle h GLN 207 CO -0.40 0.79 -0.05 1.25 -1.93 0.00 0.00 178.83 178.49 3dle h HIS 208 N 0.66 1.04 -0.20 3.99 2.76 0.39 -2.79 115.15 121.00 3dle h HIS 208 Ca 0.12 -0.18 -0.13 0.00 -2.20 0.00 0.00 60.37 57.98 3dle h HIS 208 Cb 0.53 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.21 3dle h HIS 208 CO 0.03 0.95 -0.41 -0.07 -1.30 0.00 0.00 177.93 177.13 3dle h LEU 209 N 0.87 0.50 -0.52 0.26 3.38 -0.53 -2.90 115.31 116.37 3dle h LEU 209 Ca 0.15 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 57.95 3dle h LEU 209 Cb 0.57 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 3dle h LEU 209 CO 0.03 0.85 0.25 0.25 0.09 0.00 0.00 178.44 179.92 3dle h LEU 210 N 0.39 0.34 -1.79 1.67 5.85 -1.08 0.38 115.31 121.08 3dle h LEU 210 Ca 0.03 0.04 0.25 0.00 0.84 0.00 0.00 57.88 59.04 3dle h LEU 210 Cb 0.88 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.83 3dle h LEU 210 CO 0.07 0.23 0.64 -0.09 -0.34 0.00 0.00 178.44 178.96 3dle h ARG 211 N 0.48 0.16 -1.04 1.25 2.43 -1.29 -0.05 114.38 116.32 3dle h ARG 211 Ca 0.23 -0.01 -0.53 0.00 -0.81 0.00 0.00 59.98 58.87 3dle h ARG 211 Cb 0.17 -0.04 -0.27 0.00 -0.42 0.00 0.00 29.97 29.41 3dle h ARG 211 CO -0.18 0.10 0.68 0.91 -1.51 0.00 0.00 179.97 179.97 3dle n TRP 212 N -4.38 2.85 -1.45 2.20 7.02 0.08 -4.89 117.44 118.87 3dle n TRP 212 Ca 0.20 -2.16 -0.15 0.00 -1.02 0.00 0.00 57.50 54.36 3dle n TRP 212 Cb 0.88 -1.07 -0.07 0.00 -2.42 0.00 0.00 31.31 28.63 3dle n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3dle n GLY 213 N -0.88 1.50 3.21 6.99 0.00 -0.03 -4.17 105.19 111.81 3dle n GLY 213 Ca 0.55 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 46.10 3dle n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dle s LEU 214 N -3.52 6.01 0.81 0.99 1.43 -0.92 -4.41 118.68 119.07 3dle s LEU 214 Ca 0.00 -2.80 -0.15 0.00 -1.03 0.00 0.00 54.13 50.15 3dle s LEU 214 Cb 0.00 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 3dle s LEU 214 CO 0.00 -0.46 0.48 0.41 0.23 0.00 0.00 176.35 177.01 3dle n THR 215 N 3.69 1.12 -3.68 5.49 -1.04 -1.26 -3.62 114.28 114.99 3dle n THR 215 Ca 0.11 -0.32 -0.36 0.00 -2.04 0.00 0.00 64.05 61.44 3dle n THR 215 Cb 0.42 -0.70 -0.07 0.00 -1.82 0.00 0.00 70.33 68.17 3dle n THR 215 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3dle s THR 216 N -2.09 5.35 1.19 12.58 -1.32 -1.26 -4.85 115.64 125.24 3dle s THR 216 Ca 0.62 0.41 -0.15 0.00 -1.21 0.00 0.00 61.69 61.36 3dle s THR 216 Cb -0.29 -3.54 0.29 0.00 -1.51 0.00 0.00 72.50 67.44 3dle s THR 216 CO 0.62 0.49 1.02 -2.16 -2.21 0.00 0.00 174.62 172.39 3dle s PRO 217 N -0.21 -1.11 0.52 7.08 0.04 -1.26 -5.05 135.00 135.00 3dle s PRO 217 Ca 0.15 0.60 -0.03 0.00 0.04 0.00 0.00 61.00 61.76 3dle s PRO 217 Cb -0.13 -1.55 0.11 0.00 0.04 0.00 0.00 34.50 32.97 3dle s PRO 217 CO 0.04 -3.79 0.71 -3.47 0.04 0.00 0.00 177.00 170.53 3dle n ASP 218 N -4.93 0.62 0.09 6.66 -0.08 -1.26 -4.96 116.55 112.69 3dle n ASP 218 Ca 0.05 -1.60 0.12 0.00 -1.51 0.00 0.00 54.79 51.85 3dle n ASP 218 Cb 0.56 -0.49 0.17 0.00 2.34 0.00 0.00 41.12 43.70 3dle n ASP 218 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 3dle h LYS 219 N 0.00 0.00 0.15 -0.67 1.57 -1.97 -2.87 116.57 112.79 3dle h LYS 219 Ca -0.23 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.30 3dle h LYS 219 Cb 0.78 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.11 3dle h LYS 219 CO 0.22 0.00 -1.08 0.87 -0.57 0.00 0.00 179.45 178.89 3dle h LYS 220 N 0.00 0.46 -0.00 3.15 1.57 -2.04 -3.17 116.57 116.55 3dle h LYS 220 Ca 0.00 -0.70 0.00 0.00 -1.87 0.00 0.00 60.65 58.08 3dle h LYS 220 Cb 0.82 0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.38 3dle h LYS 220 CO 0.00 1.32 -0.00 0.72 -0.57 0.00 0.00 179.45 180.91 3dle n HIS 221 N -3.95 0.00 -2.62 -1.35 8.25 -1.24 -4.76 115.22 109.56 3dle n HIS 221 Ca -0.14 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.89 3dle n HIS 221 Cb 0.92 -0.12 -0.02 0.00 1.12 0.00 0.00 29.99 31.90 3dle n HIS 221 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 3dle s GLN 222 N -2.24 3.75 0.53 -0.41 2.00 -1.08 -4.85 119.66 117.36 3dle s GLN 222 Ca 0.40 0.60 -0.10 0.00 -2.00 0.00 0.00 55.36 54.25 3dle s GLN 222 Cb 0.21 -3.89 -0.05 0.00 0.80 0.00 0.00 33.01 30.08 3dle s GLN 222 CO 0.41 -1.32 0.92 0.15 -0.50 0.00 0.00 175.29 174.95 3dle s LYS 223 N 4.33 3.67 0.12 1.67 1.02 -1.26 -4.99 119.74 124.30 3dle s LYS 223 Ca 0.47 0.60 -0.05 0.00 0.02 0.00 0.00 55.97 57.01 3dle s LYS 223 Cb -0.08 -2.21 -0.02 0.00 -0.52 0.00 0.00 37.83 34.99 3dle s LYS 223 CO 0.30 -0.34 0.13 -1.21 -0.92 0.00 0.00 175.35 173.30 3dle s GLU 224 N -4.68 0.93 0.55 1.68 0.41 -1.26 -4.77 118.70 111.56 3dle s GLU 224 Ca 0.53 -1.24 -0.21 0.00 -0.41 0.00 0.00 54.97 53.64 3dle s GLU 224 Cb -0.11 0.29 -0.05 0.00 -1.78 0.00 0.00 34.13 32.49 3dle s GLU 224 CO 0.44 -0.28 1.27 -2.14 -0.49 0.00 0.00 175.26 174.06 3dle s PRO 225 N -3.97 3.16 0.88 0.39 0.02 -1.26 -4.35 135.00 129.87 3dle s PRO 225 Ca 0.16 2.02 -0.11 0.00 0.02 0.00 0.00 61.00 63.08 3dle s PRO 225 Cb 0.06 -2.16 0.12 0.00 0.02 0.00 0.00 34.50 32.54 3dle s PRO 225 CO -0.03 -1.11 1.09 -1.25 -0.33 0.00 0.00 177.00 175.37 3dle s PRO 226 N -3.03 1.36 -0.19 5.54 0.04 -1.26 -5.13 135.00 132.33 3dle s PRO 226 Ca 0.73 0.82 -0.07 0.00 0.04 0.00 0.00 61.00 62.52 3dle s PRO 226 Cb -0.35 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 3dle s PRO 226 CO 0.40 -2.17 0.05 -0.06 0.04 0.00 0.00 177.00 175.27 3dle s PHE 227 N -2.95 3.21 -0.40 0.56 0.08 -0.89 -4.88 117.98 112.71 3dle s PHE 227 Ca 0.63 -0.01 -0.21 0.00 0.12 0.00 0.00 56.93 57.46 3dle s PHE 227 Cb -0.18 -2.08 0.01 0.00 -0.57 0.00 0.00 43.02 40.20 3dle s PHE 227 CO 0.57 0.08 0.67 -0.51 -0.10 0.00 0.00 175.22 175.93 3dle s LEU 228 N 0.50 4.34 -0.04 -0.37 1.43 -1.26 -1.58 118.68 121.70 3dle s LEU 228 Ca 0.03 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 3dle s LEU 228 Cb -0.13 -2.81 0.02 0.00 0.03 0.00 0.00 46.19 43.31 3dle s LEU 228 CO 0.01 -0.73 -0.02 0.86 0.23 0.00 0.00 176.35 176.70 3dle s TRP 229 N 2.87 0.55 -0.62 0.29 -0.00 -0.78 -4.84 118.94 116.41 3dle s TRP 229 Ca 0.25 -0.11 -0.08 0.00 -0.00 0.00 0.00 56.10 56.16 3dle s TRP 229 Cb -0.14 -0.57 0.08 0.00 -0.00 0.00 0.00 33.47 32.84 3dle s TRP 229 CO 0.18 -0.18 0.20 -1.33 -0.00 0.00 0.00 176.95 175.82 3dle n MET 230 N 4.22 -2.10 -0.13 5.86 2.81 -1.26 0.66 117.12 127.18 3dle n MET 230 Ca -0.23 0.05 0.00 0.00 -1.81 0.00 0.00 57.70 55.70 3dle n MET 230 Cb 0.51 -4.25 0.00 0.00 -0.71 0.00 0.00 33.22 28.76 3dle n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3dle n GLY 231 N -0.66 0.60 3.83 3.03 0.00 -1.26 -5.08 105.19 105.64 3dle n GLY 231 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 3dle n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dle s TYR 232 N -2.23 2.24 -0.25 1.61 1.51 0.21 -2.97 117.35 117.47 3dle s TYR 232 Ca 0.00 -0.68 0.01 0.00 -1.01 0.00 0.00 57.07 55.39 3dle s TYR 232 Cb 0.00 -1.98 0.07 0.00 -0.11 0.00 0.00 41.96 39.94 3dle s TYR 232 CO 0.00 -0.12 -0.02 -1.21 -1.11 0.00 0.00 175.55 173.09 3dle s GLU 233 N -4.09 1.43 -0.32 -0.62 2.02 -0.30 -1.86 118.70 114.96 3dle s GLU 233 Ca 0.38 -1.06 -0.16 0.00 0.02 0.00 0.00 54.97 54.15 3dle s GLU 233 Cb -0.00 -2.55 -0.02 0.00 0.10 0.00 0.00 34.13 31.66 3dle s GLU 233 CO 0.22 -0.69 0.40 -0.51 0.02 0.00 0.00 175.26 174.70 3dle s LEU 234 N 1.40 4.28 0.29 1.80 1.43 -0.61 -0.50 118.68 126.76 3dle s LEU 234 Ca -0.02 -0.00 0.08 0.00 -1.03 0.00 0.00 54.13 53.16 3dle s LEU 234 Cb -0.19 -2.42 -0.04 0.00 0.03 0.00 0.00 46.19 43.57 3dle s LEU 234 CO -0.09 -0.32 0.15 -1.00 0.23 0.00 0.00 176.35 175.32 3dle s HIS 235 N 2.12 2.87 0.31 0.29 3.76 0.30 -2.10 115.29 122.84 3dle s HIS 235 Ca 0.14 -0.23 0.07 0.00 -0.15 0.00 0.00 55.06 54.89 3dle s HIS 235 Cb -0.16 -1.46 0.83 0.00 1.11 0.00 0.00 32.58 32.90 3dle s HIS 235 CO 0.11 0.45 1.68 -1.35 -0.85 0.00 0.00 174.74 174.79 3dle h PRO 236 N 1.57 0.35 -0.00 8.40 0.11 -1.97 -2.96 132.00 137.50 3dle h PRO 236 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3dle h PRO 236 Cb 1.25 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3dle h PRO 236 CO 0.61 0.23 -0.20 -0.40 -0.21 0.00 0.00 178.00 178.03 3dle n ASP 237 N -5.07 0.95 -3.61 -2.05 5.68 -1.26 -4.80 116.55 106.40 3dle n ASP 237 Ca 0.25 -0.98 -0.06 0.00 -0.50 0.00 0.00 54.79 53.51 3dle n ASP 237 Cb 0.75 0.56 -0.02 0.00 -1.14 0.00 0.00 41.12 41.28 3dle n ASP 237 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 3dle s LYS 238 N -1.28 0.87 0.27 0.11 -2.85 -1.12 -4.68 119.74 111.06 3dle s LYS 238 Ca 0.06 -0.40 0.11 0.00 -1.00 0.00 0.00 55.97 54.74 3dle s LYS 238 Cb 0.06 0.35 -0.05 0.00 -2.06 0.00 0.00 37.83 36.13 3dle s LYS 238 CO 0.22 -0.39 -0.14 1.67 0.10 0.00 0.00 175.35 176.81 3dle s TRP 239 N -3.06 2.42 0.21 1.78 1.48 -0.90 -0.54 118.94 120.33 3dle s TRP 239 Ca 0.09 -0.30 -0.03 0.00 -1.06 0.00 0.00 56.10 54.80 3dle s TRP 239 Cb -0.01 -1.07 -0.03 0.00 -1.16 0.00 0.00 33.47 31.20 3dle s TRP 239 CO -0.04 0.67 0.20 0.95 -4.06 0.00 0.00 176.95 174.67 3dle s THR 240 N -2.38 0.00 -0.12 0.66 -4.23 0.35 -0.85 115.64 109.06 3dle s THR 240 Ca 0.30 -1.88 -0.11 0.00 -1.18 0.00 0.00 61.69 58.81 3dle s THR 240 Cb -0.06 -2.44 -0.05 0.00 1.34 0.00 0.00 72.50 71.29 3dle s THR 240 CO 0.16 0.00 0.25 -0.69 -0.54 0.00 0.00 174.62 173.80 3dle s VAL 241 N -4.13 5.33 0.50 2.29 1.01 -1.23 -1.15 120.40 123.02 3dle s VAL 241 Ca 0.36 0.45 -0.22 0.00 0.00 0.00 0.00 61.98 62.57 3dle s VAL 241 Cb 0.05 -3.56 -0.08 0.00 0.00 0.00 0.00 36.38 32.80 3dle s VAL 241 CO 0.11 0.50 1.10 0.00 0.00 0.00 0.00 175.10 176.81 3dle n GLN 242 N 2.79 1.37 -1.65 2.72 6.02 -1.16 -4.80 117.38 122.67 3dle n GLN 242 Ca -0.15 0.50 -0.49 0.00 -0.01 0.00 0.00 57.00 56.85 3dle n GLN 242 Cb 0.53 -2.24 -0.05 0.00 1.02 0.00 0.00 30.24 29.50 3dle n GLN 242 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 3dle n PRO 243 N -0.45 1.79 -3.59 -1.09 -0.04 -1.26 -4.93 135.00 125.44 3dle n PRO 243 Ca 0.10 0.65 -0.40 0.00 -0.04 0.00 0.00 63.50 63.81 3dle n PRO 243 Cb 0.43 -2.38 -0.11 0.00 -0.04 0.00 0.00 33.50 31.40 3dle n PRO 243 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3dle s ILE 244 N 1.33 4.84 -0.08 0.52 2.07 -1.26 -5.08 121.20 123.54 3dle s ILE 244 Ca 0.83 -0.51 -0.05 0.00 -1.41 0.00 0.00 60.65 59.52 3dle s ILE 244 Cb -0.79 -3.56 -0.04 0.00 0.13 0.00 0.00 42.46 38.21 3dle s ILE 244 CO 0.44 -0.07 0.13 0.68 -1.91 0.00 0.00 174.94 174.20 3dle s VAL 245 N 1.63 5.25 -0.15 4.00 -7.23 -1.26 -4.91 120.40 117.74 3dle s VAL 245 Ca 0.04 0.00 -0.00 0.00 -1.81 0.00 0.00 61.98 60.21 3dle s VAL 245 Cb -0.18 -3.33 -0.01 0.00 0.56 0.00 0.00 36.38 33.43 3dle s VAL 245 CO 0.08 0.52 -0.14 -0.76 -0.31 0.00 0.00 175.10 174.50 3dle s LEU 246 N -1.29 2.58 0.02 1.32 1.43 -1.26 -5.09 118.68 116.39 3dle s LEU 246 Ca 0.18 -0.42 -0.30 0.00 -1.03 0.00 0.00 54.13 52.56 3dle s LEU 246 Cb -0.12 -1.59 -0.08 0.00 0.03 0.00 0.00 46.19 44.42 3dle s LEU 246 CO 0.08 0.10 1.92 -2.16 0.23 0.00 0.00 176.35 176.52 3dle s PRO 247 N 0.74 4.14 -0.17 1.29 0.04 -1.26 -4.98 135.00 134.80 3dle s PRO 247 Ca -0.06 2.54 -0.19 0.00 0.04 0.00 0.00 61.00 63.33 3dle s PRO 247 Cb -0.15 -4.14 -0.03 0.00 0.04 0.00 0.00 34.50 30.22 3dle s PRO 247 CO 0.01 -0.95 0.53 -1.21 0.04 0.00 0.00 177.00 175.42 3dle s GLU 248 N 4.41 4.25 0.23 4.56 2.02 -1.26 -5.05 118.70 127.87 3dle s GLU 248 Ca 0.86 0.48 -0.10 0.00 0.02 0.00 0.00 54.97 56.23 3dle s GLU 248 Cb -0.41 -3.52 -0.01 0.00 0.10 0.00 0.00 34.13 30.29 3dle s GLU 248 CO 0.40 -0.05 0.39 0.15 0.02 0.00 0.00 175.26 176.16 3dle s LYS 249 N 1.31 1.44 -0.16 1.61 1.02 -1.26 -5.02 119.74 118.68 3dle s LYS 249 Ca 0.26 -1.33 0.17 0.00 0.02 0.00 0.00 55.97 55.10 3dle s LYS 249 Cb -0.15 0.42 0.36 0.00 -0.52 0.00 0.00 37.83 37.94 3dle s LYS 249 CO 0.10 -0.57 1.23 -0.25 -0.92 0.00 0.00 175.35 174.94 3dle n ASP 250 N -0.35 2.59 -3.46 2.83 9.92 -1.26 -4.92 116.55 121.90 3dle n ASP 250 Ca -0.01 -3.19 0.01 0.00 -0.53 0.00 0.00 54.79 51.06 3dle n ASP 250 Cb 0.63 -0.47 -0.03 0.00 -0.64 0.00 0.00 41.12 40.60 3dle n ASP 250 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 3dle s SER 251 N -2.72 -1.12 -0.14 -2.24 0.15 -1.26 -5.10 113.70 101.28 3dle s SER 251 Ca 0.35 1.24 0.01 0.00 0.70 0.00 0.00 55.95 58.25 3dle s SER 251 Cb 0.31 2.16 0.02 0.00 -1.71 0.00 0.00 66.02 66.79 3dle s SER 251 CO 0.03 -0.21 -0.16 0.26 1.20 0.00 0.00 173.24 174.35 3dle s TRP 252 N 2.84 2.23 0.40 3.44 0.52 -1.26 -5.08 118.94 122.03 3dle s TRP 252 Ca 0.02 -1.17 -0.02 0.00 0.02 0.00 0.00 56.10 54.95 3dle s TRP 252 Cb -0.12 -1.60 -0.03 0.00 -1.15 0.00 0.00 33.47 30.57 3dle s TRP 252 CO -0.19 -0.60 0.65 0.95 0.02 0.00 0.00 176.95 177.77 3dle s THR 253 N 1.18 5.02 0.24 2.01 -4.23 -1.26 -1.12 115.64 117.49 3dle s THR 253 Ca -0.01 -0.18 -0.11 0.00 -1.18 0.00 0.00 61.69 60.21 3dle s THR 253 Cb -0.14 -3.86 0.32 0.00 1.34 0.00 0.00 72.50 70.16 3dle s THR 253 CO -0.06 -0.67 1.60 0.58 -0.54 0.00 0.00 174.62 175.53 3dle h VAL 254 N 0.55 0.23 -0.95 2.29 2.07 -1.12 0.57 116.25 119.88 3dle h VAL 254 Ca -0.49 -0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.05 3dle h VAL 254 Cb 1.21 0.22 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 3dle h VAL 254 CO 0.62 0.00 0.62 -1.13 0.02 0.00 0.00 177.57 177.70 3dle h ASN 255 N 0.01 1.07 -0.02 0.57 -0.00 -1.16 -0.80 115.58 115.25 3dle h ASN 255 Ca 0.38 -0.02 0.00 0.00 -0.00 0.00 0.00 56.30 56.66 3dle h ASN 255 Cb 0.60 -0.26 -0.00 0.00 -0.00 0.00 0.00 38.32 38.66 3dle h ASN 255 CO -0.79 0.77 -0.00 0.44 -0.00 0.00 0.00 177.43 177.85 3dle h ASP 256 N 1.26 -0.01 -0.23 1.15 3.32 -0.21 -1.55 116.42 120.15 3dle h ASP 256 Ca 0.35 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.35 3dle h ASP 256 Cb -0.11 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 3dle h ASP 256 CO -0.09 -0.00 -0.03 0.40 -1.72 0.00 0.00 179.24 177.80 3dle h ILE 257 N 0.00 1.21 -0.24 0.35 2.04 -0.65 -1.60 117.51 118.63 3dle h ILE 257 Ca 0.01 -0.89 -0.10 0.00 1.00 0.00 0.00 64.86 64.88 3dle h ILE 257 Cb 0.01 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 3dle h ILE 257 CO -0.01 0.30 -0.24 1.56 0.00 0.00 0.00 178.15 179.75 3dle h GLN 258 N 0.53 0.60 -0.64 2.37 4.20 -0.93 -0.65 115.11 120.59 3dle h GLN 258 Ca 0.11 -0.32 -0.01 0.00 0.06 0.00 0.00 58.65 58.50 3dle h GLN 258 Cb 0.40 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.16 3dle h GLN 258 CO 0.02 0.91 0.38 0.87 -0.67 0.00 0.00 178.83 180.34 3dle h LYS 259 N 0.31 0.88 0.48 1.46 1.57 -1.12 -0.07 116.57 120.08 3dle h LYS 259 Ca 0.04 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3dle h LYS 259 Cb 0.80 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 3dle h LYS 259 CO 0.06 0.64 -0.45 1.25 -0.57 0.00 0.00 179.45 180.37 3dle h LEU 260 N 0.87 -1.23 -1.14 2.94 5.85 -1.21 0.10 115.31 121.49 3dle h LEU 260 Ca 0.23 0.10 0.25 0.00 0.84 0.00 0.00 57.88 59.30 3dle h LEU 260 Cb -0.01 0.40 -0.11 0.00 0.37 0.00 0.00 40.66 41.31 3dle h LEU 260 CO -0.04 -0.61 0.63 0.58 -0.34 0.00 0.00 178.44 178.66 3dle h VAL 261 N -0.92 0.54 0.78 1.05 2.07 -0.91 0.77 116.25 119.62 3dle h VAL 261 Ca -0.06 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 3dle h VAL 261 Cb 0.79 -0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.54 3dle h VAL 261 CO -0.04 0.09 -0.37 1.23 0.02 0.00 0.00 177.57 178.50 3dle h GLY 262 N 0.52 -1.09 1.24 2.17 0.00 0.05 0.11 103.07 106.08 3dle h GLY 262 Ca 0.62 0.40 0.03 0.00 0.00 0.00 0.00 47.33 48.39 3dle h GLY 262 CO -0.40 -0.40 0.43 0.50 0.00 0.00 0.00 176.54 176.67 3dle h LYS 263 N -1.06 0.74 -0.10 4.80 1.57 0.57 -1.86 116.57 121.23 3dle h LYS 263 Ca -0.11 -0.04 -0.18 0.00 -1.87 0.00 0.00 60.65 58.45 3dle h LYS 263 Cb 0.80 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.94 3dle h LYS 263 CO 0.18 0.49 -0.70 -0.07 -0.57 0.00 0.00 179.45 178.77 3dle h LEU 264 N 0.76 0.54 -0.86 2.94 3.38 -0.75 -2.01 115.31 119.31 3dle h LEU 264 Ca 0.26 -0.34 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 3dle h LEU 264 Cb 0.09 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3dle h LEU 264 CO -0.07 1.08 -0.22 -1.13 0.09 0.00 0.00 178.44 178.19 3dle h ASN 265 N 0.32 0.61 -0.09 -0.43 -0.73 -0.26 -1.96 115.58 113.04 3dle h ASN 265 Ca -0.03 -0.20 -0.00 0.00 1.87 0.00 0.00 56.30 57.94 3dle h ASN 265 Cb 1.28 -0.17 -0.00 0.00 0.27 0.00 0.00 38.32 39.70 3dle h ASN 265 CO 0.12 0.82 0.04 -0.25 -0.37 0.00 0.00 177.43 177.80 3dle h TRP 266 N 0.54 0.12 0.00 0.67 7.01 -1.20 -2.87 115.95 120.23 3dle h TRP 266 Ca 0.08 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.07 3dle h TRP 266 Cb 0.67 -0.04 -0.00 0.00 -2.10 0.00 0.00 29.16 27.69 3dle h TRP 266 CO 0.03 0.19 -0.03 0.00 -2.79 0.00 0.00 178.44 175.84 3dle h ALA 267 N 0.92 1.04 0.00 2.65 0.00 -1.09 -3.00 119.26 119.79 3dle h ALA 267 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3dle h ALA 267 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3dle h ALA 267 CO -0.00 0.03 0.00 -1.13 0.00 0.00 0.00 179.25 178.15 3dle n SER 268 N -3.18 0.53 0.20 0.00 3.41 -0.76 -0.64 113.62 113.18 3dle n SER 268 Ca -0.01 0.74 -0.09 0.00 -0.26 0.00 0.00 58.87 59.25 3dle n SER 268 Cb 0.22 -0.81 -0.04 0.00 -0.26 0.00 0.00 64.21 63.32 3dle n SER 268 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 3dle h GLN 269 N 0.00 -0.56 0.00 4.33 5.75 -1.70 -3.36 115.11 119.57 3dle h GLN 269 Ca 0.00 0.04 -0.12 0.00 -0.15 0.00 0.00 58.65 58.41 3dle h GLN 269 Cb 0.03 0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.69 3dle h GLN 269 CO 0.00 -0.37 -0.60 0.82 -2.65 0.00 0.00 178.83 176.03 3dle h ILE 270 N -1.14 0.99 -3.51 2.39 2.04 -1.73 -3.27 117.51 113.28 3dle h ILE 270 Ca -0.06 -2.40 -0.64 0.00 1.00 0.00 0.00 64.86 62.76 3dle h ILE 270 Cb 0.44 2.48 -0.22 0.00 -0.74 0.00 0.00 36.82 38.79 3dle h ILE 270 CO 0.10 0.56 -0.63 -0.31 0.00 0.00 0.00 178.15 177.87 3dle s TYR 271 N -2.92 3.09 -0.71 1.37 2.02 0.19 -5.02 117.35 115.38 3dle s TYR 271 Ca 0.03 -0.35 -0.27 0.00 -0.37 0.00 0.00 57.07 56.12 3dle s TYR 271 Cb 0.08 -2.15 0.02 0.00 -0.40 0.00 0.00 41.96 39.51 3dle s TYR 271 CO 0.76 -0.23 1.36 -1.25 -1.57 0.00 0.00 175.55 174.62 3dle s PRO 272 N 1.17 3.13 0.00 -1.71 0.04 -1.26 -3.84 135.00 132.53 3dle s PRO 272 Ca 0.04 -0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.01 3dle s PRO 272 Cb -0.14 -4.20 0.00 0.00 0.04 0.00 0.00 34.50 30.20 3dle s PRO 272 CO 0.03 -2.20 0.00 0.41 0.04 0.00 0.00 177.00 175.28 3dle n GLY 273 N 5.40 1.47 3.66 0.56 0.00 -1.26 -5.10 105.19 109.91 3dle n GLY 273 Ca 0.06 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.60 3dle n GLY 273 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dle n ILE 274 N 0.00 0.08 -4.57 -0.61 2.08 -1.25 -4.97 119.36 110.11 3dle n ILE 274 Ca 0.00 -0.01 -0.22 0.00 0.56 0.00 0.00 62.75 63.08 3dle n ILE 274 Cb 0.00 -1.41 -0.15 0.00 -0.75 0.00 0.00 39.64 37.33 3dle n ILE 274 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 3dle s LYS 275 N 1.27 1.10 0.00 0.38 1.02 -1.26 -4.90 119.74 117.36 3dle s LYS 275 Ca 0.82 -0.60 0.00 0.00 0.02 0.00 0.00 55.97 56.22 3dle s LYS 275 Cb -0.75 -1.09 0.00 0.00 -0.52 0.00 0.00 37.83 35.47 3dle s LYS 275 CO 0.42 0.29 0.69 1.33 -0.92 0.00 0.00 175.35 177.17 3dle n VAL 276 N 2.46 0.46 0.02 3.17 0.24 -1.26 -4.88 118.33 118.54 3dle n VAL 276 Ca -0.15 -0.50 -0.12 0.00 -2.04 0.00 0.00 64.34 61.53 3dle n VAL 276 Cb 0.55 0.84 -0.05 0.00 -1.47 0.00 0.00 33.84 33.71 3dle n VAL 276 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3dle h ARG 277 N 0.00 -0.46 -0.28 7.34 2.43 -2.01 -2.78 114.38 118.63 3dle h ARG 277 Ca 0.00 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 3dle h ARG 277 Cb 0.65 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 3dle h ARG 277 CO 0.00 -0.30 0.06 1.96 -1.51 0.00 0.00 179.97 180.18 3dle h GLN 278 N -0.47 0.39 -1.26 0.20 1.08 -1.91 -1.99 115.11 111.15 3dle h GLN 278 Ca 0.08 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 3dle h GLN 278 Cb 0.60 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 3dle h GLN 278 CO -0.36 0.38 0.00 1.28 -0.95 0.00 0.00 178.83 179.18 3dle n LEU 279 N -4.38 2.42 0.00 1.46 4.77 -1.05 -3.80 117.00 116.43 3dle n LEU 279 Ca 0.01 -1.20 0.00 0.00 -0.03 0.00 0.00 56.01 54.79 3dle n LEU 279 Cb 0.17 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 3dle n LEU 279 CO 0.37 0.41 0.00 0.29 -1.33 0.00 0.00 177.39 177.13 3dle n LYS 281 N 0.66 0.00 0.00 3.23 5.02 -0.75 -4.18 118.16 122.14 3dle n LYS 281 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.30 3dle n LYS 281 Cb 0.39 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.45 3dle n LYS 281 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3dle n LEU 282 N 0.00 0.00 -0.32 -0.35 4.77 -1.25 -1.76 117.00 118.09 3dle n LEU 282 Ca 0.00 0.33 0.12 0.00 -0.03 0.00 0.00 56.01 56.43 3dle n LEU 282 Cb 0.00 -0.33 0.25 0.00 -2.33 0.00 0.00 43.42 41.01 3dle n LEU 282 CO 0.00 -0.31 0.53 0.18 -1.33 0.00 0.00 177.39 176.46 3dle n LEU 283 N -1.33 1.35 -4.69 2.23 4.77 -1.26 -4.83 117.00 113.24 3dle n LEU 283 Ca 0.01 -0.42 -0.42 0.00 -0.03 0.00 0.00 56.01 55.14 3dle n LEU 283 Cb 0.02 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 3dle n LEU 283 CO 0.02 0.25 1.40 -0.13 -1.33 0.00 0.00 177.39 177.60 3dle s ARG 284 N -2.50 4.17 -0.13 3.23 0.52 -0.72 -2.87 118.95 120.64 3dle s ARG 284 Ca 0.22 2.46 0.00 0.00 -0.52 0.00 0.00 55.73 57.89 3dle s ARG 284 Cb 0.19 -3.61 0.00 0.00 0.52 0.00 0.00 34.95 32.05 3dle s ARG 284 CO 0.54 -0.79 0.00 0.41 0.02 0.00 0.00 175.30 175.48 3dle n GLY 285 N 4.12 0.21 3.63 -3.53 0.00 -1.26 -4.96 105.19 103.40 3dle n GLY 285 Ca 0.17 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 3dle n GLY 285 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dle n THR 286 N -2.21 2.91 0.49 2.61 -2.24 -1.14 -4.93 114.28 109.77 3dle n THR 286 Ca -0.01 -0.50 0.05 0.00 -2.27 0.00 0.00 64.05 61.32 3dle n THR 286 Cb 0.42 -1.26 -0.00 0.00 -2.10 0.00 0.00 70.33 67.39 3dle n THR 286 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3dle n LYS 287 N -0.29 2.05 -3.59 -0.78 2.85 -1.26 -5.03 118.16 112.11 3dle n LYS 287 Ca 0.10 -0.62 -0.10 0.00 -1.05 0.00 0.00 58.31 56.64 3dle n LYS 287 Cb 0.42 -1.11 -0.05 0.00 -0.65 0.00 0.00 35.03 33.64 3dle n LYS 287 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3dle s ALA 288 N -1.47 -1.95 0.32 0.58 0.00 -1.26 -5.01 121.76 112.97 3dle s ALA 288 Ca 0.09 1.65 0.37 0.00 0.00 0.00 0.00 51.96 54.07 3dle s ALA 288 Cb 0.09 -0.88 1.91 0.00 0.00 0.00 0.00 23.12 24.24 3dle s ALA 288 CO 0.28 -0.29 2.12 -0.07 0.00 0.00 0.00 175.76 177.81 3dle h LEU 289 N 2.78 0.00 -1.66 0.00 3.38 -1.96 -2.09 115.31 115.77 3dle h LEU 289 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 3dle h LEU 289 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 3dle h LEU 289 CO 0.27 0.00 -0.00 0.35 0.09 0.00 0.00 178.44 179.15 3dle n THR 290 N -2.86 0.00 -1.72 0.22 -2.24 -1.26 -0.63 114.28 105.79 3dle n THR 290 Ca -0.02 -0.50 -0.37 0.00 -2.27 0.00 0.00 64.05 60.89 3dle n THR 290 Cb 0.11 1.36 0.06 0.00 -2.10 0.00 0.00 70.33 69.76 3dle n THR 290 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3dle n GLU 291 N 0.96 1.19 -3.72 -0.78 2.13 -0.79 -4.69 120.64 114.94 3dle n GLU 291 Ca 0.10 0.46 -0.37 0.00 0.66 0.00 0.00 57.16 58.01 3dle n GLU 291 Cb 0.43 -2.49 -0.12 0.00 0.27 0.00 0.00 31.44 29.52 3dle n GLU 291 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3dle s VAL 292 N -1.38 4.47 -0.25 6.31 1.01 -1.26 -1.22 120.40 128.08 3dle s VAL 292 Ca 0.80 -0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.59 3dle s VAL 292 Cb -0.39 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 3dle s VAL 292 CO 0.43 0.31 0.04 -0.63 0.00 0.00 0.00 175.10 175.25 3dle s ILE 293 N 1.64 3.96 0.15 2.22 1.09 -0.28 -4.99 121.20 124.99 3dle s ILE 293 Ca 0.06 -0.39 -0.31 0.00 -1.10 0.00 0.00 60.65 58.91 3dle s ILE 293 Cb -0.15 -2.89 -0.10 0.00 -1.06 0.00 0.00 42.46 38.26 3dle s ILE 293 CO 0.05 0.30 1.53 -2.16 -0.10 0.00 0.00 174.94 174.56 3dle s PRO 294 N 1.55 4.24 0.10 2.79 0.04 -1.26 -4.50 135.00 137.96 3dle s PRO 294 Ca 0.05 2.30 -0.31 0.00 0.04 0.00 0.00 61.00 63.08 3dle s PRO 294 Cb -0.15 -3.19 -0.08 0.00 0.04 0.00 0.00 34.50 31.12 3dle s PRO 294 CO 0.01 -0.57 1.39 -0.51 0.04 0.00 0.00 177.00 177.36 3dle s LEU 295 N 1.18 4.36 0.00 -3.56 1.43 -1.26 -5.00 118.68 115.84 3dle s LEU 295 Ca 0.69 2.29 -0.11 0.00 -1.03 0.00 0.00 54.13 55.98 3dle s LEU 295 Cb -0.42 -3.58 0.16 0.00 0.03 0.00 0.00 46.19 42.38 3dle s LEU 295 CO 0.31 -0.66 0.45 0.35 0.23 0.00 0.00 176.35 177.03 3dle n THR 296 N 4.03 0.00 -0.00 5.49 -2.24 -1.26 -4.78 114.28 115.52 3dle n THR 296 Ca 0.12 -0.09 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 3dle n THR 296 Cb 0.43 -0.73 -0.10 0.00 -2.10 0.00 0.00 70.33 67.83 3dle n THR 296 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3dle h GLU 297 N 0.00 -0.05 -0.88 -0.78 4.81 -1.99 -2.69 114.58 113.01 3dle h GLU 297 Ca -0.19 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.09 3dle h GLU 297 Cb 0.60 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.94 3dle h GLU 297 CO 0.12 0.49 0.56 0.93 -0.73 0.00 0.00 179.01 180.37 3dle h GLU 298 N -0.64 1.04 0.00 1.92 3.07 -1.97 0.23 114.58 118.24 3dle h GLU 298 Ca -0.01 -0.06 -0.04 0.00 -0.50 0.00 0.00 59.36 58.76 3dle h GLU 298 Cb 0.57 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 3dle h GLU 298 CO 0.01 0.69 -0.17 0.00 -1.40 0.00 0.00 179.01 178.14 3dle h ALA 299 N 1.37 1.40 0.09 3.43 0.00 -1.80 0.18 119.26 123.94 3dle h ALA 299 Ca 0.36 -0.15 -0.24 0.00 0.00 0.00 0.00 54.91 54.87 3dle h ALA 299 Cb 0.05 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.83 3dle h ALA 299 CO -0.13 0.21 -1.00 1.49 0.00 0.00 0.00 179.25 179.82 3dle h GLU 300 N 0.00 0.52 -0.59 0.00 4.57 -0.51 -1.38 114.58 117.19 3dle h GLU 300 Ca -0.00 -0.68 -0.10 0.00 -1.18 0.00 0.00 59.36 57.40 3dle h GLU 300 Cb 0.38 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 3dle h GLU 300 CO 0.02 1.29 -0.02 1.25 -1.18 0.00 0.00 179.01 180.37 3dle h LEU 301 N 0.08 1.02 0.38 1.64 5.85 -0.15 -1.57 115.31 122.56 3dle h LEU 301 Ca -0.15 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.25 3dle h LEU 301 Cb 1.71 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 42.47 3dle h LEU 301 CO 0.19 1.08 -0.18 -0.08 -0.34 0.00 0.00 178.44 179.12 3dle h GLU 302 N 0.95 -0.49 0.00 1.25 4.81 -0.70 -1.34 114.58 119.06 3dle h GLU 302 Ca 0.16 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 3dle h GLU 302 Cb 0.57 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.06 3dle h GLU 302 CO 0.03 -0.32 0.37 1.25 -0.73 0.00 0.00 179.01 179.61 3dle h LEU 303 N -0.68 0.00 0.10 1.64 5.85 -1.29 0.22 115.31 121.14 3dle h LEU 303 Ca -0.05 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.50 3dle h LEU 303 Cb 0.39 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.43 3dle h LEU 303 CO 0.08 0.00 -0.79 0.00 -0.34 0.00 0.00 178.44 177.40 3dle h ALA 304 N 1.21 0.00 -0.37 1.25 0.00 -1.11 -3.27 119.26 116.97 3dle h ALA 304 Ca 0.00 -0.76 -0.09 0.00 0.00 0.00 0.00 54.91 54.06 3dle h ALA 304 Cb 0.74 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 3dle h ALA 304 CO 0.00 0.41 -0.14 0.93 0.00 0.00 0.00 179.25 180.45 3dle h GLU 305 N -0.53 0.67 -0.56 0.00 5.08 0.56 -3.06 114.58 116.75 3dle h GLU 305 Ca -0.16 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 57.95 3dle h GLU 305 Cb 1.51 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.68 3dle h GLU 305 CO 0.08 0.79 0.24 -0.91 -1.00 0.00 0.00 179.01 178.21 3dle h ASN 306 N 0.61 0.76 -1.00 1.42 2.35 -1.42 -2.67 115.58 115.62 3dle h ASN 306 Ca 0.10 -0.15 0.19 0.00 -0.55 0.00 0.00 56.30 55.88 3dle h ASN 306 Cb 0.59 -0.20 -0.11 0.00 0.05 0.00 0.00 38.32 38.66 3dle h ASN 306 CO 0.04 0.70 0.60 0.03 -1.65 0.00 0.00 177.43 177.15 3dle h ARG 307 N 0.76 0.74 -0.42 0.81 3.08 -1.58 0.56 114.38 118.34 3dle h ARG 307 Ca 0.19 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.11 3dle h ARG 307 Cb 0.17 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3dle h ARG 307 CO -0.02 0.49 -0.07 0.93 -1.07 0.00 0.00 179.97 180.23 3dle h GLU 308 N 0.77 0.79 -0.17 0.04 3.07 -1.51 -2.96 114.58 114.59 3dle h GLU 308 Ca 0.57 -0.29 -0.00 0.00 -0.50 0.00 0.00 59.36 59.14 3dle h GLU 308 Cb 0.87 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.72 3dle h GLU 308 CO -0.38 0.90 0.10 0.82 -1.40 0.00 0.00 179.01 179.06 3dle h ILE 309 N 0.61 1.07 0.00 3.13 2.04 -0.64 -2.45 117.51 121.28 3dle h ILE 309 Ca 0.11 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.79 3dle h ILE 309 Cb 0.59 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3dle h ILE 309 CO 0.04 0.07 0.00 -0.07 0.00 0.00 0.00 178.15 178.19 3dle h LEU 310 N 0.20 0.00 -0.07 1.44 3.38 -1.15 0.12 115.31 119.23 3dle h LEU 310 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3dle h LEU 310 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3dle h LEU 310 CO -0.01 0.00 -0.13 0.29 0.09 0.00 0.00 178.44 178.68 3dle n LYS 311 N -2.47 0.27 -2.79 1.13 5.02 -0.92 -4.71 118.16 113.68 3dle n LYS 311 Ca 0.00 -0.07 -0.38 0.00 -2.02 0.00 0.00 58.31 55.84 3dle n LYS 311 Cb 0.16 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.61 3dle n LYS 311 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3dle s GLU 312 N -2.78 4.68 -0.43 1.97 2.12 0.03 -5.00 118.70 119.29 3dle s GLU 312 Ca 0.20 1.37 -0.29 0.00 0.36 0.00 0.00 54.97 56.61 3dle s GLU 312 Cb 0.19 -3.02 0.01 0.00 0.26 0.00 0.00 34.13 31.58 3dle s GLU 312 CO 0.54 0.40 1.36 -1.25 -0.54 0.00 0.00 175.26 175.77 3dle s PRO 313 N -1.66 3.59 -0.20 4.30 0.04 -1.26 -5.01 135.00 134.81 3dle s PRO 313 Ca 0.45 0.86 0.01 0.00 0.04 0.00 0.00 61.00 62.36 3dle s PRO 313 Cb -0.22 -4.01 0.02 0.00 0.04 0.00 0.00 34.50 30.34 3dle s PRO 313 CO 0.27 -1.55 -0.16 0.14 0.04 0.00 0.00 177.00 175.74 3dle s VAL 314 N 5.28 2.25 0.13 -0.36 -7.23 -1.26 -5.11 120.40 114.10 3dle s VAL 314 Ca 0.59 -1.02 0.05 0.00 -1.81 0.00 0.00 61.98 59.78 3dle s VAL 314 Cb -0.12 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.75 3dle s VAL 314 CO 0.33 0.41 -0.11 -1.38 -0.31 0.00 0.00 175.10 174.04 3dle s HIS 315 N 1.28 1.23 0.52 2.82 -3.43 -1.26 -3.50 115.29 112.95 3dle s HIS 315 Ca 0.02 -0.68 0.01 0.00 -0.80 0.00 0.00 55.06 53.62 3dle s HIS 315 Cb -0.14 -0.64 0.01 0.00 -1.43 0.00 0.00 32.58 30.38 3dle s HIS 315 CO -0.10 0.07 0.12 0.41 -2.00 0.00 0.00 174.74 173.24 3dle n GLY 316 N 0.19 3.32 3.55 -1.38 0.00 -0.03 -4.70 105.19 106.14 3dle n GLY 316 Ca -0.13 -2.35 -0.25 0.00 0.00 0.00 0.00 46.02 43.29 3dle n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dle s VAL 317 N -2.80 1.58 0.57 1.61 1.01 -0.81 -2.11 120.40 119.45 3dle s VAL 317 Ca 0.09 -2.00 0.02 0.00 0.00 0.00 0.00 61.98 60.09 3dle s VAL 317 Cb -0.01 -2.86 0.05 0.00 0.00 0.00 0.00 36.38 33.56 3dle s VAL 317 CO 0.06 0.00 0.80 -0.31 0.00 0.00 0.00 175.10 175.65 3dle s TYR 318 N -2.99 2.57 -0.07 5.22 2.02 -1.26 -4.53 117.35 118.31 3dle s TYR 318 Ca 0.34 -0.12 -0.23 0.00 -0.37 0.00 0.00 57.07 56.69 3dle s TYR 318 Cb 0.09 -2.74 -0.04 0.00 -0.40 0.00 0.00 41.96 38.87 3dle s TYR 318 CO 0.16 -1.00 0.70 -0.47 -1.57 0.00 0.00 175.55 173.37 3dle s TYR 319 N -2.80 3.57 -0.35 2.71 6.04 0.13 -4.83 117.35 121.83 3dle s TYR 319 Ca 0.59 1.24 -0.02 0.00 0.04 0.00 0.00 57.07 58.92 3dle s TYR 319 Cb -0.09 -2.80 0.08 0.00 -1.04 0.00 0.00 41.96 38.10 3dle s TYR 319 CO 0.39 0.08 0.09 0.34 -1.54 0.00 0.00 175.55 174.91 3dle s ASP 320 N 0.81 5.04 0.00 4.32 3.68 -1.26 -3.37 116.67 125.89 3dle s ASP 320 Ca 0.37 -1.64 0.00 0.00 2.13 0.00 0.00 52.55 53.41 3dle s ASP 320 Cb -0.18 -1.76 0.00 0.00 -1.45 0.00 0.00 42.92 39.54 3dle s ASP 320 CO 0.18 -0.39 0.84 -2.65 0.13 0.00 0.00 175.17 173.28 3dle n PRO 321 N 4.59 0.00 -0.36 4.34 -0.02 -1.26 -2.21 135.00 140.08 3dle n PRO 321 Ca -0.07 0.35 0.09 0.00 -2.02 0.00 0.00 63.50 61.85 3dle n PRO 321 Cb 0.42 -1.54 0.28 0.00 -0.02 0.00 0.00 33.50 32.64 3dle n PRO 321 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dle n SER 322 N -1.34 3.80 -4.33 2.55 3.41 -1.26 -4.96 113.62 111.48 3dle n SER 322 Ca 0.00 -2.14 -0.23 0.00 -0.26 0.00 0.00 58.87 56.24 3dle n SER 322 Cb 0.04 -0.43 -0.12 0.00 -0.26 0.00 0.00 64.21 63.45 3dle n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3dle s LYS 323 N -1.26 1.27 0.60 4.33 1.02 -0.94 -5.12 119.74 119.64 3dle s LYS 323 Ca 0.41 -1.36 -0.19 0.00 0.02 0.00 0.00 55.97 54.86 3dle s LYS 323 Cb 0.23 -1.43 -0.04 0.00 -0.52 0.00 0.00 37.83 36.08 3dle s LYS 323 CO 0.25 0.31 1.15 -0.25 -0.92 0.00 0.00 175.35 175.89 3dle n ASP 324 N 0.52 1.59 -4.42 2.83 8.00 -1.26 -4.97 116.55 118.84 3dle n ASP 324 Ca -0.15 0.85 -0.38 0.00 0.71 0.00 0.00 54.79 55.82 3dle n ASP 324 Cb 0.56 -1.48 -0.12 0.00 -0.02 0.00 0.00 41.12 40.06 3dle n ASP 324 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3dle s LEU 325 N -3.07 4.03 0.01 0.64 2.96 -1.26 -4.35 118.68 117.64 3dle s LEU 325 Ca 0.77 -0.56 0.07 0.00 -0.22 0.00 0.00 54.13 54.20 3dle s LEU 325 Cb -0.41 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.28 3dle s LEU 325 CO 0.45 -0.19 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.44 3dle s ILE 326 N 1.59 2.43 -0.08 6.68 1.01 0.78 -0.09 121.20 133.52 3dle s ILE 326 Ca 0.04 -1.13 -0.01 0.00 0.00 0.00 0.00 60.65 59.55 3dle s ILE 326 Cb -0.17 -1.94 0.03 0.00 0.01 0.00 0.00 42.46 40.39 3dle s ILE 326 CO 0.05 0.47 -0.03 0.00 0.00 0.00 0.00 174.94 175.43 3dle s ALA 327 N -0.76 0.92 -0.06 9.38 0.00 -0.26 -0.19 121.76 130.78 3dle s ALA 327 Ca 0.12 -0.27 0.02 0.00 0.00 0.00 0.00 51.96 51.83 3dle s ALA 327 Cb -0.10 -0.78 -0.03 0.00 0.00 0.00 0.00 23.12 22.21 3dle s ALA 327 CO 0.02 -0.41 -0.10 -2.00 0.00 0.00 0.00 175.76 173.26 3dle s GLU 328 N 1.81 2.66 0.09 0.00 2.12 -0.89 -0.62 118.70 123.86 3dle s GLU 328 Ca 0.04 -0.62 0.09 0.00 0.36 0.00 0.00 54.97 54.84 3dle s GLU 328 Cb -0.12 -2.50 -0.03 0.00 0.26 0.00 0.00 34.13 31.73 3dle s GLU 328 CO -0.06 0.63 -0.24 0.42 -0.54 0.00 0.00 175.26 175.48 3dle s ILE 329 N -0.74 1.94 0.03 -3.70 1.01 -0.89 -2.30 121.20 116.56 3dle s ILE 329 Ca 0.11 -1.50 0.03 0.00 0.00 0.00 0.00 60.65 59.29 3dle s ILE 329 Cb -0.11 -1.72 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 3dle s ILE 329 CO 0.01 0.13 -0.10 -1.10 0.00 0.00 0.00 174.94 173.88 3dle s GLN 330 N -1.66 0.66 -0.46 2.79 1.11 0.10 -4.24 119.66 117.97 3dle s GLN 330 Ca 0.10 -0.63 -0.20 0.00 0.01 0.00 0.00 55.36 54.63 3dle s GLN 330 Cb -0.10 -0.58 0.03 0.00 -1.01 0.00 0.00 33.01 31.36 3dle s GLN 330 CO 0.04 0.14 0.65 0.21 0.01 0.00 0.00 175.29 176.33 3dle s LYS 331 N -1.08 3.24 0.25 2.91 2.20 -1.26 -0.59 119.74 125.41 3dle s LYS 331 Ca -0.03 -0.48 0.13 0.00 -0.36 0.00 0.00 55.97 55.23 3dle s LYS 331 Cb -0.07 -3.99 0.14 0.00 -1.51 0.00 0.00 37.83 32.40 3dle s LYS 331 CO 0.01 -1.07 1.47 0.37 -0.36 0.00 0.00 175.35 175.76 3dle h GLN 332 N 8.92 0.00 0.00 4.03 4.15 -0.59 -3.42 115.11 128.20 3dle h GLN 332 Ca -0.26 0.00 0.30 0.00 0.77 0.00 0.00 58.65 59.46 3dle h GLN 332 Cb 1.09 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.73 3dle h GLN 332 CO 0.91 0.65 0.77 0.41 -1.93 0.00 0.00 178.83 179.65 3dle n GLY 333 N 0.94 0.28 3.71 2.39 0.00 -1.05 -4.99 105.19 106.47 3dle n GLY 333 Ca 0.01 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 3dle n GLY 333 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dle s GLN 334 N -2.01 4.14 -0.83 1.61 0.74 -1.26 -1.52 119.66 120.53 3dle s GLN 334 Ca 0.26 2.57 0.00 0.00 0.05 0.00 0.00 55.36 58.24 3dle s GLN 334 Cb -0.01 -3.23 0.00 0.00 1.10 0.00 0.00 33.01 30.88 3dle s GLN 334 CO -0.01 -0.76 0.00 0.41 -0.55 0.00 0.00 175.29 174.38 3dle n GLY 335 N 4.02 0.87 2.95 2.59 0.00 -1.26 -4.82 105.19 109.55 3dle n GLY 335 Ca 0.16 -0.17 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 3dle n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dle s GLN 336 N -2.38 1.20 0.05 1.61 -0.21 -0.57 -2.52 119.66 116.84 3dle s GLN 336 Ca 0.00 -0.24 0.04 0.00 0.02 0.00 0.00 55.36 55.18 3dle s GLN 336 Cb 0.00 -1.07 -0.02 0.00 1.00 0.00 0.00 33.01 32.91 3dle s GLN 336 CO 0.00 -0.03 -0.11 -1.58 -2.12 0.00 0.00 175.29 171.45 3dle s TRP 337 N 0.78 0.96 0.04 0.91 0.52 -1.15 0.18 118.94 121.18 3dle s TRP 337 Ca -0.13 -0.43 0.09 0.00 0.02 0.00 0.00 56.10 55.65 3dle s TRP 337 Cb -0.15 -0.56 -0.03 0.00 -1.15 0.00 0.00 33.47 31.59 3dle s TRP 337 CO 0.02 -0.01 -0.25 0.95 0.02 0.00 0.00 176.95 177.68 3dle s THR 338 N -1.17 2.03 0.00 2.01 -4.23 0.25 -1.77 115.64 112.77 3dle s THR 338 Ca -0.04 -1.34 -0.08 0.00 -1.18 0.00 0.00 61.69 59.05 3dle s THR 338 Cb -0.09 -1.74 0.00 0.00 1.34 0.00 0.00 72.50 72.01 3dle s THR 338 CO 0.01 0.34 0.14 -0.72 -0.54 0.00 0.00 174.62 173.85 3dle s TYR 339 N -0.80 0.04 -0.01 3.99 -0.85 -0.12 0.00 117.35 119.61 3dle s TYR 339 Ca 0.11 -0.13 0.00 0.00 -0.52 0.00 0.00 57.07 56.53 3dle s TYR 339 Cb -0.10 -0.04 0.01 0.00 0.38 0.00 0.00 41.96 42.21 3dle s TYR 339 CO 0.02 -0.30 0.00 1.14 -1.52 0.00 0.00 175.55 174.90 3dle s GLN 340 N -1.43 0.10 -0.17 -3.49 0.00 -0.97 -0.43 119.66 113.27 3dle s GLN 340 Ca -0.14 0.05 -0.03 0.00 -0.00 0.00 0.00 55.36 55.24 3dle s GLN 340 Cb -0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 33.01 32.70 3dle s GLN 340 CO 0.02 -0.06 -0.07 0.42 0.00 0.00 0.00 175.29 175.59 3dle s ILE 341 N 0.50 3.45 0.21 3.63 1.01 0.71 -2.09 121.20 128.63 3dle s ILE 341 Ca -0.04 -0.50 -0.08 0.00 0.00 0.00 0.00 60.65 60.03 3dle s ILE 341 Cb -0.07 -2.51 -0.02 0.00 0.01 0.00 0.00 42.46 39.87 3dle s ILE 341 CO -0.01 0.48 0.30 -0.72 0.00 0.00 0.00 174.94 174.99 3dle s TYR 342 N 0.70 0.66 -0.04 3.97 -0.85 0.73 -0.64 117.35 121.88 3dle s TYR 342 Ca -0.03 -0.97 -0.06 0.00 -0.52 0.00 0.00 57.07 55.48 3dle s TYR 342 Cb -0.15 -0.14 -0.03 0.00 0.38 0.00 0.00 41.96 42.02 3dle s TYR 342 CO 0.02 -0.80 -0.13 1.04 -1.52 0.00 0.00 175.55 174.17 3dle n GLN 343 N -0.30 0.20 -3.72 -3.49 6.02 -1.26 -0.15 117.38 114.68 3dle n GLN 343 Ca -0.02 0.08 -0.37 0.00 -0.01 0.00 0.00 57.00 56.69 3dle n GLN 343 Cb 0.64 -0.84 -0.06 0.00 1.02 0.00 0.00 30.24 31.00 3dle n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3dle s GLU 344 N -2.27 3.63 0.36 -1.09 2.02 -1.26 -4.79 118.70 115.31 3dle s GLU 344 Ca -0.12 0.07 -0.28 0.00 0.02 0.00 0.00 54.97 54.66 3dle s GLU 344 Cb 0.03 -3.17 -0.11 0.00 0.10 0.00 0.00 34.13 30.98 3dle s GLU 344 CO 0.16 0.72 1.47 -2.14 0.02 0.00 0.00 175.26 175.49 3dle s PRO 345 N -1.23 4.15 0.00 0.39 0.02 -1.26 -2.58 135.00 134.48 3dle s PRO 345 Ca 0.21 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.75 3dle s PRO 345 Cb -0.14 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.39 3dle s PRO 345 CO 0.10 -0.49 0.00 1.19 -0.33 0.00 0.00 177.00 177.47 3dle n PHE 346 N 0.74 0.00 -3.38 6.54 0.99 -1.26 -4.93 117.46 116.16 3dle n PHE 346 Ca 0.02 0.00 -0.45 0.00 -0.00 0.00 0.00 57.45 57.01 3dle n PHE 346 Cb 0.39 0.00 -0.04 0.00 -1.00 0.00 0.00 39.48 38.83 3dle n PHE 346 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 3dle s LYS 347 N -0.05 3.23 0.18 -1.08 1.02 -1.07 -5.05 119.74 116.92 3dle s LYS 347 Ca 0.00 -2.18 -0.28 0.00 0.02 0.00 0.00 55.97 53.54 3dle s LYS 347 Cb 0.00 -4.28 -0.08 0.00 -0.52 0.00 0.00 37.83 32.95 3dle s LYS 347 CO 0.00 -1.28 0.86 -0.80 -0.92 0.00 0.00 175.35 173.20 3dle s ASN 348 N 2.51 7.49 -0.04 2.83 0.01 -1.26 -4.13 114.94 122.34 3dle s ASN 348 Ca 0.12 1.76 -0.19 0.00 -0.71 0.00 0.00 52.86 53.85 3dle s ASN 348 Cb -0.18 -2.55 -0.31 0.00 0.41 0.00 0.00 41.25 38.61 3dle s ASN 348 CO -0.04 0.15 0.84 -0.07 -1.51 0.00 0.00 177.10 176.46 3dle h LEU 349 N 4.50 0.54 -7.27 0.60 3.38 -1.14 -2.15 115.31 113.76 3dle h LEU 349 Ca -0.46 -0.93 -0.01 0.00 0.09 0.00 0.00 57.88 56.58 3dle h LEU 349 Cb 1.20 -0.17 -0.11 0.00 0.09 0.00 0.00 40.66 41.67 3dle h LEU 349 CO 0.68 1.52 0.17 -0.75 0.09 0.00 0.00 178.44 180.15 3dle s LYS 350 N -2.48 1.36 0.26 1.13 2.20 -0.91 -4.37 119.74 116.93 3dle s LYS 350 Ca -0.14 -0.62 -0.05 0.00 -0.36 0.00 0.00 55.97 54.80 3dle s LYS 350 Cb 0.02 0.57 -0.02 0.00 -1.51 0.00 0.00 37.83 36.90 3dle s LYS 350 CO 0.84 -0.59 0.34 0.95 -0.36 0.00 0.00 175.35 176.53 3dle s THR 351 N -3.80 0.00 -1.83 3.43 -4.23 -1.26 -0.20 115.64 107.74 3dle s THR 351 Ca 0.04 -1.70 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 3dle s THR 351 Cb -0.02 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.39 3dle s THR 351 CO -0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 3dle n GLY 352 N -0.41 -1.66 3.42 3.99 0.00 0.43 -4.75 105.19 106.21 3dle n GLY 352 Ca 0.01 -1.09 -0.16 0.00 0.00 0.00 0.00 46.02 44.78 3dle n GLY 352 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dle s LYS 353 N -1.72 0.88 -0.23 1.61 -2.85 -1.26 -0.94 119.74 115.22 3dle s LYS 353 Ca 0.00 0.19 -0.03 0.00 -1.00 0.00 0.00 55.97 55.13 3dle s LYS 353 Cb 0.00 0.41 0.01 0.00 -2.06 0.00 0.00 37.83 36.19 3dle s LYS 353 CO 0.00 -0.25 -0.05 0.71 0.10 0.00 0.00 175.35 175.87 3dle s TYR 354 N -1.01 3.00 0.75 1.78 2.02 -0.73 -4.97 117.35 118.18 3dle s TYR 354 Ca -0.10 -1.19 -0.14 0.00 -0.37 0.00 0.00 57.07 55.27 3dle s TYR 354 Cb -0.02 -2.09 0.05 0.00 -0.40 0.00 0.00 41.96 39.50 3dle s TYR 354 CO 0.07 -0.63 1.17 0.00 -1.57 0.00 0.00 175.55 174.58 3dle s ALA 355 N 1.42 2.09 -0.47 3.71 0.00 -1.26 -2.92 121.76 124.33 3dle s ALA 355 Ca 0.04 0.70 -0.27 0.00 0.00 0.00 0.00 51.96 52.43 3dle s ALA 355 Cb -0.15 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 3dle s ALA 355 CO -0.04 -1.90 2.02 0.50 0.00 0.00 0.00 175.76 176.34 3dle s ARG 356 N -4.18 2.72 -0.94 0.00 6.06 -1.05 -4.81 118.95 116.76 3dle s ARG 356 Ca 0.70 1.17 -0.16 0.00 -2.50 0.00 0.00 55.73 54.94 3dle s ARG 356 Cb -0.25 -4.39 0.18 0.00 0.06 0.00 0.00 34.95 30.55 3dle s ARG 356 CO 0.48 -2.58 1.04 0.00 -2.50 0.00 0.00 175.30 171.73 3dle s MET 357 N 6.93 3.72 -0.58 5.12 0.23 -1.26 -5.00 119.30 128.46 3dle s MET 357 Ca 0.81 -2.25 -0.33 0.00 -1.03 0.00 0.00 55.69 52.90 3dle s MET 357 Cb -0.18 -4.73 -0.14 0.00 -1.53 0.00 0.00 34.83 28.25 3dle s MET 357 CO 0.27 -1.55 2.38 0.54 -2.03 0.00 0.00 175.02 174.63 3dle n ARG 358 N 5.16 0.68 -3.72 3.16 1.74 -1.26 -4.91 116.66 117.51 3dle n ARG 358 Ca 0.22 0.11 -0.14 0.00 -0.77 0.00 0.00 57.85 57.28 3dle n ARG 358 Cb 0.47 -2.35 -0.09 0.00 -1.02 0.00 0.00 32.46 29.46 3dle n ARG 358 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3dle s GLY 359 N 8.87 -0.28 0.00 -0.13 0.00 -1.26 -4.96 107.32 109.55 3dle s GLY 359 Ca 1.15 0.91 0.00 0.00 0.00 0.00 0.00 44.72 46.78 3dle s GLY 359 CO 0.45 0.72 0.00 0.00 0.00 0.00 0.00 173.10 174.27 3dle n ALA 360 N 2.18 0.00 0.00 3.20 0.00 -1.26 -4.15 120.51 120.47 3dle n ALA 360 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 3dle n ALA 360 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 3dle n ALA 360 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 3dle n HIS 361 N 0.00 0.00 -2.95 0.00 1.44 -1.26 -2.72 115.22 109.72 3dle n HIS 361 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 3dle n HIS 361 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 3dle n HIS 361 CO 0.00 0.00 0.00 -2.37 -2.81 0.00 0.00 176.34 171.16 3dle n THR 362 N -0.00 0.00 -3.97 0.61 5.66 -0.46 -4.97 114.28 111.15 3dle n THR 362 Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 3dle n THR 362 Cb 0.00 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 68.69 3dle n THR 362 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3dle s ASN 363 N 0.02 0.29 0.22 1.09 2.20 -1.26 -0.84 114.94 116.66 3dle s ASN 363 Ca 0.00 -0.78 -0.09 0.00 -0.94 0.00 0.00 52.86 51.05 3dle s ASN 363 Cb 0.00 0.26 0.34 0.00 -2.00 0.00 0.00 41.25 39.84 3dle s ASN 363 CO 0.00 -0.63 1.70 0.44 -2.94 0.00 0.00 177.10 175.67 3dle h ASP 364 N 3.11 0.02 -0.73 3.54 3.45 -1.93 -0.06 116.42 123.82 3dle h ASP 364 Ca -0.34 0.12 -0.02 0.00 0.43 0.00 0.00 57.03 57.22 3dle h ASP 364 Cb 1.17 0.16 -0.04 0.00 -0.56 0.00 0.00 39.33 40.06 3dle h ASP 364 CO 0.59 0.01 0.39 0.58 -1.57 0.00 0.00 179.24 179.24 3dle h VAL 365 N 0.27 1.22 0.41 -1.35 2.07 -1.96 0.35 116.25 117.28 3dle h VAL 365 Ca 0.34 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 3dle h VAL 365 Cb 0.52 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 3dle h VAL 365 CO -0.43 0.25 -0.20 0.50 0.02 0.00 0.00 177.57 177.72 3dle h LYS 366 N 1.04 -0.53 -0.90 1.57 1.63 -1.67 -0.39 116.57 117.32 3dle h LYS 366 Ca 0.26 0.04 0.09 0.00 -0.85 0.00 0.00 60.65 60.19 3dle h LYS 366 Cb 0.05 0.12 -0.06 0.00 -0.60 0.00 0.00 32.23 31.73 3dle h LYS 366 CO -0.04 -0.23 0.58 1.96 -3.45 0.00 0.00 179.45 178.27 3dle h GLN 367 N -0.82 0.90 -0.17 1.90 4.20 -0.73 0.11 115.11 120.49 3dle h GLN 367 Ca -0.06 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 3dle h GLN 367 Cb 0.54 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 3dle h GLN 367 CO 0.09 0.59 0.10 1.25 -0.67 0.00 0.00 178.83 180.19 3dle h LEU 368 N 0.92 0.21 -1.30 1.46 5.85 -0.19 -1.24 115.31 121.02 3dle h LEU 368 Ca 0.41 -0.07 0.20 0.00 0.84 0.00 0.00 57.88 59.26 3dle h LEU 368 Cb 0.36 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.25 3dle h LEU 368 CO -0.17 0.22 0.61 0.74 -0.34 0.00 0.00 178.44 179.50 3dle h THR 369 N 0.18 0.68 0.00 1.05 2.02 0.92 0.29 112.91 118.06 3dle h THR 369 Ca 0.06 -0.19 -0.17 0.00 0.77 0.00 0.00 66.41 66.88 3dle h THR 369 Cb 0.05 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.52 3dle h THR 369 CO -0.01 0.10 -0.79 -0.33 0.37 0.00 0.00 175.52 174.86 3dle h GLU 370 N 0.55 0.00 -0.21 6.66 5.08 -0.45 -2.49 114.58 123.71 3dle h GLU 370 Ca 0.52 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.71 3dle h GLU 370 Cb 1.09 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 3dle h GLU 370 CO -0.26 0.79 -0.58 0.00 -1.00 0.00 0.00 179.01 177.97 3dle h ALA 371 N 1.21 0.58 -0.61 3.43 0.00 0.13 -1.41 119.26 122.59 3dle h ALA 371 Ca -0.01 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 3dle h ALA 371 Cb 1.55 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 3dle h ALA 371 CO 0.10 0.69 0.29 0.28 0.00 0.00 0.00 179.25 180.61 3dle h VAL 372 N 0.51 1.22 0.17 0.00 2.07 -0.95 -2.17 116.25 117.09 3dle h VAL 372 Ca 0.00 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 3dle h VAL 372 Cb 1.15 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 3dle h VAL 372 CO 0.12 0.25 -0.08 -0.61 0.02 0.00 0.00 177.57 177.27 3dle h GLN 373 N 0.85 -0.22 -0.96 1.57 -0.00 -1.23 -0.69 115.11 114.42 3dle h GLN 373 Ca 0.21 0.01 0.09 0.00 -0.00 0.00 0.00 58.65 58.96 3dle h GLN 373 Cb 0.13 0.05 -0.07 0.00 0.00 0.00 0.00 27.48 27.59 3dle h GLN 373 CO -0.02 0.02 0.62 0.87 0.00 0.00 0.00 178.83 180.31 3dle h LYS 374 N -0.44 0.99 -0.54 1.69 1.57 -1.22 -1.35 116.57 117.28 3dle h LYS 374 Ca -0.02 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.59 3dle h LYS 374 Cb 0.34 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 3dle h LYS 374 CO 0.04 0.66 -0.10 0.82 -0.57 0.00 0.00 179.45 180.30 3dle h ILE 375 N 1.02 1.27 -0.49 1.86 2.04 -1.17 -2.09 117.51 119.95 3dle h ILE 375 Ca 0.44 -1.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.05 3dle h ILE 375 Cb 0.33 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 3dle h ILE 375 CO -0.19 0.44 0.29 0.74 0.00 0.00 0.00 178.15 179.43 3dle h THR 376 N 0.90 1.16 -0.25 -0.27 2.02 -0.09 -0.85 112.91 115.53 3dle h THR 376 Ca 0.14 -0.36 -0.08 0.00 0.77 0.00 0.00 66.41 66.88 3dle h THR 376 Cb 0.65 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 3dle h THR 376 CO 0.05 0.16 -0.19 0.74 0.37 0.00 0.00 175.52 176.65 3dle h THR 377 N 0.66 1.24 -0.23 3.16 2.02 -1.21 -1.97 112.91 116.58 3dle h THR 377 Ca 0.18 -1.10 -0.04 0.00 0.77 0.00 0.00 66.41 66.22 3dle h THR 377 Cb 0.00 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 3dle h THR 377 CO -0.03 0.35 0.00 -0.08 0.37 0.00 0.00 175.52 176.13 3dle h GLU 378 N 0.40 0.40 -0.26 6.66 4.81 -0.79 -2.52 114.58 123.27 3dle h GLU 378 Ca 0.07 -0.13 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 3dle h GLU 378 Cb 0.55 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 3dle h GLU 378 CO 0.04 0.58 -0.04 0.77 -0.73 0.00 0.00 179.01 179.63 3dle h SER 379 N 0.17 0.48 -0.92 1.04 0.02 -1.09 -0.93 113.55 112.32 3dle h SER 379 Ca 0.07 -0.34 0.09 0.00 -0.84 0.00 0.00 61.79 60.76 3dle h SER 379 Cb 0.40 -0.13 -0.07 0.00 0.14 0.00 0.00 62.40 62.74 3dle h SER 379 CO 0.01 0.71 0.59 0.40 -1.14 0.00 0.00 176.83 177.40 3dle h ILE 380 N 0.24 1.01 -0.24 3.27 2.04 -1.34 1.66 117.51 124.14 3dle h ILE 380 Ca 0.07 -0.33 -0.09 0.00 1.00 0.00 0.00 64.86 65.51 3dle h ILE 380 Cb 0.49 -0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 3dle h ILE 380 CO 0.02 0.18 -0.20 0.58 0.00 0.00 0.00 178.15 178.73 3dle h VAL 381 N 0.97 1.32 0.14 1.67 2.07 -1.28 0.49 116.25 121.63 3dle h VAL 381 Ca 0.42 -1.34 -0.20 0.00 0.82 0.00 0.00 66.70 66.39 3dle h VAL 381 Cb 0.33 1.66 0.02 0.00 -1.52 0.00 0.00 31.29 31.78 3dle h VAL 381 CO -0.18 0.42 -0.91 0.40 0.02 0.00 0.00 177.57 177.32 3dle h ILE 382 N 0.25 1.44 -0.01 4.57 2.04 -0.01 -3.40 117.51 122.40 3dle h ILE 382 Ca 0.04 -2.52 0.00 0.00 1.00 0.00 0.00 64.86 63.38 3dle h ILE 382 Cb 0.74 3.13 0.00 0.00 -0.74 0.00 0.00 36.82 39.95 3dle h ILE 382 CO 0.05 0.72 -0.13 0.79 0.00 0.00 0.00 178.15 179.58 3dle n TRP 383 N -4.09 0.00 -1.50 1.37 8.01 0.56 -4.72 117.44 117.06 3dle n TRP 383 Ca -0.15 0.00 -0.12 0.00 -1.31 0.00 0.00 57.50 55.91 3dle n TRP 383 Cb 0.84 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 30.09 3dle n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3dle n GLY 384 N 0.72 1.10 3.43 6.99 0.00 0.16 -4.95 105.19 112.64 3dle n GLY 384 Ca 0.03 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.47 3dle n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dle s LYS 385 N -3.29 1.16 -0.07 1.61 -2.85 -1.26 -4.92 119.74 110.12 3dle s LYS 385 Ca 0.00 -0.28 -0.08 0.00 -1.00 0.00 0.00 55.97 54.60 3dle s LYS 385 Cb 0.00 0.54 -0.04 0.00 -2.06 0.00 0.00 37.83 36.26 3dle s LYS 385 CO 0.00 -0.46 0.22 0.95 0.10 0.00 0.00 175.35 176.16 3dle s THR 386 N -2.93 5.37 0.78 3.79 -4.23 -1.26 -3.30 115.64 113.86 3dle s THR 386 Ca -0.03 0.32 -0.12 0.00 -1.18 0.00 0.00 61.69 60.69 3dle s THR 386 Cb -0.00 -3.50 0.06 0.00 1.34 0.00 0.00 72.50 70.39 3dle s THR 386 CO -0.06 0.56 1.11 -2.16 -0.54 0.00 0.00 174.62 173.53 3dle s PRO 387 N -1.20 2.26 -0.03 3.99 0.04 -1.26 -4.94 135.00 133.86 3dle s PRO 387 Ca 0.19 0.51 -0.27 0.00 0.04 0.00 0.00 61.00 61.47 3dle s PRO 387 Cb -0.13 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 3dle s PRO 387 CO 0.09 -1.47 0.86 0.15 0.04 0.00 0.00 177.00 176.67 3dle s LYS 388 N -5.27 4.51 -0.01 4.56 1.02 0.88 -4.80 119.74 120.63 3dle s LYS 388 Ca 0.60 1.20 -0.12 0.00 0.02 0.00 0.00 55.97 57.67 3dle s LYS 388 Cb -0.13 -3.45 -0.05 0.00 -0.52 0.00 0.00 37.83 33.67 3dle s LYS 388 CO 0.53 0.00 0.34 -0.06 -0.92 0.00 0.00 175.35 175.25 3dle s PHE 389 N 0.90 3.66 -0.29 3.18 0.40 -0.80 -1.11 117.98 123.92 3dle s PHE 389 Ca 0.46 0.83 0.02 0.00 -0.60 0.00 0.00 56.93 57.64 3dle s PHE 389 Cb -0.20 -2.17 0.08 0.00 0.51 0.00 0.00 43.02 41.24 3dle s PHE 389 CO 0.24 0.64 -0.01 0.15 0.70 0.00 0.00 175.22 176.93 3dle s LYS 390 N -1.30 1.62 0.05 0.44 1.02 0.20 0.04 119.74 121.83 3dle s LYS 390 Ca 0.24 -1.43 0.08 0.00 0.02 0.00 0.00 55.97 54.88 3dle s LYS 390 Cb -0.15 -2.84 -0.03 0.00 -0.52 0.00 0.00 37.83 34.29 3dle s LYS 390 CO 0.13 -0.77 -0.20 -0.51 -0.92 0.00 0.00 175.35 173.08 3dle s LEU 391 N 1.15 2.50 -1.44 3.17 1.43 -0.79 -2.09 118.68 122.61 3dle s LEU 391 Ca 0.02 -0.49 -0.10 0.00 -1.03 0.00 0.00 54.13 52.52 3dle s LEU 391 Cb -0.19 -1.45 0.05 0.00 0.03 0.00 0.00 46.19 44.63 3dle s LEU 391 CO -0.09 0.25 2.39 -0.81 0.23 0.00 0.00 176.35 178.32 3dle n PRO 392 N 1.52 3.64 -3.64 1.29 -0.04 -1.26 -2.18 135.00 134.33 3dle n PRO 392 Ca -0.16 -2.88 -0.13 0.00 -0.04 0.00 0.00 63.50 60.28 3dle n PRO 392 Cb 0.52 -2.93 -0.07 0.00 -0.04 0.00 0.00 33.50 30.98 3dle n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3dle s ILE 393 N 1.35 -0.00 0.30 0.52 2.07 -1.26 0.49 121.20 124.66 3dle s ILE 393 Ca 0.53 0.00 -0.28 0.00 -1.41 0.00 0.00 60.65 59.49 3dle s ILE 393 Cb 0.15 -0.98 -0.09 0.00 0.13 0.00 0.00 42.46 41.67 3dle s ILE 393 CO -0.06 0.00 1.02 -1.10 -1.91 0.00 0.00 174.94 172.89 3dle s GLN 394 N 0.48 4.60 0.55 3.50 -0.21 -1.26 -4.72 119.66 122.59 3dle s GLN 394 Ca -0.01 1.57 0.30 0.00 0.02 0.00 0.00 55.36 57.25 3dle s GLN 394 Cb -0.05 -3.02 1.46 0.00 1.00 0.00 0.00 33.01 32.41 3dle s GLN 394 CO -0.01 0.24 1.91 0.87 -2.12 0.00 0.00 175.29 176.18 3dle h LYS 395 N 3.54 0.00 -0.12 2.91 1.79 -1.97 0.17 116.57 122.88 3dle h LYS 395 Ca -0.47 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 57.93 3dle h LYS 395 Cb 1.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.86 3dle h LYS 395 CO 0.66 0.00 -0.21 0.93 -1.08 0.00 0.00 179.45 179.75 3dle h GLU 396 N 0.00 0.36 -0.56 3.15 4.39 -1.99 -1.04 114.58 118.89 3dle h GLU 396 Ca 0.36 -0.22 0.01 0.00 0.34 0.00 0.00 59.36 59.84 3dle h GLU 396 Cb 1.50 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 30.15 3dle h GLU 396 CO -0.00 0.81 0.37 1.15 -1.16 0.00 0.00 179.01 180.18 3dle h THR 397 N -0.06 1.14 0.49 1.13 2.02 -1.11 -0.70 112.91 115.83 3dle h THR 397 Ca 0.01 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 66.90 3dle h THR 397 Cb 0.79 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 3dle h THR 397 CO 0.05 0.14 -0.24 -0.25 0.37 0.00 0.00 175.52 175.59 3dle h TRP 398 N 0.76 -0.61 -0.84 3.16 2.91 -1.12 -1.87 115.95 118.35 3dle h TRP 398 Ca 0.21 -0.01 0.12 0.00 1.13 0.00 0.00 58.89 60.33 3dle h TRP 398 Cb -0.09 0.20 -0.06 0.00 -0.51 0.00 0.00 29.16 28.70 3dle h TRP 398 CO -0.04 -0.31 0.54 1.49 -1.03 0.00 0.00 178.44 179.10 3dle h GLU 399 N -0.83 0.69 -0.22 2.65 4.57 -1.10 0.36 114.58 120.70 3dle h GLU 399 Ca -0.07 -0.04 -0.16 0.00 -1.18 0.00 0.00 59.36 57.92 3dle h GLU 399 Cb 0.58 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 3dle h GLU 399 CO 0.11 0.46 -0.50 1.15 -1.18 0.00 0.00 179.01 179.04 3dle h THR 400 N 0.71 1.31 0.00 0.32 2.02 -1.03 -3.03 112.91 113.20 3dle h THR 400 Ca 0.40 -1.72 0.00 0.00 0.77 0.00 0.00 66.41 65.86 3dle h THR 400 Cb 0.57 1.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 3dle h THR 400 CO -0.17 0.54 -0.03 -0.25 0.37 0.00 0.00 175.52 175.99 3dle h TRP 401 N 0.48 0.00 -0.41 3.16 7.01 -0.40 -3.37 115.95 122.42 3dle h TRP 401 Ca 0.02 0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.10 3dle h TRP 401 Cb 1.05 0.00 -0.07 0.00 -2.10 0.00 0.00 29.16 28.04 3dle h TRP 401 CO 0.05 0.00 0.00 2.35 -2.79 0.00 0.00 178.44 178.05 3dle h TRP 402 N -0.98 -0.02 -0.32 2.65 7.01 -1.13 -2.49 115.95 120.67 3dle h TRP 402 Ca 0.00 0.03 0.09 0.00 2.11 0.00 0.00 58.89 61.12 3dle h TRP 402 Cb 0.03 0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.15 3dle h TRP 402 CO -0.01 -0.08 0.29 0.00 -2.79 0.00 0.00 178.44 175.85 3dle h THR 403 N 0.11 0.57 -0.10 2.65 1.03 -1.72 -2.86 112.91 112.59 3dle h THR 403 Ca 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.60 3dle h THR 403 Cb 0.29 0.78 0.00 0.00 -1.07 0.00 0.00 68.15 68.15 3dle h THR 403 CO -0.34 0.00 0.00 -0.62 -0.01 0.00 0.00 175.52 174.55 3dle n GLU 404 N -4.01 1.37 -2.67 0.00 4.71 -1.03 -5.03 120.64 113.98 3dle n GLU 404 Ca 0.05 -1.34 -0.37 0.00 -0.01 0.00 0.00 57.16 55.49 3dle n GLU 404 Cb 0.45 -1.14 -0.05 0.00 -1.01 0.00 0.00 31.44 29.69 3dle n GLU 404 CO 0.00 0.00 0.00 -0.47 0.09 0.00 0.00 177.13 176.75 3dle s TYR 405 N -0.76 3.50 -0.57 -0.32 5.04 -0.97 -4.95 117.35 118.32 3dle s TYR 405 Ca 0.10 1.72 0.19 0.00 -2.44 0.00 0.00 57.07 56.64 3dle s TYR 405 Cb 0.06 -3.03 0.87 0.00 0.35 0.00 0.00 41.96 40.21 3dle s TYR 405 CO 0.08 -0.19 1.60 -2.67 -1.34 0.00 0.00 175.55 173.03 3dle n TRP 406 N 0.31 0.57 -4.46 4.97 4.27 -1.26 -4.77 117.44 117.06 3dle n TRP 406 Ca 0.03 0.24 -0.30 0.00 -3.89 0.00 0.00 57.50 53.58 3dle n TRP 406 Cb 0.50 -0.89 -0.11 0.00 -1.36 0.00 0.00 31.31 29.44 3dle n TRP 406 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 3dle s GLN 407 N -3.28 2.08 0.17 -2.67 0.74 -1.26 -5.08 119.66 110.37 3dle s GLN 407 Ca 0.03 -1.00 -0.31 0.00 0.05 0.00 0.00 55.36 54.13 3dle s GLN 407 Cb 0.08 -2.24 -0.09 0.00 1.10 0.00 0.00 33.01 31.86 3dle s GLN 407 CO 0.30 0.53 1.47 0.00 -0.55 0.00 0.00 175.29 177.03 3dle s ALA 408 N -1.05 3.67 0.08 1.58 0.00 -1.26 -4.97 121.76 119.81 3dle s ALA 408 Ca 0.17 1.27 -0.12 0.00 0.00 0.00 0.00 51.96 53.28 3dle s ALA 408 Cb -0.11 -3.57 0.01 0.00 0.00 0.00 0.00 23.12 19.45 3dle s ALA 408 CO 0.08 -0.70 0.27 0.95 0.00 0.00 0.00 175.76 176.36 3dle s THR 409 N 0.77 0.11 -0.16 0.00 -4.23 -1.26 -5.18 115.64 105.69 3dle s THR 409 Ca 0.65 -0.89 -0.30 0.00 -1.18 0.00 0.00 61.69 59.97 3dle s THR 409 Cb -0.41 -1.17 0.12 0.00 1.34 0.00 0.00 72.50 72.39 3dle s THR 409 CO 0.34 -0.49 0.96 0.86 -0.54 0.00 0.00 174.62 175.75 3dle s TRP 410 N -3.42 -0.41 -0.09 3.99 -0.00 -1.26 -5.08 118.94 112.66 3dle s TRP 410 Ca 0.01 0.74 0.02 0.00 -0.00 0.00 0.00 56.10 56.87 3dle s TRP 410 Cb 0.02 0.44 0.01 0.00 -0.00 0.00 0.00 33.47 33.94 3dle s TRP 410 CO -0.09 -0.37 -0.15 0.42 -0.00 0.00 0.00 176.95 176.76 3dle s ILE 411 N -1.02 1.43 0.00 5.86 1.01 -1.26 -4.92 121.20 122.30 3dle s ILE 411 Ca -0.03 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 60.00 3dle s ILE 411 Cb -0.01 -1.29 0.00 0.00 0.01 0.00 0.00 42.46 41.17 3dle s ILE 411 CO 0.02 0.42 0.00 -2.65 0.00 0.00 0.00 174.94 172.73 3dle n PRO 412 N 3.98 -1.75 -1.68 2.79 -0.02 -1.26 -4.78 135.00 132.28 3dle n PRO 412 Ca -0.20 0.00 -0.51 0.00 -2.02 0.00 0.00 63.50 60.77 3dle n PRO 412 Cb 0.52 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.94 3dle n PRO 412 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3dle n GLU 413 N -1.85 1.78 -4.21 -0.52 2.13 -1.26 -4.90 120.64 111.81 3dle n GLU 413 Ca 0.00 0.65 -0.14 0.00 0.66 0.00 0.00 57.16 58.33 3dle n GLU 413 Cb 0.00 -2.42 -0.09 0.00 0.27 0.00 0.00 31.44 29.20 3dle n GLU 413 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 3dle s TRP 414 N 3.10 1.27 0.13 4.31 1.48 -1.26 -1.91 118.94 126.06 3dle s TRP 414 Ca 0.91 -1.42 -0.01 0.00 -1.06 0.00 0.00 56.10 54.52 3dle s TRP 414 Cb -0.82 -0.57 -0.04 0.00 -1.16 0.00 0.00 33.47 30.88 3dle s TRP 414 CO 0.53 -0.71 0.04 -2.00 -4.06 0.00 0.00 176.95 170.75 3dle s GLU 415 N -3.98 0.92 -0.14 3.25 2.12 0.11 -4.90 118.70 116.07 3dle s GLU 415 Ca 0.39 -1.43 -0.07 0.00 0.36 0.00 0.00 54.97 54.21 3dle s GLU 415 Cb 0.06 0.19 -0.04 0.00 0.26 0.00 0.00 34.13 34.60 3dle s GLU 415 CO 0.16 -0.24 0.12 0.12 -0.54 0.00 0.00 175.26 174.88 3dle s PHE 416 N -4.00 3.49 -0.10 5.30 5.36 -1.26 -1.88 117.98 124.89 3dle s PHE 416 Ca 0.23 0.42 0.01 0.00 -0.96 0.00 0.00 56.93 56.63 3dle s PHE 416 Cb 0.07 -1.99 0.02 0.00 -0.34 0.00 0.00 43.02 40.78 3dle s PHE 416 CO 0.01 0.57 -0.12 0.54 -1.46 0.00 0.00 175.22 174.76 3dle s VAL 417 N -0.59 1.24 -1.45 3.12 0.11 -0.93 -4.88 120.40 117.02 3dle s VAL 417 Ca 0.12 -0.48 -0.09 0.00 -2.93 0.00 0.00 61.98 58.60 3dle s VAL 417 Cb -0.12 -1.16 0.04 0.00 -1.53 0.00 0.00 36.38 33.61 3dle s VAL 417 CO 0.02 0.39 2.49 -3.20 -3.33 0.00 0.00 175.10 171.47 3dle n ASN 418 N 4.28 7.25 -4.14 3.54 2.85 -1.26 -4.12 115.26 123.66 3dle n ASN 418 Ca -0.19 -2.89 -0.38 0.00 -0.11 0.00 0.00 54.58 51.02 3dle n ASN 418 Cb 0.51 -1.49 -0.06 0.00 1.24 0.00 0.00 39.78 39.98 3dle n ASN 418 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 3dle s THR 419 N 0.91 4.52 0.80 -0.44 2.01 -1.26 -5.07 115.64 117.11 3dle s THR 419 Ca 0.56 -3.67 -0.17 0.00 0.31 0.00 0.00 61.69 58.73 3dle s THR 419 Cb 0.16 -3.80 -0.13 0.00 0.01 0.00 0.00 72.50 68.74 3dle s THR 419 CO -0.07 -1.07 -0.39 -2.65 -0.69 0.00 0.00 174.62 169.75 3dle n PRO 420 N 2.56 0.01 -1.95 4.92 -0.02 -1.26 -4.65 135.00 134.61 3dle n PRO 420 Ca 0.20 0.01 -0.34 0.00 -2.02 0.00 0.00 63.50 61.35 3dle n PRO 420 Cb 0.38 -1.12 0.03 0.00 -0.02 0.00 0.00 33.50 32.77 3dle n PRO 420 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3dle s PRO 421 N -1.82 3.01 0.13 0.52 0.02 -1.26 -4.98 135.00 130.62 3dle s PRO 421 Ca 0.49 1.49 -0.03 0.00 0.02 0.00 0.00 61.00 62.97 3dle s PRO 421 Cb -0.30 -1.97 -0.05 0.00 0.02 0.00 0.00 34.50 32.20 3dle s PRO 421 CO 0.74 -1.10 0.33 -0.51 -0.33 0.00 0.00 177.00 176.14 3dle s LEU 422 N -4.44 4.29 -0.07 -5.54 1.43 -1.26 -4.66 118.68 108.42 3dle s LEU 422 Ca 0.70 0.48 -0.20 0.00 -1.03 0.00 0.00 54.13 54.07 3dle s LEU 422 Cb -0.22 -3.20 -0.04 0.00 0.03 0.00 0.00 46.19 42.75 3dle s LEU 422 CO 0.36 0.07 0.58 -0.69 0.23 0.00 0.00 176.35 176.90 3dle s VAL 423 N -1.64 5.08 0.36 -1.59 1.01 0.18 -5.00 120.40 118.79 3dle s VAL 423 Ca 0.39 1.19 -0.09 0.00 0.00 0.00 0.00 61.98 63.47 3dle s VAL 423 Cb -0.12 -3.92 0.03 0.00 0.00 0.00 0.00 36.38 32.37 3dle s VAL 423 CO 0.26 0.32 0.63 -1.59 0.00 0.00 0.00 175.10 174.72 3dle s LYS 424 N 0.48 2.06 -0.13 2.72 0.00 -1.26 -4.52 119.74 119.09 3dle s LYS 424 Ca 0.31 -1.59 -0.25 0.00 0.00 0.00 0.00 55.97 54.44 3dle s LYS 424 Cb -0.17 0.53 -0.02 0.00 0.00 0.00 0.00 37.83 38.17 3dle s LYS 424 CO 0.15 -0.91 0.79 -0.51 0.00 0.00 0.00 175.35 174.87 3dle s LEU 425 N -3.15 4.23 0.37 2.77 1.43 -1.26 -4.76 118.68 118.31 3dle s LEU 425 Ca 0.23 1.19 0.19 0.00 -1.03 0.00 0.00 54.13 54.71 3dle s LEU 425 Cb -0.03 -3.19 0.66 0.00 0.03 0.00 0.00 46.19 43.65 3dle s LEU 425 CO 0.16 -0.30 1.72 -0.50 0.23 0.00 0.00 176.35 177.66 3dle h TRP 426 N 7.14 0.00 -2.50 0.29 4.06 -1.98 -3.46 115.95 119.50 3dle h TRP 426 Ca -0.34 0.00 0.08 0.00 2.06 0.00 0.00 58.89 60.69 3dle h TRP 426 Cb 1.16 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 29.18 3dle h TRP 426 CO 0.69 0.37 0.41 1.52 -3.56 0.00 0.00 178.44 177.87 3dle s TYR 427 N -3.56 -0.38 -0.14 0.49 1.13 -1.26 -4.72 117.35 108.92 3dle s TYR 427 Ca 0.00 0.20 -0.04 0.00 -1.41 0.00 0.00 57.07 55.82 3dle s TYR 427 Cb 0.11 0.56 0.05 0.00 -1.10 0.00 0.00 41.96 41.58 3dle s TYR 427 CO 0.69 -0.67 0.10 -0.65 -2.51 0.00 0.00 175.55 172.50 3dle s GLN 428 N -3.32 0.03 0.62 -3.49 -0.21 -1.26 -5.10 119.66 106.93 3dle s GLN 428 Ca 0.05 0.09 -0.19 0.00 0.02 0.00 0.00 55.36 55.33 3dle s GLN 428 Cb -0.01 -1.37 -0.02 0.00 1.00 0.00 0.00 33.01 32.60 3dle s GLN 428 CO -0.09 -0.57 1.30 -0.51 -2.12 0.00 0.00 175.29 173.30 3dle s LEU 429 N 2.17 3.65 0.76 2.90 1.43 -1.26 -4.78 118.68 123.55 3dle s LEU 429 Ca 0.03 2.63 -0.12 0.00 -1.03 0.00 0.00 54.13 55.64 3dle s LEU 429 Cb -0.15 -4.54 0.06 0.00 0.03 0.00 0.00 46.19 41.59 3dle s LEU 429 CO -0.08 -1.86 1.13 -1.61 0.23 0.00 0.00 176.35 174.16 3dle s GLU 430 N -3.27 2.15 0.17 1.70 0.41 -0.71 -4.96 118.70 114.19 3dle s GLU 430 Ca 0.80 1.40 0.17 0.00 -0.41 0.00 0.00 54.97 56.93 3dle s GLU 430 Cb -0.37 -1.87 -0.03 0.00 -1.78 0.00 0.00 34.13 30.08 3dle s GLU 430 CO 0.41 -1.76 1.09 0.87 -0.49 0.00 0.00 175.26 175.37 3dle h LYS 431 N -0.82 0.00 -4.36 1.61 1.79 -1.92 -3.46 116.57 109.42 3dle h LYS 431 Ca -0.45 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 57.85 3dle h LYS 431 Cb 1.25 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 31.74 3dle h LYS 431 CO 0.50 0.30 -0.69 -1.21 -1.08 0.00 0.00 179.45 177.27 3dle s GLU 432 N -3.01 0.63 0.50 3.15 0.41 -1.26 -5.13 118.70 113.98 3dle s GLU 432 Ca 0.00 -1.13 -0.23 0.00 -0.41 0.00 0.00 54.97 53.20 3dle s GLU 432 Cb 0.08 0.03 -0.07 0.00 -1.78 0.00 0.00 34.13 32.39 3dle s GLU 432 CO 0.78 -0.06 1.27 -0.35 -0.49 0.00 0.00 175.26 176.41 3dle n PRO 433 N 0.38 1.69 -2.87 0.39 -0.04 -1.26 -4.90 135.00 128.40 3dle n PRO 433 Ca -0.16 0.62 -0.41 0.00 -0.04 0.00 0.00 63.50 63.50 3dle n PRO 433 Cb 0.60 -2.44 -0.04 0.00 -0.04 0.00 0.00 33.50 31.58 3dle n PRO 433 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3dle s ILE 434 N -1.28 4.87 0.23 0.52 1.01 -1.26 -5.04 121.20 120.25 3dle s ILE 434 Ca 0.68 1.69 -0.29 0.00 0.00 0.00 0.00 60.65 62.72 3dle s ILE 434 Cb -0.45 -4.16 -0.09 0.00 0.01 0.00 0.00 42.46 37.77 3dle s ILE 434 CO 0.53 0.03 0.90 -0.69 0.00 0.00 0.00 174.94 175.72 3dle s VAL 435 N 2.07 4.15 0.00 2.92 1.01 -1.26 -3.37 120.40 125.91 3dle s VAL 435 Ca 0.40 1.98 0.00 0.00 0.00 0.00 0.00 61.98 64.36 3dle s VAL 435 Cb -0.17 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 31.95 3dle s VAL 435 CO 0.13 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.32 3dle n GLY 436 N 1.43 1.08 3.72 4.51 0.00 -1.26 -5.01 105.19 109.65 3dle n GLY 436 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 3dle n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dle s ALA 437 N -3.84 3.53 0.64 4.61 0.00 -1.22 -5.07 121.76 120.41 3dle s ALA 437 Ca 0.00 -0.73 -0.17 0.00 0.00 0.00 0.00 51.96 51.06 3dle s ALA 437 Cb 0.00 -1.83 -0.03 0.00 0.00 0.00 0.00 23.12 21.26 3dle s ALA 437 CO 0.00 0.42 0.96 -1.91 0.00 0.00 0.00 175.76 175.22 3dle n GLU 438 N 2.71 0.76 -4.01 0.00 2.13 -1.26 -4.64 120.64 116.33 3dle n GLU 438 Ca -0.18 0.31 -0.34 0.00 0.66 0.00 0.00 57.16 57.61 3dle n GLU 438 Cb 0.53 -2.18 -0.15 0.00 0.27 0.00 0.00 31.44 29.91 3dle n GLU 438 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 3dle s THR 439 N -1.61 2.59 -0.22 6.31 2.01 -1.26 -1.54 115.64 121.91 3dle s THR 439 Ca 0.76 -1.15 -0.15 0.00 0.31 0.00 0.00 61.69 61.46 3dle s THR 439 Cb -0.39 -2.32 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 3dle s THR 439 CO 0.47 0.20 0.34 -0.36 -0.69 0.00 0.00 174.62 174.59 3dle s PHE 440 N 1.27 3.33 -0.68 4.92 0.40 0.12 -2.27 117.98 125.07 3dle s PHE 440 Ca -0.01 0.49 -0.15 0.00 -0.60 0.00 0.00 56.93 56.66 3dle s PHE 440 Cb -0.17 -2.48 0.17 0.00 0.51 0.00 0.00 43.02 41.05 3dle s PHE 440 CO -0.06 -0.04 0.64 0.71 0.70 0.00 0.00 175.22 177.17 3dle s TYR 441 N 1.43 3.48 0.20 0.36 1.51 -0.51 -0.57 117.35 123.26 3dle s TYR 441 Ca 0.16 -1.61 -0.06 0.00 -1.01 0.00 0.00 57.07 54.54 3dle s TYR 441 Cb -0.15 -3.82 -0.06 0.00 -0.11 0.00 0.00 41.96 37.82 3dle s TYR 441 CO 0.08 -1.02 0.47 0.14 -1.11 0.00 0.00 175.55 174.10 3dle s VAL 442 N 0.98 5.06 -0.03 0.71 -7.23 -0.73 -2.14 120.40 117.03 3dle s VAL 442 Ca 0.11 0.17 -0.21 0.00 -1.81 0.00 0.00 61.98 60.24 3dle s VAL 442 Cb -0.20 -3.65 0.04 0.00 0.56 0.00 0.00 36.38 33.13 3dle s VAL 442 CO -0.03 -0.08 0.44 -0.62 -0.31 0.00 0.00 175.10 174.51 3dle s ASP 443 N -2.58 -0.36 -0.06 4.85 2.15 -0.33 -4.57 116.67 115.77 3dle s ASP 443 Ca 0.44 0.32 -0.04 0.00 0.43 0.00 0.00 52.55 53.69 3dle s ASP 443 Cb -0.11 0.40 0.03 0.00 -0.30 0.00 0.00 42.92 42.93 3dle s ASP 443 CO 0.25 -0.50 0.16 -0.83 -0.17 0.00 0.00 175.17 174.07 3dle s GLY 444 N -1.27 -0.09 0.01 2.66 0.00 -1.26 -1.93 107.32 105.44 3dle s GLY 444 Ca -0.13 0.58 -0.01 0.00 0.00 0.00 0.00 44.72 45.16 3dle s GLY 444 CO 0.06 0.68 0.00 0.00 0.00 0.00 0.00 173.10 173.85 3dle s ALA 445 N 0.60 0.03 -0.23 3.20 0.00 -0.68 -4.47 121.76 120.21 3dle s ALA 445 Ca -0.04 -0.36 -0.16 0.00 0.00 0.00 0.00 51.96 51.40 3dle s ALA 445 Cb -0.06 0.09 0.07 0.00 0.00 0.00 0.00 23.12 23.22 3dle s ALA 445 CO -0.03 -0.12 0.58 0.00 0.00 0.00 0.00 175.76 176.19 3dle s ALA 446 N -1.03 -1.52 -0.46 0.00 0.00 -1.26 0.15 121.76 117.64 3dle s ALA 446 Ca -0.11 1.94 -0.27 0.00 0.00 0.00 0.00 51.96 53.52 3dle s ALA 446 Cb -0.07 -1.14 -0.03 0.00 0.00 0.00 0.00 23.12 21.87 3dle s ALA 446 CO -0.00 -0.32 1.98 1.21 0.00 0.00 0.00 175.76 178.63 3dle s ASN 447 N 1.13 5.33 0.29 0.00 3.84 0.21 -4.60 114.94 121.15 3dle s ASN 447 Ca -0.07 0.94 0.18 0.00 0.21 0.00 0.00 52.86 54.13 3dle s ASN 447 Cb -0.06 -2.52 0.97 0.00 -0.55 0.00 0.00 41.25 39.09 3dle s ASN 447 CO -0.11 -2.22 1.52 -2.11 -2.79 0.00 0.00 177.10 171.39 3dle n ARG 448 N 8.86 0.12 -0.11 0.43 -4.01 -1.26 0.21 116.66 120.90 3dle n ARG 448 Ca 0.25 0.61 -0.22 0.00 -1.04 0.00 0.00 57.85 57.45 3dle n ARG 448 Cb 0.50 -1.95 -0.10 0.00 -3.04 0.00 0.00 32.46 27.87 3dle n ARG 448 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 3dle n GLU 449 N -2.14 0.56 0.12 2.89 1.02 -1.26 -4.29 120.64 117.53 3dle n GLU 449 Ca -0.01 0.46 0.13 0.00 -0.02 0.00 0.00 57.16 57.72 3dle n GLU 449 Cb 0.10 -1.65 0.39 0.00 -0.02 0.00 0.00 31.44 30.26 3dle n GLU 449 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3dle h THR 450 N -1.00 0.00 -4.40 2.62 1.35 -1.87 -3.47 112.91 106.15 3dle h THR 450 Ca -0.40 -0.51 -0.40 0.00 -0.55 0.00 0.00 66.41 64.55 3dle h THR 450 Cb 1.30 1.49 0.03 0.00 -1.73 0.00 0.00 68.15 69.24 3dle h THR 450 CO -0.24 0.00 -0.58 0.29 -0.25 0.00 0.00 175.52 174.74 3dle n LYS 451 N -2.33 -4.15 -4.06 4.72 5.02 0.57 -4.65 118.16 113.28 3dle n LYS 451 Ca 0.05 0.85 -0.35 0.00 -2.02 0.00 0.00 58.31 56.84 3dle n LYS 451 Cb 0.43 -5.66 -0.13 0.00 -0.02 0.00 0.00 35.03 29.65 3dle n LYS 451 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dle s LEU 452 N -6.53 3.07 0.38 -0.35 1.43 -1.18 -0.20 118.68 115.30 3dle s LEU 452 Ca 0.26 -0.29 -0.07 0.00 -1.03 0.00 0.00 54.13 53.00 3dle s LEU 452 Cb -0.12 -1.77 0.03 0.00 0.03 0.00 0.00 46.19 44.35 3dle s LEU 452 CO 0.33 0.03 0.62 -0.83 0.23 0.00 0.00 176.35 176.73 3dle s GLY 453 N 1.16 1.11 0.10 -3.19 0.00 -1.06 0.68 107.32 106.12 3dle s GLY 453 Ca 0.02 -1.25 0.03 0.00 0.00 0.00 0.00 44.72 43.52 3dle s GLY 453 CO 0.00 -0.73 -0.09 0.54 0.00 0.00 0.00 173.10 172.82 3dle s LYS 454 N -2.56 0.86 -0.00 2.90 1.02 0.12 0.30 119.74 122.38 3dle s LYS 454 Ca 0.25 -1.22 -0.00 0.00 0.02 0.00 0.00 55.97 55.02 3dle s LYS 454 Cb -0.03 -0.46 -0.00 0.00 -0.52 0.00 0.00 37.83 36.82 3dle s LYS 454 CO 0.18 0.06 0.01 0.00 -0.92 0.00 0.00 175.35 174.67 3dle s ALA 455 N -2.77 -0.01 -0.00 5.17 0.00 0.50 -1.68 121.76 122.97 3dle s ALA 455 Ca 0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 51.96 51.95 3dle s ALA 455 Cb -0.01 0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.13 3dle s ALA 455 CO -0.01 -0.03 0.08 0.41 0.00 0.00 0.00 175.76 176.20 3dle n GLY 456 N 2.81 0.46 3.73 0.00 0.00 -0.81 -0.12 105.19 111.25 3dle n GLY 456 Ca -0.14 -0.82 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 3dle n GLY 456 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3dle s TYR 457 N -2.36 -0.01 -0.09 1.61 -0.85 -0.94 -1.18 117.35 113.53 3dle s TYR 457 Ca 0.02 -0.40 -0.04 0.00 -0.52 0.00 0.00 57.07 56.13 3dle s TYR 457 Cb -0.00 0.51 0.05 0.00 0.38 0.00 0.00 41.96 42.89 3dle s TYR 457 CO -0.00 -1.12 0.18 0.08 -1.52 0.00 0.00 175.55 173.17 3dle s VAL 458 N -3.94 -0.16 0.29 -3.49 1.01 -0.91 -2.29 120.40 110.92 3dle s VAL 458 Ca 0.14 0.24 0.07 0.00 0.00 0.00 0.00 61.98 62.43 3dle s VAL 458 Cb -0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 36.38 36.01 3dle s VAL 458 CO 0.06 0.10 0.32 0.42 0.00 0.00 0.00 175.10 176.00 3dle s THR 459 N 1.69 4.23 0.55 3.92 -4.23 0.15 -1.42 115.64 120.52 3dle s THR 459 Ca -0.04 -1.22 0.37 0.00 -1.18 0.00 0.00 61.69 59.61 3dle s THR 459 Cb -0.12 -3.42 0.39 0.00 1.34 0.00 0.00 72.50 70.70 3dle s THR 459 CO -0.07 -0.25 2.26 -0.55 -0.54 0.00 0.00 174.62 175.47 3dle h ASN 460 N 1.22 0.00 -0.05 3.99 -1.07 -1.79 -1.35 115.58 116.52 3dle h ASN 460 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.90 3dle h ASN 460 Cb 1.25 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.50 3dle h ASN 460 CO 0.58 0.02 0.00 0.54 0.07 0.00 0.00 177.43 178.64 3dle n ARG 461 N -3.38 1.40 -0.73 4.14 1.74 -1.26 -4.90 116.66 113.67 3dle n ARG 461 Ca -0.02 -0.60 0.00 0.00 -0.77 0.00 0.00 57.85 56.46 3dle n ARG 461 Cb 0.12 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 3dle n ARG 461 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dle n GLY 462 N 1.04 0.59 3.77 -0.13 0.00 -0.51 -5.05 105.19 104.91 3dle n GLY 462 Ca 0.18 -0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 3dle n GLY 462 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dle s ARG 463 N -0.80 4.23 0.11 1.61 3.52 -1.26 -4.88 118.95 121.49 3dle s ARG 463 Ca 0.00 0.62 -0.04 0.00 -0.13 0.00 0.00 55.73 56.18 3dle s ARG 463 Cb 0.00 -3.32 -0.03 0.00 -1.56 0.00 0.00 34.95 30.04 3dle s ARG 463 CO 0.00 0.42 0.11 1.14 -0.81 0.00 0.00 175.30 176.16 3dle s GLN 464 N -0.32 0.88 -0.07 5.12 -2.07 -1.26 -0.68 119.66 121.26 3dle s GLN 464 Ca 0.28 -1.25 -0.30 0.00 -1.82 0.00 0.00 55.36 52.28 3dle s GLN 464 Cb -0.17 0.28 0.11 0.00 -1.09 0.00 0.00 33.01 32.13 3dle s GLN 464 CO 0.15 -0.26 0.91 0.21 -1.32 0.00 0.00 175.29 174.98 3dle s LYS 465 N -3.97 0.75 -0.24 9.60 2.20 -0.97 -4.99 119.74 122.13 3dle s LYS 465 Ca 0.15 -0.05 -0.11 0.00 -0.36 0.00 0.00 55.97 55.61 3dle s LYS 465 Cb 0.06 0.35 0.09 0.00 -1.51 0.00 0.00 37.83 36.82 3dle s LYS 465 CO -0.04 -0.28 0.55 0.54 -0.36 0.00 0.00 175.35 175.76 3dle s VAL 466 N -2.05 -0.42 -0.03 4.02 0.11 -1.26 -2.22 120.40 118.55 3dle s VAL 466 Ca 0.00 0.06 0.05 0.00 -2.93 0.00 0.00 61.98 59.17 3dle s VAL 466 Cb -0.01 -0.83 -0.03 0.00 -1.53 0.00 0.00 36.38 33.99 3dle s VAL 466 CO -0.02 0.03 -0.17 -0.69 -3.33 0.00 0.00 175.10 170.91 3dle s VAL 467 N 2.14 2.81 -0.21 2.04 1.01 0.82 -4.94 120.40 124.08 3dle s VAL 467 Ca -0.07 -0.85 -0.13 0.00 0.00 0.00 0.00 61.98 60.93 3dle s VAL 467 Cb -0.09 -2.08 -0.05 0.00 0.00 0.00 0.00 36.38 34.16 3dle s VAL 467 CO -0.16 0.56 0.26 -0.89 0.00 0.00 0.00 175.10 174.87 3dle s THR 468 N -0.72 5.30 -0.17 3.92 2.01 -1.26 -0.37 115.64 124.34 3dle s THR 468 Ca 0.11 0.41 -0.05 0.00 0.31 0.00 0.00 61.69 62.48 3dle s THR 468 Cb -0.10 -3.59 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 3dle s THR 468 CO 0.01 0.33 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.49 3dle s LEU 469 N 1.01 3.35 -0.25 4.42 1.43 0.15 -4.98 118.68 123.82 3dle s LEU 469 Ca 0.13 -0.11 -0.16 0.00 -1.03 0.00 0.00 54.13 52.96 3dle s LEU 469 Cb -0.14 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.22 3dle s LEU 469 CO 0.05 0.14 0.40 -0.89 0.23 0.00 0.00 176.35 176.28 3dle s THR 470 N 0.56 5.17 -0.51 5.49 2.01 -1.26 -2.57 115.64 124.52 3dle s THR 470 Ca -0.01 0.65 -0.02 0.00 0.31 0.00 0.00 61.69 62.62 3dle s THR 470 Cb -0.14 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.62 3dle s THR 470 CO 0.02 0.18 0.46 -0.67 -0.69 0.00 0.00 174.62 173.92 3dle n ASP 471 N 5.06 -4.69 -1.27 3.53 4.64 0.72 -5.03 116.55 119.50 3dle n ASP 471 Ca -0.08 -0.27 0.00 0.00 -1.38 0.00 0.00 54.79 53.06 3dle n ASP 471 Cb 0.51 -3.12 0.00 0.00 -1.04 0.00 0.00 41.12 37.47 3dle n ASP 471 CO 0.00 0.00 0.00 1.07 -0.82 0.00 0.00 177.20 177.45 3dle n THR 472 N -2.11 0.00 -4.40 5.18 5.66 -0.27 -5.03 114.28 113.31 3dle n THR 472 Ca -0.03 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.78 3dle n THR 472 Cb 0.54 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.22 3dle n THR 472 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3dle s THR 473 N -1.10 0.83 0.07 1.09 -4.23 -1.26 -4.52 115.64 106.52 3dle s THR 473 Ca 0.00 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 58.22 3dle s THR 473 Cb 0.00 -2.68 -0.18 0.00 1.34 0.00 0.00 72.50 70.99 3dle s THR 473 CO 0.00 0.00 1.62 -1.13 -0.54 0.00 0.00 174.62 174.57 3dle h ASN 474 N 2.20 -0.50 -0.35 3.99 -0.00 -1.94 -2.58 115.58 116.40 3dle h ASN 474 Ca -0.39 -0.00 0.06 0.00 -0.00 0.00 0.00 56.30 55.97 3dle h ASN 474 Cb 1.25 0.13 -0.08 0.00 -0.00 0.00 0.00 38.32 39.61 3dle h ASN 474 CO 0.64 -0.33 -0.44 -0.61 -0.00 0.00 0.00 177.43 176.69 3dle h GLN 475 N -0.62 -0.36 -0.90 6.67 4.15 -1.97 -1.94 115.11 120.15 3dle h GLN 475 Ca -0.06 0.02 0.21 0.00 0.77 0.00 0.00 58.65 59.59 3dle h GLN 475 Cb 0.47 0.08 -0.06 0.00 0.21 0.00 0.00 27.48 28.17 3dle h GLN 475 CO 0.10 -0.24 0.60 0.87 -1.93 0.00 0.00 178.83 178.23 3dle h LYS 476 N -0.37 0.36 -0.06 1.69 1.57 -1.93 -0.66 116.57 117.17 3dle h LYS 476 Ca 0.12 -0.02 -0.22 0.00 -1.87 0.00 0.00 60.65 58.65 3dle h LYS 476 Cb 0.60 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 32.83 3dle h LYS 476 CO -0.54 0.24 -0.87 1.79 -0.57 0.00 0.00 179.45 179.50 3dle h THR 477 N 0.37 1.34 0.62 -0.16 1.35 -0.97 -0.35 112.91 115.10 3dle h THR 477 Ca 0.46 -2.21 -0.03 0.00 -0.55 0.00 0.00 66.41 64.09 3dle h THR 477 Cb 1.21 2.22 0.00 0.00 -1.73 0.00 0.00 68.15 69.86 3dle h THR 477 CO -0.16 0.68 -0.31 -0.33 -0.25 0.00 0.00 175.52 175.14 3dle h GLU 478 N 0.35 -0.81 -0.73 4.72 5.08 -0.67 0.19 114.58 122.72 3dle h GLU 478 Ca -0.07 0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 3dle h GLU 478 Cb 1.49 0.18 -0.04 0.00 0.50 0.00 0.00 28.75 30.88 3dle h GLU 478 CO 0.16 -0.54 0.48 -0.07 -1.00 0.00 0.00 179.01 178.04 3dle h LEU 479 N -0.84 0.75 -0.51 1.33 3.38 -1.21 -1.07 115.31 117.14 3dle h LEU 479 Ca -0.08 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.72 3dle h LEU 479 Cb 0.65 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3dle h LEU 479 CO 0.13 0.52 -0.60 -0.61 0.09 0.00 0.00 178.44 177.97 3dle h GLN 480 N 0.87 0.49 -0.61 1.13 5.75 -0.81 0.22 115.11 122.15 3dle h GLN 480 Ca 0.29 -0.33 0.10 0.00 -0.15 0.00 0.00 58.65 58.56 3dle h GLN 480 Cb 0.07 0.05 -0.08 0.00 1.07 0.00 0.00 27.48 28.59 3dle h GLN 480 CO -0.08 0.94 0.20 0.00 -2.65 0.00 0.00 178.83 177.23 3dle h ALA 481 N 0.98 0.77 -0.32 3.38 0.00 0.68 0.49 119.26 125.23 3dle h ALA 481 Ca -0.00 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3dle h ALA 481 Cb 1.14 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3dle h ALA 481 CO 0.11 -0.23 -0.01 0.82 0.00 0.00 0.00 179.25 179.94 3dle h ILE 482 N 0.36 1.26 -0.38 0.00 2.04 -1.19 -2.29 117.51 117.31 3dle h ILE 482 Ca 0.31 -0.97 0.03 0.00 1.00 0.00 0.00 64.86 65.23 3dle h ILE 482 Cb 0.42 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 3dle h ILE 482 CO -0.34 0.32 0.20 0.22 0.00 0.00 0.00 178.15 178.54 3dle h TYR 483 N 0.38 0.36 -0.92 1.37 3.20 0.65 -0.40 116.97 121.61 3dle h TYR 483 Ca 0.09 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.03 3dle h TYR 483 Cb 0.45 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.56 3dle h TYR 483 CO 0.04 0.20 0.59 -0.07 -1.64 0.00 0.00 178.16 177.27 3dle h LEU 484 N 0.40 0.96 -0.52 2.82 3.38 -0.00 -0.71 115.31 121.63 3dle h LEU 484 Ca 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 3dle h LEU 484 Cb 0.05 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 3dle h LEU 484 CO -0.10 0.63 0.31 0.00 0.09 0.00 0.00 178.44 179.37 3dle h ALA 485 N 1.41 0.66 -0.47 1.53 0.00 -0.76 -1.31 119.26 120.33 3dle h ALA 485 Ca 0.39 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 3dle h ALA 485 Cb 0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3dle h ALA 485 CO -0.15 0.16 0.12 -0.07 0.00 0.00 0.00 179.25 179.31 3dle h LEU 486 N 0.70 0.70 -0.38 0.00 3.38 -0.20 -2.35 115.31 117.16 3dle h LEU 486 Ca 0.19 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 3dle h LEU 486 Cb 0.00 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 3dle h LEU 486 CO -0.03 0.74 -0.27 0.06 0.09 0.00 0.00 178.44 179.03 3dle h GLN 487 N 0.63 0.00 0.00 1.13 3.07 -1.01 -3.23 115.11 115.70 3dle h GLN 487 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.89 3dle h GLN 487 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.87 3dle h GLN 487 CO -0.00 0.27 -0.57 -0.25 0.09 0.00 0.00 178.83 178.37 3dle n ASP 488 N -3.23 0.55 -4.96 0.06 10.43 -0.51 -4.95 116.55 113.95 3dle n ASP 488 Ca 0.02 -0.28 -0.20 0.00 2.57 0.00 0.00 54.79 56.90 3dle n ASP 488 Cb 0.58 0.33 0.04 0.00 1.84 0.00 0.00 41.12 43.90 3dle n ASP 488 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 3dle s SER 489 N -3.12 5.28 0.13 -2.24 1.04 -0.89 -5.08 113.70 108.83 3dle s SER 489 Ca 0.10 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.27 3dle s SER 489 Cb 0.17 -0.60 0.00 0.00 0.10 0.00 0.00 66.02 65.69 3dle s SER 489 CO 0.72 -1.12 0.00 0.61 0.98 0.00 0.00 173.24 174.43 3dle n GLY 490 N -2.23 -0.77 0.00 7.32 0.00 -1.26 -4.92 105.19 103.33 3dle n GLY 490 Ca 0.09 -1.64 0.13 0.00 0.00 0.00 0.00 46.02 44.60 3dle n GLY 490 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dle n LEU 491 N 0.00 0.00 -3.69 0.99 4.77 -1.26 -4.55 117.00 113.26 3dle n LEU 491 Ca 0.00 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.81 3dle n LEU 491 Cb 0.00 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 40.93 3dle n LEU 491 CO 0.00 0.00 -0.26 -1.61 -1.33 0.00 0.00 177.39 174.19 3dle s GLU 492 N -2.00 0.02 0.03 3.23 2.02 -1.24 0.24 118.70 121.00 3dle s GLU 492 Ca 0.38 0.47 0.00 0.00 0.02 0.00 0.00 54.97 55.85 3dle s GLU 492 Cb 0.18 -0.30 -0.02 0.00 0.10 0.00 0.00 34.13 34.09 3dle s GLU 492 CO 0.30 -0.28 -0.03 0.08 0.02 0.00 0.00 175.26 175.34 3dle s VAL 493 N 2.00 0.16 -0.10 2.63 1.01 -0.77 -4.20 120.40 121.14 3dle s VAL 493 Ca 0.01 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 60.98 3dle s VAL 493 Cb -0.12 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.81 3dle s VAL 493 CO -0.05 -0.55 -0.16 0.20 0.00 0.00 0.00 175.10 174.54 3dle s ASN 494 N -1.64 3.78 -0.08 3.32 0.01 -0.59 -0.54 114.94 119.20 3dle s ASN 494 Ca -0.13 -0.34 0.00 0.00 -0.71 0.00 0.00 52.86 51.68 3dle s ASN 494 Cb -0.08 -1.28 0.02 0.00 0.41 0.00 0.00 41.25 40.33 3dle s ASN 494 CO -0.02 0.22 -0.06 -0.63 -1.51 0.00 0.00 177.10 175.10 3dle s ILE 495 N -0.01 0.84 -0.19 0.60 1.01 0.27 -0.71 121.20 123.01 3dle s ILE 495 Ca -0.05 -0.22 -0.06 0.00 0.00 0.00 0.00 60.65 60.33 3dle s ILE 495 Cb -0.14 -0.86 -0.03 0.00 0.01 0.00 0.00 42.46 41.43 3dle s ILE 495 CO 0.04 0.32 0.02 -0.69 0.00 0.00 0.00 174.94 174.63 3dle s VAL 496 N 1.43 4.22 0.07 2.92 1.01 0.27 0.26 120.40 130.58 3dle s VAL 496 Ca -0.01 -0.23 -0.07 0.00 0.00 0.00 0.00 61.98 61.67 3dle s VAL 496 Cb -0.13 -2.90 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 3dle s VAL 496 CO -0.04 0.44 0.13 0.28 0.00 0.00 0.00 175.10 175.91 3dle s THR 497 N 0.71 0.15 -1.03 3.92 -1.32 -0.26 -1.77 115.64 116.05 3dle s THR 497 Ca 0.01 -1.28 0.12 0.00 -1.21 0.00 0.00 61.69 59.33 3dle s THR 497 Cb -0.14 -1.26 0.32 0.00 -1.51 0.00 0.00 72.50 69.91 3dle s THR 497 CO 0.02 -0.70 1.26 -0.90 -2.21 0.00 0.00 174.62 172.08 3dle n ASP 498 N 0.18 2.95 -4.64 8.08 5.68 -1.25 -1.14 116.55 126.41 3dle n ASP 498 Ca -0.16 -1.98 -0.43 0.00 -0.50 0.00 0.00 54.79 51.73 3dle n ASP 498 Cb 0.61 -0.24 -0.02 0.00 -1.14 0.00 0.00 41.12 40.33 3dle n ASP 498 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 3dle s SER 499 N -1.00 6.56 0.37 -1.12 0.15 -1.26 -4.60 113.70 112.80 3dle s SER 499 Ca 0.25 1.68 0.08 0.00 0.70 0.00 0.00 55.95 58.66 3dle s SER 499 Cb 0.13 -2.53 0.82 0.00 -1.71 0.00 0.00 66.02 62.72 3dle s SER 499 CO 0.17 -1.10 1.92 1.56 1.20 0.00 0.00 173.24 176.99 3dle h GLN 500 N 9.91 0.66 -0.08 5.44 1.08 -1.96 -1.89 115.11 128.27 3dle h GLN 500 Ca -0.32 -0.04 0.03 0.00 -1.45 0.00 0.00 58.65 56.86 3dle h GLN 500 Cb 1.14 -0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 28.40 3dle h GLN 500 CO 0.99 0.44 -0.07 -0.92 -0.95 0.00 0.00 178.83 178.32 3dle h TYR 501 N 0.68 -0.17 -0.77 2.96 3.20 -2.01 -2.35 116.97 118.51 3dle h TYR 501 Ca 0.37 0.01 0.15 0.00 3.14 0.00 0.00 58.73 62.40 3dle h TYR 501 Cb 0.52 0.09 -0.10 0.00 1.54 0.00 0.00 36.73 38.78 3dle h TYR 501 CO -0.00 -0.11 0.31 0.00 -1.64 0.00 0.00 178.16 176.72 3dle h ALA 502 N 0.98 1.09 -0.93 1.82 0.00 -1.74 0.88 119.26 121.36 3dle h ALA 502 Ca 0.06 0.12 0.25 0.00 0.00 0.00 0.00 54.91 55.34 3dle h ALA 502 Cb 0.17 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3dle h ALA 502 CO -0.14 -0.21 0.65 1.25 0.00 0.00 0.00 179.25 180.80 3dle h LEU 503 N 0.45 0.15 -0.28 0.00 5.85 -1.28 0.47 115.31 120.68 3dle h LEU 503 Ca 0.43 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 59.02 3dle h LEU 503 Cb 0.65 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.67 3dle h LEU 503 CO -0.41 0.05 -0.41 1.23 -0.34 0.00 0.00 178.44 178.56 3dle h GLY 504 N 0.15 0.84 1.45 3.75 0.00 0.94 -2.63 103.07 107.57 3dle h GLY 504 Ca 0.46 -0.93 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 3dle h GLY 504 CO -0.08 0.84 0.04 -2.22 0.00 0.00 0.00 176.54 175.12 3dle h ILE 505 N 0.52 1.22 -0.19 2.60 2.04 0.28 -2.02 117.51 121.96 3dle h ILE 505 Ca 0.03 -0.85 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 3dle h ILE 505 Cb 1.00 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 3dle h ILE 505 CO 0.09 0.30 0.08 0.40 0.00 0.00 0.00 178.15 179.03 3dle h ILE 506 N 0.66 1.15 -0.47 -0.67 2.04 -0.86 0.87 117.51 120.23 3dle h ILE 506 Ca 0.14 -0.46 -0.07 0.00 1.00 0.00 0.00 64.86 65.47 3dle h ILE 506 Cb 0.35 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 3dle h ILE 506 CO 0.01 0.15 0.00 -0.61 0.00 0.00 0.00 178.15 177.70 3dle h GLN 507 N 0.16 0.82 0.00 2.37 4.15 -1.21 -3.36 115.11 118.05 3dle h GLN 507 Ca 0.06 -0.26 -0.24 0.00 0.77 0.00 0.00 58.65 58.99 3dle h GLN 507 Cb 0.16 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 27.73 3dle h GLN 507 CO -0.01 0.87 -2.01 0.00 -1.93 0.00 0.00 178.83 175.76 3dle n ALA 508 N -2.43 1.78 -3.71 3.38 0.00 -0.78 -4.51 120.51 114.23 3dle n ALA 508 Ca 0.00 -0.92 -0.33 0.00 0.00 0.00 0.00 53.44 52.20 3dle n ALA 508 Cb 0.30 -0.15 0.04 0.00 0.00 0.00 0.00 19.45 19.64 3dle n ALA 508 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3dle n GLN 509 N -2.49 -1.11 -1.36 0.00 6.02 0.30 -4.92 117.38 113.82 3dle n GLN 509 Ca -0.22 0.44 -0.33 0.00 -0.01 0.00 0.00 57.00 56.88 3dle n GLN 509 Cb 0.91 -3.93 0.10 0.00 1.02 0.00 0.00 30.24 28.33 3dle n GLN 509 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3dle s PRO 510 N -6.06 2.08 -0.02 -1.09 0.04 -1.26 -4.88 135.00 123.81 3dle s PRO 510 Ca 0.46 1.64 0.02 0.00 0.04 0.00 0.00 61.00 63.16 3dle s PRO 510 Cb -0.18 -1.84 0.04 0.00 0.04 0.00 0.00 34.50 32.56 3dle s PRO 510 CO 0.87 -1.85 0.95 -0.40 0.04 0.00 0.00 177.00 176.61 3dle n ASP 511 N -2.95 1.72 -3.64 6.66 5.68 -0.02 -4.96 116.55 119.04 3dle n ASP 511 Ca 0.12 -2.00 -0.09 0.00 -0.50 0.00 0.00 54.79 52.33 3dle n ASP 511 Cb 0.51 -0.06 -0.07 0.00 -1.14 0.00 0.00 41.12 40.36 3dle n ASP 511 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3dle s GLN 512 N -1.07 0.59 0.31 0.11 -2.07 -1.06 -4.97 119.66 111.50 3dle s GLN 512 Ca 0.04 0.77 -0.03 0.00 -1.82 0.00 0.00 55.36 54.32 3dle s GLN 512 Cb 0.03 0.25 -0.01 0.00 -1.09 0.00 0.00 33.01 32.19 3dle s GLN 512 CO 0.00 -0.08 0.41 0.45 -1.32 0.00 0.00 175.29 174.76 3dle s SER 513 N 0.59 0.77 0.04 12.60 0.15 -1.26 -1.35 113.70 125.23 3dle s SER 513 Ca -0.01 -1.42 0.22 0.00 0.70 0.00 0.00 55.95 55.44 3dle s SER 513 Cb -0.05 0.61 -0.17 0.00 -1.71 0.00 0.00 66.02 64.70 3dle s SER 513 CO -0.07 -1.20 0.76 -1.84 1.20 0.00 0.00 173.24 172.09 3dle n GLU 514 N -0.51 0.49 -2.76 5.44 -0.00 -1.10 -4.82 120.64 117.38 3dle n GLU 514 Ca 0.01 -0.07 -0.42 0.00 -0.00 0.00 0.00 57.16 56.68 3dle n GLU 514 Cb 0.62 -1.59 -0.03 0.00 -0.00 0.00 0.00 31.44 30.44 3dle n GLU 514 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3dle s SER 515 N -4.38 7.03 0.55 -1.84 0.15 -1.26 -4.93 113.70 109.01 3dle s SER 515 Ca -0.02 1.28 0.22 0.00 0.70 0.00 0.00 55.95 58.12 3dle s SER 515 Cb 0.13 -2.50 1.46 0.00 -1.71 0.00 0.00 66.02 63.41 3dle s SER 515 CO 0.86 -0.55 2.16 -0.08 1.20 0.00 0.00 173.24 176.83 3dle h GLU 516 N 7.43 0.00 0.07 5.44 4.57 -1.99 -0.91 114.58 129.19 3dle h GLU 516 Ca -0.24 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.94 3dle h GLU 516 Cb 1.10 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.69 3dle h GLU 516 CO 0.91 0.00 -0.03 1.25 -1.18 0.00 0.00 179.01 179.96 3dle h LEU 517 N 0.00 -0.07 -1.08 1.64 6.46 -1.99 -2.16 115.31 118.10 3dle h LEU 517 Ca 0.03 -0.55 0.10 0.00 -0.12 0.00 0.00 57.88 57.34 3dle h LEU 517 Cb 0.14 0.02 -0.07 0.00 -0.73 0.00 0.00 40.66 40.01 3dle h LEU 517 CO -0.00 0.61 0.62 0.58 -0.62 0.00 0.00 178.44 179.63 3dle h VAL 518 N -0.87 0.97 -0.41 1.05 2.07 -1.91 0.42 116.25 117.57 3dle h VAL 518 Ca -0.01 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 3dle h VAL 518 Cb 0.62 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 3dle h VAL 518 CO 0.01 0.18 0.08 0.78 0.02 0.00 0.00 177.57 178.65 3dle h ASN 519 N 0.99 0.57 -0.35 0.57 4.21 -1.18 0.12 115.58 120.52 3dle h ASN 519 Ca 0.45 -0.09 -0.14 0.00 1.21 0.00 0.00 56.30 57.73 3dle h ASN 519 Cb 0.40 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 37.44 3dle h ASN 519 CO -0.21 0.59 -0.30 1.56 -1.29 0.00 0.00 177.43 177.78 3dle h GLN 520 N 0.60 0.87 -0.59 0.81 4.20 -0.28 -2.39 115.11 118.34 3dle h GLN 520 Ca 0.14 -0.41 -0.10 0.00 0.06 0.00 0.00 58.65 58.34 3dle h GLN 520 Cb 0.26 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 3dle h GLN 520 CO 0.00 1.05 -0.01 0.82 -0.67 0.00 0.00 178.83 180.02 3dle h ILE 521 N 0.74 1.26 -0.82 2.54 2.04 -0.50 -2.48 117.51 120.29 3dle h ILE 521 Ca 0.08 -1.15 -0.03 0.00 1.00 0.00 0.00 64.86 64.76 3dle h ILE 521 Cb 0.86 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.72 3dle h ILE 521 CO 0.08 0.42 0.39 0.40 0.00 0.00 0.00 178.15 179.43 3dle h ILE 522 N 0.94 1.26 -0.62 -0.67 2.04 -0.64 0.89 117.51 120.71 3dle h ILE 522 Ca 0.17 -0.73 -0.06 0.00 1.00 0.00 0.00 64.86 65.23 3dle h ILE 522 Cb 0.56 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 3dle h ILE 522 CO 0.03 0.31 0.13 -0.33 0.00 0.00 0.00 178.15 178.29 3dle h GLU 523 N 1.17 0.98 -0.15 2.37 4.39 -1.16 -0.20 114.58 121.97 3dle h GLU 523 Ca 0.28 -0.23 -0.03 0.00 0.34 0.00 0.00 59.36 59.72 3dle h GLU 523 Cb 0.13 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3dle h GLU 523 CO -0.03 0.88 -0.03 1.96 -1.16 0.00 0.00 179.01 180.63 3dle h GLN 524 N 0.93 0.29 -0.22 2.33 1.08 -0.99 -2.43 115.11 116.09 3dle h GLN 524 Ca 0.20 -0.11 0.06 0.00 -1.45 0.00 0.00 58.65 57.34 3dle h GLN 524 Cb 0.36 -0.02 -0.07 0.00 -0.05 0.00 0.00 27.48 27.70 3dle h GLN 524 CO 0.00 0.57 -0.30 -0.07 -0.95 0.00 0.00 178.83 178.08 3dle h LEU 525 N -0.01 -0.97 -1.65 1.46 3.38 -0.55 -0.96 115.31 116.01 3dle h LEU 525 Ca 0.04 0.16 0.11 0.00 0.09 0.00 0.00 57.88 58.27 3dle h LEU 525 Cb 0.46 0.43 -0.04 0.00 0.09 0.00 0.00 40.66 41.60 3dle h LEU 525 CO 0.01 -0.33 0.41 0.40 0.09 0.00 0.00 178.44 179.03 3dle h ILE 526 N -0.33 0.87 0.00 1.22 2.04 -1.01 -2.64 117.51 117.66 3dle h ILE 526 Ca 0.12 -0.13 -0.13 0.00 1.00 0.00 0.00 64.86 65.72 3dle h ILE 526 Cb 0.52 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 3dle h ILE 526 CO -0.41 0.07 -0.61 0.50 0.00 0.00 0.00 178.15 177.70 3dle h LYS 527 N 0.38 0.00 -7.32 2.37 1.63 -0.67 -3.46 116.57 109.50 3dle h LYS 527 Ca 0.29 0.00 -0.51 0.00 -0.85 0.00 0.00 60.65 59.58 3dle h LYS 527 Cb 0.61 0.00 0.13 0.00 -0.60 0.00 0.00 32.23 32.38 3dle h LYS 527 CO -0.08 0.61 0.30 0.15 -3.45 0.00 0.00 179.45 176.99 3dle s LYS 528 N -3.47 2.06 -0.07 1.90 -0.14 -0.95 -4.96 119.74 114.11 3dle s LYS 528 Ca -0.01 1.11 -0.01 0.00 -1.36 0.00 0.00 55.97 55.71 3dle s LYS 528 Cb 0.12 -1.88 -0.26 0.00 -1.68 0.00 0.00 37.83 34.13 3dle s LYS 528 CO 0.75 -1.76 0.55 0.93 -0.76 0.00 0.00 175.35 175.06 3dle h GLU 529 N -1.21 0.19 -2.89 1.68 5.08 -0.52 -3.47 114.58 113.44 3dle h GLU 529 Ca -0.45 -0.33 -0.15 0.00 -1.00 0.00 0.00 59.36 57.44 3dle h GLU 529 Cb 1.24 0.12 -0.26 0.00 0.50 0.00 0.00 28.75 30.35 3dle h GLU 529 CO 0.52 1.00 -0.35 0.15 -1.00 0.00 0.00 179.01 179.33 3dle s LYS 530 N -2.58 0.36 -0.10 2.33 1.02 -0.18 -5.02 119.74 115.57 3dle s LYS 530 Ca -0.15 0.53 -0.06 0.00 0.02 0.00 0.00 55.97 56.32 3dle s LYS 530 Cb 0.07 0.10 0.04 0.00 -0.52 0.00 0.00 37.83 37.52 3dle s LYS 530 CO 0.80 -0.09 0.25 0.54 -0.92 0.00 0.00 175.35 175.94 3dle s VAL 531 N 0.58 -0.03 -0.19 3.17 0.11 -1.26 -1.84 120.40 120.93 3dle s VAL 531 Ca -0.03 0.12 0.01 0.00 -2.93 0.00 0.00 61.98 59.15 3dle s VAL 531 Cb -0.05 -0.38 0.02 0.00 -1.53 0.00 0.00 36.38 34.45 3dle s VAL 531 CO -0.03 0.05 -0.18 -0.47 -3.33 0.00 0.00 175.10 171.14 3dle s TYR 532 N 1.07 2.85 -0.23 1.54 5.04 0.30 -1.74 117.35 126.19 3dle s TYR 532 Ca -0.08 -1.67 -0.08 0.00 -2.44 0.00 0.00 57.07 52.80 3dle s TYR 532 Cb -0.09 -1.94 -0.04 0.00 0.35 0.00 0.00 41.96 40.24 3dle s TYR 532 CO -0.07 -0.80 0.10 -0.51 -1.34 0.00 0.00 175.55 172.93 3dle s LEU 533 N 1.28 3.75 -0.07 6.97 1.02 -1.26 0.93 118.68 131.31 3dle s LEU 533 Ca 0.04 -0.03 0.05 0.00 0.02 0.00 0.00 54.13 54.20 3dle s LEU 533 Cb -0.14 -1.99 -0.00 0.00 0.02 0.00 0.00 46.19 44.08 3dle s LEU 533 CO -0.11 0.05 -0.21 0.00 0.02 0.00 0.00 176.35 176.09 3dle s ALA 534 N 1.13 1.92 -0.04 4.21 0.00 0.14 -4.95 121.76 124.17 3dle s ALA 534 Ca 0.05 -0.87 -0.02 0.00 0.00 0.00 0.00 51.96 51.12 3dle s ALA 534 Cb -0.14 -0.67 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 3dle s ALA 534 CO 0.04 0.31 0.10 -0.46 0.00 0.00 0.00 175.76 175.74 3dle s TRP 535 N 0.15 3.37 -0.03 0.00 -0.00 -1.26 -1.11 118.94 120.07 3dle s TRP 535 Ca -0.10 0.29 -0.02 0.00 -0.00 0.00 0.00 56.10 56.27 3dle s TRP 535 Cb -0.15 -1.80 0.02 0.00 -0.00 0.00 0.00 33.47 31.54 3dle s TRP 535 CO 0.05 0.59 0.08 0.14 -0.00 0.00 0.00 176.95 177.81 3dle s VAL 536 N -1.14 -0.02 0.58 5.86 -7.23 -0.30 -4.93 120.40 113.23 3dle s VAL 536 Ca 0.21 0.08 -0.18 0.00 -1.81 0.00 0.00 61.98 60.27 3dle s VAL 536 Cb -0.12 -0.13 -0.07 0.00 0.56 0.00 0.00 36.38 36.62 3dle s VAL 536 CO 0.11 0.03 0.70 -0.81 -0.31 0.00 0.00 175.10 174.82 3dle n PRO 537 N 3.48 0.65 0.00 4.82 -0.04 -1.26 -3.91 135.00 138.74 3dle n PRO 537 Ca -0.18 0.26 0.12 0.00 -0.04 0.00 0.00 63.50 63.66 3dle n PRO 537 Cb 0.56 -1.88 0.15 0.00 -0.04 0.00 0.00 33.50 32.29 3dle n PRO 537 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46